A0A3Q0KNR4_SCHMA Loading...

Nuclear pore membrane glycoprotein gp210-related

AlphaFold DB , UniProt , Accession A0A3Q0KNR4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,492 aa.

						>A0A3Q0KNR4_SCHMA|A0A3Q0KNR4
MVVRGPAMNGKIVSLITQCRHSGTPEVAVVSPVVSSENSCSSAAVITAVWQSRHRAVATIYAKIINADHIVKCDVIVDDINRIEIATTTQELYLHNTPVPLIVTAYDEYGNTFTSLEGVPFEWRIFEDKYEEFGDIQGVLRFITWRESEYTTPSTMALLESKGMQGYMQLISGLRTGSAVVSVALHESIYKNVAPSQVRLLVMANAQLSPALAYLVPNSLLTFTVHVIQQGDDQEVSMPSLQYHLQVNDTNLAVLNPLDGSTLKALNYGQTEVTLLDRNVEEALEKLNEVLNSKVDDSDLRLPKRRRPTSLIQIVEPAYLGFTLIQKYTNKNPDICQLASFLNSGSYVNQVASGSYMPIRRWIMESGKVYVINLDIYDRNNHRLYPSDNLRLSLYFPESHFEILKSSLNQTYVVVRAFSSGSVSLKAVLRGVVDQDGNVVEFNSTITGNQDVTIYSPIKIYPTPVILPWSTGLLSPNLTHSDHGYHLRANGGCGQYRWTALSVRALEHHSDPGKLPDSELLTNTVVSITKTGVISALNPGESIIVASSSSNPQICGYTVVYVRPPSEMKFVYERNEVLIPPRRNAKFIDEELTRSYSNQPTNEEWSVRDPSAVEFDLERLAIGLAVLDSDGQSMTDCRNLNIEIRAVDSNVVKIIPGFHAPRLNSSTEYGLFDSNECLHFYVIGVNVGFTEIKAIYNPSPVNKFDESVLIVSRVHVAAYRKINFIDPVSEVTPVAIGSTRNMLVTHGPQPWPLQLSEHYVNVFPQPDADNDISSLPTLISEPHFSKTVYQKTNFDDEAKPVQSYIMDQTEGHVRLVSFSLRCESIGMFEFVIEIGNRPTPSNLHPMVLSSKFTIMCDVAVSLQLLPVFQFPSLPPHFPPCPLVNISSNDWSHDKLILPNTIPTVIHLIFFGSESQELESVDSLVSNVVISSIDDDRGTTEKLQLVQYVDPPVQMDYSDYDKRSFNRRMHSRPYFLITPANLGHSSGSLAVHVTVHSSLPNRYVPFLPGIQGLKSILNIYLSPVINAVPSQLIKLFYHSEASSTVYIHGGSGYYYLENSGNLTDRHHYPIRITEKLNEPTLATHTIPYIMPRRTYEIQPQHVGRVTIQAIDLCFPSTKSNPSNEYNLSPSQAEFNVDVIGLSALNLRVHNQIQLGDEVTAFVEAIGTDGITLPSKCARLLKLSIISDHVTHSTSTGHKESSHDSKRILRVPETYVPSDSFWICDSSNAEEPCSGQFTVRGIALGTSKLMITSIVPGLLYGKPITVQSNVVEIQVFAPLRLTPCNFNLLLGAEYELHAVGGPSQASLEFIPESISSRIIIVKTNPSSVLIRASESLGLANIRARAVGMTGNKLSSSLDEKRDDYVIYSETVCNIHIVALSGVRIRCPLANLDEITSQISDSSNANIPELSNSDRSDRHFLLACPPGRSDDCGSTPLWVEGTAYSPYFSEDQSISNIVSPLGMAAVNPPLRYRWHLNPPEPNSFVRLEYWLDRFGINMDETHLASGMVLVGLKPGTVTVHLTVEPVEPYAKQIIAVSTDGMSTDRLHAQLTIVVLSRLGLSSPHREPQQIILSPNSQLNLIPWTDLHSDSILQYKILTVPHNRNLSLEHASQFLTVTPDGILRANDKCSESGLVCRVTLQIQSMPNGNLVNSKYTHNFDNSLIQTLILDVLIKVPRYMMFSVPSITIPQNERLSKVVGLPVGGPYNIKISYHDELGRVFDAVSNDFYRLKASLHRSDLFSTHFIRDFIIEQNFPVNNINSYNPIRHAAFGFSIHSLPFSKSTNQVEFIQDEKNSHWAALRIGLSNKINGVSPSYLSLPYSNSLDLLGLTSLIEGQWMCLPKFSSSTSYSDLDNTWSSVDPSIIWIDPLNQIILARHSGQGVLTFSLTSSVKTYQQIETVKNTTYSNMKSEPLTYLINLQVIPLELYTSGIPSASLIFVDSGNNVLQSESIIFPIGVDRPSRSESFLSILRFLIQLPIKESNDIPCSKTPGSLLTFENFAPFKCQIQLQIDDEFHIDFNYRSSLLPNWFSHLLLWEHNETIESILELESAKFSLQRYITTQLEPLSQSSPFHTSSTQWQCVIKSPTTWSLNVDAISLTLMPKTRMILQLVKTHVSGNIEQGENSSLIAQTSLLPLPGIRILIPPAVKLQEDSHMSTSKDSYQFWITETDHFTRRLLIFIPPATSFALNMQELGSDKLLVRSQFPEILEIVQSPRPVQSLLEVVDIYKEYSRSFSSSLASSTLASYPSTVTTELSHWLHIVHEQIGKIEDDVISDLNPSILKHQVLWLVQVKCIPGDSPIDTLVNVVLSLRSTGQHIEIPVRINIPSLNQLDNKEITSSKPSFYLLNFSWIHLFAMIVITLFIAIIIHIIFRSETLISSSNNSNIGKYSPGPLPPLVKGGISRSPPGRQLWSQNFIPGGSPNTIRQPFSTFDGLRSSNVSSSPIHPQNLSSNTSYNNTQRISPRFDLGTSGDLVNDERRWRQALSGSINRLRDSFDG
					

Structure Viewer

Loading PAE data...

(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	47	Very low	36.1	Very low	61 Å²	61	90 Å²	90	30%	0.3	51%	0.51	S	S	.	.				0	143.4	0	-179.9	167.4	127.5	0	0	109.6	V3 I46 A48 V75 T114 S115	M1-V3 HydrophobicContact CE-CG2 3.44Å; M1-V3 VanDerWaalsContact CE-CG2 3.44Å; M1-V3 HydrophobicContact CG-CG2 4.26Å; M1-I46 HydrophobicContact CE-CB 4.1Å; M1-I46 HydrophobicContact CE-CG2 3.57Å; M1-I46 HydrophobicContact SD-CG2 4.49Å; M1-A48 HydrophobicContact SD-CB 3.9Å; M1-V75 HydrophobicContact CE-CG1 3.84Å; M1-V75 HydrophobicContact CG-CG1 3.89Å; M1-V75 HydrophobicContact SD-CG1 3.84Å; M1-T114 PolarHBondContact O-N 2.77Å; M1-T114 PolarHBondContact O-OG1 2.99Å; M1-S115 PolarHBondContact O-N 3.19Å
2	V	41.3	Very low	35.5	Very low	17 Å²	17	93.8 Å²	93.8	10%	0.103	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	117	179.6	166.9	0	0	0	0	109.4	R4 I76 F113 T114	V2-R4 HydrophobicContact CG1-CG 4.44Å; V2-I76 HydrophobicContact CB-CB 4.13Å; V2-I76 HydrophobicContact CG1-CB 4.36Å; V2-I76 HydrophobicContact CG1-CD1 4.4Å; V2-I76 PolarHBondContact N-O 2.85Å; V2-I76 WeakPolarHBondContact O-CA 3.42Å; V2-I76 PolarHBondContact O-N 3.14Å; V2-F113 HydrophobicContact CG2-CD1 3.79Å; V2-F113 HydrophobicContact CG2-CE1 4.22Å; V2-F113 HydrophobicContact CG2-CG 4.37Å; V2-T114 WeakPolarHBondContact CA-OG1 3.27Å; V2-T114 HydrophobicContact CG1-CG2 4.27Å
3	V	46.1	Very low	35	Very low	40 Å²	40	95.2 Å²	95.2	24%	0.242	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	101.9	-175.4	-175.5	0	0	0	0	111.2	M1 G5 C73 V75 T114	M1-V3 HydrophobicContact CE-CG2 3.44Å; M1-V3 VanDerWaalsContact CE-CG2 3.44Å; M1-V3 HydrophobicContact CG-CG2 4.26Å; V3-G5 VanDerWaalsContact C-N 3.33Å; V3-G5 PolarHBondContact O-N 2.85Å; V3-C73 WeakPolarHBondContact CG1-SG 3.29Å; V3-V75 HydrophobicContact CG1-CG2 4.42Å; V3-V75 HydrophobicContact CG2-CG2 4.49Å; V3-T114 PolarHBondContact N-OG1 2.88Å
4	R	45.2	Very low	34.7	Very low	140 Å²	140	90.9 Å²	90.9	53%	0.528	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	69.1	171.5	-68.8	-166.3	179.5	-176.5	-3.2	111	V2 D74 I76	V2-R4 HydrophobicContact CG1-CG 4.44Å; R4-D74 CarbonylContact C-O 3.58Å; R4-D74 WeakPolarHBondContact CA-O 3.48Å; R4-D74 HydrophobicContact CB-CB 4.3Å; R4-D74 PolarHBondContact N-O 2.68Å; R4-D74 PolarHBondContact O-N 2.97Å; R4-I76 HydrophobicContact CG-CD1 4.06Å
5	G	41.4	Very low	34.8	Very low	24 Å²	24	90.5 Å²	90.5	25%	0.247	51%	0.511	C	S	.	.	S	Bend	trans	-86.1	-175.9	153.6	0	0	0	0	0	111.1	V3 A7	V3-G5 VanDerWaalsContact C-N 3.33Å; V3-G5 PolarHBondContact O-N 2.85Å; G5-A7 PolarHBondContact O-N 2.9Å
6	P	32.2	Very low	35	Very low	101 Å²	101	90.4 Å²	90.4	66%	0.656	51%	0.508	S	S	*	.	S	Bend	trans	-63.4	98.1	162.2	27.9	-32.9	0	0	0	108.9	M8	P6-M8 PolarHBondContact O-N 3.14Å
7	A	29.3	Very low	35.1	Very low	71 Å²	71	85.9 Å²	85.9	59%	0.587	48%	0.483	S	S	*	.			trans	-66.4	103.4	-163.5	0	0	0	0	0	113.2	G5	G5-A7 PolarHBondContact O-N 2.9Å
8	M	27.6	Very low	35.5	Very low	107 Å²	107	85.9 Å²	85.9	53%	0.527	48%	0.479	S	S	.	.			trans	-87.4	112.9	148.5	-64.3	-164.5	-168.5	0	0	107.5	P6 G10	P6-M8 PolarHBondContact O-N 3.14Å; M8-G10 PolarHBondContact O-N 3.48Å
9	N	29	Very low	36.4	Very low	163 Å²	163	82.9 Å²	82.9	87%	0.872	46%	0.464	S	S	*	.	S	Bend	trans	-75	107.2	174.6	-70.7	-16.4	0	0	0	109.3
10	G	27.7	Very low	37.3	Very low	66 Å²	66	86.2 Å²	86.2	68%	0.68	47%	0.469	S	S	*	.	S	Bend	trans	141.6	-5	154	0	0	0	0	0	121.9	M8	M8-G10 PolarHBondContact O-N 3.48Å
11	K	30.1	Very low	38.8	Very low	200 Å²	200	87.3 Å²	87.3	87%	0.87	47%	0.471	S	S	*	.			trans	-178.5	152.6	163.8	-103.2	147.8	-171.7	177.1	0	112
12	I	29.6	Very low	40	Very low	136 Å²	136	85.1 Å²	85.1	70%	0.697	46%	0.462	S	S	*	.			trans	-126.3	95.7	-171.8	-53.8	173.1	0	0	0	111.4
13	V	29.2	Very low	41.6	Very low	112 Å²	112	86.1 Å²	86.1	68%	0.679	48%	0.475	S	S	*	.			trans	-152	151	168.3	-165.6	0	0	0	0	110.9	A43	V13-A43 HydrophobicContact CG1-CB 4.23Å
14	S	30.6	Very low	43.3	Very low	34 Å²	34	86.4 Å²	86.4	24%	0.238	48%	0.477	C	S	.	.			trans	73.9	65.9	159	55.6	0	0	0	0	120.6	S42	S14-S42 CarbonylContact C-O 3.57Å; S14-S42 WeakPolarHBondContact CA-O 3.39Å; S14-S42 PolarHBondContact N-O 2.94Å
15	L	36.5	Very low	44.9	Very low	85 Å²	85	83.3 Å²	83.3	45%	0.445	48%	0.475	S	S	.	.			trans	-133.9	137.3	145.1	-89.7	-179.9	0	0	0	112.4	T17 S42 D1541	L15-T17 PolarHBondContact O-N 3.06Å; L15-S42 PolarHBondContact N-O 2.8Å; L15-S42 CarbonylContact O-C 3.58Å; L15-S42 WeakPolarHBondContact O-CA 3.47Å; L15-D1541 HydrophobicContact CD2-CB 4.49Å; L15-D1541 WeakPolarHBondContact CD2-OD2 3.16Å
16	I	37.8	Very low	46.6	Very low	89 Å²	89	89.3 Å²	89.3	46%	0.456	50%	0.497	S	S	.	.			trans	-88.1	105.2	-156	-65.3	178.5	0	0	0	111	C40	I16-C40 HydrophobicContact CG2-CB 3.29Å
17	T	36.1	Very low	48.9	Very low	14 Å²	14	84.9 Å²	84.9	9%	0.086	47%	0.468	C	S	.	.	B	Isolated β-bridge	trans	-135.9	153.2	-169.5	59.4	0	0	0	0	114.1	L15 S41 A62 K63 I64	L15-T17 PolarHBondContact O-N 3.06Å; T17-S41 PolarHBondContact N-O 2.92Å; T17-S41 PolarHBondContact O-N 2.97Å; T17-A62 HydrophobicContact CG2-CB 4.03Å; T17-K63 CarbonylContact C-O 3.47Å; T17-K63 VanDerWaalsContact CA-O 3.26Å; T17-K63 WeakPolarHBondContact CA-O 3.2Å; T17-K63 WeakPolarHBondContact CB-O 3.24Å; T17-I64 HydrophobicContact CG2-CB 4.43Å; T17-I64 HydrophobicContact CG2-CG1 3.7Å
18	Q	42.7	Very low	51.2	Low	86 Å²	86	81.5 Å²	81.5	40%	0.402	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	106.8	149.1	-109.6	-179.7	6.1	0	0	107.2	R20 K63 I65	Q18-R20 HydrophobicContact CB-CG 4.08Å; Q18-R20 PolarHBondContact O-N 3.02Å; Q18-K63 PolarHBondContact N-O 3.32Å; Q18-K63 PolarHBondContact O-N 3.04Å; Q18-I65 HydrophobicContact CB-CD1 3.91Å; Q18-I65 HydrophobicContact CB-CG1 4.1Å; Q18-I65 HydrophobicContact CG-CD1 3.77Å; Q18-I65 HydrophobicContact CG-CG1 4.49Å
19	C	51.9	Low	53.6	Low	30 Å²	30	79.5 Å²	79.5	20%	0.203	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	103.7	163.6	-73	0	0	0	0	107.9	V30	C19-V30 HydrophobicContact CB-CG1 4.14Å
20	R	54.4	Low	55.7	Low	147 Å²	147	73 Å²	73	56%	0.555	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	-28.4	-168.1	-80.2	-163.7	168.4	-165.1	-4.2	113.9	Q18 Y61 K63	Q18-R20 HydrophobicContact CB-CG 4.08Å; Q18-R20 PolarHBondContact O-N 3.02Å; R20-Y61 PolarHBondContact N-O 2.83Å; R20-Y61 VanDerWaalsContact N-O 3.07Å; R20-K63 HydrophobicContact CG-CB 4.33Å
21	H	69.3	Low	57.9	Low	110 Å²	110	72.4 Å²	72.4	51%	0.509	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	165.1	160.4	54.6	97.9	0	0	0	111.6	Y61	H21-Y61 AromaticContact CE1-CD2 3.43Å; H21-Y61 VanDerWaalsContact CE1-CD2 3.43Å; H21-Y61 WeakPolarHBondContact CE1-CD2 3.26Å; H21-Y61 AromaticContact CE1-CE2 3.82Å; H21-Y61 AromaticContact ND1-CD2 3.8Å; H21-Y61 PolarHBondContact O-N 2.93Å; H21-Y61 VanDerWaalsContact O-N 3.15Å
22	S	72.1	Confident	59.7	Low	16 Å²	16	65.9 Å²	65.9	11%	0.112	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	143.3	152.6	-177.4	0	0	0	0	109.1	T24 A28	S22-T24 VanDerWaalsContact C-N 3.3Å; S22-T24 PolarHBondContact OG-N 3.11Å; S22-T24 PolarHBondContact OG-O 3.14Å; S22-A28 VanDerWaalsContact CB-O 3.23Å; S22-A28 WeakPolarHBondContact CB-O 3.36Å; S22-A28 PolarHBondContact OG-O 3.13Å
23	G	74.7	Confident	61.5	Low	38 Å²	38	63 Å²	63	39%	0.392	35%	0.352	S	S	.	.	S	Bend	trans	-71.3	-26.2	173	0	0	0	0	0	112.9	T59	G23-T59 WeakPolarHBondContact CA-O 3.38Å; G23-T59 PolarHBondContact N-O 2.75Å
24	T	81.6	Confident	62.9	Low	46 Å²	46	61.7 Å²	61.7	28%	0.282	34%	0.344	S	S	.	.			trans	-140.3	83.8	174	45.4	0	0	0	0	108.7	S22 E26 V27 A28 V57 A58	S22-T24 VanDerWaalsContact C-N 3.3Å; S22-T24 PolarHBondContact OG-N 3.11Å; S22-T24 PolarHBondContact OG-O 3.14Å; T24-E26 PolarHBondContact O-N 3.32Å; T24-E26 VanDerWaalsContact O-N 3.11Å; T24-V27 PolarHBondContact O-N 3.14Å; T24-A28 PolarHBondContact O-N 2.9Å; T24-V57 PolarHBondContact OG1-O 2.82Å; T24-V57 VanDerWaalsContact OG1-O 3.08Å; T24-A58 VanDerWaalsContact OG1-CA 3.23Å; T24-A58 WeakPolarHBondContact OG1-CA 3.44Å; T24-A58 WeakPolarHBondContact OG1-CB 3.34Å
25	P	78.3	Confident	64.2	Low	75 Å²	75	64.8 Å²	64.8	49%	0.487	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.8	-179.1	25.8	-34.5	0	0	0	113.3	V27 V29	P25-V27 PolarHBondContact O-N 2.98Å; P25-V29 WeakPolarHBondContact O-CG2 3.23Å
26	E	77.7	Confident	65	Low	149 Å²	149	63.8 Å²	63.8	70%	0.696	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.6	171	-60.5	168.8	-105.9	0	0	113.4	T24	T24-E26 PolarHBondContact O-N 3.32Å; T24-E26 VanDerWaalsContact O-N 3.11Å
27	V	79.7	Confident	65.8	Low	8 Å²	8	69 Å²	69	5%	0.048	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-48.6	-175.3	177	0	0	0	0	110.8	T24 P25 V49 W50 A56 A58 V77	T24-V27 PolarHBondContact O-N 3.14Å; P25-V27 PolarHBondContact O-N 2.98Å; V27-V49 PolarHBondContact O-N 3Å; V27-W50 HydrophobicContact CB-CE3 4.32Å; V27-W50 HydrophobicContact CG1-CB 4.27Å; V27-W50 HydrophobicContact CG1-CG 4.5Å; V27-W50 HydrophobicContact CG2-CD2 4.17Å; V27-W50 HydrophobicContact CG2-CE3 3.61Å; V27-W50 HydrophobicContact CG2-CZ3 3.88Å; V27-W50 PolarHBondContact O-N 3.02Å; V27-W50 VanDerWaalsContact O-N 3.13Å; V27-A56 HydrophobicContact CB-CB 4.39Å; V27-A56 HydrophobicContact CG1-CB 3.67Å; V27-A56 HydrophobicContact CG2-CB 3.77Å; V27-A58 HydrophobicContact CB-CB 3.99Å; V27-A58 HydrophobicContact CG1-CB 3.9Å; V27-V77 HydrophobicContact CG1-CG2 4.17Å
28	A	77.9	Confident	66.6	Low	0 Å²	0	76.4 Å²	76.4	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	133	174.5	0	0	0	0	0	111.9	S22 T24 I46 T47 A58 V75	S22-A28 VanDerWaalsContact CB-O 3.23Å; S22-A28 WeakPolarHBondContact CB-O 3.36Å; S22-A28 PolarHBondContact OG-O 3.13Å; T24-A28 PolarHBondContact O-N 2.9Å; A28-I46 HydrophobicContact CB-CG2 4.44Å; A28-T47 CarbonylContact C-O 3.54Å; A28-T47 VanDerWaalsContact CA-O 3.32Å; A28-T47 WeakPolarHBondContact CA-O 3.47Å; A28-A58 HydrophobicContact CB-CB 3.66Å; A28-V75 HydrophobicContact CB-CB 4.45Å; A28-V75 HydrophobicContact CB-CG1 4.19Å
29	V	78.6	Confident	67.1	Low	65 Å²	65	74.8 Å²	74.8	39%	0.394	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	146.1	173.8	168.4	0	0	0	0	109.3	P25 T47 V49	P25-V29 WeakPolarHBondContact O-CG2 3.23Å; V29-T47 PolarHBondContact N-O 3.06Å; V29-T47 PolarHBondContact O-N 3.39Å; V29-V49 HydrophobicContact CB-CG2 3.78Å; V29-V49 HydrophobicContact CG2-CG2 3.62Å
30	V	74.1	Confident	67.4	Low	27 Å²	27	74.8 Å²	74.8	16%	0.164	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	111.4	-175	-175.7	0	0	0	0	108.5	C19 A44 I60	C19-V30 HydrophobicContact CB-CG1 4.14Å; V30-A44 HydrophobicContact CG1-CB 3.62Å; V30-I60 HydrophobicContact CG1-CG2 4.35Å; V30-I60 HydrophobicContact CG2-CB 4.41Å; V30-I60 HydrophobicContact CG2-CD1 3.48Å; V30-I60 VanDerWaalsContact CG2-CD1 3.48Å; V30-I60 HydrophobicContact CG2-CG1 3.64Å; V30-I60 HydrophobicContact CG2-CG2 3.96Å
31	S	73	Confident	67.8	Low	53 Å²	53	68 Å²	68	37%	0.371	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	115.7	176.5	40	0	0	0	0	110.2	A44 V45	S31-A44 CarbonylContact O-C 3.56Å; S31-A44 WeakPolarHBondContact O-CA 3.39Å; S31-V45 PolarHBondContact N-O 3.29Å; S31-V45 PolarHBondContact O-N 2.78Å; S31-V45 PolarHBondContact OG-O 3.18Å
32	P	68.3	Low	67.6	Low	64 Å²	64	64.2 Å²	64.2	42%	0.416	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	133.8	178.4	27.8	-33.2	0	0	0	111.1	V34 S41	P32-V34 HydrophobicContact CB-CG2 4.14Å; P32-V34 HydrophobicContact CG-CG2 4.27Å; P32-V34 PolarHBondContact O-N 3.26Å; P32-S41 WeakPolarHBondContact CB-OG 3.2Å
33	V	67.3	Low	67.2	Low	74 Å²	74	64.5 Å²	64.5	45%	0.448	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	96.2	170	-174.3	0	0	0	0	107.4	S41 A43 V45	V33-S41 PolarHBondContact N-OG 2.61Å; V33-S41 WeakPolarHBondContact O-CB 3.25Å; V33-S41 PolarHBondContact O-OG 2.89Å; V33-A43 VanDerWaalsContact CB-O 3.27Å; V33-A43 WeakPolarHBondContact CB-O 3.29Å; V33-A43 WeakPolarHBondContact CG2-O 3.27Å; V33-A43 PolarHBondContact N-O 3.25Å; V33-V45 HydrophobicContact CG2-CG2 4.07Å
34	V	58.2	Low	66.9	Low	85 Å²	85	64 Å²	64	52%	0.515	38%	0.382	S	S	.	.			trans	-93	128.4	-177.6	-177.2	0	0	0	0	109.7	P32 S36	P32-V34 HydrophobicContact CB-CG2 4.14Å; P32-V34 HydrophobicContact CG-CG2 4.27Å; P32-V34 PolarHBondContact O-N 3.26Å; V34-S36 WeakPolarHBondContact CG1-O 3.3Å
35	S	58.3	Low	66.4	Low	100 Å²	100	65.5 Å²	65.5	70%	0.699	39%	0.391	S	S	*	.	S	Bend	trans	-103.9	-14.1	-176.4	50.7	0	0	0	0	114.9
36	S	53.8	Low	66.1	Low	63 Å²	63	64.1 Å²	64.1	44%	0.441	38%	0.379	S	S	.	.	S	Bend	trans	-154.9	154.2	165.2	80.3	0	0	0	0	112	V34 N38 S39	V34-S36 WeakPolarHBondContact CG1-O 3.3Å; S36-N38 PolarHBondContact O-N 3.12Å; S36-S39 PolarHBondContact N-OG 2.88Å; S36-S39 PolarHBondContact O-N 2.84Å; S36-S39 VanDerWaalsContact O-N 3.14Å; S36-S39 PolarHBondContact O-OG 2.83Å; S36-S39 VanDerWaalsContact OG-CB 3.31Å; S36-S39 WeakPolarHBondContact OG-CB 3.42Å; S36-S39 PolarHBondContact OG-OG 3.01Å
37	E	52.9	Low	65.9	Low	198 Å²	198	60.3 Å²	60.3	93%	0.925	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.3	-168.2	-62.6	-169.9	138.6	0	0	116.1
38	N	53.3	Low	65.6	Low	171 Å²	171	62 Å²	62	91%	0.914	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	17.7	177.8	-92.2	-47.4	0	0	0	113.3	S36	S36-N38 PolarHBondContact O-N 3.12Å
39	S	53.4	Low	65.7	Low	51 Å²	51	65 Å²	65	36%	0.357	40%	0.399	S	S	.	.	S	Bend	trans	-117.7	154.4	179.1	67.4	0	0	0	0	113.6	S36	S36-S39 PolarHBondContact N-OG 2.88Å; S36-S39 PolarHBondContact O-N 2.84Å; S36-S39 VanDerWaalsContact O-N 3.14Å; S36-S39 PolarHBondContact O-OG 2.83Å; S36-S39 VanDerWaalsContact OG-CB 3.31Å; S36-S39 WeakPolarHBondContact OG-CB 3.42Å; S36-S39 PolarHBondContact OG-OG 3.01Å
40	C	59.4	Low	65.8	Low	31 Å²	31	65.7 Å²	65.7	21%	0.209	40%	0.395	C	S	.	.			trans	-70.8	154.4	175.8	-69.8	0	0	0	0	111.8	I16 I65	I16-C40 HydrophobicContact CG2-CB 3.29Å; C40-I65 WeakPolarHBondContact SG-CD1 3.22Å; C40-I65 VanDerWaalsContact SG-CG1 3.55Å
41	S	62.5	Low	65.5	Low	4 Å²	4	73.6 Å²	73.6	3%	0.028	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	-86.6	131.5	-175.9	178	0	0	0	0	111.6	T17 P32 V33 A43	T17-S41 PolarHBondContact N-O 2.92Å; T17-S41 PolarHBondContact O-N 2.97Å; P32-S41 WeakPolarHBondContact CB-OG 3.2Å; V33-S41 PolarHBondContact N-OG 2.61Å; V33-S41 WeakPolarHBondContact O-CB 3.25Å; V33-S41 PolarHBondContact O-OG 2.89Å; S41-A43 PolarHBondContact OG-O 3.33Å
42	S	64.3	Low	65.5	Low	30 Å²	30	73.7 Å²	73.7	21%	0.21	43%	0.43	C	S	.	.	S	Bend	trans	-90.7	-15.9	-176	70.9	0	0	0	0	113.9	S14 L15	S14-S42 CarbonylContact C-O 3.57Å; S14-S42 WeakPolarHBondContact CA-O 3.39Å; S14-S42 PolarHBondContact N-O 2.94Å; L15-S42 PolarHBondContact N-O 2.8Å; L15-S42 CarbonylContact O-C 3.58Å; L15-S42 WeakPolarHBondContact O-CA 3.47Å
43	A	63.4	Low	65.3	Low	23 Å²	23	79.2 Å²	79.2	19%	0.19	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	153.6	174.9	0	0	0	0	0	109.6	V13 V33 S41	V13-A43 HydrophobicContact CG1-CB 4.23Å; V33-A43 VanDerWaalsContact CB-O 3.27Å; V33-A43 WeakPolarHBondContact CB-O 3.29Å; V33-A43 WeakPolarHBondContact CG2-O 3.27Å; V33-A43 PolarHBondContact N-O 3.25Å; S41-A43 PolarHBondContact OG-O 3.33Å
44	A	68.2	Low	65.5	Low	27 Å²	27	82.7 Å²	82.7	22%	0.223	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.3	173	0	0	0	0	0	110.1	V30 S31 I46	V30-A44 HydrophobicContact CG1-CB 3.62Å; S31-A44 CarbonylContact O-C 3.56Å; S31-A44 WeakPolarHBondContact O-CA 3.39Å; A44-I46 PolarHBondContact O-N 3.14Å
45	V	71.4	Confident	66.3	Low	78 Å²	78	83.2 Å²	83.2	47%	0.473	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.5	169.4	176.3	0	0	0	0	107.2	S31 V33	S31-V45 PolarHBondContact N-O 3.29Å; S31-V45 PolarHBondContact O-N 2.78Å; S31-V45 PolarHBondContact OG-O 3.18Å; V33-V45 HydrophobicContact CG2-CG2 4.07Å
46	I	73.2	Confident	67.2	Low	46 Å²	46	78.9 Å²	78.9	24%	0.236	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.8	176.1	-58.7	171.1	0	0	0	107.1	M1 A28 A44 I60 V75	M1-I46 HydrophobicContact CE-CB 4.1Å; M1-I46 HydrophobicContact CE-CG2 3.57Å; M1-I46 HydrophobicContact SD-CG2 4.49Å; A28-I46 HydrophobicContact CB-CG2 4.44Å; A44-I46 PolarHBondContact O-N 3.14Å; I46-I60 HydrophobicContact CB-CD1 4.45Å; I46-I60 HydrophobicContact CD1-CD1 3.59Å; I46-I60 HydrophobicContact CG1-CD1 3.76Å; I46-I60 HydrophobicContact CG2-CD1 3.85Å; I46-V75 HydrophobicContact CD1-CG2 4.41Å; I46-V75 HydrophobicContact CG2-CG1 4.41Å; I46-V75 HydrophobicContact CG2-CG2 3.97Å
47	T	73.1	Confident	68.5	Low	68 Å²	68	79.1 Å²	79.1	42%	0.417	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.2	175.7	-52.5	0	0	0	0	108.7	A28 V29 V49	A28-T47 CarbonylContact C-O 3.54Å; A28-T47 VanDerWaalsContact CA-O 3.32Å; A28-T47 WeakPolarHBondContact CA-O 3.47Å; V29-T47 PolarHBondContact N-O 3.06Å; V29-T47 PolarHBondContact O-N 3.39Å; T47-V49 HydrophobicContact CG2-CG2 4.29Å; T47-V49 WeakPolarHBondContact O-CG2 3.27Å; T47-V49 PolarHBondContact O-N 3.14Å
48	A	74.2	Confident	69.6	Low	44 Å²	44	69.7 Å²	69.7	36%	0.364	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	124.5	164.5	0	0	0	0	0	108.7	M1 V77	M1-A48 HydrophobicContact SD-CB 3.9Å; A48-V77 HydrophobicContact CB-CG1 4.5Å; A48-V77 HydrophobicContact CB-CG2 3.78Å
49	V	79.5	Confident	70.9	Confident	64 Å²	64	62.7 Å²	62.7	39%	0.388	34%	0.335	S	S	.	.			trans	-118.4	-4.3	-179	-156.2	0	0	0	0	111.5	V27 V29 T47 Q51	V27-V49 PolarHBondContact O-N 3Å; V29-V49 HydrophobicContact CB-CG2 3.78Å; V29-V49 HydrophobicContact CG2-CG2 3.62Å; T47-V49 HydrophobicContact CG2-CG2 4.29Å; T47-V49 WeakPolarHBondContact O-CG2 3.27Å; T47-V49 PolarHBondContact O-N 3.14Å; V49-Q51 WeakPolarHBondContact O-CG 3.11Å; V49-Q51 PolarHBondContact O-N 2.97Å
50	W	79.9	Confident	72	Confident	79 Å²	79	60.8 Å²	60.8	30%	0.299	32%	0.321	S	S	.	.			trans	-60.3	129.1	177.8	-169.3	-119.5	0	0	0	112.8	V27 S52 H54 A56 V77	V27-W50 HydrophobicContact CB-CE3 4.32Å; V27-W50 HydrophobicContact CG1-CB 4.27Å; V27-W50 HydrophobicContact CG1-CG 4.5Å; V27-W50 HydrophobicContact CG2-CD2 4.17Å; V27-W50 HydrophobicContact CG2-CE3 3.61Å; V27-W50 HydrophobicContact CG2-CZ3 3.88Å; V27-W50 PolarHBondContact O-N 3.02Å; V27-W50 VanDerWaalsContact O-N 3.13Å; W50-S52 VanDerWaalsContact CD1-O 3.28Å; W50-S52 PolarHBondContact NE1-O 3.49Å; W50-H54 PolarHBondContact NE1-O 3.16Å; W50-A56 HydrophobicContact CD2-CB 3.64Å; W50-A56 HydrophobicContact CE3-CB 4.26Å; W50-A56 HydrophobicContact CG-CB 3.95Å; W50-A56 HydrophobicContact CH2-CB 4.26Å; W50-A56 HydrophobicContact CZ2-CB 3.65Å; W50-V77 HydrophobicContact CB-CB 4.13Å; W50-V77 HydrophobicContact CB-CG1 4.1Å; W50-V77 HydrophobicContact CB-CG2 4.25Å; W50-V77 HydrophobicContact CG-CB 4.46Å
51	Q	68.9	Low	72.7	Confident	192 Å²	192	63.3 Å²	63.3	90%	0.897	33%	0.326	S	S	*	.			trans	-113.5	7.8	-176.1	-60.4	-173.4	-10.3	0	0	114.1	V49	V49-Q51 WeakPolarHBondContact O-CG 3.11Å; V49-Q51 PolarHBondContact O-N 2.97Å
52	S	72	Confident	73.2	Confident	55 Å²	55	63.8 Å²	63.8	39%	0.385	33%	0.331	S	S	.	.	S	Bend	trans	-106	150.8	-177.6	-175.7	0	0	0	0	112	W50 H54	W50-S52 VanDerWaalsContact CD1-O 3.28Å; W50-S52 PolarHBondContact NE1-O 3.49Å; S52-H54 PolarHBondContact O-N 3.18Å; S52-H54 PolarHBondContact OG-N 3.22Å
53	R	64.9	Low	73.2	Confident	181 Å²	181	64 Å²	64	68%	0.683	33%	0.328	S	S	*	.	S	Bend	trans	-72	-12.5	174.6	-69.2	-174.5	175.8	-174.1	-5.6	114
54	H	71	Confident	73.3	Confident	146 Å²	146	64 Å²	64	68%	0.676	32%	0.324	S	S	*	.	S	Bend	trans	-78.9	125.9	175.4	-62	-51.8	0	0	0	109.9	W50 S52 A56	W50-H54 PolarHBondContact NE1-O 3.16Å; S52-H54 PolarHBondContact O-N 3.18Å; S52-H54 PolarHBondContact OG-N 3.22Å; H54-A56 PolarHBondContact O-N 2.85Å
55	R	75.8	Confident	72.9	Confident	96 Å²	96	65.7 Å²	65.7	36%	0.362	33%	0.329	S	S	.	.			trans	-41.6	125.9	169.2	176.6	-177.6	-177.7	124.7	-14.2	111.9	I76 V77 D78 D107	R55-I76 HydrophobicContact CG-CG2 4.03Å; R55-V77 WeakPolarHBondContact CA-O 3.38Å; R55-D78 WeakPolarHBondContact CB-OD1 3.29Å; R55-D78 WeakPolarHBondContact CD-OD2 3.4Å; R55-D78 WeakPolarHBondContact CG-OD2 3.36Å; R55-D78 IonicContact CZ-OD2 3.54Å; R55-D78 IonicContact NE-OD2 2.97Å; R55-D78 IonicContact NH1-OD2 3.25Å; R55-D78 PolarHBondContact NH1-OD2 2.99Å; R55-D107 IonicContact NH1-OD2 3.14Å
56	A	75.1	Confident	72.5	Confident	10 Å²	10	66.7 Å²	66.7	8%	0.083	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	152.9	178	0	0	0	0	0	112.2	V27 W50 H54 I76 V77	V27-A56 HydrophobicContact CB-CB 4.39Å; V27-A56 HydrophobicContact CG1-CB 3.67Å; V27-A56 HydrophobicContact CG2-CB 3.77Å; W50-A56 HydrophobicContact CD2-CB 3.64Å; W50-A56 HydrophobicContact CE3-CB 4.26Å; W50-A56 HydrophobicContact CG-CB 3.95Å; W50-A56 HydrophobicContact CH2-CB 4.26Å; W50-A56 HydrophobicContact CZ2-CB 3.65Å; H54-A56 PolarHBondContact O-N 2.85Å; A56-I76 WeakPolarHBondContact O-CA 3.14Å; A56-V77 PolarHBondContact N-O 2.99Å; A56-V77 PolarHBondContact O-N 3.15Å
57	V	81.6	Confident	71.8	Confident	68 Å²	68	64.7 Å²	64.7	41%	0.412	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.6	-176.2	-169.9	0	0	0	0	109.9	T24 D74 V75 I76	T24-V57 PolarHBondContact OG1-O 2.82Å; T24-V57 VanDerWaalsContact OG1-O 3.08Å; V57-D74 HydrophobicContact CG1-CB 4.08Å; V57-V75 CarbonylContact C-O 3.58Å; V57-V75 WeakPolarHBondContact CA-O 2.93Å; V57-I76 HydrophobicContact CG1-CG1 4.3Å; V57-I76 HydrophobicContact CG2-CG1 4.19Å
58	A	77.2	Confident	71.3	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	109.5	171.4	0	0	0	0	0	110.7	T24 V27 A28 I60 V75	T24-A58 VanDerWaalsContact OG1-CA 3.23Å; T24-A58 WeakPolarHBondContact OG1-CA 3.44Å; T24-A58 WeakPolarHBondContact OG1-CB 3.34Å; V27-A58 HydrophobicContact CB-CB 3.99Å; V27-A58 HydrophobicContact CG1-CB 3.9Å; A28-A58 HydrophobicContact CB-CB 3.66Å; A58-I60 PolarHBondContact O-N 3.2Å; A58-V75 HydrophobicContact CB-CB 4.38Å; A58-V75 PolarHBondContact N-O 3.1Å; A58-V75 PolarHBondContact O-N 3.11Å
59	T	79.7	Confident	70.6	Confident	24 Å²	24	68.8 Å²	68.8	15%	0.147	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	115.9	165.4	-63.3	0	0	0	0	109.5	G23 Y61 K72 D74	G23-T59 WeakPolarHBondContact CA-O 3.38Å; G23-T59 PolarHBondContact N-O 2.75Å; T59-Y61 HydrophobicContact CG2-CD1 4.14Å; T59-Y61 HydrophobicContact CG2-CD2 4.15Å; T59-Y61 HydrophobicContact CG2-CE1 3.61Å; T59-Y61 HydrophobicContact CG2-CE2 3.62Å; T59-Y61 HydrophobicContact CG2-CG 4.4Å; T59-K72 HydrophobicContact CG2-CD 4.03Å; T59-K72 HydrophobicContact CG2-CG 3.42Å; T59-K72 VanDerWaalsContact CG2-CG 3.42Å; T59-K72 WeakPolarHBondContact OG1-CE 3.4Å; T59-D74 WeakPolarHBondContact CA-OD1 3.48Å; T59-D74 WeakPolarHBondContact CB-OD1 3.28Å; T59-D74 PolarHBondContact OG1-OD1 3.1Å
60	I	76.8	Confident	70	Confident	10 Å²	10	71 Å²	71	5%	0.051	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	134.1	170.2	-62.1	175.6	0	0	0	109.1	V30 I46 A58 C73 V75	V30-I60 HydrophobicContact CG1-CG2 4.35Å; V30-I60 HydrophobicContact CG2-CB 4.41Å; V30-I60 HydrophobicContact CG2-CD1 3.48Å; V30-I60 VanDerWaalsContact CG2-CD1 3.48Å; V30-I60 HydrophobicContact CG2-CG1 3.64Å; V30-I60 HydrophobicContact CG2-CG2 3.96Å; I46-I60 HydrophobicContact CB-CD1 4.45Å; I46-I60 HydrophobicContact CD1-CD1 3.59Å; I46-I60 HydrophobicContact CG1-CD1 3.76Å; I46-I60 HydrophobicContact CG2-CD1 3.85Å; A58-I60 PolarHBondContact O-N 3.2Å; I60-C73 HydrophobicContact CB-CB 4.42Å; I60-C73 PolarHBondContact N-O 3.41Å; I60-C73 PolarHBondContact O-N 2.92Å; I60-C73 VanDerWaalsContact O-N 3.12Å; I60-V75 HydrophobicContact CD1-CG2 3.51Å; I60-V75 HydrophobicContact CG1-CG2 4.21Å
61	Y	74.3	Confident	69.4	Low	84 Å²	84	70.1 Å²	70.1	33%	0.329	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	105.3	176.3	-61.2	-80.2	0	0	0	110.9	R20 H21 T59 I70	R20-Y61 PolarHBondContact N-O 2.83Å; R20-Y61 VanDerWaalsContact N-O 3.07Å; H21-Y61 AromaticContact CE1-CD2 3.43Å; H21-Y61 VanDerWaalsContact CE1-CD2 3.43Å; H21-Y61 WeakPolarHBondContact CE1-CD2 3.26Å; H21-Y61 AromaticContact CE1-CE2 3.82Å; H21-Y61 AromaticContact ND1-CD2 3.8Å; H21-Y61 PolarHBondContact O-N 2.93Å; H21-Y61 VanDerWaalsContact O-N 3.15Å; T59-Y61 HydrophobicContact CG2-CD1 4.14Å; T59-Y61 HydrophobicContact CG2-CD2 4.15Å; T59-Y61 HydrophobicContact CG2-CE1 3.61Å; T59-Y61 HydrophobicContact CG2-CE2 3.62Å; T59-Y61 HydrophobicContact CG2-CG 4.4Å; Y61-I70 HydrophobicContact CD1-CG2 3.83Å
62	A	72.2	Confident	69.5	Low	14 Å²	14	66.1 Å²	66.1	12%	0.116	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.1	173.7	0	0	0	0	0	110.1	T17 V71	T17-A62 HydrophobicContact CG2-CB 4.03Å; A62-V71 HydrophobicContact CB-CB 4.44Å; A62-V71 PolarHBondContact N-O 2.87Å; A62-V71 VanDerWaalsContact N-O 3.07Å; A62-V71 PolarHBondContact O-N 3.3Å
63	K	63.9	Low	69.7	Low	36 Å²	36	64.7 Å²	64.7	16%	0.157	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.6	176.4	178.1	165.1	178.1	157	0	109.8	T17 Q18 R20 I65 D68	T17-K63 CarbonylContact C-O 3.47Å; T17-K63 VanDerWaalsContact CA-O 3.26Å; T17-K63 WeakPolarHBondContact CA-O 3.2Å; T17-K63 WeakPolarHBondContact CB-O 3.24Å; Q18-K63 PolarHBondContact N-O 3.32Å; Q18-K63 PolarHBondContact O-N 3.04Å; R20-K63 HydrophobicContact CG-CB 4.33Å; K63-I65 PolarHBondContact O-N 3.14Å; K63-D68 WeakPolarHBondContact CE-OD1 3.49Å; K63-D68 IonicContact NZ-OD1 2.73Å; K63-D68 PolarHBondContact NZ-OD1 3.32Å; K63-D68 IonicContact NZ-OD2 2.68Å; K63-D68 PolarHBondContact NZ-OD2 3.02Å
64	I	67.1	Low	70.3	Confident	22 Å²	22	57.8 Å²	57.8	11%	0.113	29%	0.289	C	S	.	.			trans	-74.3	109.4	168.2	-57.4	167.9	0	0	0	106.7	T17 N66 A67 D68 H69 V71	T17-I64 HydrophobicContact CG2-CB 4.43Å; T17-I64 HydrophobicContact CG2-CG1 3.7Å; I64-N66 PolarHBondContact O-N 2.83Å; I64-A67 HydrophobicContact CB-CB 3.99Å; I64-A67 HydrophobicContact CG2-CB 3.55Å; I64-A67 PolarHBondContact O-N 3.23Å; I64-D68 PolarHBondContact O-N 3.31Å; I64-D68 VanDerWaalsContact O-N 3.09Å; I64-H69 HydrophobicContact CD1-CB 4.22Å; I64-H69 PolarHBondContact N-O 2.77Å; I64-V71 HydrophobicContact CD1-CG2 3.76Å; I64-V71 HydrophobicContact CG1-CG2 4.14Å
65	I	60.2	Low	70.6	Confident	63 Å²	63	50.9 Å²	50.9	32%	0.323	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-35.1	-174.1	-60.6	-156.2	0	0	0	111.3	Q18 C40 K63 A67	Q18-I65 HydrophobicContact CB-CD1 3.91Å; Q18-I65 HydrophobicContact CB-CG1 4.1Å; Q18-I65 HydrophobicContact CG-CD1 3.77Å; Q18-I65 HydrophobicContact CG-CG1 4.49Å; C40-I65 WeakPolarHBondContact SG-CD1 3.22Å; C40-I65 VanDerWaalsContact SG-CG1 3.55Å; K63-I65 PolarHBondContact O-N 3.14Å; I65-A67 VanDerWaalsContact C-N 3.32Å; I65-A67 PolarHBondContact O-N 3.3Å
66	N	61.1	Low	70.8	Confident	98 Å²	98	46.7 Å²	46.7	52%	0.524	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	0.1	-175.9	-60.9	6	0	0	0	114	I64 M1538 S1539	I64-N66 PolarHBondContact O-N 2.83Å; N66-M1538 CarbonylContact O-C 3.57Å; N66-M1538 WeakPolarHBondContact O-CA 3.23Å; N66-M1538 VanDerWaalsContact O-CB 3.26Å; N66-M1538 WeakPolarHBondContact O-CB 3.4Å; N66-S1539 PolarHBondContact O-N 2.87Å
67	A	60	Low	71.1	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.033	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.2	-5.1	-175.1	0	0	0	0	0	114.5	I64 I65 H69 M1538 S1539	I64-A67 HydrophobicContact CB-CB 3.99Å; I64-A67 HydrophobicContact CG2-CB 3.55Å; I64-A67 PolarHBondContact O-N 3.23Å; I65-A67 VanDerWaalsContact C-N 3.32Å; I65-A67 PolarHBondContact O-N 3.3Å; A67-H69 HydrophobicContact CB-CB 4.38Å; A67-H69 PolarHBondContact O-N 3.4Å; A67-H69 PolarHBondContact O-ND1 2.89Å; A67-M1538 WeakPolarHBondContact O-CE 3.31Å; A67-S1539 WeakPolarHBondContact CB-O 3.28Å
68	D	61.2	Low	71.1	Confident	89 Å²	89	45.3 Å²	45.3	48%	0.476	23%	0.231	S	C	.	.			trans	49	-6.3	-166.3	-118.9	54.8	0	0	0	117.5	K63 I64 I70 M1538	K63-D68 WeakPolarHBondContact CE-OD1 3.49Å; K63-D68 IonicContact NZ-OD1 2.73Å; K63-D68 PolarHBondContact NZ-OD1 3.32Å; K63-D68 IonicContact NZ-OD2 2.68Å; K63-D68 PolarHBondContact NZ-OD2 3.02Å; I64-D68 PolarHBondContact O-N 3.31Å; I64-D68 VanDerWaalsContact O-N 3.09Å; D68-I70 PolarHBondContact O-N 3.48Å; D68-M1538 HydrophobicContact CB-CE 3.93Å; D68-M1538 HydrophobicContact CB-SD 3.79Å; D68-M1538 PolarHBondContact N-SD 3.43Å; D68-M1538 VanDerWaalsContact N-SD 3.41Å
69	H	60.9	Low	71.3	Confident	110 Å²	110	48.4 Å²	48.4	51%	0.509	25%	0.248	S	C	.	.			trans	-60.1	128.4	176	-78.2	72.9	0	0	0	111.2	I64 A67	I64-H69 HydrophobicContact CD1-CB 4.22Å; I64-H69 PolarHBondContact N-O 2.77Å; A67-H69 HydrophobicContact CB-CB 4.38Å; A67-H69 PolarHBondContact O-N 3.4Å; A67-H69 PolarHBondContact O-ND1 2.89Å
70	I	67.2	Low	71.5	Confident	111 Å²	111	47.8 Å²	47.8	57%	0.569	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	106.5	172.3	-57.5	175.3	0	0	0	107.5	Y61 D68 K72	Y61-I70 HydrophobicContact CD1-CG2 3.83Å; D68-I70 PolarHBondContact O-N 3.48Å; I70-K72 PolarHBondContact O-N 3.46Å
71	V	67.2	Low	71.9	Confident	60 Å²	60	51.7 Å²	51.7	36%	0.364	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	118.4	173.3	-177.5	0	0	0	0	108.5	A62 I64	A62-V71 HydrophobicContact CB-CB 4.44Å; A62-V71 PolarHBondContact N-O 2.87Å; A62-V71 VanDerWaalsContact N-O 3.07Å; A62-V71 PolarHBondContact O-N 3.3Å; I64-V71 HydrophobicContact CD1-CG2 3.76Å; I64-V71 HydrophobicContact CG1-CG2 4.14Å
72	K	71.3	Confident	72.5	Confident	108 Å²	108	52.6 Å²	52.6	47%	0.47	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.5	172.2	-163.5	-158.6	-175.6	-147.6	0	109.8	T59 I70 D74	T59-K72 HydrophobicContact CG2-CD 4.03Å; T59-K72 HydrophobicContact CG2-CG 3.42Å; T59-K72 VanDerWaalsContact CG2-CG 3.42Å; T59-K72 WeakPolarHBondContact OG1-CE 3.4Å; I70-K72 PolarHBondContact O-N 3.46Å; K72-D74 WeakPolarHBondContact CE-OD1 3.23Å; K72-D74 IonicContact NZ-OD1 2.75Å; K72-D74 PolarHBondContact NZ-OD1 3.22Å; K72-D74 IonicContact NZ-OD2 3.33Å; K72-D74 PolarHBondContact NZ-OD2 2.93Å
73	C	74.7	Confident	73.4	Confident	24 Å²	24	52.4 Å²	52.4	16%	0.162	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	122.6	170.5	-175.5	0	0	0	0	109.7	V3 I60	V3-C73 WeakPolarHBondContact CG1-SG 3.29Å; I60-C73 HydrophobicContact CB-CB 4.42Å; I60-C73 PolarHBondContact N-O 3.41Å; I60-C73 PolarHBondContact O-N 2.92Å; I60-C73 VanDerWaalsContact O-N 3.12Å
74	D	78.3	Confident	74.5	Confident	37 Å²	37	54.4 Å²	54.4	20%	0.198	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	108.3	-178.4	-68	-37.3	0	0	0	110.9	R4 V57 T59 K72	R4-D74 CarbonylContact C-O 3.58Å; R4-D74 WeakPolarHBondContact CA-O 3.48Å; R4-D74 HydrophobicContact CB-CB 4.3Å; R4-D74 PolarHBondContact N-O 2.68Å; R4-D74 PolarHBondContact O-N 2.97Å; V57-D74 HydrophobicContact CG1-CB 4.08Å; T59-D74 WeakPolarHBondContact CA-OD1 3.48Å; T59-D74 WeakPolarHBondContact CB-OD1 3.28Å; T59-D74 PolarHBondContact OG1-OD1 3.1Å; K72-D74 WeakPolarHBondContact CE-OD1 3.23Å; K72-D74 IonicContact NZ-OD1 2.75Å; K72-D74 PolarHBondContact NZ-OD1 3.22Å; K72-D74 IonicContact NZ-OD2 3.33Å; K72-D74 PolarHBondContact NZ-OD2 2.93Å
75	V	77.2	Confident	75.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	117	175.5	177.4	0	0	0	0	109.2	M1 V3 A28 I46 V57 A58 I60	M1-V75 HydrophobicContact CE-CG1 3.84Å; M1-V75 HydrophobicContact CG-CG1 3.89Å; M1-V75 HydrophobicContact SD-CG1 3.84Å; V3-V75 HydrophobicContact CG1-CG2 4.42Å; V3-V75 HydrophobicContact CG2-CG2 4.49Å; A28-V75 HydrophobicContact CB-CB 4.45Å; A28-V75 HydrophobicContact CB-CG1 4.19Å; I46-V75 HydrophobicContact CD1-CG2 4.41Å; I46-V75 HydrophobicContact CG2-CG1 4.41Å; I46-V75 HydrophobicContact CG2-CG2 3.97Å; V57-V75 CarbonylContact C-O 3.58Å; V57-V75 WeakPolarHBondContact CA-O 2.93Å; A58-V75 HydrophobicContact CB-CB 4.38Å; A58-V75 PolarHBondContact N-O 3.1Å; A58-V75 PolarHBondContact O-N 3.11Å; I60-V75 HydrophobicContact CD1-CG2 3.51Å; I60-V75 HydrophobicContact CG1-CG2 4.21Å
76	I	80.5	Confident	76.3	Confident	9 Å²	9	53.1 Å²	53.1	5%	0.046	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.3	175.8	-52	177.5	0	0	0	108.3	V2 R4 R55 A56 V57 D78	V2-I76 HydrophobicContact CB-CB 4.13Å; V2-I76 HydrophobicContact CG1-CB 4.36Å; V2-I76 HydrophobicContact CG1-CD1 4.4Å; V2-I76 PolarHBondContact N-O 2.85Å; V2-I76 WeakPolarHBondContact O-CA 3.42Å; V2-I76 PolarHBondContact O-N 3.14Å; R4-I76 HydrophobicContact CG-CD1 4.06Å; R55-I76 HydrophobicContact CG-CG2 4.03Å; A56-I76 WeakPolarHBondContact O-CA 3.14Å; V57-I76 HydrophobicContact CG1-CG1 4.3Å; V57-I76 HydrophobicContact CG2-CG1 4.19Å; I76-D78 HydrophobicContact CG2-CB 4.39Å
77	V	81.1	Confident	77	Confident	22 Å²	22	50.7 Å²	50.7	13%	0.133	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127.6	167.7	-169.3	0	0	0	0	107.2	V27 A48 W50 R55 A56	V27-V77 HydrophobicContact CG1-CG2 4.17Å; A48-V77 HydrophobicContact CB-CG1 4.5Å; A48-V77 HydrophobicContact CB-CG2 3.78Å; W50-V77 HydrophobicContact CB-CB 4.13Å; W50-V77 HydrophobicContact CB-CG1 4.1Å; W50-V77 HydrophobicContact CB-CG2 4.25Å; W50-V77 HydrophobicContact CG-CB 4.46Å; R55-V77 WeakPolarHBondContact CA-O 3.38Å; A56-V77 PolarHBondContact N-O 2.99Å; A56-V77 PolarHBondContact O-N 3.15Å
78	D	81.5	Confident	77.3	Confident	26 Å²	26	56.5 Å²	56.5	14%	0.139	30%	0.298	C	S	.	.			trans	-151.3	160.6	-169.2	-135.3	-29.2	0	0	0	109.2	R55 I76 F113	R55-D78 WeakPolarHBondContact CB-OD1 3.29Å; R55-D78 WeakPolarHBondContact CD-OD2 3.4Å; R55-D78 WeakPolarHBondContact CG-OD2 3.36Å; R55-D78 IonicContact CZ-OD2 3.54Å; R55-D78 IonicContact NE-OD2 2.97Å; R55-D78 IonicContact NH1-OD2 3.25Å; R55-D78 PolarHBondContact NH1-OD2 2.99Å; I76-D78 HydrophobicContact CG2-CB 4.39Å; D78-F113 HydrophobicContact CB-CE1 4.37Å; D78-F113 HydrophobicContact CB-CZ 4.27Å; D78-F113 WeakPolarHBondContact O-CE1 3.36Å; D78-F113 WeakPolarHBondContact O-CZ 3.38Å
79	D	80.8	Confident	77.6	Confident	65 Å²	65	54.5 Å²	54.5	35%	0.348	29%	0.289	S	S	.	.			trans	-88	150.2	-173.8	-154.6	-8.9	0	0	0	112.6	F113 Y190	D79-F113 WeakPolarHBondContact O-CZ 3.45Å; D79-Y190 WeakPolarHBondContact OD1-CE1 3.41Å
80	I	83.5	Confident	78.1	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.062	28%	0.28	C	S	.	.			trans	-86.9	116.7	179.4	-58.3	174.2	0	0	0	109	I83 A105 F113 L116 L185 Y190 V193	I80-I83 HydrophobicContact CG2-CG2 4.07Å; I80-A105 HydrophobicContact CG2-CB 4.06Å; I80-F113 HydrophobicContact CB-CE2 4.32Å; I80-F113 HydrophobicContact CG1-CD2 4.23Å; I80-F113 HydrophobicContact CG1-CE2 3.77Å; I80-F113 HydrophobicContact CG1-CZ 3.98Å; I80-L116 HydrophobicContact CD1-CD2 4.13Å; I80-L185 HydrophobicContact CB-CD1 4.42Å; I80-L185 HydrophobicContact CD1-CD1 4.25Å; I80-L185 HydrophobicContact CD1-CD2 4.43Å; I80-L185 HydrophobicContact CG2-CD1 3.97Å; I80-Y190 HydrophobicContact CB-CD1 4.16Å; I80-Y190 HydrophobicContact CB-CE1 4.06Å; I80-Y190 HydrophobicContact CD1-CE1 4.18Å; I80-Y190 HydrophobicContact CG1-CE1 4.16Å; I80-V193 HydrophobicContact CG2-CG1 4.49Å; I80-V193 HydrophobicContact CG2-CG2 4.47Å; I80-V193 WeakPolarHBondContact O-CG2 3.38Å
81	N	85.2	Confident	78.4	Confident	91 Å²	91	49.6 Å²	49.6	49%	0.487	26%	0.264	S	S	.	.			trans	-92.7	-44.9	-178.8	-177.1	36.6	0	0	0	112.3	Y106	N81-Y106 PolarHBondContact N-O 2.67Å
82	R	88	Confident	78.8	Confident	103 Å²	103	47.6 Å²	47.6	39%	0.389	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.9	178.5	68.2	178.4	-157.4	97	11.2	112.4	E84 A105 Y106	R82-E84 IonicContact CZ-OE2 2.68Å; R82-E84 IonicContact NH1-OE2 2.7Å; R82-E84 PolarHBondContact NH1-OE2 3.44Å; R82-E84 IonicContact NH2-OE2 3.27Å; R82-E84 PolarHBondContact NH2-OE2 3.45Å; R82-A105 WeakPolarHBondContact O-CA 3.28Å; R82-Y106 HydrophobicContact CG-CD2 4.05Å; R82-Y106 HydrophobicContact CG-CG 4.23Å; R82-Y106 PolarHBondContact N-O 2.62Å; R82-Y106 PolarHBondContact O-N 3.25Å
83	I	89.6	Confident	78.9	Confident	10 Å²	10	47.7 Å²	47.7	5%	0.051	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	152.3	173.7	58.5	177.8	0	0	0	110.6	I80 V103 T104 A105 V183 L185 V193 A194 S196	I80-I83 HydrophobicContact CG2-CG2 4.07Å; I83-V103 HydrophobicContact CB-CG1 3.9Å; I83-V103 HydrophobicContact CG2-CG1 4.19Å; I83-T104 CarbonylContact C-O 3.54Å; I83-T104 VanDerWaalsContact CA-O 3.3Å; I83-T104 WeakPolarHBondContact CA-O 3.4Å; I83-A105 HydrophobicContact CG2-CB 3.98Å; I83-V183 HydrophobicContact CD1-CG1 4.3Å; I83-L185 HydrophobicContact CD1-CG 4.43Å; I83-L185 HydrophobicContact CG2-CD1 4.06Å; I83-L185 HydrophobicContact CG2-CG 4.41Å; I83-V193 HydrophobicContact CG1-CG1 4.17Å; I83-V193 HydrophobicContact CG2-CG1 4.23Å; I83-A194 WeakPolarHBondContact CG1-O 3.42Å; I83-S196 WeakPolarHBondContact O-CB 3.4Å
84	E	87	Confident	78.8	Confident	78 Å²	78	49.1 Å²	49.1	36%	0.364	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	129.7	-175.4	-164.1	172.7	167.2	0	0	110.4	R82 A86 T104 Y106 S196	R82-E84 IonicContact CZ-OE2 2.68Å; R82-E84 IonicContact NH1-OE2 2.7Å; R82-E84 PolarHBondContact NH1-OE2 3.44Å; R82-E84 IonicContact NH2-OE2 3.27Å; R82-E84 PolarHBondContact NH2-OE2 3.45Å; E84-A86 PolarHBondContact O-N 3.33Å; E84-T104 PolarHBondContact N-O 3.23Å; E84-T104 PolarHBondContact O-N 2.69Å; E84-T104 PolarHBondContact O-OG1 2.77Å; E84-Y106 HydrophobicContact CB-CE2 3.86Å; E84-S196 WeakPolarHBondContact CA-OG 3.3Å
85	I	86.4	Confident	78.3	Confident	17 Å²	17	52.5 Å²	52.5	9%	0.087	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	114	177.8	-61.7	170.1	0	0	0	109.8	L101 W123 V183 S196 V198	I85-L101 HydrophobicContact CG2-CB 4.11Å; I85-L101 HydrophobicContact CG2-CD1 4.07Å; I85-L101 HydrophobicContact CG2-CD2 4.14Å; I85-L101 HydrophobicContact CG2-CG 4.36Å; I85-W123 HydrophobicContact CD1-CZ3 4.18Å; I85-W123 HydrophobicContact CG1-CZ3 4.24Å; I85-W123 HydrophobicContact CG2-CZ3 4.4Å; I85-V183 HydrophobicContact CD1-CB 4.37Å; I85-V183 HydrophobicContact CD1-CG1 3.88Å; I85-V183 HydrophobicContact CG1-CB 4.43Å; I85-V183 HydrophobicContact CG1-CG1 3.54Å; I85-S196 PolarHBondContact N-OG 2.81Å; I85-V198 HydrophobicContact CB-CG1 4.42Å; I85-V198 HydrophobicContact CD1-CB 4.48Å; I85-V198 HydrophobicContact CD1-CG1 4.06Å; I85-V198 HydrophobicContact CG2-CB 4.45Å; I85-V198 HydrophobicContact CG2-CG1 3.9Å
86	A	80.5	Confident	78.1	Confident	41 Å²	41	57.3 Å²	57.3	34%	0.339	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	133.4	166.6	0	0	0	0	0	110.6	E84 I102 T104	E84-A86 PolarHBondContact O-N 3.33Å; A86-I102 HydrophobicContact CB-CB 4.47Å; A86-I102 PolarHBondContact N-O 3.47Å; A86-I102 PolarHBondContact O-N 2.97Å; A86-T104 HydrophobicContact CB-CG2 4.18Å
87	T	74.6	Confident	77.7	Confident	47 Å²	47	61.6 Å²	61.6	29%	0.288	32%	0.322	S	S	.	.			trans	-137.3	155.2	175.9	-176.9	0	0	0	0	110.1	T89 V198	T87-T89 WeakPolarHBondContact CG2-O 3.49Å; T87-T89 PolarHBondContact OG1-N 3.22Å; T87-T89 PolarHBondContact OG1-O 3.08Å; T87-V198 HydrophobicContact CG2-CG2 4.41Å
88	T	67.6	Low	77.6	Confident	126 Å²	126	62 Å²	62	77%	0.773	33%	0.325	S	S	*	.	S	Bend	trans	-87.6	-18.3	172.3	52.4	0	0	0	0	113.5
89	T	66.5	Low	77.7	Confident	48 Å²	48	62 Å²	62	29%	0.294	33%	0.326	S	S	.	.			trans	-149.2	155	178.2	-173.8	0	0	0	0	112.3	T87 E91 L92 V99	T87-T89 WeakPolarHBondContact CG2-O 3.49Å; T87-T89 PolarHBondContact OG1-N 3.22Å; T87-T89 PolarHBondContact OG1-O 3.08Å; T89-E91 VanDerWaalsContact CG2-O 3.29Å; T89-E91 WeakPolarHBondContact CG2-O 3.39Å; T89-E91 PolarHBondContact OG1-N 2.92Å; T89-E91 PolarHBondContact OG1-O 3.47Å; T89-L92 HydrophobicContact CG2-CD2 4.17Å; T89-V99 HydrophobicContact CG2-CG1 4.39Å; T89-V99 HydrophobicContact CG2-CG2 4.39Å
90	Q	71.1	Confident	78	Confident	66 Å²	66	60.6 Å²	60.6	31%	0.308	32%	0.32	S	S	.	.	S	Bend	trans	-106.1	-10.3	165.7	-69.5	-179.1	-32.9	0	0	112.6	L200 L201	Q90-L200 WeakPolarHBondContact O-CA 3.43Å; Q90-L201 PolarHBondContact O-N 3.1Å
91	E	73.3	Confident	78.2	Confident	52 Å²	52	60.1 Å²	60.1	24%	0.243	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	133.4	179	-61.7	-175.4	159.6	0	0	109.9	T89 L201 P303	T89-E91 VanDerWaalsContact CG2-O 3.29Å; T89-E91 WeakPolarHBondContact CG2-O 3.39Å; T89-E91 PolarHBondContact OG1-N 2.92Å; T89-E91 PolarHBondContact OG1-O 3.47Å; E91-L201 CarbonylContact C-O 3.55Å; E91-L201 WeakPolarHBondContact CA-O 3.44Å; E91-L201 HydrophobicContact CG-CD2 4.44Å; E91-P303 HydrophobicContact CG-CB 4.16Å; E91-P303 HydrophobicContact CG-CG 4.29Å
92	L	75.5	Confident	78.4	Confident	18 Å²	18	58.7 Å²	58.7	9%	0.094	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.8	179.5	-71.2	169	0	0	0	109.2	T89 V99 L140 L200 L201 V202 M203	T89-L92 HydrophobicContact CG2-CD2 4.17Å; L92-V99 HydrophobicContact CD2-CB 4.37Å; L92-V99 HydrophobicContact CD2-CG2 3.68Å; L92-L140 HydrophobicContact CD1-CD2 3.78Å; L92-L200 HydrophobicContact CD1-CB 4.49Å; L92-L200 HydrophobicContact CD1-CD1 4.24Å; L92-L201 PolarHBondContact N-O 3.28Å; L92-V202 HydrophobicContact CB-CG2 4.37Å; L92-V202 CarbonylContact O-C 2.83Å; L92-V202 VanDerWaalsContact O-CA 3.25Å; L92-V202 WeakPolarHBondContact O-CA 3.35Å; L92-M203 PolarHBondContact O-N 3.02Å
93	Y	75.2	Confident	78.5	Confident	110 Å²	110	54 Å²	54	43%	0.431	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	143.1	170.3	-68.7	-74.2	0	0	0	111.1	H95 N96 M203	Y93-H95 PolarHBondContact O-N 3.19Å; Y93-N96 PolarHBondContact O-N 3.11Å; Y93-M203 WeakPolarHBondContact CA-O 3.34Å
94	L	71.9	Confident	78.4	Confident	53 Å²	53	55.5 Å²	55.5	28%	0.277	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	128.7	173.3	-163	75.2	0	0	0	110.1	N96 L174 V202 M203	L94-N96 PolarHBondContact O-N 3.01Å; L94-L174 WeakPolarHBondContact CD1-O 3.38Å; L94-V202 HydrophobicContact CD1-CG1 4.29Å; L94-M203 PolarHBondContact N-O 2.74Å
95	H	68.3	Low	78.4	Confident	109 Å²	109	51.9 Å²	51.9	51%	0.505	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	13.4	-179.2	-49.4	-55.6	0	0	0	117.9	Y93	Y93-H95 PolarHBondContact O-N 3.19Å
96	N	71.7	Confident	78.3	Confident	100 Å²	100	53 Å²	53	54%	0.535	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-75.4	167.4	168.3	-87.1	17.5	0	0	0	113.5	Y93 L94	Y93-N96 PolarHBondContact O-N 3.11Å; L94-N96 PolarHBondContact O-N 3.01Å
97	T	71.9	Confident	78.4	Confident	99 Å²	99	51.3 Å²	51.3	61%	0.607	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-61.8	152.9	179.9	46.8	0	0	0	0	114
98	P	80.2	Confident	78.8	Confident	31 Å²	31	54.9 Å²	54.9	20%	0.201	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-66.3	143.6	-176.9	-20.8	33.6	0	0	0	114.7	I143 Y150 I171	P98-I143 HydrophobicContact CB-CD1 4.19Å; P98-I143 HydrophobicContact CG-CD1 3.83Å; P98-Y150 PolarHBondContact O-OH 3.1Å; P98-I171 CarbonylContact C-O 3.46Å; P98-I171 WeakPolarHBondContact CA-O 3.12Å; P98-I171 WeakPolarHBondContact CB-O 3.33Å
99	V	84.1	Confident	79.4	Confident	26 Å²	26	56.1 Å²	56.1	16%	0.158	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.6	-178.5	177.4	0	0	0	0	110.9	T89 L92 I171	T89-V99 HydrophobicContact CG2-CG1 4.39Å; T89-V99 HydrophobicContact CG2-CG2 4.39Å; L92-V99 HydrophobicContact CD2-CB 4.37Å; L92-V99 HydrophobicContact CD2-CG2 3.68Å; V99-I171 PolarHBondContact N-O 3.43Å; V99-I171 PolarHBondContact O-N 2.79Å
100	P	86.7	Confident	79.8	Confident	35 Å²	35	56 Å²	56	23%	0.227	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	134	173.2	31.5	-32.7	0	0	0	112.8	W145 L170	P100-W145 HydrophobicContact CB-CH2 4.48Å; P100-L170 HydrophobicContact CB-CD2 3.83Å
101	L	88.2	Confident	80.1	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	145.3	161.1	-61	-172.5	0	0	0	110.2	I85 W123 M168 Q169 I171 V181 V198	I85-L101 HydrophobicContact CG2-CB 4.11Å; I85-L101 HydrophobicContact CG2-CD1 4.07Å; I85-L101 HydrophobicContact CG2-CD2 4.14Å; I85-L101 HydrophobicContact CG2-CG 4.36Å; L101-W123 HydrophobicContact CB-CH2 3.58Å; L101-W123 HydrophobicContact CB-CZ3 3.67Å; L101-W123 HydrophobicContact CD1-CZ3 3.79Å; L101-W123 HydrophobicContact CG-CZ3 4.42Å; L101-M168 VanDerWaalsContact O-CA 3.29Å; L101-M168 WeakPolarHBondContact O-CA 3.08Å; L101-Q169 PolarHBondContact N-O 3.35Å; L101-Q169 PolarHBondContact O-N 3.29Å; L101-I171 HydrophobicContact CD1-CD1 3.42Å; L101-I171 VanDerWaalsContact CD1-CD1 3.42Å; L101-I171 HydrophobicContact CD1-CG1 4.48Å; L101-I171 HydrophobicContact CG-CD1 3.91Å; L101-V181 HydrophobicContact CD1-CB 4.04Å; L101-V181 HydrophobicContact CD1-CG1 3.73Å; L101-V181 HydrophobicContact CD1-CG2 4.31Å; L101-V198 HydrophobicContact CD1-CG1 4.21Å
102	I	88.6	Confident	80.4	Confident	62 Å²	62	57.1 Å²	57.1	32%	0.318	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132.7	-176.6	-54.3	179.7	0	0	0	109.5	A86 Y167 M168	A86-I102 HydrophobicContact CB-CB 4.47Å; A86-I102 PolarHBondContact N-O 3.47Å; A86-I102 PolarHBondContact O-N 2.97Å; I102-Y167 HydrophobicContact CG2-CD2 4.22Å; I102-Y167 HydrophobicContact CG2-CE2 4.45Å; I102-M168 HydrophobicContact CD1-CE 3.93Å; I102-M168 HydrophobicContact CG1-CE 3.99Å; I102-M168 HydrophobicContact CG1-CG 4.26Å; I102-M168 HydrophobicContact CG2-CG 4.26Å
103	V	89.3	Confident	80.6	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	126.6	171.2	-165.2	0	0	0	0	110.2	I83 F121 W123 Y167 V183	I83-V103 HydrophobicContact CB-CG1 3.9Å; I83-V103 HydrophobicContact CG2-CG1 4.19Å; V103-F121 HydrophobicContact CB-CE1 4.13Å; V103-F121 HydrophobicContact CB-CZ 4.41Å; V103-F121 HydrophobicContact CG1-CD1 4.39Å; V103-F121 HydrophobicContact CG1-CE1 3.76Å; V103-F121 HydrophobicContact CG1-CZ 4.3Å; V103-F121 HydrophobicContact CG2-CD1 4.03Å; V103-F121 HydrophobicContact CG2-CE1 4.12Å; V103-F121 HydrophobicContact CG2-CG 4.49Å; V103-W123 HydrophobicContact CG2-CH2 3.87Å; V103-W123 HydrophobicContact CG2-CZ2 3.44Å; V103-W123 VanDerWaalsContact CG2-CZ2 3.44Å; V103-Y167 PolarHBondContact N-O 3.19Å; V103-V183 HydrophobicContact CG1-CG1 4.42Å; V103-V183 HydrophobicContact CG2-CB 4.39Å; V103-V183 HydrophobicContact CG2-CG1 3.98Å; V103-V183 HydrophobicContact CG2-CG2 3.72Å
104	T	88.1	Confident	80.7	Confident	41 Å²	41	56 Å²	56	25%	0.252	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	145.6	162	59.5	0	0	0	0	109.3	I83 E84 A86	I83-T104 CarbonylContact C-O 3.54Å; I83-T104 VanDerWaalsContact CA-O 3.3Å; I83-T104 WeakPolarHBondContact CA-O 3.4Å; E84-T104 PolarHBondContact N-O 3.23Å; E84-T104 PolarHBondContact O-N 2.69Å; E84-T104 PolarHBondContact O-OG1 2.77Å; A86-T104 HydrophobicContact CB-CG2 4.18Å
105	A	87.5	Confident	81	Confident	2 Å²	2	55.8 Å²	55.8	2%	0.017	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148.1	179.6	0	0	0	0	0	110.3	I80 R82 I83 T112 F113 L116	I80-A105 HydrophobicContact CG2-CB 4.06Å; R82-A105 WeakPolarHBondContact O-CA 3.28Å; I83-A105 HydrophobicContact CG2-CB 3.98Å; A105-T112 WeakPolarHBondContact O-CA 3.22Å; A105-F113 HydrophobicContact CB-CB 4.48Å; A105-F113 HydrophobicContact CB-CD2 3.97Å; A105-F113 PolarHBondContact O-N 3.45Å; A105-L116 HydrophobicContact CB-CD1 3.72Å; A105-L116 HydrophobicContact CB-CD2 3.8Å; A105-L116 HydrophobicContact CB-CG 4.32Å
106	Y	84.6	Confident	81.7	Confident	41 Å²	41	51.4 Å²	51.4	16%	0.161	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.9	-173.2	-57.2	-101.6	0	0	0	112.1	N81 R82 E84 G110 N111 T112	N81-Y106 PolarHBondContact N-O 2.67Å; R82-Y106 HydrophobicContact CG-CD2 4.05Å; R82-Y106 HydrophobicContact CG-CG 4.23Å; R82-Y106 PolarHBondContact N-O 2.62Å; R82-Y106 PolarHBondContact O-N 3.25Å; E84-Y106 HydrophobicContact CB-CE2 3.86Å; Y106-G110 WeakPolarHBondContact CD1-O 3.19Å; Y106-N111 VanDerWaalsContact CA-O 3.25Å; Y106-N111 WeakPolarHBondContact CA-O 3.31Å; Y106-T112 HydrophobicContact CD1-CG2 3.79Å; Y106-T112 HydrophobicContact CE1-CG2 3.42Å; Y106-T112 VanDerWaalsContact CE1-CG2 3.42Å
107	D	82.6	Confident	81.9	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.027	28%	0.284	C	S	.	.			trans	-78.6	-176.3	170.3	73.4	2.6	0	0	0	112.3	R55 Y109 G110 N111 F113	R55-D107 IonicContact NH1-OD2 3.14Å; D107-Y109 PolarHBondContact O-N 3.03Å; D107-Y109 WeakPolarHBondContact OD1-CA 3.28Å; D107-Y109 WeakPolarHBondContact OD1-CB 3.14Å; D107-Y109 PolarHBondContact OD1-N 3.34Å; D107-G110 PolarHBondContact O-N 2.91Å; D107-G110 PolarHBondContact OD1-N 2.76Å; D107-N111 PolarHBondContact N-O 2.04Å; D107-N111 PolarHBondContact OD1-N 3.06Å; D107-N111 PolarHBondContact OD1-ND2 2.8Å; D107-N111 WeakPolarHBondContact OD2-CB 3.44Å; D107-N111 PolarHBondContact OD2-ND2 2.7Å; D107-F113 HydrophobicContact CB-CE2 4.25Å; D107-F113 HydrophobicContact CB-CZ 4.44Å
108	E	82.6	Confident	81.9	Confident	123 Å²	123	49.4 Å²	49.4	58%	0.575	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.3	177.3	69	178.9	167.8	0	0	114.2
109	Y	80.6	Confident	82	Confident	152 Å²	152	49.2 Å²	49.2	60%	0.596	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-3.3	-179.9	-53.8	-81.4	0	0	0	113.2	D107	D107-Y109 PolarHBondContact O-N 3.03Å; D107-Y109 WeakPolarHBondContact OD1-CA 3.28Å; D107-Y109 WeakPolarHBondContact OD1-CB 3.14Å; D107-Y109 PolarHBondContact OD1-N 3.34Å
110	G	73.4	Confident	82	Confident	44 Å²	44	48.5 Å²	48.5	45%	0.454	28%	0.276	S	S	.	.	S	Bend	trans	79.7	15	-174.9	0	0	0	0	0	115	Y106 D107	Y106-G110 WeakPolarHBondContact CD1-O 3.19Å; D107-G110 PolarHBondContact O-N 2.91Å; D107-G110 PolarHBondContact OD1-N 2.76Å
111	N	77.5	Confident	82.2	Confident	61 Å²	61	47.1 Å²	47.1	33%	0.326	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-73.8	143.3	166.9	-53.7	-78.1	0	0	0	109.7	Y106 D107	Y106-N111 VanDerWaalsContact CA-O 3.25Å; Y106-N111 WeakPolarHBondContact CA-O 3.31Å; D107-N111 PolarHBondContact N-O 2.04Å; D107-N111 PolarHBondContact OD1-N 3.06Å; D107-N111 PolarHBondContact OD1-ND2 2.8Å; D107-N111 WeakPolarHBondContact OD2-CB 3.44Å; D107-N111 PolarHBondContact OD2-ND2 2.7Å
112	T	79.7	Confident	82.3	Confident	81 Å²	81	50.2 Å²	50.2	50%	0.497	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-81.1	143.9	174.8	45.9	0	0	0	0	112.6	A105 Y106	A105-T112 WeakPolarHBondContact O-CA 3.22Å; Y106-T112 HydrophobicContact CD1-CG2 3.79Å; Y106-T112 HydrophobicContact CE1-CG2 3.42Å; Y106-T112 VanDerWaalsContact CE1-CG2 3.42Å
113	F	80.8	Confident	82.4	Confident	22 Å²	22	47.8 Å²	47.8	10%	0.096	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-72.3	127.8	172.1	-81.9	-83.3	0	0	0	111.7	V2 D78 D79 I80 A105 D107 S115 L116	V2-F113 HydrophobicContact CG2-CD1 3.79Å; V2-F113 HydrophobicContact CG2-CE1 4.22Å; V2-F113 HydrophobicContact CG2-CG 4.37Å; D78-F113 HydrophobicContact CB-CE1 4.37Å; D78-F113 HydrophobicContact CB-CZ 4.27Å; D78-F113 WeakPolarHBondContact O-CE1 3.36Å; D78-F113 WeakPolarHBondContact O-CZ 3.38Å; D79-F113 WeakPolarHBondContact O-CZ 3.45Å; I80-F113 HydrophobicContact CB-CE2 4.32Å; I80-F113 HydrophobicContact CG1-CD2 4.23Å; I80-F113 HydrophobicContact CG1-CE2 3.77Å; I80-F113 HydrophobicContact CG1-CZ 3.98Å; A105-F113 HydrophobicContact CB-CB 4.48Å; A105-F113 HydrophobicContact CB-CD2 3.97Å; A105-F113 PolarHBondContact O-N 3.45Å; D107-F113 HydrophobicContact CB-CE2 4.25Å; D107-F113 HydrophobicContact CB-CZ 4.44Å; F113-S115 VanDerWaalsContact C-N 3.3Å; F113-S115 PolarHBondContact O-N 3.37Å; F113-L116 HydrophobicContact CB-CD2 4.09Å; F113-L116 HydrophobicContact CB-CG 4.46Å
114	T	76.7	Confident	82.4	Confident	84 Å²	84	53.4 Å²	53.4	52%	0.515	29%	0.289	S	S	.	.	S	Bend	trans	-76.4	-15.3	-176.1	64	0	0	0	0	113.9	M1 V2 V3	M1-T114 PolarHBondContact O-N 2.77Å; M1-T114 PolarHBondContact O-OG1 2.99Å; V2-T114 WeakPolarHBondContact CA-OG1 3.27Å; V2-T114 HydrophobicContact CG1-CG2 4.27Å; V3-T114 PolarHBondContact N-OG1 2.88Å
115	S	77.9	Confident	82.1	Confident	48 Å²	48	53.6 Å²	53.6	34%	0.336	29%	0.288	S	S	.	.			trans	-154.7	141.3	165.5	179.9	0	0	0	0	111.1	M1 F113 E117	M1-S115 PolarHBondContact O-N 3.19Å; F113-S115 VanDerWaalsContact C-N 3.3Å; F113-S115 PolarHBondContact O-N 3.37Å; S115-E117 PolarHBondContact OG-N 2.76Å; S115-E117 VanDerWaalsContact OG-N 3.12Å
116	L	83.2	Confident	81.5	Confident	16 Å²	16	57.7 Å²	57.7	8%	0.084	31%	0.305	C	S	.	.			trans	-117	12.6	171.5	-64.1	171	0	0	0	111.4	I80 A105 F113 G118 V119 F121 Y167	I80-L116 HydrophobicContact CD1-CD2 4.13Å; A105-L116 HydrophobicContact CB-CD1 3.72Å; A105-L116 HydrophobicContact CB-CD2 3.8Å; A105-L116 HydrophobicContact CB-CG 4.32Å; F113-L116 HydrophobicContact CB-CD2 4.09Å; F113-L116 HydrophobicContact CB-CG 4.46Å; L116-G118 PolarHBondContact O-N 3.39Å; L116-V119 WeakPolarHBondContact O-CB 3.29Å; L116-V119 PolarHBondContact O-N 3.01Å; L116-F121 HydrophobicContact CB-CE2 4.44Å; L116-F121 HydrophobicContact CD1-CZ 4.19Å; L116-Y167 HydrophobicContact CB-CG 4.4Å
117	E	77	Confident	80.4	Confident	102 Å²	102	60 Å²	60	48%	0.477	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	135.1	179.4	-68.5	-166.6	104.4	0	0	111.6	S115 V119 T155 Y167	S115-E117 PolarHBondContact OG-N 2.76Å; S115-E117 VanDerWaalsContact OG-N 3.12Å; E117-V119 VanDerWaalsContact C-N 3.31Å; E117-T155 HydrophobicContact CB-CG2 4.39Å; E117-T155 WeakPolarHBondContact OE1-CB 3.42Å; E117-T155 VanDerWaalsContact OE1-CG2 3.23Å; E117-T155 WeakPolarHBondContact OE1-CG2 3.18Å; E117-T155 PolarHBondContact OE1-OG1 3.01Å; E117-Y167 HydrophobicContact CG-CE1 4.1Å
118	G	71.4	Confident	79.2	Confident	55 Å²	55	62.8 Å²	62.8	57%	0.567	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-14.5	-175.2	0	0	0	0	0	114.9	L116 P120	L116-G118 PolarHBondContact O-N 3.39Å; G118-P120 WeakPolarHBondContact O-CD 3.04Å
119	V	80.9	Confident	77.4	Confident	27 Å²	27	65.6 Å²	65.6	16%	0.164	34%	0.343	C	S	.	.			trans	-78.1	124.6	174.7	-176.1	0	0	0	0	109.8	L116 E117 F121 L185	L116-V119 WeakPolarHBondContact O-CB 3.29Å; L116-V119 PolarHBondContact O-N 3.01Å; E117-V119 VanDerWaalsContact C-N 3.31Å; V119-F121 HydrophobicContact CB-CE2 3.9Å; V119-F121 HydrophobicContact CB-CZ 4.48Å; V119-F121 HydrophobicContact CG1-CD2 4.46Å; V119-F121 HydrophobicContact CG1-CE2 3.83Å; V119-F121 HydrophobicContact CG1-CZ 4.08Å; V119-F121 VanDerWaalsContact O-CD2 3.3Å; V119-F121 WeakPolarHBondContact O-CD2 3.37Å; V119-L185 HydrophobicContact CG1-CD2 3.52Å
120	P	85.5	Confident	75.4	Confident	12 Å²	12	65.5 Å²	65.5	8%	0.078	34%	0.342	C	S	.	.			trans	-80.4	135.3	176	30.1	-31.5	0	0	0	111.8	G118 M164 H186 E187	G118-P120 WeakPolarHBondContact O-CD 3.04Å; P120-M164 HydrophobicContact CB-SD 4.06Å; P120-H186 HydrophobicContact CB-CB 4.02Å; P120-H186 HydrophobicContact CG-CB 4.09Å; P120-H186 WeakPolarHBondContact O-CB 3.14Å; P120-H186 PolarHBondContact O-N 3.39Å; P120-H186 VanDerWaalsContact O-N 3.1Å; P120-E187 HydrophobicContact CG-CG 3.87Å
121	F	90.5	Very high	73.5	Confident	5 Å²	5	72.3 Å²	72.3	2%	0.022	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	160.8	176.7	-70.7	-92.9	0	0	0	110.8	V103 L116 V119 Q165 V183 A184 L185	V103-F121 HydrophobicContact CB-CE1 4.13Å; V103-F121 HydrophobicContact CB-CZ 4.41Å; V103-F121 HydrophobicContact CG1-CD1 4.39Å; V103-F121 HydrophobicContact CG1-CE1 3.76Å; V103-F121 HydrophobicContact CG1-CZ 4.3Å; V103-F121 HydrophobicContact CG2-CD1 4.03Å; V103-F121 HydrophobicContact CG2-CE1 4.12Å; V103-F121 HydrophobicContact CG2-CG 4.49Å; L116-F121 HydrophobicContact CB-CE2 4.44Å; L116-F121 HydrophobicContact CD1-CZ 4.19Å; V119-F121 HydrophobicContact CB-CE2 3.9Å; V119-F121 HydrophobicContact CB-CZ 4.48Å; V119-F121 HydrophobicContact CG1-CD2 4.46Å; V119-F121 HydrophobicContact CG1-CE2 3.83Å; V119-F121 HydrophobicContact CG1-CZ 4.08Å; V119-F121 VanDerWaalsContact O-CD2 3.3Å; V119-F121 WeakPolarHBondContact O-CD2 3.37Å; F121-Q165 PolarHBondContact N-O 3.18Å; F121-V183 HydrophobicContact CB-CG2 4.16Å; F121-V183 HydrophobicContact CD1-CG2 4Å; F121-V183 HydrophobicContact CG-CG2 4.47Å; F121-A184 WeakPolarHBondContact CA-O 3.24Å; F121-L185 HydrophobicContact CD1-CD2 3.97Å; F121-L185 HydrophobicContact CD1-CG 4.43Å; F121-L185 HydrophobicContact CE1-CD2 3.36Å; F121-L185 HydrophobicContact CE1-CG 3.97Å; F121-L185 HydrophobicContact CE2-CD2 4.38Å; F121-L185 HydrophobicContact CZ-CD2 3.6Å
122	E	90.7	Very high	71.4	Confident	68 Å²	68	77.6 Å²	77.6	32%	0.318	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.4	170.6	-175.7	-177.6	-173.2	0	0	109.2	R124 V183 A184	E122-R124 HydrophobicContact CG-CG 4.45Å; E122-R124 IonicContact OE1-CZ 2.72Å; E122-R124 IonicContact OE1-NE 2.68Å; E122-R124 PolarHBondContact OE1-NE 3.28Å; E122-R124 IonicContact OE1-NH2 3.82Å; E122-R124 PolarHBondContact OE1-NH2 2.98Å; E122-R124 IonicContact OE2-CZ 2.75Å; E122-R124 IonicContact OE2-NE 3.13Å; E122-R124 IonicContact OE2-NH2 3.62Å; E122-R124 PolarHBondContact OE2-NH2 3.08Å; E122-V183 CarbonylContact O-C 3.57Å; E122-V183 VanDerWaalsContact O-CA 3.31Å; E122-V183 WeakPolarHBondContact O-CA 3.44Å; E122-A184 PolarHBondContact N-O 2.04Å; E122-A184 PolarHBondContact O-N 2.76Å
123	W	90.1	Very high	69.1	Low	10 Å²	10	83.6 Å²	83.6	4%	0.038	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.5	176.6	-64.4	81.7	0	0	0	111.3	I85 L101 V103 F142 G166 Q169 V181 S182 V183	I85-W123 HydrophobicContact CD1-CZ3 4.18Å; I85-W123 HydrophobicContact CG1-CZ3 4.24Å; I85-W123 HydrophobicContact CG2-CZ3 4.4Å; L101-W123 HydrophobicContact CB-CH2 3.58Å; L101-W123 HydrophobicContact CB-CZ3 3.67Å; L101-W123 HydrophobicContact CD1-CZ3 3.79Å; L101-W123 HydrophobicContact CG-CZ3 4.42Å; V103-W123 HydrophobicContact CG2-CH2 3.87Å; V103-W123 HydrophobicContact CG2-CZ2 3.44Å; V103-W123 VanDerWaalsContact CG2-CZ2 3.44Å; W123-F142 HydrophobicContact CB-CE1 4.31Å; W123-F142 HydrophobicContact CB-CE2 4.09Å; W123-F142 HydrophobicContact CB-CZ 3.64Å; W123-G166 PolarHBondContact NE1-O 2.87Å; W123-Q169 HydrophobicContact CB-CG 4.44Å; W123-Q169 HydrophobicContact CD2-CB 3.76Å; W123-Q169 HydrophobicContact CD2-CG 4.26Å; W123-Q169 HydrophobicContact CE3-CB 4.24Å; W123-Q169 HydrophobicContact CG-CB 4.06Å; W123-Q169 HydrophobicContact CG-CG 4.19Å; W123-Q169 HydrophobicContact CH2-CB 4.47Å; W123-Q169 HydrophobicContact CZ2-CB 3.99Å; W123-V181 HydrophobicContact CE3-CG1 4.16Å; W123-S182 WeakPolarHBondContact CA-O 3.29Å; W123-V183 HydrophobicContact CD2-CB 3.88Å; W123-V183 HydrophobicContact CD2-CG2 3.58Å; W123-V183 HydrophobicContact CE3-CB 3.75Å; W123-V183 HydrophobicContact CE3-CG2 3.99Å; W123-V183 HydrophobicContact CG-CB 4.45Å; W123-V183 HydrophobicContact CG-CG2 3.92Å; W123-V183 HydrophobicContact CH2-CB 4.42Å; W123-V183 HydrophobicContact CH2-CG2 4.43Å; W123-V183 HydrophobicContact CZ2-CG2 4.08Å; W123-V183 HydrophobicContact CZ3-CB 4.02Å; W123-V183 HydrophobicContact CZ3-CG1 4.5Å; W123-V183 HydrophobicContact CZ3-CG2 4.38Å
124	R	88.6	Confident	66.6	Low	123 Å²	123	86.1 Å²	86.1	46%	0.464	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	142.6	179.7	-59.1	-177.7	-175.8	161.9	4.2	110.9	E122 F126 S182	E122-R124 HydrophobicContact CG-CG 4.45Å; E122-R124 IonicContact OE1-CZ 2.72Å; E122-R124 IonicContact OE1-NE 2.68Å; E122-R124 PolarHBondContact OE1-NE 3.28Å; E122-R124 IonicContact OE1-NH2 3.82Å; E122-R124 PolarHBondContact OE1-NH2 2.98Å; E122-R124 IonicContact OE2-CZ 2.75Å; E122-R124 IonicContact OE2-NE 3.13Å; E122-R124 IonicContact OE2-NH2 3.62Å; E122-R124 PolarHBondContact OE2-NH2 3.08Å; R124-F126 HydrophobicContact CB-CE2 4.28Å; R124-F126 HydrophobicContact CB-CZ 4.16Å; R124-S182 PolarHBondContact N-O 3.5Å; R124-S182 PolarHBondContact O-N 3Å
125	I	82.3	Confident	64.3	Low	45 Å²	45	89.6 Å²	89.6	23%	0.231	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.9	166.1	-60.9	174.6	0	0	0	107.7	L140 F142	I125-L140 HydrophobicContact CD1-CB 4.17Å; I125-L140 HydrophobicContact CG2-CB 4.49Å; I125-F142 HydrophobicContact CD1-CD1 4.1Å; I125-F142 HydrophobicContact CD1-CD2 4.08Å; I125-F142 HydrophobicContact CD1-CE1 4.16Å; I125-F142 HydrophobicContact CD1-CE2 4.16Å; I125-F142 HydrophobicContact CD1-CG 4.04Å; I125-F142 HydrophobicContact CD1-CZ 4.19Å; I125-F142 HydrophobicContact CG1-CD1 4.34Å; I125-F142 HydrophobicContact CG1-CD2 4.16Å; I125-F142 HydrophobicContact CG1-CE1 3.9Å; I125-F142 HydrophobicContact CG1-CE2 3.73Å; I125-F142 HydrophobicContact CG1-CG 4.45Å; I125-F142 HydrophobicContact CG1-CZ 3.57Å
126	F	75.1	Confident	62.4	Low	88 Å²	88	94.5 Å²	94.5	39%	0.386	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.4	170.8	-62.7	-64.2	0	0	0	108.8	R124 V180	R124-F126 HydrophobicContact CB-CE2 4.28Å; R124-F126 HydrophobicContact CB-CZ 4.16Å; F126-V180 HydrophobicContact CB-CB 4.29Å; F126-V180 PolarHBondContact N-O 3.21Å; F126-V180 PolarHBondContact O-N 2.86Å
127	E	61.4	Low	60.8	Low	89 Å²	89	101.6 Å²	101.6	42%	0.416	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	149.5	165.7	-69.1	161.3	179.8	0	0	109.4	K129 G138	E127-K129 PolarHBondContact O-N 3.35Å; E127-G138 WeakPolarHBondContact OE1-CA 3.05Å
128	D	56.8	Low	60	Low	64 Å²	64	97.8 Å²	97.8	34%	0.342	49%	0.493	S	S	.	.			trans	-69.2	85.5	167.1	-67	-47.6	0	0	0	108.5	Y130 S178 R199	D128-Y130 HydrophobicContact CB-CE2 4.09Å; D128-Y130 VanDerWaalsContact O-CD2 3.27Å; D128-Y130 WeakPolarHBondContact O-CD2 3.09Å; D128-Y130 PolarHBondContact O-N 2.59Å; D128-S178 PolarHBondContact OD2-OG 3.31Å; D128-R199 IonicContact OD1-CZ 3.81Å; D128-R199 IonicContact OD1-NH1 2.72Å; D128-R199 PolarHBondContact OD1-NH1 3.09Å; D128-R199 IonicContact OD1-NH2 3.93Å; D128-R199 PolarHBondContact OD1-NH2 2.87Å; D128-R199 IonicContact OD2-CZ 2.83Å; D128-R199 IonicContact OD2-NH1 3.99Å; D128-R199 PolarHBondContact OD2-NH1 2.73Å; D128-R199 IonicContact OD2-NH2 2.87Å
129	K	44.6	Very low	60.1	Low	181 Å²	181	96.2 Å²	96.2	79%	0.787	47%	0.473	S	S	*	.			trans	-70.2	97	-178.1	-75.5	-165.3	173.4	-167.1	0	111.7	E127	E127-K129 PolarHBondContact O-N 3.35Å
130	Y	40.5	Very low	60.1	Low	151 Å²	151	95.3 Å²	95.3	59%	0.592	47%	0.467	S	S	*	.			trans	-79.2	142.9	153.4	-60.9	-86.8	0	0	0	108.7	D128 K286	D128-Y130 HydrophobicContact CB-CE2 4.09Å; D128-Y130 VanDerWaalsContact O-CD2 3.27Å; D128-Y130 WeakPolarHBondContact O-CD2 3.09Å; D128-Y130 PolarHBondContact O-N 2.59Å; Y130-K286 HydrophobicContact CE1-CD 4.48Å
131	E	32.6	Very low	60	Low	187 Å²	187	100.7 Å²	100.7	87%	0.874	49%	0.486	S	S	*	.			trans	-84.9	160.2	-179.4	-63.8	-169.1	132.6	0	0	112.3
132	E	33.2	Very low	59.8	Low	172 Å²	172	103.2 Å²	103.2	80%	0.804	50%	0.497	S	S	*	.	S	Bend	trans	74.8	148.3	-179.3	-52.1	-161.6	146.1	0	0	117.6
133	F	31.4	Very low	59.5	Low	207 Å²	207	100.8 Å²	100.8	91%	0.908	49%	0.486	S	S	*	.			trans	64.6	108.7	-167.6	-61.2	-85	0	0	0	115.1
134	G	28.6	Very low	59.2	Low	74 Å²	74	102.9 Å²	102.9	76%	0.763	50%	0.5	S	S	*	.			trans	-95.5	176.7	-170.5	0	0	0	0	0	115.6
135	D	28	Very low	59	Low	157 Å²	157	98 Å²	98	84%	0.84	48%	0.481	S	S	*	.			trans	41	94.2	171.9	-67.5	-7	0	0	0	117.1
136	I	38.9	Very low	58.7	Low	152 Å²	152	106.2 Å²	106.2	78%	0.779	51%	0.509	S	S	*	.	S	Bend		176	119.6	127.2	-88.7	150.5	0	0	0	110.4
137	Q	49.9	Very low	58.9	Low	165 Å²	165	108.8 Å²	108.8	77%	0.771	52%	0.523	S	S	*	.			trans	50.2	116.1	155.9	-65.1	171.8	-13.9	0	0	119.7
138	G	59.4	Low	59.7	Low	21 Å²	21	105.6 Å²	105.6	22%	0.216	51%	0.511	C	S	.	.			trans	-68.2	168.2	176.8	0	0	0	0	0	116.3	E127 L174	E127-G138 WeakPolarHBondContact OE1-CA 3.05Å; G138-L174 VanDerWaalsContact O-CB 3.25Å; G138-L174 WeakPolarHBondContact O-CB 3.48Å; G138-L174 VanDerWaalsContact O-CD1 3.31Å; G138-L174 WeakPolarHBondContact O-CD1 3.45Å
139	V	72.8	Confident	60.5	Low	23 Å²	23	111.7 Å²	111.7	14%	0.139	54%	0.537	C	S	.	.	S	Bend	trans	-72.4	-33	-177	176.1	0	0	0	0	112.9	L174 A179 V202	V139-L174 PolarHBondContact O-N 2.67Å; V139-A179 HydrophobicContact CB-CB 4.2Å; V139-A179 HydrophobicContact CG1-CB 4.19Å; V139-V202 HydrophobicContact CG1-CB 4.49Å; V139-V202 HydrophobicContact CG1-CG2 3.84Å
140	L	80.9	Confident	62.1	Low	8 Å²	8	108 Å²	108	4%	0.042	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	157.7	179.9	-63.7	179.8	0	0	0	110.9	L92 I125 I171 S172 A179 V181 L200 V202	L92-L140 HydrophobicContact CD1-CD2 3.78Å; I125-L140 HydrophobicContact CD1-CB 4.17Å; I125-L140 HydrophobicContact CG2-CB 4.49Å; L140-I171 HydrophobicContact CB-CG2 4.32Å; L140-I171 HydrophobicContact CD1-CG2 4.25Å; L140-I171 HydrophobicContact CD2-CG2 4.12Å; L140-I171 HydrophobicContact CG-CG2 4.48Å; L140-S172 WeakPolarHBondContact CA-O 3.3Å; L140-A179 HydrophobicContact CD1-CB 3.68Å; L140-A179 HydrophobicContact CG-CB 3.87Å; L140-V181 HydrophobicContact CD1-CG2 4.06Å; L140-L200 HydrophobicContact CD1-CB 4.25Å; L140-L200 HydrophobicContact CD1-CD1 3.95Å; L140-V202 HydrophobicContact CD2-CG2 3.91Å
141	R	84	Confident	63.9	Low	125 Å²	125	107.2 Å²	107.2	47%	0.472	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	148.6	168.7	59.5	174.6	-179.6	154.7	2.9	112.2	I171 S172 L174	R141-I171 WeakPolarHBondContact O-CA 3.37Å; R141-S172 PolarHBondContact N-O 3.31Å; R141-S172 PolarHBondContact NE-OG 2.92Å; R141-S172 PolarHBondContact O-N 3.4Å; R141-L174 HydrophobicContact CB-CD1 4.09Å; R141-L174 HydrophobicContact CG-CD1 4.08Å; R141-L174 HydrophobicContact CG-CG 4.35Å
142	F	86.3	Confident	66.3	Low	58 Å²	58	101.2 Å²	101.2	25%	0.254	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	154.1	162.8	-68.9	-47.2	0	0	0	111	W123 I125 Q169 L170 I171 V181	W123-F142 HydrophobicContact CB-CE1 4.31Å; W123-F142 HydrophobicContact CB-CE2 4.09Å; W123-F142 HydrophobicContact CB-CZ 3.64Å; I125-F142 HydrophobicContact CD1-CD1 4.1Å; I125-F142 HydrophobicContact CD1-CD2 4.08Å; I125-F142 HydrophobicContact CD1-CE1 4.16Å; I125-F142 HydrophobicContact CD1-CE2 4.16Å; I125-F142 HydrophobicContact CD1-CG 4.04Å; I125-F142 HydrophobicContact CD1-CZ 4.19Å; I125-F142 HydrophobicContact CG1-CD1 4.34Å; I125-F142 HydrophobicContact CG1-CD2 4.16Å; I125-F142 HydrophobicContact CG1-CE1 3.9Å; I125-F142 HydrophobicContact CG1-CE2 3.73Å; I125-F142 HydrophobicContact CG1-CG 4.45Å; I125-F142 HydrophobicContact CG1-CZ 3.57Å; F142-Q169 HydrophobicContact CD1-CG 3.37Å; F142-Q169 HydrophobicContact CE1-CG 3.54Å; F142-Q169 HydrophobicContact CG-CG 4.07Å; F142-Q169 HydrophobicContact CZ-CG 4.33Å; F142-L170 WeakPolarHBondContact CA-O 3.36Å; F142-I171 HydrophobicContact CD1-CD1 4.18Å; F142-I171 HydrophobicContact CD1-CG1 3.82Å; F142-I171 HydrophobicContact CE1-CD1 3.9Å; F142-I171 HydrophobicContact CE1-CG1 4.05Å; F142-V181 HydrophobicContact CE1-CG1 3.97Å; F142-V181 HydrophobicContact CZ-CG1 4.06Å
143	I	84.5	Confident	68.5	Low	17 Å²	17	94.9 Å²	94.9	9%	0.087	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	139.7	172.5	-60.8	177.4	0	0	0	107.7	P98 E147 Q169 L170	P98-I143 HydrophobicContact CB-CD1 4.19Å; P98-I143 HydrophobicContact CG-CD1 3.83Å; I143-E147 HydrophobicContact CG2-CB 3.85Å; I143-Q169 PolarHBondContact O-NE2 2.81Å; I143-L170 HydrophobicContact CB-CB 4.26Å; I143-L170 PolarHBondContact N-O 3.09Å
144	T	83.1	Confident	70.8	Confident	54 Å²	54	89.9 Å²	89.9	33%	0.331	47%	0.47	S	S	.	.			trans	-77.1	158.3	175	65.1	0	0	0	0	111.6	R146 E147 S148	T144-R146 PolarHBondContact O-N 2.86Å; T144-R146 VanDerWaalsContact O-N 3.17Å; T144-E147 WeakPolarHBondContact CB-OE2 3.47Å; T144-E147 WeakPolarHBondContact CG2-OE2 3.32Å; T144-E147 PolarHBondContact N-OE2 3.12Å; T144-E147 PolarHBondContact O-N 2.59Å; T144-E147 VanDerWaalsContact O-N 3.16Å; T144-E147 WeakPolarHBondContact OG1-CG 3.33Å; T144-E147 PolarHBondContact OG1-N 3.17Å; T144-E147 PolarHBondContact OG1-OE2 2.76Å; T144-S148 PolarHBondContact O-N 3.06Å
145	W	84.4	Confident	73	Confident	19 Å²	19	88.1 Å²	88.1	7%	0.072	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.4	178.5	-75	92.2	0	0	0	112.5	P100 S148 Y150 T152 E160 M168 L170	P100-W145 HydrophobicContact CB-CH2 4.48Å; W145-S148 PolarHBondContact O-OG 2.87Å; W145-Y150 HydrophobicContact CZ3-CG 4.37Å; W145-T152 HydrophobicContact CB-CG2 3.78Å; W145-T152 PolarHBondContact O-OG1 3.46Å; W145-E160 PolarHBondContact N-OE1 3.49Å; W145-M168 HydrophobicContact CH2-CE 3.89Å; W145-M168 HydrophobicContact CZ2-CB 3.73Å; W145-M168 HydrophobicContact CZ2-CE 3.91Å; W145-M168 PolarHBondContact NE1-O 2.9Å; W145-L170 HydrophobicContact CD2-CD1 4.05Å; W145-L170 HydrophobicContact CD2-CG 4.44Å; W145-L170 HydrophobicContact CE3-CD1 4.02Å; W145-L170 HydrophobicContact CG-CD1 4.48Å; W145-L170 HydrophobicContact CH2-CD2 4.15Å; W145-L170 HydrophobicContact CH2-CG 4.35Å; W145-L170 HydrophobicContact CZ2-CD2 4.4Å; W145-L170 HydrophobicContact CZ2-CG 4.2Å; W145-L170 HydrophobicContact CZ3-CD1 4.32Å; W145-L170 HydrophobicContact CZ3-CD2 4.42Å
146	R	77.5	Confident	75.5	Confident	218 Å²	218	80.9 Å²	80.9	82%	0.823	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-18.9	179	-169.3	174.3	-178.8	177.6	0.9	114.5	T144	T144-R146 PolarHBondContact O-N 2.86Å; T144-R146 VanDerWaalsContact O-N 3.17Å
147	E	78	Confident	77.5	Confident	142 Å²	142	75.6 Å²	75.6	66%	0.664	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-4.8	174.6	-70	162.5	139.1	0	0	112.7	I143 T144	I143-E147 HydrophobicContact CG2-CB 3.85Å; T144-E147 WeakPolarHBondContact CB-OE2 3.47Å; T144-E147 WeakPolarHBondContact CG2-OE2 3.32Å; T144-E147 PolarHBondContact N-OE2 3.12Å; T144-E147 PolarHBondContact O-N 2.59Å; T144-E147 VanDerWaalsContact O-N 3.16Å; T144-E147 WeakPolarHBondContact OG1-CG 3.33Å; T144-E147 PolarHBondContact OG1-N 3.17Å; T144-E147 PolarHBondContact OG1-OE2 2.76Å
148	S	78.8	Confident	79	Confident	23 Å²	23	72.3 Å²	72.3	16%	0.161	37%	0.373	C	S	.	.	S	Bend	trans	-98	163.5	-175.2	82.3	0	0	0	0	113	T144 W145 Y150 L170	T144-S148 PolarHBondContact O-N 3.06Å; W145-S148 PolarHBondContact O-OG 2.87Å; S148-Y150 PolarHBondContact O-N 3.24Å; S148-Y150 PolarHBondContact OG-N 3.04Å; S148-Y150 VanDerWaalsContact OG-N 3.16Å; S148-L170 VanDerWaalsContact CB-CD1 3.4Å; S148-L170 WeakPolarHBondContact OG-CD1 3.35Å
149	E	73.3	Confident	80.2	Confident	191 Å²	191	72 Å²	72	89%	0.893	37%	0.366	S	S	*	.	S	Bend	trans	-76.1	-2.2	170.8	-62.8	174.2	179.8	0	0	112.8
150	Y	77.5	Confident	80.8	Confident	104 Å²	104	73.7 Å²	73.7	41%	0.408	37%	0.372	S	S	.	.	S	Bend	trans	-89.5	154.8	178.8	-60.2	-73.5	0	0	0	112.8	P98 W145 S148 T152 L170	P98-Y150 PolarHBondContact O-OH 3.1Å; W145-Y150 HydrophobicContact CZ3-CG 4.37Å; S148-Y150 PolarHBondContact O-N 3.24Å; S148-Y150 PolarHBondContact OG-N 3.04Å; S148-Y150 VanDerWaalsContact OG-N 3.16Å; Y150-T152 PolarHBondContact O-N 2.82Å; Y150-L170 HydrophobicContact CD2-CD1 4.02Å; Y150-L170 HydrophobicContact CD2-CD2 3.72Å; Y150-L170 HydrophobicContact CE2-CD2 3.75Å
151	T	79.6	Confident	80.9	Confident	134 Å²	134	77.7 Å²	77.7	82%	0.822	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-78.1	122.7	-179.9	48	0	0	0	0	112.4	P153	T151-P153 WeakPolarHBondContact O-CD 3.45Å
152	T	81.7	Confident	80.8	Confident	61 Å²	61	78 Å²	78	37%	0.374	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-70.3	123.1	-176.4	-44.1	0	0	0	0	112.9	W145 Y150 A157	W145-T152 HydrophobicContact CB-CG2 3.78Å; W145-T152 PolarHBondContact O-OG1 3.46Å; Y150-T152 PolarHBondContact O-N 2.82Å; T152-A157 HydrophobicContact CG2-CB 4.08Å
153	P	80.6	Confident	80.6	Confident	39 Å²	39	78.8 Å²	78.8	25%	0.253	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-69.5	144.5	174	-17.9	31.1	0	0	0	112.7	T151 T155 M156 A157	T151-P153 WeakPolarHBondContact O-CD 3.45Å; P153-T155 PolarHBondContact O-N 3.07Å; P153-M156 HydrophobicContact CB-CB 4.15Å; P153-M156 HydrophobicContact CB-CG 3.87Å; P153-M156 HydrophobicContact CG-CB 4.31Å; P153-M156 HydrophobicContact CG-CG 3.86Å; P153-M156 PolarHBondContact O-N 2.89Å; P153-M156 VanDerWaalsContact O-N 3.16Å; P153-A157 PolarHBondContact O-N 3.38Å
154	S	78.6	Confident	80.6	Confident	102 Å²	102	81.1 Å²	81.1	71%	0.713	44%	0.441	S	S	*	.	H	α-helix	trans	-65.7	-34.6	-175.7	53.8	0	0	0	0	114.2	L158	S154-L158 PolarHBondContact O-N 2.91Å; S154-L158 VanDerWaalsContact O-N 3.1Å
155	T	75.1	Confident	80.7	Confident	38 Å²	38	81.3 Å²	81.3	23%	0.233	44%	0.438	C	S	.	.	H	α-helix	trans	-70.7	-35.3	173.5	43	0	0	0	0	112	E117 P153 L158 L159	E117-T155 HydrophobicContact CB-CG2 4.39Å; E117-T155 WeakPolarHBondContact OE1-CB 3.42Å; E117-T155 VanDerWaalsContact OE1-CG2 3.23Å; E117-T155 WeakPolarHBondContact OE1-CG2 3.18Å; E117-T155 PolarHBondContact OE1-OG1 3.01Å; P153-T155 PolarHBondContact O-N 3.07Å; T155-L158 PolarHBondContact O-N 3.37Å; T155-L159 WeakPolarHBondContact O-CG 3.07Å; T155-L159 PolarHBondContact O-N 2.92Å
156	M	81.8	Confident	80.8	Confident	4 Å²	4	80.6 Å²	80.6	2%	0.02	44%	0.437	C	S	.	.	H	α-helix	trans	-68.9	-44.7	172.4	-61.3	-58.2	94.9	0	0	111	P153 L158 L159 E160 Y167	P153-M156 HydrophobicContact CB-CB 4.15Å; P153-M156 HydrophobicContact CB-CG 3.87Å; P153-M156 HydrophobicContact CG-CB 4.31Å; P153-M156 HydrophobicContact CG-CG 3.86Å; P153-M156 PolarHBondContact O-N 2.89Å; P153-M156 VanDerWaalsContact O-N 3.16Å; M156-L158 PolarHBondContact O-N 2.93Å; M156-L159 HydrophobicContact CE-CD1 3.9Å; M156-L159 CarbonylContact O-C 3.59Å; M156-L159 PolarHBondContact O-N 2.86Å; M156-E160 WeakPolarHBondContact O-CG 3.13Å; M156-E160 PolarHBondContact O-N 3.42Å; M156-Y167 HydrophobicContact CE-CD1 3.81Å; M156-Y167 HydrophobicContact CE-CE1 3.73Å; M156-Y167 HydrophobicContact SD-CD1 4.45Å; M156-Y167 HydrophobicContact SD-CE1 4.46Å
157	A	80.5	Confident	81.2	Confident	41 Å²	41	72.8 Å²	72.8	34%	0.339	41%	0.408	S	S	.	.	H	α-helix	trans	-57.4	-35.4	174.8	0	0	0	0	0	112.5	T152 P153 S161	T152-A157 HydrophobicContact CG2-CB 4.08Å; P153-A157 PolarHBondContact O-N 3.38Å; A157-S161 WeakPolarHBondContact O-CB 3.35Å; A157-S161 PolarHBondContact O-N 3.41Å; A157-S161 PolarHBondContact O-OG 3.43Å
158	L	81	Confident	81.7	Confident	97 Å²	97	67.6 Å²	67.6	51%	0.508	38%	0.384	S	S	.	.	H	α-helix	trans	-68.9	-35.6	174.7	-173.7	64.2	0	0	0	112.7	S154 T155 M156 S161 K162	S154-L158 PolarHBondContact O-N 2.91Å; S154-L158 VanDerWaalsContact O-N 3.1Å; T155-L158 PolarHBondContact O-N 3.37Å; M156-L158 PolarHBondContact O-N 2.93Å; L158-S161 PolarHBondContact O-OG 3.46Å; L158-K162 WeakPolarHBondContact O-CG 3.18Å
159	L	85.4	Confident	82.1	Confident	14 Å²	14	67.3 Å²	67.3	7%	0.073	38%	0.38	C	S	.	.	H	α-helix	trans	-73.5	-48	174.3	-66.9	176.7	0	0	0	111.4	T155 M156 S161 K162 G163 M164	T155-L159 WeakPolarHBondContact O-CG 3.07Å; T155-L159 PolarHBondContact O-N 2.92Å; M156-L159 HydrophobicContact CE-CD1 3.9Å; M156-L159 CarbonylContact O-C 3.59Å; M156-L159 PolarHBondContact O-N 2.86Å; L159-S161 VanDerWaalsContact C-N 3.3Å; L159-S161 PolarHBondContact O-N 2.94Å; L159-K162 CarbonylContact O-C 3.43Å; L159-K162 WeakPolarHBondContact O-CA 3.3Å; L159-K162 WeakPolarHBondContact O-CB 3.47Å; L159-K162 PolarHBondContact O-N 2.96Å; L159-G163 PolarHBondContact O-N 2.74Å; L159-G163 VanDerWaalsContact O-N 3.13Å; L159-M164 CarbonylContact C-O 3.15Å; L159-M164 HydrophobicContact CB-CB 4.25Å; L159-M164 WeakPolarHBondContact CB-O 3.32Å; L159-M164 HydrophobicContact CD2-CB 4.23Å; L159-M164 HydrophobicContact CD2-CE 3.8Å; L159-M164 PolarHBondContact O-N 3.13Å
160	E	84.7	Confident	82.8	Confident	59 Å²	59	58.2 Å²	58.2	28%	0.276	34%	0.338	S	S	.	.	H	α-helix	trans	-56.3	-42.7	175.2	-71.8	-177.5	155.7	0	0	110.9	W145 M156 K162 G163 M164	W145-E160 PolarHBondContact N-OE1 3.49Å; M156-E160 WeakPolarHBondContact O-CG 3.13Å; M156-E160 PolarHBondContact O-N 3.42Å; E160-K162 PolarHBondContact O-N 2.98Å; E160-K162 VanDerWaalsContact O-N 3.13Å; E160-G163 PolarHBondContact O-N 3.2Å; E160-M164 PolarHBondContact N-O 2.84Å
161	S	83.1	Confident	83.4	Confident	92 Å²	92	53.3 Å²	53.3	64%	0.643	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.6	175.5	75.3	0	0	0	0	114.9	A157 L158 L159	A157-S161 WeakPolarHBondContact O-CB 3.35Å; A157-S161 PolarHBondContact O-N 3.41Å; A157-S161 PolarHBondContact O-OG 3.43Å; L158-S161 PolarHBondContact O-OG 3.46Å; L159-S161 VanDerWaalsContact C-N 3.3Å; L159-S161 PolarHBondContact O-N 2.94Å
162	K	81.5	Confident	83.6	Confident	132 Å²	132	47.6 Å²	47.6	57%	0.574	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	3.7	174.9	-66.5	175.7	-178.7	178.7	0	112.8	L158 L159 E160 M164	L158-K162 WeakPolarHBondContact O-CG 3.18Å; L159-K162 CarbonylContact O-C 3.43Å; L159-K162 WeakPolarHBondContact O-CA 3.3Å; L159-K162 WeakPolarHBondContact O-CB 3.47Å; L159-K162 PolarHBondContact O-N 2.96Å; E160-K162 PolarHBondContact O-N 2.98Å; E160-K162 VanDerWaalsContact O-N 3.13Å; K162-M164 VanDerWaalsContact C-N 3.33Å; K162-M164 HydrophobicContact CB-CE 3.79Å; K162-M164 HydrophobicContact CD-CE 3.72Å; K162-M164 HydrophobicContact CG-CE 4.43Å
163	G	81.2	Confident	83.4	Confident	74 Å²	74	45 Å²	45	76%	0.763	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	23.4	-176.2	0	0	0	0	0	114.5	L159 E160	L159-G163 PolarHBondContact O-N 2.74Å; L159-G163 VanDerWaalsContact O-N 3.13Å; E160-G163 PolarHBondContact O-N 3.2Å
164	M	85.3	Confident	83.1	Confident	65 Å²	65	46.5 Å²	46.5	32%	0.32	28%	0.275	S	S	.	.			trans	-109.8	149.9	177.7	-66.1	-172.7	-72.3	0	0	111.2	P120 L159 E160 K162	P120-M164 HydrophobicContact CB-SD 4.06Å; L159-M164 CarbonylContact C-O 3.15Å; L159-M164 HydrophobicContact CB-CB 4.25Å; L159-M164 WeakPolarHBondContact CB-O 3.32Å; L159-M164 HydrophobicContact CD2-CB 4.23Å; L159-M164 HydrophobicContact CD2-CE 3.8Å; L159-M164 PolarHBondContact O-N 3.13Å; E160-M164 PolarHBondContact N-O 2.84Å; K162-M164 VanDerWaalsContact C-N 3.33Å; K162-M164 HydrophobicContact CB-CE 3.79Å; K162-M164 HydrophobicContact CD-CE 3.72Å; K162-M164 HydrophobicContact CG-CE 4.43Å
165	Q	85.9	Confident	82.8	Confident	58 Å²	58	49.4 Å²	49.4	27%	0.271	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-94.5	150.9	172.7	-62.1	169.5	-59.7	0	0	110.7	F121	F121-Q165 PolarHBondContact N-O 3.18Å
166	G	85.2	Confident	82.7	Confident	5 Å²	5	48.9 Å²	48.9	5%	0.052	27%	0.268	C	S	.	.			trans	-107.3	-167.4	175.3	0	0	0	0	0	113.1	W123 M168	W123-G166 PolarHBondContact NE1-O 2.87Å; G166-M168 PolarHBondContact O-N 2.88Å; G166-M168 VanDerWaalsContact O-N 3.09Å
167	Y	87.5	Confident	82.1	Confident	53 Å²	53	49.6 Å²	49.6	21%	0.208	28%	0.275	C	S	.	.	S	Bend	trans	-73	5.5	-175.9	73.5	-83.1	0	0	0	114.8	I102 V103 L116 E117 M156	I102-Y167 HydrophobicContact CG2-CD2 4.22Å; I102-Y167 HydrophobicContact CG2-CE2 4.45Å; V103-Y167 PolarHBondContact N-O 3.19Å; L116-Y167 HydrophobicContact CB-CG 4.4Å; E117-Y167 HydrophobicContact CG-CE1 4.1Å; M156-Y167 HydrophobicContact CE-CD1 3.81Å; M156-Y167 HydrophobicContact CE-CE1 3.73Å; M156-Y167 HydrophobicContact SD-CD1 4.45Å; M156-Y167 HydrophobicContact SD-CE1 4.46Å
168	M	87.5	Confident	81.7	Confident	33 Å²	33	48.7 Å²	48.7	16%	0.163	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	135.3	177.8	-51.3	174.9	65.2	0	0	112.1	L101 I102 W145 G166	L101-M168 VanDerWaalsContact O-CA 3.29Å; L101-M168 WeakPolarHBondContact O-CA 3.08Å; I102-M168 HydrophobicContact CD1-CE 3.93Å; I102-M168 HydrophobicContact CG1-CE 3.99Å; I102-M168 HydrophobicContact CG1-CG 4.26Å; I102-M168 HydrophobicContact CG2-CG 4.26Å; W145-M168 HydrophobicContact CH2-CE 3.89Å; W145-M168 HydrophobicContact CZ2-CB 3.73Å; W145-M168 HydrophobicContact CZ2-CE 3.91Å; W145-M168 PolarHBondContact NE1-O 2.9Å; G166-M168 PolarHBondContact O-N 2.88Å; G166-M168 VanDerWaalsContact O-N 3.09Å
169	Q	88	Confident	81.4	Confident	17 Å²	17	44 Å²	44	8%	0.079	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	136.2	-175.4	-176.5	64.3	76.5	0	0	111.4	L101 W123 F142 I143	L101-Q169 PolarHBondContact N-O 3.35Å; L101-Q169 PolarHBondContact O-N 3.29Å; W123-Q169 HydrophobicContact CB-CG 4.44Å; W123-Q169 HydrophobicContact CD2-CB 3.76Å; W123-Q169 HydrophobicContact CD2-CG 4.26Å; W123-Q169 HydrophobicContact CE3-CB 4.24Å; W123-Q169 HydrophobicContact CG-CB 4.06Å; W123-Q169 HydrophobicContact CG-CG 4.19Å; W123-Q169 HydrophobicContact CH2-CB 4.47Å; W123-Q169 HydrophobicContact CZ2-CB 3.99Å; F142-Q169 HydrophobicContact CD1-CG 3.37Å; F142-Q169 HydrophobicContact CE1-CG 3.54Å; F142-Q169 HydrophobicContact CG-CG 4.07Å; F142-Q169 HydrophobicContact CZ-CG 4.33Å; I143-Q169 PolarHBondContact O-NE2 2.81Å
170	L	87.7	Confident	81.2	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	145.5	-179.3	-64.8	165	0	0	0	112.7	P100 F142 I143 W145 S148 Y150	P100-L170 HydrophobicContact CB-CD2 3.83Å; F142-L170 WeakPolarHBondContact CA-O 3.36Å; I143-L170 HydrophobicContact CB-CB 4.26Å; I143-L170 PolarHBondContact N-O 3.09Å; W145-L170 HydrophobicContact CD2-CD1 4.05Å; W145-L170 HydrophobicContact CD2-CG 4.44Å; W145-L170 HydrophobicContact CE3-CD1 4.02Å; W145-L170 HydrophobicContact CG-CD1 4.48Å; W145-L170 HydrophobicContact CH2-CD2 4.15Å; W145-L170 HydrophobicContact CH2-CG 4.35Å; W145-L170 HydrophobicContact CZ2-CD2 4.4Å; W145-L170 HydrophobicContact CZ2-CG 4.2Å; W145-L170 HydrophobicContact CZ3-CD1 4.32Å; W145-L170 HydrophobicContact CZ3-CD2 4.42Å; S148-L170 VanDerWaalsContact CB-CD1 3.4Å; S148-L170 WeakPolarHBondContact OG-CD1 3.35Å; Y150-L170 HydrophobicContact CD2-CD1 4.02Å; Y150-L170 HydrophobicContact CD2-CD2 3.72Å; Y150-L170 HydrophobicContact CE2-CD2 3.75Å
171	I	88.8	Confident	81.2	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	146.7	-176.6	-62.7	-172.6	0	0	0	112.6	P98 V99 L101 L140 R141 F142 V181 L200	P98-I171 CarbonylContact C-O 3.46Å; P98-I171 WeakPolarHBondContact CA-O 3.12Å; P98-I171 WeakPolarHBondContact CB-O 3.33Å; V99-I171 PolarHBondContact N-O 3.43Å; V99-I171 PolarHBondContact O-N 2.79Å; L101-I171 HydrophobicContact CD1-CD1 3.42Å; L101-I171 VanDerWaalsContact CD1-CD1 3.42Å; L101-I171 HydrophobicContact CD1-CG1 4.48Å; L101-I171 HydrophobicContact CG-CD1 3.91Å; L140-I171 HydrophobicContact CB-CG2 4.32Å; L140-I171 HydrophobicContact CD1-CG2 4.25Å; L140-I171 HydrophobicContact CD2-CG2 4.12Å; L140-I171 HydrophobicContact CG-CG2 4.48Å; R141-I171 WeakPolarHBondContact O-CA 3.37Å; F142-I171 HydrophobicContact CD1-CD1 4.18Å; F142-I171 HydrophobicContact CD1-CG1 3.82Å; F142-I171 HydrophobicContact CE1-CD1 3.9Å; F142-I171 HydrophobicContact CE1-CG1 4.05Å; I171-V181 HydrophobicContact CD1-CB 4.34Å; I171-V181 HydrophobicContact CD1-CG1 3.92Å; I171-V181 HydrophobicContact CD1-CG2 3.62Å; I171-L200 HydrophobicContact CD1-CD1 4.5Å
172	S	84.1	Confident	81.5	Confident	13 Å²	13	37.2 Å²	37.2	9%	0.091	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	143	175.8	166.3	0	0	0	0	110.8	L140 R141	L140-S172 WeakPolarHBondContact CA-O 3.3Å; R141-S172 PolarHBondContact N-O 3.31Å; R141-S172 PolarHBondContact NE-OG 2.92Å; R141-S172 PolarHBondContact O-N 3.4Å
173	G	77	Confident	81.9	Confident	8 Å²	8	31 Å²	31	8%	0.082	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	148	-179.7	0	0	0	0	0	114.3
174	L	74.8	Confident	82.3	Confident	69 Å²	69	28.8 Å²	28.8	36%	0.361	15%	0.149	S	C	.	.			trans	-126	-28.4	-168.5	-72.1	170.5	0	0	0	115.2	L94 G138 V139 R141	L94-L174 WeakPolarHBondContact CD1-O 3.38Å; G138-L174 VanDerWaalsContact O-CB 3.25Å; G138-L174 WeakPolarHBondContact O-CB 3.48Å; G138-L174 VanDerWaalsContact O-CD1 3.31Å; G138-L174 WeakPolarHBondContact O-CD1 3.45Å; V139-L174 PolarHBondContact O-N 2.67Å; R141-L174 HydrophobicContact CB-CD1 4.09Å; R141-L174 HydrophobicContact CG-CD1 4.08Å; R141-L174 HydrophobicContact CG-CG 4.35Å
175	R	72.5	Confident	82.5	Confident	164 Å²	164	26.8 Å²	26.8	62%	0.619	14%	0.14	S	C	*	.	S	Bend	trans	-149.2	153.6	175.3	-157.5	-179.4	88.4	-173.6	9.6	109.7	V202	R175-V202 VanDerWaalsContact O-CB 3.23Å; R175-V202 WeakPolarHBondContact O-CB 3.14Å; R175-V202 WeakPolarHBondContact O-CG1 3Å
176	T	72.2	Confident	82.3	Confident	27 Å²	27	29.6 Å²	29.6	17%	0.166	15%	0.153	C	C	.	.	S	Bend	trans	-61.2	139.3	168.8	49.6	0	0	0	0	110.9	V202 A204	T176-V202 VanDerWaalsContact CA-O 3.31Å; T176-V202 WeakPolarHBondContact CA-O 3.31Å; T176-A204 HydrophobicContact CG2-CB 4.04Å
177	G	70.8	Confident	82.1	Confident	18 Å²	18	33.3 Å²	33.3	19%	0.186	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.6	-162.7	-170.3	0	0	0	0	0	113.3	V202	G177-V202 PolarHBondContact N-O 2.81Å; G177-V202 VanDerWaalsContact N-O 3.14Å; G177-V202 PolarHBondContact O-N 3.39Å
178	S	70.6	Confident	81.7	Confident	22 Å²	22	35.4 Å²	35.4	15%	0.154	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.6	-178.5	158.3	0	0	0	0	110.2	D128 R199	D128-S178 PolarHBondContact OD2-OG 3.31Å; S178-R199 PolarHBondContact OG-NH1 3.01Å
179	A	76.4	Confident	81	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	159.6	172.3	0	0	0	0	0	111.7	V139 L140 R199 L200	V139-A179 HydrophobicContact CB-CB 4.2Å; V139-A179 HydrophobicContact CG1-CB 4.19Å; L140-A179 HydrophobicContact CD1-CB 3.68Å; L140-A179 HydrophobicContact CG-CB 3.87Å; A179-R199 WeakPolarHBondContact O-CA 3.46Å; A179-L200 PolarHBondContact N-O 3.12Å; A179-L200 VanDerWaalsContact N-O 3.07Å; A179-L200 PolarHBondContact O-N 3.02Å
180	V	79.8	Confident	80.6	Confident	13 Å²	13	39.9 Å²	39.9	8%	0.079	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.5	179.4	-179.7	0	0	0	0	110.1	F126 Q197 V198 R199	F126-V180 HydrophobicContact CB-CB 4.29Å; F126-V180 PolarHBondContact N-O 3.21Å; F126-V180 PolarHBondContact O-N 2.86Å; V180-Q197 HydrophobicContact CG1-CB 4.17Å; V180-V198 CarbonylContact C-O 2.9Å; V180-V198 WeakPolarHBondContact CA-O 3.29Å; V180-R199 HydrophobicContact CG2-CB 4.1Å; V180-R199 HydrophobicContact CG2-CG 4.07Å
181	V	85.6	Confident	80.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.5	173.8	-169.1	0	0	0	0	108.5	L101 W123 L140 F142 I171 Q197 V198 L200	L101-V181 HydrophobicContact CD1-CB 4.04Å; L101-V181 HydrophobicContact CD1-CG1 3.73Å; L101-V181 HydrophobicContact CD1-CG2 4.31Å; W123-V181 HydrophobicContact CE3-CG1 4.16Å; L140-V181 HydrophobicContact CD1-CG2 4.06Å; F142-V181 HydrophobicContact CE1-CG1 3.97Å; F142-V181 HydrophobicContact CZ-CG1 4.06Å; I171-V181 HydrophobicContact CD1-CB 4.34Å; I171-V181 HydrophobicContact CD1-CG1 3.92Å; I171-V181 HydrophobicContact CD1-CG2 3.62Å; V181-Q197 CarbonylContact O-C 3.59Å; V181-Q197 VanDerWaalsContact O-CA 3.26Å; V181-Q197 WeakPolarHBondContact O-CA 3.33Å; V181-V198 HydrophobicContact CB-CG1 4.16Å; V181-V198 PolarHBondContact N-O 2.72Å; V181-V198 PolarHBondContact O-N 3.05Å; V181-L200 HydrophobicContact CG2-CD1 3.96Å
182	S	88.4	Confident	79.7	Confident	9 Å²	9	55.3 Å²	55.3	6%	0.063	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.7	-179.5	-173.7	0	0	0	0	112.2	W123 R124 S196	W123-S182 WeakPolarHBondContact CA-O 3.29Å; R124-S182 PolarHBondContact N-O 3.5Å; R124-S182 PolarHBondContact O-N 3Å; S182-S196 CarbonylContact C-O 3.58Å; S182-S196 WeakPolarHBondContact CA-O 3.11Å; S182-S196 PolarHBondContact OG-O 2.75Å
183	V	91.2	Very high	79.7	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.5	175.8	72.5	0	0	0	0	111.9	I83 I85 V103 F121 E122 W123 P195 S196	I83-V183 HydrophobicContact CD1-CG1 4.3Å; I85-V183 HydrophobicContact CD1-CB 4.37Å; I85-V183 HydrophobicContact CD1-CG1 3.88Å; I85-V183 HydrophobicContact CG1-CB 4.43Å; I85-V183 HydrophobicContact CG1-CG1 3.54Å; V103-V183 HydrophobicContact CG1-CG1 4.42Å; V103-V183 HydrophobicContact CG2-CB 4.39Å; V103-V183 HydrophobicContact CG2-CG1 3.98Å; V103-V183 HydrophobicContact CG2-CG2 3.72Å; F121-V183 HydrophobicContact CB-CG2 4.16Å; F121-V183 HydrophobicContact CD1-CG2 4Å; F121-V183 HydrophobicContact CG-CG2 4.47Å; E122-V183 CarbonylContact O-C 3.57Å; E122-V183 VanDerWaalsContact O-CA 3.31Å; E122-V183 WeakPolarHBondContact O-CA 3.44Å; W123-V183 HydrophobicContact CD2-CB 3.88Å; W123-V183 HydrophobicContact CD2-CG2 3.58Å; W123-V183 HydrophobicContact CE3-CB 3.75Å; W123-V183 HydrophobicContact CE3-CG2 3.99Å; W123-V183 HydrophobicContact CG-CB 4.45Å; W123-V183 HydrophobicContact CG-CG2 3.92Å; W123-V183 HydrophobicContact CH2-CB 4.42Å; W123-V183 HydrophobicContact CH2-CG2 4.43Å; W123-V183 HydrophobicContact CZ2-CG2 4.08Å; W123-V183 HydrophobicContact CZ3-CB 4.02Å; W123-V183 HydrophobicContact CZ3-CG1 4.5Å; W123-V183 HydrophobicContact CZ3-CG2 4.38Å; V183-P195 CarbonylContact O-C 3.5Å; V183-P195 VanDerWaalsContact O-CA 3.26Å; V183-P195 WeakPolarHBondContact O-CA 3.3Å; V183-P195 WeakPolarHBondContact O-CB 3.11Å; V183-S196 PolarHBondContact N-O 2.82Å; V183-S196 PolarHBondContact O-N 2.83Å
184	A	89.7	Confident	79.9	Confident	27 Å²	27	58.6 Å²	58.6	22%	0.223	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	158.4	176.6	0	0	0	0	0	111.7	F121 E122 P195	F121-A184 WeakPolarHBondContact CA-O 3.24Å; E122-A184 PolarHBondContact N-O 2.04Å; E122-A184 PolarHBondContact O-N 2.76Å; A184-P195 HydrophobicContact CB-CB 4.17Å
185	L	88	Confident	80.5	Confident	23 Å²	23	58.7 Å²	58.7	12%	0.12	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	132.6	168	-75.5	161.9	0	0	0	109.6	I80 I83 V119 F121 Y190 V193	I80-L185 HydrophobicContact CB-CD1 4.42Å; I80-L185 HydrophobicContact CD1-CD1 4.25Å; I80-L185 HydrophobicContact CD1-CD2 4.43Å; I80-L185 HydrophobicContact CG2-CD1 3.97Å; I83-L185 HydrophobicContact CD1-CG 4.43Å; I83-L185 HydrophobicContact CG2-CD1 4.06Å; I83-L185 HydrophobicContact CG2-CG 4.41Å; V119-L185 HydrophobicContact CG1-CD2 3.52Å; F121-L185 HydrophobicContact CD1-CD2 3.97Å; F121-L185 HydrophobicContact CD1-CG 4.43Å; F121-L185 HydrophobicContact CE1-CD2 3.36Å; F121-L185 HydrophobicContact CE1-CG 3.97Å; F121-L185 HydrophobicContact CE2-CD2 4.38Å; F121-L185 HydrophobicContact CZ-CD2 3.6Å; L185-Y190 HydrophobicContact CB-CD2 4.24Å; L185-Y190 HydrophobicContact CB-CG 4.34Å; L185-Y190 HydrophobicContact CD1-CD1 4.29Å; L185-Y190 HydrophobicContact CD1-CD2 4.13Å; L185-Y190 HydrophobicContact CD1-CG 3.77Å; L185-Y190 HydrophobicContact CD2-CD2 4.43Å; L185-V193 HydrophobicContact CD1-CB 4.11Å; L185-V193 HydrophobicContact CD1-CG1 3.97Å; L185-V193 HydrophobicContact CD1-CG2 4.13Å
186	H	83.6	Confident	81.2	Confident	117 Å²	117	51.8 Å²	51.8	54%	0.542	29%	0.293	S	S	.	.			trans	-81	-25.9	-173.7	-174.9	84.9	0	0	0	113.6	P120	P120-H186 HydrophobicContact CB-CB 4.02Å; P120-H186 HydrophobicContact CG-CB 4.09Å; P120-H186 WeakPolarHBondContact O-CB 3.14Å; P120-H186 PolarHBondContact O-N 3.39Å; P120-H186 VanDerWaalsContact O-N 3.1Å
187	E	80.6	Confident	81.7	Confident	83 Å²	83	56.1 Å²	56.1	39%	0.388	31%	0.311	S	S	.	.	S	Bend	trans	-78.3	136.7	-174.8	-55.8	-170.8	147.2	0	0	113.1	P120 I189 Y190	P120-E187 HydrophobicContact CG-CG 3.87Å; E187-I189 HydrophobicContact CB-CG1 4.13Å; E187-I189 PolarHBondContact O-N 2.75Å; E187-I189 VanDerWaalsContact O-N 3.07Å; E187-Y190 HydrophobicContact CB-CD2 4.01Å; E187-Y190 HydrophobicContact CB-CE2 4.29Å; E187-Y190 PolarHBondContact O-N 2.93Å; E187-Y190 WeakPolarHBondContact OE2-CE2 3.04Å
188	S	79.4	Confident	82.2	Confident	97 Å²	97	56 Å²	56	68%	0.678	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-64.1	-18.3	-172.1	60.1	0	0	0	0	115.2	Y190	S188-Y190 VanDerWaalsContact C-N 3.34Å
189	I	70.9	Confident	82.6	Confident	103 Å²	103	59 Å²	59	53%	0.528	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-68.5	-31.5	174.1	54.7	173.2	0	0	0	112.5	E187 K191	E187-I189 HydrophobicContact CB-CG1 4.13Å; E187-I189 PolarHBondContact O-N 2.75Å; E187-I189 VanDerWaalsContact O-N 3.07Å; I189-K191 VanDerWaalsContact C-N 3.3Å; I189-K191 PolarHBondContact O-N 3.44Å
190	Y	79.9	Confident	82.7	Confident	42 Å²	42	59.3 Å²	59.3	17%	0.165	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-91	17.8	-179.8	-55.4	-63.9	0	0	0	113.2	D79 I80 L185 E187 S188 N192 V193	D79-Y190 WeakPolarHBondContact OD1-CE1 3.41Å; I80-Y190 HydrophobicContact CB-CD1 4.16Å; I80-Y190 HydrophobicContact CB-CE1 4.06Å; I80-Y190 HydrophobicContact CD1-CE1 4.18Å; I80-Y190 HydrophobicContact CG1-CE1 4.16Å; L185-Y190 HydrophobicContact CB-CD2 4.24Å; L185-Y190 HydrophobicContact CB-CG 4.34Å; L185-Y190 HydrophobicContact CD1-CD1 4.29Å; L185-Y190 HydrophobicContact CD1-CD2 4.13Å; L185-Y190 HydrophobicContact CD1-CG 3.77Å; L185-Y190 HydrophobicContact CD2-CD2 4.43Å; E187-Y190 HydrophobicContact CB-CD2 4.01Å; E187-Y190 HydrophobicContact CB-CE2 4.29Å; E187-Y190 PolarHBondContact O-N 2.93Å; E187-Y190 WeakPolarHBondContact OE2-CE2 3.04Å; S188-Y190 VanDerWaalsContact C-N 3.34Å; Y190-N192 PolarHBondContact O-N 3.02Å; Y190-V193 HydrophobicContact CD1-CG2 4.31Å; Y190-V193 WeakPolarHBondContact O-CB 3.47Å; Y190-V193 PolarHBondContact O-N 2.96Å
191	K	77.5	Confident	82.6	Confident	178 Å²	178	59.4 Å²	59.4	77%	0.774	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-16.2	176.7	-100.9	-170.4	171.1	-172.2	0	115.2	I189	I189-K191 VanDerWaalsContact C-N 3.3Å; I189-K191 PolarHBondContact O-N 3.44Å
192	N	80.2	Confident	82.2	Confident	147 Å²	147	59.4 Å²	59.4	79%	0.786	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-13.2	176.7	-65.2	4	0	0	0	112.8	Y190	Y190-N192 PolarHBondContact O-N 3.02Å
193	V	84.4	Confident	81.5	Confident	21 Å²	21	60.6 Å²	60.6	13%	0.127	32%	0.321	C	S	.	.	S	Bend	trans	-81.4	121.3	179.3	-175	0	0	0	0	108.7	I80 I83 L185 Y190	I80-V193 HydrophobicContact CG2-CG1 4.49Å; I80-V193 HydrophobicContact CG2-CG2 4.47Å; I80-V193 WeakPolarHBondContact O-CG2 3.38Å; I83-V193 HydrophobicContact CG1-CG1 4.17Å; I83-V193 HydrophobicContact CG2-CG1 4.23Å; L185-V193 HydrophobicContact CD1-CB 4.11Å; L185-V193 HydrophobicContact CD1-CG1 3.97Å; L185-V193 HydrophobicContact CD1-CG2 4.13Å; Y190-V193 HydrophobicContact CD1-CG2 4.31Å; Y190-V193 WeakPolarHBondContact O-CB 3.47Å; Y190-V193 PolarHBondContact O-N 2.96Å
194	A	81.8	Confident	80.6	Confident	69 Å²	69	62.1 Å²	62.1	57%	0.57	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-65.4	140.6	179.3	0	0	0	0	0	111.5	I83	I83-A194 WeakPolarHBondContact CG1-O 3.42Å
195	P	86.3	Confident	80	Confident	72 Å²	72	64.3 Å²	64.3	47%	0.468	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-68.3	138.4	172.7	30.2	-34.6	0	0	0	110.3	V183 A184	V183-P195 CarbonylContact O-C 3.5Å; V183-P195 VanDerWaalsContact O-CA 3.26Å; V183-P195 WeakPolarHBondContact O-CA 3.3Å; V183-P195 WeakPolarHBondContact O-CB 3.11Å; A184-P195 HydrophobicContact CB-CB 4.17Å
196	S	87.5	Confident	79.3	Confident	18 Å²	18	64.1 Å²	64.1	13%	0.126	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	155.3	175.1	-171.9	0	0	0	0	110.8	I83 E84 I85 S182 V183	I83-S196 WeakPolarHBondContact O-CB 3.4Å; E84-S196 WeakPolarHBondContact CA-OG 3.3Å; I85-S196 PolarHBondContact N-OG 2.81Å; S182-S196 CarbonylContact C-O 3.58Å; S182-S196 WeakPolarHBondContact CA-O 3.11Å; S182-S196 PolarHBondContact OG-O 2.75Å; V183-S196 PolarHBondContact N-O 2.82Å; V183-S196 PolarHBondContact O-N 2.83Å
197	Q	84.2	Confident	79	Confident	119 Å²	119	63.3 Å²	63.3	56%	0.556	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.8	149.6	-180	-57.4	-166.2	8.4	0	0	111.2	V180 V181	V180-Q197 HydrophobicContact CG1-CB 4.17Å; V181-Q197 CarbonylContact O-C 3.59Å; V181-Q197 VanDerWaalsContact O-CA 3.26Å; V181-Q197 WeakPolarHBondContact O-CA 3.33Å
198	V	80.8	Confident	79.2	Confident	16 Å²	16	60 Å²	60	10%	0.097	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	136.5	170.1	67.6	0	0	0	0	110	I85 T87 L101 V180 V181 L200	I85-V198 HydrophobicContact CB-CG1 4.42Å; I85-V198 HydrophobicContact CD1-CB 4.48Å; I85-V198 HydrophobicContact CD1-CG1 4.06Å; I85-V198 HydrophobicContact CG2-CB 4.45Å; I85-V198 HydrophobicContact CG2-CG1 3.9Å; T87-V198 HydrophobicContact CG2-CG2 4.41Å; L101-V198 HydrophobicContact CD1-CG1 4.21Å; V180-V198 CarbonylContact C-O 2.9Å; V180-V198 WeakPolarHBondContact CA-O 3.29Å; V181-V198 HydrophobicContact CB-CG1 4.16Å; V181-V198 PolarHBondContact N-O 2.72Å; V181-V198 PolarHBondContact O-N 3.05Å; V198-L200 HydrophobicContact CG2-CD2 4.33Å
199	R	78.8	Confident	79.2	Confident	84 Å²	84	58 Å²	58	32%	0.317	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.2	175.1	-174.6	172.5	-81	-102.4	-5.1	109.6	D128 S178 A179 V180	D128-R199 IonicContact OD1-CZ 3.81Å; D128-R199 IonicContact OD1-NH1 2.72Å; D128-R199 PolarHBondContact OD1-NH1 3.09Å; D128-R199 IonicContact OD1-NH2 3.93Å; D128-R199 PolarHBondContact OD1-NH2 2.87Å; D128-R199 IonicContact OD2-CZ 2.83Å; D128-R199 IonicContact OD2-NH1 3.99Å; D128-R199 PolarHBondContact OD2-NH1 2.73Å; D128-R199 IonicContact OD2-NH2 2.87Å; S178-R199 PolarHBondContact OG-NH1 3.01Å; A179-R199 WeakPolarHBondContact O-CA 3.46Å; V180-R199 HydrophobicContact CG2-CB 4.1Å; V180-R199 HydrophobicContact CG2-CG 4.07Å
200	L	78.6	Confident	80	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140	-177.5	-57.9	176.2	0	0	0	110	Q90 L92 L140 I171 A179 V181 V198	Q90-L200 WeakPolarHBondContact O-CA 3.43Å; L92-L200 HydrophobicContact CD1-CB 4.49Å; L92-L200 HydrophobicContact CD1-CD1 4.24Å; L140-L200 HydrophobicContact CD1-CB 4.25Å; L140-L200 HydrophobicContact CD1-CD1 3.95Å; I171-L200 HydrophobicContact CD1-CD1 4.5Å; A179-L200 PolarHBondContact N-O 3.12Å; A179-L200 VanDerWaalsContact N-O 3.07Å; A179-L200 PolarHBondContact O-N 3.02Å; V181-L200 HydrophobicContact CG2-CD1 3.96Å; V198-L200 HydrophobicContact CG2-CD2 4.33Å
201	L	77.4	Confident	80	Confident	15 Å²	15	55.4 Å²	55.4	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.5	-179.2	-177.6	72.2	0	0	0	110.2	Q90 E91 L92 M203 R305	Q90-L201 PolarHBondContact O-N 3.1Å; E91-L201 CarbonylContact C-O 3.55Å; E91-L201 WeakPolarHBondContact CA-O 3.44Å; E91-L201 HydrophobicContact CG-CD2 4.44Å; L92-L201 PolarHBondContact N-O 3.28Å; L201-M203 HydrophobicContact CD2-CG 4.07Å; L201-M203 HydrophobicContact CD2-SD 3.7Å; L201-M203 HydrophobicContact CG-CG 4.13Å; L201-M203 HydrophobicContact CG-SD 4.41Å; L201-R305 HydrophobicContact CD2-CG 4.3Å; L201-R305 VanDerWaalsContact CD2-NE 3.27Å
202	V	76.9	Confident	80.4	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.8	176.7	-172.2	0	0	0	0	110.7	L92 L94 V139 L140 R175 T176 G177	L92-V202 HydrophobicContact CB-CG2 4.37Å; L92-V202 CarbonylContact O-C 2.83Å; L92-V202 VanDerWaalsContact O-CA 3.25Å; L92-V202 WeakPolarHBondContact O-CA 3.35Å; L94-V202 HydrophobicContact CD1-CG1 4.29Å; V139-V202 HydrophobicContact CG1-CB 4.49Å; V139-V202 HydrophobicContact CG1-CG2 3.84Å; L140-V202 HydrophobicContact CD2-CG2 3.91Å; R175-V202 VanDerWaalsContact O-CB 3.23Å; R175-V202 WeakPolarHBondContact O-CB 3.14Å; R175-V202 WeakPolarHBondContact O-CG1 3Å; T176-V202 VanDerWaalsContact CA-O 3.31Å; T176-V202 WeakPolarHBondContact CA-O 3.31Å; G177-V202 PolarHBondContact N-O 2.81Å; G177-V202 VanDerWaalsContact N-O 3.14Å; G177-V202 PolarHBondContact O-N 3.39Å
203	M	73.5	Confident	80.7	Confident	33 Å²	33	44.2 Å²	44.2	16%	0.163	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	158.1	-174.6	-70.9	-177.2	61.6	0	0	113.6	L92 Y93 L94 L201	L92-M203 PolarHBondContact O-N 3.02Å; Y93-M203 WeakPolarHBondContact CA-O 3.34Å; L94-M203 PolarHBondContact N-O 2.74Å; L201-M203 HydrophobicContact CD2-CG 4.07Å; L201-M203 HydrophobicContact CD2-SD 3.7Å; L201-M203 HydrophobicContact CG-CG 4.13Å; L201-M203 HydrophobicContact CG-SD 4.41Å
204	A	73.1	Confident	80.9	Confident	34 Å²	34	44.6 Å²	44.6	28%	0.281	26%	0.259	S	S	.	.			trans	-94.7	161.1	173.6	0	0	0	0	0	111.7	T176	T176-A204 HydrophobicContact CG2-CB 4.04Å
205	N	75.8	Confident	81.3	Confident	72 Å²	72	41.3 Å²	41.3	39%	0.385	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	94.7	-179	-171.8	5.2	0	0	0	110	I228	N205-I228 HydrophobicContact CB-CB 4.42Å; N205-I228 PolarHBondContact O-N 3.15Å
206	A	75	Confident	81.4	Confident	19 Å²	19	38.1 Å²	38.1	16%	0.157	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.9	-173.9	0	0	0	0	0	112	H226 V227 L275	A206-H226 CarbonylContact C-O 3.56Å; A206-H226 VanDerWaalsContact CA-O 3.29Å; A206-H226 WeakPolarHBondContact CA-O 3.22Å; A206-V227 HydrophobicContact CB-CG2 4Å; A206-L275 HydrophobicContact CB-CD2 4.48Å
207	Q	77.3	Confident	81.4	Confident	100 Å²	100	38.1 Å²	38.1	47%	0.467	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152.3	-168.8	-57.6	-174.9	8.1	0	0	112	H226	Q207-H226 PolarHBondContact N-O 3.24Å; Q207-H226 PolarHBondContact O-N 2.76Å
208	L	84.2	Confident	81.5	Confident	14 Å²	14	35.1 Å²	35.1	7%	0.073	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.3	172.7	-75.6	170.1	0	0	0	110.1	A211 V225 L245 L275	L208-A211 PolarHBondContact O-N 2.75Å; L208-V225 HydrophobicContact CD2-CG2 4.03Å; L208-L245 HydrophobicContact CD2-CD2 3.57Å; L208-L275 HydrophobicContact CD1-CB 4.05Å; L208-L275 HydrophobicContact CD2-CB 4.13Å; L208-L275 HydrophobicContact CD2-CD1 4.26Å; L208-L275 HydrophobicContact CD2-CD2 4.42Å; L208-L275 HydrophobicContact CG-CB 4.08Å; L208-L275 HydrophobicContact CG-CD2 4.5Å
209	S	79.9	Confident	81.8	Confident	56 Å²	56	34.4 Å²	34.4	39%	0.392	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.9	174.1	-169	0	0	0	0	111.1	F223 T224	S209-F223 WeakPolarHBondContact O-CA 3.36Å; S209-T224 WeakPolarHBondContact CB-OG1 3.39Å; S209-T224 PolarHBondContact N-O 3.16Å; S209-T224 PolarHBondContact O-N 2.93Å
210	P	86.4	Confident	82.3	Confident	32 Å²	32	33.8 Å²	33.8	21%	0.208	20%	0.197	C	C	.	.	S	Bend	cis	-68.3	153.2	-13.6	31.6	-35.3	0	0	0	111.7	A213 L221 S310	P210-A213 HydrophobicContact CG-CB 4.05Å; P210-L221 HydrophobicContact CG-CD1 3.98Å; P210-L221 HydrophobicContact CG-CD2 4.48Å; P210-S310 PolarHBondContact O-OG 3.14Å
211	A	80.6	Confident	82.7	Confident	57 Å²	57	33.5 Å²	33.5	47%	0.471	20%	0.195	S	C	.	.	S	Bend	trans	-89	-9.1	173.3	0	0	0	0	0	113.8	L208 S310 L311	L208-A211 PolarHBondContact O-N 2.75Å; A211-S310 VanDerWaalsContact C-OG 3.26Å; A211-S310 VanDerWaalsContact O-CA 3.25Å; A211-S310 WeakPolarHBondContact O-CA 3.3Å; A211-S310 PolarHBondContact O-OG 3.45Å; A211-L311 PolarHBondContact O-N 3.33Å
212	L	85.9	Confident	83.3	Confident	86 Å²	86	36 Å²	36	45%	0.45	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	127.6	174.8	173.9	62.6	0	0	0	107.6	Y214 L311	L212-Y214 HydrophobicContact CD1-CE2 3.98Å; L212-Y214 HydrophobicContact CD2-CE2 3.82Å; L212-Y214 HydrophobicContact CG-CD2 4.48Å; L212-Y214 HydrophobicContact CG-CE2 3.76Å; L212-L311 WeakPolarHBondContact CA-O 3.3Å; L212-L311 HydrophobicContact CD1-CB 3.95Å; L212-L311 HydrophobicContact CD1-CD2 4.07Å; L212-L311 HydrophobicContact CD1-CG 4.24Å
213	A	85.4	Confident	83.8	Confident	4 Å²	4	36.2 Å²	36.2	3%	0.033	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	135.1	174.2	0	0	0	0	0	112.3	P210 L221 L311 I312 Q313	P210-A213 HydrophobicContact CG-CB 4.05Å; A213-L221 HydrophobicContact CB-CD2 3.74Å; A213-L311 PolarHBondContact N-O 2.94Å; A213-I312 HydrophobicContact CB-CD1 3.79Å; A213-Q313 PolarHBondContact O-N 3.11Å
214	Y	88.9	Confident	84.5	Confident	29 Å²	29	36.8 Å²	36.8	11%	0.114	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.4	173.1	-62.6	-94.7	0	0	0	108.5	L212 Q313 V315 H382 Y385	L212-Y214 HydrophobicContact CD1-CE2 3.98Å; L212-Y214 HydrophobicContact CD2-CE2 3.82Å; L212-Y214 HydrophobicContact CG-CD2 4.48Å; L212-Y214 HydrophobicContact CG-CE2 3.76Å; Y214-Q313 CarbonylContact C-O 2.98Å; Y214-Q313 WeakPolarHBondContact CA-O 3.35Å; Y214-Q313 HydrophobicContact CD1-CB 3.79Å; Y214-Q313 HydrophobicContact CD1-CG 4.48Å; Y214-Q313 HydrophobicContact CE1-CB 3.94Å; Y214-Q313 HydrophobicContact CE1-CG 4.14Å; Y214-V315 HydrophobicContact CD1-CG1 4.31Å; Y214-V315 HydrophobicContact CD1-CG2 4.33Å; Y214-H382 HydrophobicContact CD1-CB 3.5Å; Y214-H382 AromaticContact CD1-CG 3.76Å; Y214-H382 AromaticContact CD1-ND1 3.95Å; Y214-H382 HydrophobicContact CD2-CB 3.78Å; Y214-H382 HydrophobicContact CE1-CB 3.56Å; Y214-H382 AromaticContact CE1-CD2 3.67Å; Y214-H382 AromaticContact CE1-CE1 3.86Å; Y214-H382 AromaticContact CE1-CG 3.28Å; Y214-H382 AromaticContact CE1-ND1 3.43Å; Y214-H382 WeakPolarHBondContact CE1-ND1 3.5Å; Y214-H382 HydrophobicContact CE2-CB 3.82Å; Y214-H382 AromaticContact CE2-CD2 4Å; Y214-H382 HydrophobicContact CG-CB 3.63Å; Y214-H382 AromaticContact CZ-CD2 3.37Å; Y214-H382 AromaticContact CZ-CG 3.44Å; Y214-H382 VanDerWaalsContact CZ-CG 3.44Å; Y214-H382 AromaticContact CZ-ND1 3.99Å; Y214-H382 AromaticContact CZ-NE2 3.88Å; Y214-H382 PolarHBondContact OH-CD2 3.2Å; Y214-H382 VanDerWaalsContact OH-CD2 3.25Å; Y214-H382 PolarHBondContact OH-NE2 3.19Å; Y214-Y385 WeakPolarHBondContact O-CB 3.25Å; Y214-Y385 PolarHBondContact O-N 3.08Å
215	L	90	Very high	85.1	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	152.3	-173.4	-70.1	176.3	0	0	0	110.8	S219 L221 L263 A265 I312 Q313 I314 V315 Y385	L215-S219 WeakPolarHBondContact CB-OG 3.38Å; L215-S219 WeakPolarHBondContact CD2-OG 3.49Å; L215-L221 HydrophobicContact CD1-CB 4.13Å; L215-L221 HydrophobicContact CD1-CD2 4.2Å; L215-L221 HydrophobicContact CD2-CB 4.18Å; L215-L263 HydrophobicContact CD1-CD2 3.69Å; L215-A265 HydrophobicContact CB-CB 4.1Å; L215-A265 HydrophobicContact CD1-CB 4.19Å; L215-I312 HydrophobicContact CD1-CG2 3.88Å; L215-Q313 PolarHBondContact N-O 3.47Å; L215-I314 HydrophobicContact CB-CG1 4.38Å; L215-I314 CarbonylContact O-C 3.49Å; L215-I314 VanDerWaalsContact O-CA 3.25Å; L215-I314 WeakPolarHBondContact O-CA 3.25Å; L215-V315 PolarHBondContact O-N 2.91Å; L215-Y385 HydrophobicContact CD2-CD1 4.4Å; L215-Y385 HydrophobicContact CD2-CG 4.45Å
216	V	88.3	Confident	85.5	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.024	20%	0.196	C	C	.	.			trans	-94	155.6	166.2	-60.4	0	0	0	0	110	N218 S219 A265 P317 L384 L390 V432 F442	V216-N218 PolarHBondContact O-N 2.82Å; V216-S219 PolarHBondContact N-OG 2.9Å; V216-S219 WeakPolarHBondContact O-CB 3.34Å; V216-S219 PolarHBondContact O-N 2.88Å; V216-S219 PolarHBondContact O-OG 2.81Å; V216-A265 WeakPolarHBondContact O-CB 3Å; V216-P317 HydrophobicContact CG1-CB 4.18Å; V216-P317 HydrophobicContact CG1-CG 4.01Å; V216-L384 HydrophobicContact CG1-CD1 3.88Å; V216-L384 HydrophobicContact CG1-CD2 3.82Å; V216-L384 HydrophobicContact CG1-CG 4.48Å; V216-L390 HydrophobicContact CG2-CD2 3.96Å; V216-V432 HydrophobicContact CG2-CG2 3.75Å; V216-F442 HydrophobicContact CB-CE1 4.38Å; V216-F442 HydrophobicContact CB-CZ 4.41Å; V216-F442 HydrophobicContact CG2-CZ 4.18Å
217	P	87.7	Confident	85.7	Confident	19 Å²	19	33.4 Å²	33.4	12%	0.123	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	140.5	172.6	-28.4	36	0	0	0	112.5	S219 Y268 I314	P217-S219 PolarHBondContact O-N 2.83Å; P217-Y268 VanDerWaalsContact CD-CE1 3.47Å; P217-Y268 HydrophobicContact CG-CD1 3.83Å; P217-Y268 HydrophobicContact CG-CE1 3.39Å; P217-Y268 HydrophobicContact CG-CE2 4.15Å; P217-Y268 HydrophobicContact CG-CG 4.37Å; P217-I314 HydrophobicContact CG-CG2 4.05Å
218	N	87.6	Confident	85.4	Confident	55 Å²	55	31.6 Å²	31.6	29%	0.294	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	0.9	-173	-58.2	-65.5	0	0	0	117.2	V216 A265 N389 V432	V216-N218 PolarHBondContact O-N 2.82Å; N218-A265 VanDerWaalsContact CA-O 3.29Å; N218-A265 WeakPolarHBondContact CA-O 3.14Å; N218-A265 PolarHBondContact N-O 2.96Å; N218-N389 PolarHBondContact O-ND2 2.61Å; N218-V432 HydrophobicContact CB-CB 4.47Å; N218-V432 HydrophobicContact CB-CG1 3.98Å
219	S	87.3	Confident	84.4	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.007	20%	0.202	C	C	.	.			trans	-73.3	162.7	172.9	63.7	0	0	0	0	113.1	L215 V216 P217 A265 S387	L215-S219 WeakPolarHBondContact CB-OG 3.38Å; L215-S219 WeakPolarHBondContact CD2-OG 3.49Å; V216-S219 PolarHBondContact N-OG 2.9Å; V216-S219 WeakPolarHBondContact O-CB 3.34Å; V216-S219 PolarHBondContact O-N 2.88Å; V216-S219 PolarHBondContact O-OG 2.81Å; P217-S219 PolarHBondContact O-N 2.83Å; S219-A265 PolarHBondContact O-N 3.27Å; S219-S387 WeakPolarHBondContact CB-OG 3.48Å
220	L	87.8	Confident	83.4	Confident	71 Å²	71	41.1 Å²	41.1	37%	0.372	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.3	-176.5	-59.4	175.1	0	0	0	111.1	L263 K264 S387	L220-L263 WeakPolarHBondContact CA-O 3.21Å; L220-K264 HydrophobicContact CD2-CB 3.76Å; L220-K264 HydrophobicContact CD2-CD 4.47Å; L220-K264 HydrophobicContact CD2-CG 3.86Å; L220-S387 WeakPolarHBondContact O-CB 3.29Å
221	L	88.3	Confident	81.9	Confident	1 Å²	1	43 Å²	43	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147.7	179.1	172.1	63.2	0	0	0	109.6	P210 A213 L215 F223 T262 L263 I312 Y385	P210-L221 HydrophobicContact CG-CD1 3.98Å; P210-L221 HydrophobicContact CG-CD2 4.48Å; A213-L221 HydrophobicContact CB-CD2 3.74Å; L215-L221 HydrophobicContact CD1-CB 4.13Å; L215-L221 HydrophobicContact CD1-CD2 4.2Å; L215-L221 HydrophobicContact CD2-CB 4.18Å; L221-F223 HydrophobicContact CD2-CE1 3.99Å; L221-F223 HydrophobicContact CD2-CE2 4.4Å; L221-F223 HydrophobicContact CD2-CZ 3.83Å; L221-T262 CarbonylContact O-C 3.27Å; L221-T262 VanDerWaalsContact O-CA 3.26Å; L221-T262 WeakPolarHBondContact O-CA 3.3Å; L221-T262 WeakPolarHBondContact O-CG2 3.38Å; L221-L263 PolarHBondContact N-O 3.18Å; L221-L263 PolarHBondContact O-N 2.87Å; L221-I312 HydrophobicContact CD2-CD1 3.49Å; L221-I312 VanDerWaalsContact CD2-CD1 3.49Å; L221-Y385 HydrophobicContact CD1-CD1 3.81Å; L221-Y385 HydrophobicContact CD1-CD2 3.8Å; L221-Y385 HydrophobicContact CD1-CE1 3.58Å; L221-Y385 HydrophobicContact CD1-CE2 3.56Å; L221-Y385 HydrophobicContact CD1-CG 3.92Å; L221-Y385 VanDerWaalsContact CD1-CZ 3.46Å
222	T	88.6	Confident	80.7	Confident	68 Å²	68	45.5 Å²	45.5	42%	0.417	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.8	173.4	-55.1	0	0	0	0	109.8	S261 T262	T222-S261 WeakPolarHBondContact CA-O 3.02Å; T222-T262 PolarHBondContact OG1-OG1 2.7Å
223	F	87.8	Confident	79.8	Confident	5 Å²	5	45.9 Å²	45.9	2%	0.022	26%	0.255	C	S	.	.			trans	-93.4	145.2	-178.2	-64.6	-77.6	0	0	0	113.2	S209 L221 L245 S261 L263 V273 I312	S209-F223 WeakPolarHBondContact O-CA 3.36Å; L221-F223 HydrophobicContact CD2-CE1 3.99Å; L221-F223 HydrophobicContact CD2-CE2 4.4Å; L221-F223 HydrophobicContact CD2-CZ 3.83Å; F223-L245 HydrophobicContact CB-CD1 4.06Å; F223-L245 HydrophobicContact CD2-CD1 4.07Å; F223-L245 HydrophobicContact CG-CD1 4.36Å; F223-S261 WeakPolarHBondContact CD2-O 3.36Å; F223-S261 PolarHBondContact N-O 2.75Å; F223-L263 HydrophobicContact CE2-CB 4.09Å; F223-L263 HydrophobicContact CE2-CD1 4.01Å; F223-L263 HydrophobicContact CZ-CD1 4.35Å; F223-V273 HydrophobicContact CD2-CG1 4.5Å; F223-V273 HydrophobicContact CE2-CB 4.29Å; F223-V273 HydrophobicContact CE2-CG1 3.94Å; F223-V273 HydrophobicContact CE2-CG2 4Å; F223-V273 HydrophobicContact CZ-CB 4.03Å; F223-V273 HydrophobicContact CZ-CG1 4.15Å; F223-V273 HydrophobicContact CZ-CG2 3.75Å; F223-I312 HydrophobicContact CE1-CD1 4.27Å; F223-I312 HydrophobicContact CZ-CD1 3.87Å; F223-I312 HydrophobicContact CZ-CG1 4.2Å
224	T	88.1	Confident	79.4	Confident	45 Å²	45	50.3 Å²	50.3	28%	0.276	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	161.3	162.9	70.7	0	0	0	0	111.1	S209 H226 E235	S209-T224 WeakPolarHBondContact CB-OG1 3.39Å; S209-T224 PolarHBondContact N-O 3.16Å; S209-T224 PolarHBondContact O-N 2.93Å; T224-H226 PolarHBondContact OG1-NE2 3.39Å; T224-E235 WeakPolarHBondContact CG2-OE1 3.26Å
225	V	86.4	Confident	79.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.8	-175.8	175.2	0	0	0	0	108.9	L208 E235 V236 M238 L275	L208-V225 HydrophobicContact CD2-CG2 4.03Å; V225-E235 CarbonylContact O-C 3.45Å; V225-E235 WeakPolarHBondContact O-CA 3.44Å; V225-V236 HydrophobicContact CB-CB 4.11Å; V225-V236 HydrophobicContact CG1-CB 4.02Å; V225-V236 HydrophobicContact CG1-CG2 4.16Å; V225-V236 PolarHBondContact O-N 3.36Å; V225-M238 HydrophobicContact CG2-SD 4.42Å; V225-L275 HydrophobicContact CG1-CD1 4.27Å; V225-L275 HydrophobicContact CG1-CD2 3.83Å; V225-L275 HydrophobicContact CG2-CD1 3.9Å
226	H	84.4	Confident	78.8	Confident	43 Å²	43	56.5 Å²	56.5	20%	0.199	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145.5	-175.4	-75.3	-104.9	0	0	0	111.3	A206 Q207 T224 D233 Q234	A206-H226 CarbonylContact C-O 3.56Å; A206-H226 VanDerWaalsContact CA-O 3.29Å; A206-H226 WeakPolarHBondContact CA-O 3.22Å; Q207-H226 PolarHBondContact N-O 3.24Å; Q207-H226 PolarHBondContact O-N 2.76Å; T224-H226 PolarHBondContact OG1-NE2 3.39Å; H226-D233 WeakPolarHBondContact CB-OD1 3.22Å; H226-D233 IonicContact CE1-OD2 2.61Å; H226-D233 IonicContact CG-OD1 2.92Å; H226-D233 IonicContact ND1-OD1 3.15Å; H226-D233 PolarHBondContact ND1-OD1 3.29Å; H226-D233 IonicContact ND1-OD2 3.66Å; H226-D233 PolarHBondContact ND1-OD2 2.82Å; H226-Q234 WeakPolarHBondContact CA-O 3.4Å
227	V	78.4	Confident	78.5	Confident	10 Å²	10	61.2 Å²	61.2	6%	0.061	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	128.3	179.8	-175.5	0	0	0	0	110.7	A206 Q229 Q234 V236	A206-V227 HydrophobicContact CB-CG2 4Å; V227-Q229 HydrophobicContact CG1-CG 4.3Å; V227-Q234 PolarHBondContact N-O 2.91Å; V227-Q234 PolarHBondContact O-N 3.17Å; V227-Q234 VanDerWaalsContact O-N 3.08Å; V227-V236 HydrophobicContact CG2-CG2 3.73Å
228	I	70.9	Confident	78.2	Confident	62 Å²	62	62.5 Å²	62.5	32%	0.318	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.3	-178.7	-59	172.4	0	0	0	110.3	N205 D232	N205-I228 HydrophobicContact CB-CB 4.42Å; N205-I228 PolarHBondContact O-N 3.15Å; I228-D232 CarbonylContact C-O 3.53Å; I228-D232 WeakPolarHBondContact CA-O 3.15Å
229	Q	63.2	Low	77.9	Confident	96 Å²	96	64.8 Å²	64.8	45%	0.449	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	119.3	177.9	-61.8	-174.9	46.4	0	0	110.9	V227 G231 D232	V227-Q229 HydrophobicContact CG1-CG 4.3Å; Q229-G231 PolarHBondContact O-N 2.78Å; Q229-D232 PolarHBondContact N-O 2.82Å; Q229-D232 WeakPolarHBondContact O-CB 3.21Å; Q229-D232 PolarHBondContact O-N 3.35Å
230	Q	59.2	Low	77.6	Confident	175 Å²	175	66.1 Å²	66.1	82%	0.818	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	15.1	179.5	-56.3	-174.1	6.7	0	0	115.7
231	G	55.4	Low	77.2	Confident	71 Å²	71	70.2 Å²	70.2	73%	0.732	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.7	-6.5	-176.5	0	0	0	0	0	114.7	Q229	Q229-G231 PolarHBondContact O-N 2.78Å
232	D	55.1	Low	76.8	Confident	109 Å²	109	73 Å²	73	58%	0.583	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	144.9	179.2	-139	17	0	0	0	110.7	I228 Q229	I228-D232 CarbonylContact C-O 3.53Å; I228-D232 WeakPolarHBondContact CA-O 3.15Å; Q229-D232 PolarHBondContact N-O 2.82Å; Q229-D232 WeakPolarHBondContact O-CB 3.21Å; Q229-D232 PolarHBondContact O-N 3.35Å
233	D	67.1	Low	76.5	Confident	95 Å²	95	71 Å²	71	51%	0.508	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.7	-178.6	175.8	21.8	0	0	0	110.9	H226	H226-D233 WeakPolarHBondContact CB-OD1 3.22Å; H226-D233 IonicContact CE1-OD2 2.61Å; H226-D233 IonicContact CG-OD1 2.92Å; H226-D233 IonicContact ND1-OD1 3.15Å; H226-D233 PolarHBondContact ND1-OD1 3.29Å; H226-D233 IonicContact ND1-OD2 3.66Å; H226-D233 PolarHBondContact ND1-OD2 2.82Å
234	Q	76.7	Confident	76.5	Confident	97 Å²	97	73.8 Å²	73.8	45%	0.453	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129.2	-176.9	-62.8	-175.8	1.5	0	0	112.4	H226 V227	H226-Q234 WeakPolarHBondContact CA-O 3.4Å; V227-Q234 PolarHBondContact N-O 2.91Å; V227-Q234 PolarHBondContact O-N 3.17Å; V227-Q234 VanDerWaalsContact O-N 3.08Å
235	E	82.5	Confident	76.5	Confident	129 Å²	129	72.6 Å²	72.6	60%	0.603	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	136.7	175.8	-171.5	-177.1	177.7	0	0	111.9	T224 V225	T224-E235 WeakPolarHBondContact CG2-OE1 3.26Å; V225-E235 CarbonylContact O-C 3.45Å; V225-E235 WeakPolarHBondContact O-CA 3.44Å
236	V	83	Confident	76.6	Confident	30 Å²	30	77.5 Å²	77.5	18%	0.182	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-101.8	119.3	179.2	179.7	0	0	0	0	110.6	V225 V227 M238 Y243	V225-V236 HydrophobicContact CB-CB 4.11Å; V225-V236 HydrophobicContact CG1-CB 4.02Å; V225-V236 HydrophobicContact CG1-CG2 4.16Å; V225-V236 PolarHBondContact O-N 3.36Å; V227-V236 HydrophobicContact CG2-CG2 3.73Å; V236-M238 PolarHBondContact O-N 2.89Å; V236-Y243 HydrophobicContact CG1-CD2 4.06Å
237	S	82	Confident	76.8	Confident	104 Å²	104	76.3 Å²	76.3	73%	0.727	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-63.6	133.1	176.5	-48.3	0	0	0	0	112.3
238	M	82.8	Confident	77	Confident	46 Å²	46	81.1 Å²	81.1	23%	0.227	44%	0.441	C	S	.	.	S	Bend	trans	-106.1	145.3	178.2	-72.5	-68.4	-73	0	0	111.6	V225 V236 L245	V225-M238 HydrophobicContact CG2-SD 4.42Å; V236-M238 PolarHBondContact O-N 2.89Å; M238-L245 HydrophobicContact CE-CD1 4.08Å; M238-L245 HydrophobicContact CE-CG 3.85Å
239	P	81.2	Confident	77.7	Confident	103 Å²	103	80.9 Å²	80.9	67%	0.669	44%	0.44	S	S	*	.	S	Bend	cis	-73.6	137.6	-5.8	30.5	-35.3	0	0	0	112.8
240	S	79.8	Confident	78.9	Confident	29 Å²	29	80.6 Å²	80.6	20%	0.203	45%	0.445	C	S	.	.			trans	-95.2	156.2	-177.5	178.2	0	0	0	0	113	Q242 Y243	S240-Q242 PolarHBondContact OG-N 2.98Å; S240-Y243 WeakPolarHBondContact CB-O 3.22Å; S240-Y243 PolarHBondContact OG-N 2.74Å
241	L	80.5	Confident	80.1	Confident	156 Å²	156	77.6 Å²	77.6	82%	0.817	43%	0.434	S	S	*	.	S	Bend	trans	-81.3	-21.2	174.5	-71.3	176.2	0	0	0	113.6	R278	L241-R278 WeakPolarHBondContact O-CD 3.27Å; L241-R278 PolarHBondContact O-NH1 2.86Å
242	Q	79.3	Confident	81.6	Confident	61 Å²	61	75.3 Å²	75.3	29%	0.285	41%	0.406	S	S	.	.	S	Bend	trans	-102.5	-41.6	177.1	-179.3	178.5	-5	0	0	111.9	S240 D277 R278 N279	S240-Q242 PolarHBondContact OG-N 2.98Å; Q242-D277 WeakPolarHBondContact CG-OD1 3.17Å; Q242-D277 PolarHBondContact NE2-OD1 3.18Å; Q242-D277 PolarHBondContact NE2-OD2 3.45Å; Q242-D277 VanDerWaalsContact NE2-OD2 3.09Å; Q242-R278 PolarHBondContact O-N 3.43Å; Q242-R278 VanDerWaalsContact O-N 3.16Å; Q242-N279 VanDerWaalsContact CD-ND2 3.33Å; Q242-N279 PolarHBondContact NE2-ND2 2.95Å
243	Y	83.3	Confident	83.2	Confident	24 Å²	24	70.1 Å²	70.1	9%	0.094	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.5	-170.8	-60.2	-77.9	0	0	0	112.3	V236 S240 L275 L276 D277	V236-Y243 HydrophobicContact CG1-CD2 4.06Å; S240-Y243 WeakPolarHBondContact CB-O 3.22Å; S240-Y243 PolarHBondContact OG-N 2.74Å; Y243-L275 HydrophobicContact CD1-CD2 4.45Å; Y243-L275 HydrophobicContact CD1-CG 4.43Å; Y243-L276 WeakPolarHBondContact CA-O 3.27Å; Y243-D277 HydrophobicContact CD1-CB 4.09Å; Y243-D277 HydrophobicContact CE1-CB 3.89Å
244	H	87.4	Confident	84.3	Confident	64 Å²	64	68.7 Å²	68.7	30%	0.296	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	161.5	174.6	68	-63.5	0	0	0	113.1	L275 L276 E281	H244-L275 WeakPolarHBondContact O-CA 3.47Å; H244-L276 WeakPolarHBondContact CE1-CB 3.45Å; H244-L276 PolarHBondContact N-O 3.46Å; H244-L276 VanDerWaalsContact N-O 3.11Å; H244-L276 PolarHBondContact ND1-O 3.14Å; H244-L276 PolarHBondContact O-N 2.99Å; H244-E281 IonicContact CE1-OE2 3.8Å
245	L	88.4	Confident	84.9	Confident	20 Å²	20	65.9 Å²	65.9	11%	0.105	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.5	-177.7	-59.9	179.2	0	0	0	111.9	L208 F223 M238 L255 V273 T274 L275	L208-L245 HydrophobicContact CD2-CD2 3.57Å; F223-L245 HydrophobicContact CB-CD1 4.06Å; F223-L245 HydrophobicContact CD2-CD1 4.07Å; F223-L245 HydrophobicContact CG-CD1 4.36Å; M238-L245 HydrophobicContact CE-CD1 4.08Å; M238-L245 HydrophobicContact CE-CG 3.85Å; L245-L255 HydrophobicContact CB-CD1 4.15Å; L245-V273 HydrophobicContact CB-CG1 4.33Å; L245-T274 WeakPolarHBondContact CA-O 3.24Å; L245-L275 HydrophobicContact CD2-CB 4.45Å; L245-L275 HydrophobicContact CD2-CD1 3.75Å
246	Q	87.7	Confident	85	Confident	103 Å²	103	62.1 Å²	62.1	48%	0.481	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.4	174	-178.2	-178.2	6.8	0	0	110.7	V273 T274 L276	Q246-V273 CarbonylContact O-C 3.56Å; Q246-V273 VanDerWaalsContact O-CA 3.32Å; Q246-V273 WeakPolarHBondContact O-CA 3.28Å; Q246-T274 PolarHBondContact N-O 3.39Å; Q246-T274 PolarHBondContact O-N 2.7Å; Q246-L276 HydrophobicContact CB-CD1 4.24Å
247	V	88.4	Confident	84.8	Confident	19 Å²	19	66.7 Å²	66.7	12%	0.115	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	141.1	170.9	-178.5	0	0	0	0	110	L255 L263 T271 E272 V273	V247-L255 HydrophobicContact CG2-CD1 3.77Å; V247-L255 HydrophobicContact CG2-CG 3.71Å; V247-L263 HydrophobicContact CG2-CD1 4.31Å; V247-T271 HydrophobicContact CG1-CG2 4.5Å; V247-E272 WeakPolarHBondContact CA-O 3.36Å; V247-V273 HydrophobicContact CG2-CG2 4.21Å
248	N	84.3	Confident	84.7	Confident	111 Å²	111	68.9 Å²	68.9	59%	0.594	38%	0.377	S	S	*	.	S	Bend	trans	-79.2	-58.2	-179.3	-161.6	-6.7	0	0	0	112.6	E272	N248-E272 HydrophobicContact CB-CB 4.05Å; N248-E272 PolarHBondContact N-O 3.17Å; N248-E272 PolarHBondContact ND2-OE2 3.11Å
249	D	85.4	Confident	84.6	Confident	56 Å²	56	69.4 Å²	69.4	30%	0.299	38%	0.381	S	S	.	.			trans	-107.7	113.9	174.8	-172.2	-2.4	0	0	0	112.6	N251 L252 A253 T271	D249-N251 WeakPolarHBondContact OD1-CB 3.22Å; D249-N251 PolarHBondContact OD1-N 3.45Å; D249-N251 PolarHBondContact OD1-ND2 2.93Å; D249-L252 HydrophobicContact CB-CD1 4.32Å; D249-A253 PolarHBondContact O-N 2.9Å; D249-T271 PolarHBondContact N-OG1 2.67Å; D249-T271 PolarHBondContact O-OG1 3.43Å
250	T	86.6	Confident	84.6	Confident	90 Å²	90	65.8 Å²	65.8	55%	0.552	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.4	179.3	54.8	0	0	0	0	114.8	L252 A253 V254	T250-L252 VanDerWaalsContact C-N 3.33Å; T250-A253 WeakPolarHBondContact CA-O 3.02Å; T250-V254 WeakPolarHBondContact O-CG2 3.07Å
251	N	85.3	Confident	85	Confident	112 Å²	112	65.1 Å²	65.1	60%	0.599	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-20	174.8	-55	-78.9	0	0	0	112.1	D249 N267	D249-N251 WeakPolarHBondContact OD1-CB 3.22Å; D249-N251 PolarHBondContact OD1-N 3.45Å; D249-N251 PolarHBondContact OD1-ND2 2.93Å; N251-N267 PolarHBondContact O-ND2 3.32Å
252	L	86.8	Confident	85.3	Confident	24 Å²	24	58.9 Å²	58.9	13%	0.126	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-43.1	179.5	-63.3	177.8	0	0	0	111.7	D249 T250 L266 N267 Q270 T271 I314	D249-L252 HydrophobicContact CB-CD1 4.32Å; T250-L252 VanDerWaalsContact C-N 3.33Å; L252-L266 WeakPolarHBondContact O-CB 3.3Å; L252-L266 PolarHBondContact O-N 2.72Å; L252-N267 HydrophobicContact CD2-CB 4.1Å; L252-Q270 WeakPolarHBondContact CD1-O 3.41Å; L252-T271 HydrophobicContact CB-CG2 4.33Å; L252-I314 HydrophobicContact CB-CD1 4.37Å; L252-I314 WeakPolarHBondContact O-CD1 3.18Å
253	A	88.2	Confident	85.9	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	152.5	178.6	0	0	0	0	0	113.6	D249 T250 L263 K264 T271	D249-A253 PolarHBondContact O-N 2.9Å; T250-A253 WeakPolarHBondContact CA-O 3.02Å; A253-L263 HydrophobicContact CB-CD1 3.91Å; A253-L263 HydrophobicContact CB-CD2 3.9Å; A253-L263 HydrophobicContact CB-CG 3.92Å; A253-K264 VanDerWaalsContact CA-O 3.27Å; A253-K264 WeakPolarHBondContact CA-O 3.05Å; A253-T271 HydrophobicContact CB-CG2 3.95Å
254	V	91	Very high	86.2	Confident	64 Å²	64	57.5 Å²	57.5	39%	0.388	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134.3	-178.1	175.5	0	0	0	0	111	T250 L263 K264 L266	T250-V254 WeakPolarHBondContact O-CG2 3.07Å; V254-L263 WeakPolarHBondContact O-CA 3.19Å; V254-K264 PolarHBondContact N-O 2.79Å; V254-K264 PolarHBondContact O-N 3.02Å; V254-L266 HydrophobicContact CG2-CD1 3.89Å
255	L	88.7	Confident	86.3	Confident	38 Å²	38	54.5 Å²	54.5	20%	0.199	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	142.9	171.4	-81.1	167.3	0	0	0	111.7	L245 V247 P257 T262 L263	L245-L255 HydrophobicContact CB-CD1 4.15Å; V247-L255 HydrophobicContact CG2-CD1 3.77Å; V247-L255 HydrophobicContact CG2-CG 3.71Å; L255-P257 WeakPolarHBondContact O-CD 2.98Å; L255-T262 CarbonylContact C-O 3.6Å; L255-T262 WeakPolarHBondContact CA-O 3.36Å; L255-L263 HydrophobicContact CD2-CB 4.28Å
256	N	85	Confident	86.3	Confident	50 Å²	50	56.2 Å²	56.2	27%	0.267	32%	0.315	S	S	.	.			trans	-71.2	118.9	172.5	-177.8	7.3	0	0	0	110.1	L258 D259 G260 T262	N256-L258 PolarHBondContact O-N 2.83Å; N256-L258 VanDerWaalsContact O-N 3.16Å; N256-L258 PolarHBondContact OD1-N 2.79Å; N256-L258 VanDerWaalsContact OD1-N 3.16Å; N256-D259 PolarHBondContact ND2-OD1 3.09Å; N256-D259 PolarHBondContact ND2-OD2 2.68Å; N256-D259 PolarHBondContact O-N 2.67Å; N256-G260 PolarHBondContact O-N 2.83Å; N256-G260 VanDerWaalsContact O-N 3.09Å; N256-T262 PolarHBondContact N-O 2.78Å
257	P	78.8	Confident	86.3	Confident	127 Å²	127	55.9 Å²	55.9	83%	0.825	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-9.5	-179.5	29.1	-37	0	0	0	114.5	L255	L255-P257 WeakPolarHBondContact O-CD 2.98Å
258	L	79.7	Confident	86.3	Confident	150 Å²	150	61.3 Å²	61.3	79%	0.785	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-45.5	177	-67.1	167.8	0	0	0	112.7	N256	N256-L258 PolarHBondContact O-N 2.83Å; N256-L258 VanDerWaalsContact O-N 3.16Å; N256-L258 PolarHBondContact OD1-N 2.79Å; N256-L258 VanDerWaalsContact OD1-N 3.16Å
259	D	81.6	Confident	86.3	Confident	57 Å²	57	57.6 Å²	57.6	31%	0.305	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-28	-172.3	-20.4	-42.9	0	0	0	112.3	N256 S261 T262	N256-D259 PolarHBondContact ND2-OD1 3.09Å; N256-D259 PolarHBondContact ND2-OD2 2.68Å; N256-D259 PolarHBondContact O-N 2.67Å; D259-S261 PolarHBondContact O-N 3.2Å; D259-T262 WeakPolarHBondContact OD2-CB 3.41Å; D259-T262 PolarHBondContact OD2-OG1 3.46Å
260	G	81	Confident	86.4	Confident	26 Å²	26	61.4 Å²	61.4	27%	0.268	34%	0.34	S	S	.	.	S	Bend	trans	71.7	-3.6	-173.8	0	0	0	0	0	115.5	N256	N256-G260 PolarHBondContact O-N 2.83Å; N256-G260 VanDerWaalsContact O-N 3.09Å
261	S	86.8	Confident	86.6	Confident	16 Å²	16	57.4 Å²	57.4	11%	0.112	32%	0.315	C	S	.	.	S	Bend	trans	-122.7	-17.9	-176.2	57.6	0	0	0	0	115.3	T222 F223 D259	T222-S261 WeakPolarHBondContact CA-O 3.02Å; F223-S261 WeakPolarHBondContact CD2-O 3.36Å; F223-S261 PolarHBondContact N-O 2.75Å; D259-S261 PolarHBondContact O-N 3.2Å
262	T	88.4	Confident	86.7	Confident	25 Å²	25	56.1 Å²	56.1	15%	0.153	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	132	-179.6	-52.8	0	0	0	0	111.3	L221 T222 L255 N256 D259	L221-T262 CarbonylContact O-C 3.27Å; L221-T262 VanDerWaalsContact O-CA 3.26Å; L221-T262 WeakPolarHBondContact O-CA 3.3Å; L221-T262 WeakPolarHBondContact O-CG2 3.38Å; T222-T262 PolarHBondContact OG1-OG1 2.7Å; L255-T262 CarbonylContact C-O 3.6Å; L255-T262 WeakPolarHBondContact CA-O 3.36Å; N256-T262 PolarHBondContact N-O 2.78Å; D259-T262 WeakPolarHBondContact OD2-CB 3.41Å; D259-T262 PolarHBondContact OD2-OG1 3.46Å
263	L	90.7	Very high	86.8	Confident	1 Å²	1	55 Å²	55	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.5	-178.3	174.6	150.6	0	0	0	110.8	L215 L220 L221 F223 V247 A253 V254 L255 V273 I312	L215-L263 HydrophobicContact CD1-CD2 3.69Å; L220-L263 WeakPolarHBondContact CA-O 3.21Å; L221-L263 PolarHBondContact N-O 3.18Å; L221-L263 PolarHBondContact O-N 2.87Å; F223-L263 HydrophobicContact CE2-CB 4.09Å; F223-L263 HydrophobicContact CE2-CD1 4.01Å; F223-L263 HydrophobicContact CZ-CD1 4.35Å; V247-L263 HydrophobicContact CG2-CD1 4.31Å; A253-L263 HydrophobicContact CB-CD1 3.91Å; A253-L263 HydrophobicContact CB-CD2 3.9Å; A253-L263 HydrophobicContact CB-CG 3.92Å; V254-L263 WeakPolarHBondContact O-CA 3.19Å; L255-L263 HydrophobicContact CD2-CB 4.28Å; L263-V273 HydrophobicContact CD1-CG2 3.82Å; L263-I312 HydrophobicContact CD1-CG1 4.31Å; L263-I312 HydrophobicContact CD2-CG2 4.45Å
264	K	90.1	Very high	86.7	Confident	55 Å²	55	55.9 Å²	55.9	24%	0.239	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.9	173.4	-177.7	179.8	-177.6	-175.6	0	110.7	L220 A253 V254 L266	L220-K264 HydrophobicContact CD2-CB 3.76Å; L220-K264 HydrophobicContact CD2-CD 4.47Å; L220-K264 HydrophobicContact CD2-CG 3.86Å; A253-K264 VanDerWaalsContact CA-O 3.27Å; A253-K264 WeakPolarHBondContact CA-O 3.05Å; V254-K264 PolarHBondContact N-O 2.79Å; V254-K264 PolarHBondContact O-N 3.02Å; K264-L266 HydrophobicContact CD-CD2 4.33Å; K264-L266 HydrophobicContact CG-CD2 4.35Å
265	A	90.4	Very high	86.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.8	173	0	0	0	0	0	111.5	L215 V216 N218 S219 I314	L215-A265 HydrophobicContact CB-CB 4.1Å; L215-A265 HydrophobicContact CD1-CB 4.19Å; V216-A265 WeakPolarHBondContact O-CB 3Å; N218-A265 VanDerWaalsContact CA-O 3.29Å; N218-A265 WeakPolarHBondContact CA-O 3.14Å; N218-A265 PolarHBondContact N-O 2.96Å; S219-A265 PolarHBondContact O-N 3.27Å; A265-I314 HydrophobicContact CB-CD1 3.7Å; A265-I314 HydrophobicContact CB-CG1 3.92Å; A265-I314 HydrophobicContact CB-CG2 4.29Å
266	L	88.2	Confident	86.1	Confident	57 Å²	57	51.7 Å²	51.7	30%	0.298	28%	0.281	S	S	.	.			trans	-112.6	-62.1	-177.8	-58	-179.5	0	0	0	112.8	L252 V254 K264	L252-L266 WeakPolarHBondContact O-CB 3.3Å; L252-L266 PolarHBondContact O-N 2.72Å; V254-L266 HydrophobicContact CG2-CD1 3.89Å; K264-L266 HydrophobicContact CD-CD2 4.33Å; K264-L266 HydrophobicContact CG-CD2 4.35Å
267	N	86.6	Confident	85.8	Confident	95 Å²	95	50.5 Å²	50.5	51%	0.508	27%	0.274	S	S	.	.	S	Bend	trans	-128.5	153.6	-171.9	-64.8	-67.2	0	0	0	110.7	N251 L252 I314	N251-N267 PolarHBondContact O-ND2 3.32Å; L252-N267 HydrophobicContact CD2-CB 4.1Å; N267-I314 WeakPolarHBondContact O-CB 3.42Å; N267-I314 VanDerWaalsContact O-CD1 3.24Å; N267-I314 WeakPolarHBondContact O-CD1 3.23Å; N267-I314 WeakPolarHBondContact O-CG2 3.45Å
268	Y	88.3	Confident	85.8	Confident	133 Å²	133	50.2 Å²	50.2	52%	0.522	26%	0.257	S	S	.	.	S	Bend	trans	-59	135.7	174.4	-59.1	-67.4	0	0	0	111.6	P217 I314 E316	P217-Y268 VanDerWaalsContact CD-CE1 3.47Å; P217-Y268 HydrophobicContact CG-CD1 3.83Å; P217-Y268 HydrophobicContact CG-CE1 3.39Å; P217-Y268 HydrophobicContact CG-CE2 4.15Å; P217-Y268 HydrophobicContact CG-CG 4.37Å; Y268-I314 VanDerWaalsContact CA-O 3.31Å; Y268-I314 WeakPolarHBondContact CA-O 3.42Å; Y268-I314 HydrophobicContact CD1-CG2 4.33Å; Y268-E316 HydrophobicContact CE1-CB 4.18Å
269	G	85.4	Confident	85.3	Confident	33 Å²	33	47.1 Å²	47.1	34%	0.34	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	154	-169.1	-175.3	0	0	0	0	0	113.4	I314	G269-I314 PolarHBondContact N-O 2.9Å; G269-I314 VanDerWaalsContact N-O 3.12Å; G269-I314 PolarHBondContact O-N 2.79Å
270	Q	87.9	Confident	84.7	Confident	137 Å²	137	45.5 Å²	45.5	64%	0.64	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.1	179.5	65.9	-176.1	8.1	0	0	111.3	L252 I312 Q313	L252-Q270 WeakPolarHBondContact CD1-O 3.41Å; Q270-I312 CarbonylContact C-O 3.38Å; Q270-I312 WeakPolarHBondContact CA-O 3.29Å; Q270-Q313 HydrophobicContact CB-CG 4.42Å
271	T	89.8	Confident	84.2	Confident	6 Å²	6	46.4 Å²	46.4	4%	0.037	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	161.9	177.7	-168.8	0	0	0	0	110.9	V247 D249 L252 A253 I312	V247-T271 HydrophobicContact CG1-CG2 4.5Å; D249-T271 PolarHBondContact N-OG1 2.67Å; D249-T271 PolarHBondContact O-OG1 3.43Å; L252-T271 HydrophobicContact CB-CG2 4.33Å; A253-T271 HydrophobicContact CB-CG2 3.95Å; T271-I312 HydrophobicContact CG2-CB 3.97Å; T271-I312 HydrophobicContact CG2-CG2 4.2Å; T271-I312 PolarHBondContact N-O 2.97Å; T271-I312 PolarHBondContact O-N 2.89Å
272	E	87.9	Confident	83.3	Confident	84 Å²	84	50.1 Å²	50.1	39%	0.393	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	145	-175.2	-60.7	173.2	139	0	0	110.8	V247 N248 L311	V247-E272 WeakPolarHBondContact CA-O 3.36Å; N248-E272 HydrophobicContact CB-CB 4.05Å; N248-E272 PolarHBondContact N-O 3.17Å; N248-E272 PolarHBondContact ND2-OE2 3.11Å; E272-L311 HydrophobicContact CG-CD1 4.22Å
273	V	88.5	Confident	82.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.1	172.3	-170.8	0	0	0	0	108.8	F223 L245 Q246 V247 L263 T309 S310 I312	F223-V273 HydrophobicContact CD2-CG1 4.5Å; F223-V273 HydrophobicContact CE2-CB 4.29Å; F223-V273 HydrophobicContact CE2-CG1 3.94Å; F223-V273 HydrophobicContact CE2-CG2 4Å; F223-V273 HydrophobicContact CZ-CB 4.03Å; F223-V273 HydrophobicContact CZ-CG1 4.15Å; F223-V273 HydrophobicContact CZ-CG2 3.75Å; L245-V273 HydrophobicContact CB-CG1 4.33Å; Q246-V273 CarbonylContact O-C 3.56Å; Q246-V273 VanDerWaalsContact O-CA 3.32Å; Q246-V273 WeakPolarHBondContact O-CA 3.28Å; V247-V273 HydrophobicContact CG2-CG2 4.21Å; L263-V273 HydrophobicContact CD1-CG2 3.82Å; V273-T309 CarbonylContact O-C 3.53Å; V273-T309 WeakPolarHBondContact O-CA 3.48Å; V273-S310 PolarHBondContact N-O 3.42Å; V273-S310 PolarHBondContact O-N 2.93Å; V273-I312 HydrophobicContact CG2-CG1 3.93Å
274	T	86.2	Confident	80.9	Confident	20 Å²	20	52.3 Å²	52.3	12%	0.123	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	139.8	-172.4	81.7	0	0	0	0	111.9	L245 Q246 T309	L245-T274 WeakPolarHBondContact CA-O 3.24Å; Q246-T274 PolarHBondContact N-O 3.39Å; Q246-T274 PolarHBondContact O-N 2.7Å; T274-T309 HydrophobicContact CG2-CG2 3.71Å
275	L	86.1	Confident	79.7	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.1	173.7	-173	68.2	0	0	0	110.2	A206 L208 V225 Y243 H244 L245 P308	A206-L275 HydrophobicContact CB-CD2 4.48Å; L208-L275 HydrophobicContact CD1-CB 4.05Å; L208-L275 HydrophobicContact CD2-CB 4.13Å; L208-L275 HydrophobicContact CD2-CD1 4.26Å; L208-L275 HydrophobicContact CD2-CD2 4.42Å; L208-L275 HydrophobicContact CG-CB 4.08Å; L208-L275 HydrophobicContact CG-CD2 4.5Å; V225-L275 HydrophobicContact CG1-CD1 4.27Å; V225-L275 HydrophobicContact CG1-CD2 3.83Å; V225-L275 HydrophobicContact CG2-CD1 3.9Å; Y243-L275 HydrophobicContact CD1-CD2 4.45Å; Y243-L275 HydrophobicContact CD1-CG 4.43Å; H244-L275 WeakPolarHBondContact O-CA 3.47Å; L245-L275 HydrophobicContact CD2-CB 4.45Å; L245-L275 HydrophobicContact CD2-CD1 3.75Å; L275-P308 HydrophobicContact CB-CB 4.07Å; L275-P308 HydrophobicContact CB-CG 4.32Å; L275-P308 HydrophobicContact CD2-CB 4.31Å; L275-P308 HydrophobicContact CD2-CG 4.33Å; L275-P308 PolarHBondContact N-O 3.26Å
276	L	81.7	Confident	78.2	Confident	8 Å²	8	59.3 Å²	59.3	4%	0.042	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.7	-173.2	-59.3	177.9	0	0	0	111.4	Y243 H244 Q246	Y243-L276 WeakPolarHBondContact CA-O 3.27Å; H244-L276 WeakPolarHBondContact CE1-CB 3.45Å; H244-L276 PolarHBondContact N-O 3.46Å; H244-L276 VanDerWaalsContact N-O 3.11Å; H244-L276 PolarHBondContact ND1-O 3.14Å; H244-L276 PolarHBondContact O-N 2.99Å; Q246-L276 HydrophobicContact CB-CD1 4.24Å
277	D	77.3	Confident	76.7	Confident	24 Å²	24	57.6 Å²	57.6	13%	0.128	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	113.1	177	174.4	5.3	0	0	0	110.6	Q242 Y243 N279 V280 E281	Q242-D277 WeakPolarHBondContact CG-OD1 3.17Å; Q242-D277 PolarHBondContact NE2-OD1 3.18Å; Q242-D277 PolarHBondContact NE2-OD2 3.45Å; Q242-D277 VanDerWaalsContact NE2-OD2 3.09Å; Y243-D277 HydrophobicContact CD1-CB 4.09Å; Y243-D277 HydrophobicContact CE1-CB 3.89Å; D277-N279 VanDerWaalsContact C-N 3.25Å; D277-N279 PolarHBondContact O-N 3.46Å; D277-N279 PolarHBondContact OD1-N 3.23Å; D277-N279 PolarHBondContact OD1-ND2 2.86Å; D277-V280 HydrophobicContact CB-CB 4.21Å; D277-V280 HydrophobicContact CB-CG2 4.34Å; D277-V280 PolarHBondContact O-N 2.86Å; D277-V280 WeakPolarHBondContact OD2-CG2 3.44Å; D277-E281 WeakPolarHBondContact O-CG 3.36Å; D277-E281 PolarHBondContact O-N 2.87Å
278	R	78.8	Confident	75.2	Confident	122 Å²	122	56.9 Å²	56.9	46%	0.46	28%	0.28	S	S	.	.	H	α-helix	trans	-56.2	-34.2	-176.3	-69.4	172.7	176.3	171.7	-4.3	114	L241 Q242 V280 E281 E282	L241-R278 WeakPolarHBondContact O-CD 3.27Å; L241-R278 PolarHBondContact O-NH1 2.86Å; Q242-R278 PolarHBondContact O-N 3.43Å; Q242-R278 VanDerWaalsContact O-N 3.16Å; R278-V280 PolarHBondContact O-N 3.01Å; R278-E281 PolarHBondContact O-N 2.99Å; R278-E282 WeakPolarHBondContact O-CB 3.25Å; R278-E282 PolarHBondContact O-N 3.38Å
279	N	70.5	Confident	73.8	Confident	84 Å²	84	57.3 Å²	57.3	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-65.9	-31.8	178.6	-65.9	-55	0	0	0	112.1	Q242 D277 A283	Q242-N279 VanDerWaalsContact CD-ND2 3.33Å; Q242-N279 PolarHBondContact NE2-ND2 2.95Å; D277-N279 VanDerWaalsContact C-N 3.25Å; D277-N279 PolarHBondContact O-N 3.46Å; D277-N279 PolarHBondContact OD1-N 3.23Å; D277-N279 PolarHBondContact OD1-ND2 2.86Å; N279-A283 WeakPolarHBondContact O-CB 3.46Å
280	V	68.1	Low	72.4	Confident	24 Å²	24	59.8 Å²	59.8	15%	0.145	30%	0.295	C	S	.	.	H	α-helix	trans	-90.2	-20	-175.8	171.8	0	0	0	0	111.3	D277 R278 R305	D277-V280 HydrophobicContact CB-CB 4.21Å; D277-V280 HydrophobicContact CB-CG2 4.34Å; D277-V280 PolarHBondContact O-N 2.86Å; D277-V280 WeakPolarHBondContact OD2-CG2 3.44Å; R278-V280 PolarHBondContact O-N 3.01Å; V280-R305 PolarHBondContact O-NH1 3.41Å
281	E	69.8	Low	70.4	Confident	44 Å²	44	56.7 Å²	56.7	21%	0.206	28%	0.283	C	S	.	.	H	α-helix	trans	-80.8	-47.5	169.3	-66.6	-179.3	126.6	0	0	112.2	H244 D277 R278 A283 L284 E285	H244-E281 IonicContact CE1-OE2 3.8Å; D277-E281 WeakPolarHBondContact O-CG 3.36Å; D277-E281 PolarHBondContact O-N 2.87Å; R278-E281 PolarHBondContact O-N 2.99Å; E281-A283 PolarHBondContact O-N 3.42Å; E281-L284 CarbonylContact O-C 3.59Å; E281-L284 WeakPolarHBondContact O-CA 3.4Å; E281-L284 WeakPolarHBondContact O-CB 3.35Å; E281-L284 PolarHBondContact O-N 3.07Å; E281-E285 PolarHBondContact O-N 2.64Å
282	E	69.6	Low	68.5	Low	94 Å²	94	63.2 Å²	63.2	44%	0.439	32%	0.317	S	S	.	.	H	α-helix	trans	-57.5	-37.7	176	-168.9	-170.5	155.3	0	0	111.5	R278 L284 E285 K286	R278-E282 WeakPolarHBondContact O-CB 3.25Å; R278-E282 PolarHBondContact O-N 3.38Å; E282-L284 VanDerWaalsContact C-N 3.29Å; E282-L284 PolarHBondContact O-N 3.32Å; E282-E285 PolarHBondContact O-N 3.38Å; E282-K286 HydrophobicContact CG-CD 4.21Å; E282-K286 WeakPolarHBondContact O-CB 3.35Å; E282-K286 WeakPolarHBondContact O-CG 3.37Å; E282-K286 PolarHBondContact O-N 2.94Å; E282-K286 WeakPolarHBondContact OE1-CE 3.47Å; E282-K286 IonicContact OE1-NZ 2.8Å; E282-K286 PolarHBondContact OE1-NZ 2.96Å
283	A	62.5	Low	66.4	Low	30 Å²	30	62.2 Å²	62.2	25%	0.248	32%	0.32	C	S	.	.	H	α-helix	trans	-70.7	-16.3	173.7	0	0	0	0	0	114.5	N279 E281 L287	N279-A283 WeakPolarHBondContact O-CB 3.46Å; E281-A283 PolarHBondContact O-N 3.42Å; A283-L287 WeakPolarHBondContact O-CB 3.37Å
284	L	64.4	Low	63.9	Low	43 Å²	43	72.5 Å²	72.5	23%	0.225	36%	0.364	C	S	.	.	H	α-helix	trans	-88.1	-41.8	168.3	-82.8	171.3	0	0	0	111.9	E281 E282 L287 N288 R305	E281-L284 CarbonylContact O-C 3.59Å; E281-L284 WeakPolarHBondContact O-CA 3.4Å; E281-L284 WeakPolarHBondContact O-CB 3.35Å; E281-L284 PolarHBondContact O-N 3.07Å; E282-L284 VanDerWaalsContact C-N 3.29Å; E282-L284 PolarHBondContact O-N 3.32Å; L284-L287 CarbonylContact O-C 3.6Å; L284-L287 PolarHBondContact O-N 3.24Å; L284-N288 PolarHBondContact O-N 3.45Å; L284-R305 VanDerWaalsContact CG-NH1 3.3Å
285	E	65.5	Low	61.7	Low	134 Å²	134	77.3 Å²	77.3	63%	0.626	39%	0.394	S	S	*	.	H	α-helix	trans	-62.5	-49.6	-178.7	-69.1	-175.3	150.6	0	0	110.7	E281 E282 L287 N288 E289	E281-E285 PolarHBondContact O-N 2.64Å; E282-E285 PolarHBondContact O-N 3.38Å; E285-L287 PolarHBondContact O-N 3.31Å; E285-N288 CarbonylContact O-C 3.57Å; E285-N288 WeakPolarHBondContact O-CB 3.37Å; E285-N288 PolarHBondContact O-N 3.03Å; E285-N288 VanDerWaalsContact O-N 3.1Å; E285-E289 PolarHBondContact O-N 2.77Å
286	K	58.9	Low	59.4	Low	68 Å²	68	83.9 Å²	83.9	30%	0.296	43%	0.429	S	S	.	.	H	α-helix	trans	-62	-31	174.1	-71.5	173.6	172.2	176.7	0	113	Y130 E282 E289 V290	Y130-K286 HydrophobicContact CE1-CD 4.48Å; E282-K286 HydrophobicContact CG-CD 4.21Å; E282-K286 WeakPolarHBondContact O-CB 3.35Å; E282-K286 WeakPolarHBondContact O-CG 3.37Å; E282-K286 PolarHBondContact O-N 2.94Å; E282-K286 WeakPolarHBondContact OE1-CE 3.47Å; E282-K286 IonicContact OE1-NZ 2.8Å; E282-K286 PolarHBondContact OE1-NZ 2.96Å; K286-E289 PolarHBondContact O-N 2.8Å; K286-V290 WeakPolarHBondContact O-CG2 3.4Å; K286-V290 PolarHBondContact O-N 3.49Å; K286-V290 VanDerWaalsContact O-N 3.12Å
287	L	56	Low	57.4	Low	20 Å²	20	91.8 Å²	91.8	11%	0.105	47%	0.471	C	S	.	.	H	α-helix	trans	-75.1	-34	175.5	-173.2	149.9	0	0	0	111.7	A283 L284 E285 V290 L291 L302	A283-L287 WeakPolarHBondContact O-CB 3.37Å; L284-L287 CarbonylContact O-C 3.6Å; L284-L287 PolarHBondContact O-N 3.24Å; E285-L287 PolarHBondContact O-N 3.31Å; L287-V290 PolarHBondContact O-N 3.28Å; L287-L291 HydrophobicContact CD2-CD1 3.91Å; L287-L291 WeakPolarHBondContact O-CB 3.31Å; L287-L291 PolarHBondContact O-N 2.83Å; L287-L302 HydrophobicContact CD1-CD2 4.18Å; L287-L302 HydrophobicContact CD2-CD1 3.77Å; L287-L302 HydrophobicContact CD2-CD2 3.67Å; L287-L302 HydrophobicContact CD2-CG 4.09Å
288	N	55.5	Low	55.7	Low	80 Å²	80	94.8 Å²	94.8	43%	0.428	49%	0.494	S	S	.	.	H	α-helix	trans	-66.8	-36.2	169.1	-80.6	-22.2	0	0	0	111.7	L284 E285 V290 L291 N292	L284-N288 PolarHBondContact O-N 3.45Å; E285-N288 CarbonylContact O-C 3.57Å; E285-N288 WeakPolarHBondContact O-CB 3.37Å; E285-N288 PolarHBondContact O-N 3.03Å; E285-N288 VanDerWaalsContact O-N 3.1Å; N288-V290 VanDerWaalsContact C-N 3.32Å; N288-V290 PolarHBondContact O-N 2.82Å; N288-L291 PolarHBondContact O-N 2.72Å; N288-N292 PolarHBondContact O-N 3.3Å; N288-N292 PolarHBondContact O-ND2 3.48Å
289	E	60.3	Low	54	Low	142 Å²	142	95.7 Å²	95.7	66%	0.664	51%	0.508	S	S	*	.	H	α-helix	trans	-60	-43.1	171.1	-68.8	-172.6	127	0	0	111.3	E285 K286 N292	E285-E289 PolarHBondContact O-N 2.77Å; K286-E289 PolarHBondContact O-N 2.8Å; E289-N292 PolarHBondContact O-N 3.24Å
290	V	54.1	Low	52.7	Low	85 Å²	85	96.7 Å²	96.7	52%	0.515	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-43.3	175.1	173.4	0	0	0	0	112.1	K286 L287 N288 N292 S293	K286-V290 WeakPolarHBondContact O-CG2 3.4Å; K286-V290 PolarHBondContact O-N 3.49Å; K286-V290 VanDerWaalsContact O-N 3.12Å; L287-V290 PolarHBondContact O-N 3.28Å; N288-V290 VanDerWaalsContact C-N 3.32Å; N288-V290 PolarHBondContact O-N 2.82Å; V290-N292 PolarHBondContact O-N 2.93Å; V290-S293 WeakPolarHBondContact O-CB 3.47Å; V290-S293 PolarHBondContact O-N 2.87Å; V290-S293 PolarHBondContact O-OG 2.88Å
291	L	46.6	Very low	51.7	Low	73 Å²	73	106 Å²	106	38%	0.382	55%	0.545	S	S	.	.	H	α-helix	trans	-64	-26.4	177.8	-115	70.5	0	0	0	113.4	L287 N288 S293 L300 L302	L287-L291 HydrophobicContact CD2-CD1 3.91Å; L287-L291 WeakPolarHBondContact O-CB 3.31Å; L287-L291 PolarHBondContact O-N 2.83Å; N288-L291 PolarHBondContact O-N 2.72Å; L291-S293 PolarHBondContact O-N 2.97Å; L291-L300 HydrophobicContact CD1-CD1 4.39Å; L291-L302 HydrophobicContact CD2-CD1 4.01Å
292	N	49.6	Very low	50.6	Low	142 Å²	142	107.7 Å²	107.7	76%	0.759	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-2.2	173.3	-76.3	-67.3	0	0	0	113.2	N288 E289 V290	N288-N292 PolarHBondContact O-N 3.3Å; N288-N292 PolarHBondContact O-ND2 3.48Å; E289-N292 PolarHBondContact O-N 3.24Å; V290-N292 PolarHBondContact O-N 2.93Å
293	S	44.7	Very low	49.4	Very low	64 Å²	64	105.1 Å²	105.1	45%	0.448	55%	0.547	S	S	.	.	S	Bend	trans	-93.3	139.2	170.7	81.7	0	0	0	0	111.1	V290 L291 V295	V290-S293 WeakPolarHBondContact O-CB 3.47Å; V290-S293 PolarHBondContact O-N 2.87Å; V290-S293 PolarHBondContact O-OG 2.88Å; L291-S293 PolarHBondContact O-N 2.97Å; S293-V295 PolarHBondContact O-N 3.48Å; S293-V295 VanDerWaalsContact O-N 3.08Å
294	K	36.6	Very low	48.5	Very low	215 Å²	215	112.9 Å²	112.9	94%	0.935	58%	0.575	S	S	*	*			trans	-73.2	101.4	-165.3	-64.2	179.3	-179.7	178.7	0	113.5
295	V	38.1	Very low	47.9	Very low	122 Å²	122	113.6 Å²	113.6	74%	0.739	58%	0.575	S	S	*	*			trans	-137.2	152.1	163.7	-173.3	0	0	0	0	108.2	S293	S293-V295 PolarHBondContact O-N 3.48Å; S293-V295 VanDerWaalsContact O-N 3.08Å
296	D	39.1	Very low	47.4	Very low	144 Å²	144	118 Å²	118	77%	0.77	59%	0.586	S	S	*	*			trans	-66.8	143.2	-169.6	-77.3	-60.3	0	0	0	115	S298	D296-S298 VanDerWaalsContact C-N 3.26Å; D296-S298 PolarHBondContact O-N 2.97Å
297	D	40.3	Very low	47.9	Very low	173 Å²	173	120.8 Å²	120.8	93%	0.925	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	35	-161.8	-163.8	26	0	0	0	114.7
298	S	41.1	Very low	48.6	Very low	88 Å²	88	121.9 Å²	121.9	62%	0.615	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-29.4	-177.6	58.7	0	0	0	0	115.1	D296	D296-S298 VanDerWaalsContact C-N 3.26Å; D296-S298 PolarHBondContact O-N 2.97Å
299	D	42.1	Very low	49.8	Very low	140 Å²	140	121.5 Å²	121.5	75%	0.749	60%	0.603	S	S	*	*	S	Bend	trans	-110.6	-1.3	-157.5	-68.6	11.4	0	0	0	114.6
300	L	44.7	Very low	51	Low	106 Å²	106	114.8 Å²	114.8	56%	0.555	57%	0.572	S	S	*	*			trans	-121.9	70.7	-169.8	-82.7	157.7	0	0	0	113.8	L291 L302	L291-L300 HydrophobicContact CD1-CD1 4.39Å; L300-L302 PolarHBondContact O-N 2.67Å
301	R	46.4	Very low	52.5	Low	218 Å²	218	113.6 Å²	113.6	82%	0.823	56%	0.563	S	S	*	*			trans	-80.3	112.6	168.2	-74	-173.4	178.2	134.5	6.1	111.6
302	L	47.5	Very low	54.6	Low	81 Å²	81	110.1 Å²	110.1	42%	0.424	55%	0.545	S	S	.	.			trans	-73.7	135.7	169.3	-86.2	163.9	0	0	0	111.9	L287 L291 L300	L287-L302 HydrophobicContact CD1-CD2 4.18Å; L287-L302 HydrophobicContact CD2-CD1 3.77Å; L287-L302 HydrophobicContact CD2-CD2 3.67Å; L287-L302 HydrophobicContact CD2-CG 4.09Å; L291-L302 HydrophobicContact CD2-CD1 4.01Å; L300-L302 PolarHBondContact O-N 2.67Å
303	P	44.6	Very low	56.4	Low	39 Å²	39	105.5 Å²	105.5	25%	0.253	52%	0.518	S	S	.	.			trans	-70.1	139.1	173.4	28.3	-33.9	0	0	0	112	E91 R305	E91-P303 HydrophobicContact CG-CB 4.16Å; E91-P303 HydrophobicContact CG-CG 4.29Å; P303-R305 PolarHBondContact O-N 3.43Å
304	K	43.1	Very low	58.6	Low	193 Å²	193	102.7 Å²	102.7	84%	0.839	50%	0.498	S	S	*	.			trans	-75.3	86.7	174.6	-83.3	-169.2	171.4	-170.8	0	110.4
305	R	50.9	Low	61.1	Low	58 Å²	58	93.5 Å²	93.5	22%	0.219	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-59.8	133.2	177.5	-57.6	-177.7	-171.9	-179.2	1.2	112.1	L201 V280 L284 P303	L201-R305 HydrophobicContact CD2-CG 4.3Å; L201-R305 VanDerWaalsContact CD2-NE 3.27Å; V280-R305 PolarHBondContact O-NH1 3.41Å; L284-R305 VanDerWaalsContact CG-NH1 3.3Å; P303-R305 PolarHBondContact O-N 3.43Å
306	R	56.1	Low	63.3	Low	228 Å²	228	91 Å²	91	86%	0.86	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-85.2	125.4	158	-75	-178	170.7	178.3	-3.6	108.6
307	R	67.7	Low	65.6	Low	125 Å²	125	84.4 Å²	84.4	47%	0.472	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-83.5	154.2	171.5	-68.3	179.5	172.3	-167.8	-10.9	109.5	T309	R307-T309 HydrophobicContact CB-CG2 4.26Å; R307-T309 PolarHBondContact O-N 3.02Å
308	P	72.2	Confident	67.5	Low	44 Å²	44	77.9 Å²	77.9	29%	0.286	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-68.7	119.6	167.7	-9.4	25.2	0	0	0	108.8	L275	L275-P308 HydrophobicContact CB-CB 4.07Å; L275-P308 HydrophobicContact CB-CG 4.32Å; L275-P308 HydrophobicContact CD2-CB 4.31Å; L275-P308 HydrophobicContact CD2-CG 4.33Å; L275-P308 PolarHBondContact N-O 3.26Å
309	T	80.3	Confident	69.4	Low	71 Å²	71	75.5 Å²	75.5	44%	0.436	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	146.4	-175.9	56.1	0	0	0	0	110.8	V273 T274 R307	V273-T309 CarbonylContact O-C 3.53Å; V273-T309 WeakPolarHBondContact O-CA 3.48Å; T274-T309 HydrophobicContact CG2-CG2 3.71Å; R307-T309 HydrophobicContact CB-CG2 4.26Å; R307-T309 PolarHBondContact O-N 3.02Å
310	S	84.7	Confident	71.3	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	135.3	169.6	177.9	0	0	0	0	109.9	P210 A211 V273	P210-S310 PolarHBondContact O-OG 3.14Å; A211-S310 VanDerWaalsContact C-OG 3.26Å; A211-S310 VanDerWaalsContact O-CA 3.25Å; A211-S310 WeakPolarHBondContact O-CA 3.3Å; A211-S310 PolarHBondContact O-OG 3.45Å; V273-S310 PolarHBondContact N-O 3.42Å; V273-S310 PolarHBondContact O-N 2.93Å
311	L	87.3	Confident	72.6	Confident	60 Å²	60	64.2 Å²	64.2	31%	0.314	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.1	176.8	-172.5	68	0	0	0	110.5	A211 L212 A213 E272	A211-L311 PolarHBondContact O-N 3.33Å; L212-L311 WeakPolarHBondContact CA-O 3.3Å; L212-L311 HydrophobicContact CD1-CB 3.95Å; L212-L311 HydrophobicContact CD1-CD2 4.07Å; L212-L311 HydrophobicContact CD1-CG 4.24Å; A213-L311 PolarHBondContact N-O 2.94Å; E272-L311 HydrophobicContact CG-CD1 4.22Å
312	I	89.4	Confident	74.2	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.7	178.5	-61.7	-59.8	0	0	0	109.1	A213 L215 L221 F223 L263 Q270 T271 V273 I314	A213-I312 HydrophobicContact CB-CD1 3.79Å; L215-I312 HydrophobicContact CD1-CG2 3.88Å; L221-I312 HydrophobicContact CD2-CD1 3.49Å; L221-I312 VanDerWaalsContact CD2-CD1 3.49Å; F223-I312 HydrophobicContact CE1-CD1 4.27Å; F223-I312 HydrophobicContact CZ-CD1 3.87Å; F223-I312 HydrophobicContact CZ-CG1 4.2Å; L263-I312 HydrophobicContact CD1-CG1 4.31Å; L263-I312 HydrophobicContact CD2-CG2 4.45Å; Q270-I312 CarbonylContact C-O 3.38Å; Q270-I312 WeakPolarHBondContact CA-O 3.29Å; T271-I312 HydrophobicContact CG2-CB 3.97Å; T271-I312 HydrophobicContact CG2-CG2 4.2Å; T271-I312 PolarHBondContact N-O 2.97Å; T271-I312 PolarHBondContact O-N 2.89Å; V273-I312 HydrophobicContact CG2-CG1 3.93Å; I312-I314 HydrophobicContact CG2-CG1 4.36Å
313	Q	88.4	Confident	75.5	Confident	45 Å²	45	52 Å²	52	21%	0.21	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	133.2	173.2	-61.7	-165.1	18.6	0	0	109.8	A213 Y214 L215 Q270 V315	A213-Q313 PolarHBondContact O-N 3.11Å; Y214-Q313 CarbonylContact C-O 2.98Å; Y214-Q313 WeakPolarHBondContact CA-O 3.35Å; Y214-Q313 HydrophobicContact CD1-CB 3.79Å; Y214-Q313 HydrophobicContact CD1-CG 4.48Å; Y214-Q313 HydrophobicContact CE1-CB 3.94Å; Y214-Q313 HydrophobicContact CE1-CG 4.14Å; L215-Q313 PolarHBondContact N-O 3.47Å; Q270-Q313 HydrophobicContact CB-CG 4.42Å; Q313-V315 HydrophobicContact CB-CG1 4.15Å
314	I	90.9	Very high	77	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.9	179	-57.1	167.9	0	0	0	107.4	L215 P217 L252 A265 N267 Y268 G269 I312	L215-I314 HydrophobicContact CB-CG1 4.38Å; L215-I314 CarbonylContact O-C 3.49Å; L215-I314 VanDerWaalsContact O-CA 3.25Å; L215-I314 WeakPolarHBondContact O-CA 3.25Å; P217-I314 HydrophobicContact CG-CG2 4.05Å; L252-I314 HydrophobicContact CB-CD1 4.37Å; L252-I314 WeakPolarHBondContact O-CD1 3.18Å; A265-I314 HydrophobicContact CB-CD1 3.7Å; A265-I314 HydrophobicContact CB-CG1 3.92Å; A265-I314 HydrophobicContact CB-CG2 4.29Å; N267-I314 WeakPolarHBondContact O-CB 3.42Å; N267-I314 VanDerWaalsContact O-CD1 3.24Å; N267-I314 WeakPolarHBondContact O-CD1 3.23Å; N267-I314 WeakPolarHBondContact O-CG2 3.45Å; Y268-I314 VanDerWaalsContact CA-O 3.31Å; Y268-I314 WeakPolarHBondContact CA-O 3.42Å; Y268-I314 HydrophobicContact CD1-CG2 4.33Å; G269-I314 PolarHBondContact N-O 2.9Å; G269-I314 VanDerWaalsContact N-O 3.12Å; G269-I314 PolarHBondContact O-N 2.79Å; I312-I314 HydrophobicContact CG2-CG1 4.36Å
315	V	88.7	Confident	78.5	Confident	22 Å²	22	45.9 Å²	45.9	13%	0.133	22%	0.219	C	C	.	.			trans	-133.8	163.3	-163.6	-59.3	0	0	0	0	112.1	Y214 L215 Q313 D378 L384	Y214-V315 HydrophobicContact CD1-CG1 4.31Å; Y214-V315 HydrophobicContact CD1-CG2 4.33Å; L215-V315 PolarHBondContact O-N 2.91Å; Q313-V315 HydrophobicContact CB-CG1 4.15Å; V315-D378 HydrophobicContact CB-CB 4.21Å; V315-D378 HydrophobicContact CG2-CB 3.66Å; V315-L384 HydrophobicContact CG2-CD2 3.65Å; V315-L384 HydrophobicContact CG2-CG 4.44Å
316	E	84.8	Confident	79.4	Confident	70 Å²	70	46.6 Å²	46.6	33%	0.327	23%	0.225	S	C	.	.			trans	-84.5	129.7	178.5	-168.7	-166	170.7	0	0	110.6	Y268 D378 R379	Y268-E316 HydrophobicContact CE1-CB 4.18Å; E316-D378 WeakPolarHBondContact O-CA 3.22Å; E316-D378 WeakPolarHBondContact O-CB 3.46Å; E316-R379 IonicContact OE1-CZ 2.69Å; E316-R379 IonicContact OE1-NE 2.68Å; E316-R379 IonicContact OE1-NH2 3.33Å; E316-R379 PolarHBondContact OE1-NH2 3.27Å; E316-R379 IonicContact OE2-CZ 2.74Å; E316-R379 IonicContact OE2-NE 3.87Å; E316-R379 PolarHBondContact OE2-NE 2.89Å; E316-R379 IonicContact OE2-NH2 3.27Å; E316-R379 PolarHBondContact OE2-NH2 3.26Å
317	P	86.3	Confident	79.9	Confident	5 Å²	5	41 Å²	41	3%	0.032	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	150.3	174.3	30.6	-33.5	0	0	0	111	V216 I376 L384 L429 F442 I446	V216-P317 HydrophobicContact CG1-CB 4.18Å; V216-P317 HydrophobicContact CG1-CG 4.01Å; P317-I376 HydrophobicContact CB-CG2 4.16Å; P317-L384 HydrophobicContact CB-CD1 3.73Å; P317-L429 HydrophobicContact CB-CD2 4.15Å; P317-L429 HydrophobicContact CG-CD2 4.4Å; P317-F442 HydrophobicContact CG-CD1 4.36Å; P317-F442 HydrophobicContact CG-CE1 4.15Å; P317-F442 HydrophobicContact CG-CE2 4.39Å; P317-F442 HydrophobicContact CG-CZ 4.17Å; P317-I446 VanDerWaalsContact C-CD1 3.45Å; P317-I446 HydrophobicContact CB-CD1 3.64Å; P317-I446 HydrophobicContact CG-CD1 3.62Å; P317-I446 WeakPolarHBondContact O-CD1 3.3Å
318	A	79.9	Confident	79.4	Confident	36 Å²	36	43.2 Å²	43.2	30%	0.298	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	-45.5	-177.1	0	0	0	0	0	114.2	Y377 D378 R379 I446	A318-Y377 PolarHBondContact N-O 3.05Å; A318-D378 VanDerWaalsContact CB-C 3.44Å; A318-D378 WeakPolarHBondContact CB-O 3.49Å; A318-R379 HydrophobicContact CB-CB 4.36Å; A318-R379 HydrophobicContact CB-CG 3.74Å; A318-I446 WeakPolarHBondContact O-CG2 3.3Å
319	Y	81.5	Confident	78.2	Confident	37 Å²	37	46.5 Å²	46.5	15%	0.145	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	168.5	-177.8	66.4	-99	0	0	0	113.3	Y377 N381 R1872	Y319-Y377 AromaticContact CD2-CD2 3.95Å; Y319-Y377 HydrophobicContact CD2-CD2 3.95Å; Y319-Y377 HydrophobicContact CD2-CG 4.24Å; Y319-Y377 HydrophobicContact CE2-CD1 4.36Å; Y319-Y377 AromaticContact CE2-CD2 3.39Å; Y319-Y377 HydrophobicContact CE2-CD2 3.39Å; Y319-Y377 HydrophobicContact CE2-CE2 4.26Å; Y319-Y377 AromaticContact CE2-CG 3.44Å; Y319-Y377 HydrophobicContact CE2-CG 3.44Å; Y319-Y377 VanDerWaalsContact CE2-CG 3.44Å; Y319-Y377 AromaticContact CZ-CG 3.7Å; Y319-Y377 PolarHBondContact N-O 2.83Å; Y319-Y377 PolarHBondContact O-N 3.35Å; Y319-N381 WeakPolarHBondContact CE1-OD1 3.21Å; Y319-N381 VanDerWaalsContact OH-CG 3.31Å; Y319-N381 PolarHBondContact OH-OD1 2.9Å; Y319-R1872 HydrophobicContact CE2-CG 4.28Å; Y319-R1872 PolarHBondContact OH-O 2.65Å
320	L	82.3	Confident	76.4	Confident	9 Å²	9	50.6 Å²	50.6	5%	0.047	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	141.6	178.7	-60.5	179.6	0	0	0	111.3	D375 I376 L392 A427 L429 I446	L320-D375 WeakPolarHBondContact CA-O 3.3Å; L320-I376 HydrophobicContact CD2-CB 4.26Å; L320-I376 HydrophobicContact CD2-CG1 3.87Å; L320-I376 HydrophobicContact CD2-CG2 4.02Å; L320-L392 HydrophobicContact CD1-CD1 4.43Å; L320-L392 HydrophobicContact CD1-CD2 4.32Å; L320-L392 HydrophobicContact CD2-CD1 3.97Å; L320-A427 HydrophobicContact CD1-CB 3.59Å; L320-L429 HydrophobicContact CD2-CB 4.34Å; L320-I446 HydrophobicContact CG-CG2 4.26Å
321	G	72.8	Confident	74.5	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	151.7	169.2	0	0	0	0	0	111.8	L374 D375	G321-L374 VanDerWaalsContact O-CA 3.27Å; G321-L374 WeakPolarHBondContact O-CA 3.4Å; G321-D375 PolarHBondContact N-O 3.41Å; G321-D375 PolarHBondContact O-N 3.09Å
322	F	80.1	Confident	72.5	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.6	177.3	-60.1	-110	0	0	0	109.2	W362 N373 L374 L394 L425 A427 N449 Q450	F322-W362 HydrophobicContact CB-CH2 3.51Å; F322-W362 HydrophobicContact CB-CZ2 3.59Å; F322-W362 WeakPolarHBondContact O-CZ2 3.33Å; F322-N373 CarbonylContact C-O 3.56Å; F322-L374 HydrophobicContact CB-CD2 4.29Å; F322-L374 HydrophobicContact CD1-CD2 3.25Å; F322-L374 HydrophobicContact CD2-CD2 4.42Å; F322-L374 HydrophobicContact CE1-CD2 3.6Å; F322-L374 HydrophobicContact CG-CD2 3.71Å; F322-L374 HydrophobicContact CZ-CD2 4.31Å; F322-L394 HydrophobicContact CE1-CD2 4.44Å; F322-L425 HydrophobicContact CE1-CB 4.27Å; F322-A427 HydrophobicContact CE1-CB 3.84Å; F322-A427 HydrophobicContact CZ-CB 3.56Å; F322-N449 WeakPolarHBondContact CE2-O 3.34Å; F322-Q450 HydrophobicContact CB-CB 4.06Å; F322-Q450 HydrophobicContact CB-CG 3.98Å; F322-Q450 HydrophobicContact CD1-CB 3.7Å; F322-Q450 HydrophobicContact CD1-CG 4.4Å; F322-Q450 HydrophobicContact CD2-CB 3.72Å; F322-Q450 HydrophobicContact CD2-CG 4.48Å; F322-Q450 HydrophobicContact CE1-CB 3.97Å; F322-Q450 HydrophobicContact CE2-CB 3.99Å; F322-Q450 HydrophobicContact CG-CB 3.59Å; F322-Q450 HydrophobicContact CG-CG 4.09Å; F322-Q450 HydrophobicContact CZ-CB 4.11Å
323	T	73.9	Confident	70.7	Confident	37 Å²	37	68.5 Å²	68.5	23%	0.227	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	151.1	171.6	58.8	0	0	0	0	111	I372 N373	T323-I372 VanDerWaalsContact O-CA 3.26Å; T323-I372 WeakPolarHBondContact O-CA 3.39Å; T323-N373 PolarHBondContact N-O 3.29Å; T323-N373 PolarHBondContact O-N 3.5Å; T323-N373 WeakPolarHBondContact OG1-CB 3.41Å; T323-N373 PolarHBondContact OG1-ND2 3.34Å; T323-N373 PolarHBondContact OG1-O 3.18Å
324	L	76.4	Confident	69.3	Low	9 Å²	9	69.9 Å²	69.9	5%	0.047	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	139.5	-179.2	-173.9	68.3	0	0	0	111.4	R361 W362 M364 Y370 V371 I372	L324-R361 WeakPolarHBondContact CB-O 3.44Å; L324-R361 WeakPolarHBondContact CD2-O 3.31Å; L324-W362 HydrophobicContact CB-CE3 4.01Å; L324-W362 HydrophobicContact CB-CH2 4.04Å; L324-W362 HydrophobicContact CB-CZ3 3.63Å; L324-W362 HydrophobicContact CD2-CE3 4.07Å; L324-W362 HydrophobicContact CD2-CZ3 4.34Å; L324-W362 HydrophobicContact CG-CZ3 4.39Å; L324-M364 HydrophobicContact CD1-CE 3.45Å; L324-M364 VanDerWaalsContact CD1-CE 3.45Å; L324-M364 HydrophobicContact CD2-CE 4.05Å; L324-M364 HydrophobicContact CD2-CG 4.08Å; L324-M364 HydrophobicContact CG-CE 4.43Å; L324-Y370 HydrophobicContact CD1-CD1 4.12Å; L324-Y370 HydrophobicContact CD1-CG 4.19Å; L324-Y370 HydrophobicContact CD2-CD1 4.4Å; L324-Y370 HydrophobicContact CG-CD1 4.19Å; L324-V371 CarbonylContact C-O 3.58Å; L324-V371 WeakPolarHBondContact CA-O 3.04Å; L324-I372 HydrophobicContact CD1-CD1 4.38Å; L324-I372 HydrophobicContact CD1-CG1 3.62Å
325	I	73.6	Confident	68.2	Low	95 Å²	95	71.3 Å²	71.3	49%	0.487	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	128.8	179.3	-50.8	176.7	0	0	0	109.6	Y370 V371	I325-Y370 CarbonylContact O-C 3.57Å; I325-Y370 WeakPolarHBondContact O-CA 3.42Å; I325-V371 HydrophobicContact CB-CB 4.41Å; I325-V371 PolarHBondContact N-O 3.04Å; I325-V371 PolarHBondContact O-N 2.82Å
326	Q	70.2	Confident	67.1	Low	74 Å²	74	71.3 Å²	71.3	35%	0.346	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	136.2	173.3	-172.3	166.9	-48.5	0	0	111.4	Y370	Q326-Y370 HydrophobicContact CB-CD1 3.89Å; Q326-Y370 HydrophobicContact CB-CE1 3.59Å; Q326-Y370 HydrophobicContact CG-CD1 4.22Å; Q326-Y370 HydrophobicContact CG-CE1 3.7Å; Q326-Y370 PolarHBondContact OE1-OH 3.11Å
327	K	67.5	Low	66	Low	111 Å²	111	72.1 Å²	72.1	48%	0.483	37%	0.366	S	S	.	.			trans	-98	102.2	-179.9	-167.3	171.9	-176.4	174.8	0	110.8	V369	K327-V369 HydrophobicContact CB-CB 4.4Å; K327-V369 HydrophobicContact CB-CG1 4.14Å; K327-V369 WeakPolarHBondContact CB-O 3.37Å; K327-V369 HydrophobicContact CD-CG1 4.16Å; K327-V369 PolarHBondContact N-O 2.94Å
328	Y	56.3	Low	65	Low	171 Å²	171	73.4 Å²	73.4	67%	0.671	37%	0.373	S	S	*	.			trans	-63.9	141	-179.2	-73.9	-88.2	0	0	0	113.3
329	T	46.4	Very low	64.1	Low	112 Å²	112	71.7 Å²	71.7	69%	0.687	36%	0.359	S	S	*	.			trans	-145	132.2	174.5	56.6	0	0	0	0	110.8
330	N	42.2	Very low	63	Low	158 Å²	158	71.7 Å²	71.7	85%	0.845	36%	0.364	S	S	*	.	S	Bend	trans	81.2	161.6	177.8	-57.5	-24.7	0	0	0	117.5
331	K	45.2	Very low	61.7	Low	211 Å²	211	76.9 Å²	76.9	92%	0.917	39%	0.386	S	S	*	.			trans	-104.8	21.8	-153.2	-58.5	-176.8	175.5	-176.3	0	115.8
332	N	46.7	Very low	60.9	Low	144 Å²	144	81 Å²	81	77%	0.77	41%	0.408	S	S	*	.			trans	-87.1	143.5	-179.1	-71.4	11.1	0	0	0	110.7	D334	N332-D334 PolarHBondContact O-N 3.27Å
333	P	50.8	Low	59.5	Low	82 Å²	82	82.4 Å²	82.4	53%	0.532	42%	0.416	S	S	.	.			trans	-65.9	128.4	169	28.4	-33.1	0	0	0	109.3	I335	P333-I335 PolarHBondContact O-N 3Å
334	D	59.5	Low	58.3	Low	75 Å²	75	83.6 Å²	83.6	40%	0.401	43%	0.425	S	S	.	.			trans	-69.8	104.5	-179.2	-97.8	-29.3	0	0	0	110.5	N332 C336 Q337 L338	N332-D334 PolarHBondContact O-N 3.27Å; D334-C336 PolarHBondContact O-N 2.83Å; D334-C336 VanDerWaalsContact O-N 3.17Å; D334-Q337 HydrophobicContact CB-CB 3.74Å; D334-Q337 HydrophobicContact CB-CG 3.53Å; D334-Q337 PolarHBondContact O-N 2.89Å; D334-Q337 PolarHBondContact OD2-NE2 3.31Å; D334-L338 PolarHBondContact O-N 3Å
335	I	67.1	Low	56.7	Low	34 Å²	34	87.3 Å²	87.3	17%	0.174	47%	0.466	C	S	.	.	H	α-helix	trans	-54.3	-33	170	-62.8	173.8	0	0	0	110.3	P333 L338 A339 L501 V545 Y557	P333-I335 PolarHBondContact O-N 3Å; I335-L338 PolarHBondContact O-N 3.39Å; I335-A339 VanDerWaalsContact O-CB 3.29Å; I335-A339 WeakPolarHBondContact O-CB 3.33Å; I335-A339 PolarHBondContact O-N 2.88Å; I335-L501 HydrophobicContact CG2-CD1 4.16Å; I335-V545 HydrophobicContact CG2-CG2 3.59Å; I335-Y557 HydrophobicContact CD1-CD1 4.37Å; I335-Y557 HydrophobicContact CD1-CE1 4.3Å
336	C	65.6	Low	54.9	Low	23 Å²	23	87.5 Å²	87.5	16%	0.155	48%	0.475	C	S	.	.	H	α-helix	trans	-66.8	-36.2	174	-53.9	0	0	0	0	113.5	D334 S340 C555	D334-C336 PolarHBondContact O-N 2.83Å; D334-C336 VanDerWaalsContact O-N 3.17Å; C336-S340 WeakPolarHBondContact O-CB 3.48Å; C336-S340 PolarHBondContact O-N 3.34Å; C336-C555 WeakPolarHBondContact CA-SG 3.45Å; C336-C555 HydrophobicContact CB-CB 3.73Å; C336-C555 WeakPolarHBondContact CB-SG 3.32Å; C336-C555 WeakPolarHBondContact SG-CB 3.48Å; C336-C555 CovalentContact SG-SG 2.03Å; C336-C555 PolarHBondContact SG-SG 2.88Å
337	Q	62.2	Low	53	Low	86 Å²	86	91.2 Å²	91.2	40%	0.402	49%	0.487	S	S	.	.	H	α-helix	trans	-72	-43.1	174.3	-69.2	-177.8	41.6	0	0	110.6	D334 A339 S340 F341	D334-Q337 HydrophobicContact CB-CB 3.74Å; D334-Q337 HydrophobicContact CB-CG 3.53Å; D334-Q337 PolarHBondContact O-N 2.89Å; D334-Q337 PolarHBondContact OD2-NE2 3.31Å; Q337-A339 VanDerWaalsContact C-N 3.3Å; Q337-A339 PolarHBondContact O-N 3.34Å; Q337-S340 PolarHBondContact O-N 3.06Å; Q337-S340 PolarHBondContact O-OG 3.28Å; Q337-F341 HydrophobicContact CB-CE2 4.42Å; Q337-F341 WeakPolarHBondContact O-CD2 3.45Å; Q337-F341 PolarHBondContact O-N 3.41Å
338	L	63.9	Low	51.4	Low	33 Å²	33	91.8 Å²	91.8	17%	0.173	50%	0.5	C	S	.	.	H	α-helix	trans	-59.8	-42.6	176.8	-155.9	77.3	0	0	0	111.6	D334 I335 S340 L342 L506 H509	D334-L338 PolarHBondContact O-N 3Å; I335-L338 PolarHBondContact O-N 3.39Å; L338-S340 VanDerWaalsContact C-N 3.35Å; L338-L342 WeakPolarHBondContact O-CG 3.43Å; L338-L342 PolarHBondContact O-N 2.8Å; L338-L506 HydrophobicContact CD2-CD2 4.16Å; L338-H509 WeakPolarHBondContact CD1-NE2 3.24Å
339	A	61.9	Low	50.4	Low	0 Å²	0	91 Å²	91	0%	0	51%	0.508	C	S	.	.	H	α-helix	trans	-68.4	-27.8	174.1	0	0	0	0	0	113.4	I335 Q337 N343 V545	I335-A339 VanDerWaalsContact O-CB 3.29Å; I335-A339 WeakPolarHBondContact O-CB 3.33Å; I335-A339 PolarHBondContact O-N 2.88Å; Q337-A339 VanDerWaalsContact C-N 3.3Å; Q337-A339 PolarHBondContact O-N 3.34Å; A339-N343 WeakPolarHBondContact O-CB 3.32Å; A339-N343 PolarHBondContact O-N 3.11Å; A339-N343 PolarHBondContact O-ND2 2.79Å; A339-V545 HydrophobicContact CB-CB 4.22Å; A339-V545 HydrophobicContact CB-CG1 3.86Å; A339-V545 HydrophobicContact CB-CG2 4.43Å
340	S	57.9	Low	49.9	Very low	36 Å²	36	92.5 Å²	92.5	25%	0.252	51%	0.507	S	S	.	.	H	α-helix	trans	-75.6	-42.1	176	78.3	0	0	0	0	111.9	C336 Q337 L338 L342 N343 S344	C336-S340 WeakPolarHBondContact O-CB 3.48Å; C336-S340 PolarHBondContact O-N 3.34Å; Q337-S340 PolarHBondContact O-N 3.06Å; Q337-S340 PolarHBondContact O-OG 3.28Å; L338-S340 VanDerWaalsContact C-N 3.35Å; S340-L342 PolarHBondContact O-N 3.24Å; S340-N343 WeakPolarHBondContact O-CA 3.38Å; S340-N343 WeakPolarHBondContact O-CB 3.33Å; S340-N343 PolarHBondContact O-N 3.16Å; S340-S344 PolarHBondContact O-N 2.85Å; S340-S344 PolarHBondContact O-OG 3.35Å
341	F	55.6	Low	49.4	Very low	118 Å²	118	90 Å²	90	52%	0.518	50%	0.497	S	S	.	.	H	α-helix	trans	-57.7	-47.7	175.1	-76.8	-64.2	0	0	0	112.5	Q337 N343 S344	Q337-F341 HydrophobicContact CB-CE2 4.42Å; Q337-F341 WeakPolarHBondContact O-CD2 3.45Å; Q337-F341 PolarHBondContact O-N 3.41Å; F341-N343 PolarHBondContact O-N 2.88Å; F341-S344 PolarHBondContact O-N 2.87Å; F341-S344 VanDerWaalsContact O-N 3.1Å; F341-S344 PolarHBondContact O-OG 3.47Å
342	L	56.3	Low	48.6	Very low	87 Å²	87	84.7 Å²	84.7	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-64.8	-20	177.5	-69.5	167.8	0	0	0	113.1	L338 S340 L501 L521	L338-L342 WeakPolarHBondContact O-CG 3.43Å; L338-L342 PolarHBondContact O-N 2.8Å; S340-L342 PolarHBondContact O-N 3.24Å; L342-L501 HydrophobicContact CD1-CD2 3.5Å; L342-L521 HydrophobicContact CD1-CD2 4.44Å; L342-L521 HydrophobicContact CD2-CD1 4.26Å; L342-L521 HydrophobicContact CD2-CD2 4.46Å
343	N	50.5	Low	47.9	Very low	35 Å²	35	82.3 Å²	82.3	19%	0.187	49%	0.487	C	S	.	.	H	α-helix	trans	-88.8	-12.8	176.1	-87.6	-54.6	0	0	0	114	A339 S340 F341 R497 T499	A339-N343 WeakPolarHBondContact O-CB 3.32Å; A339-N343 PolarHBondContact O-N 3.11Å; A339-N343 PolarHBondContact O-ND2 2.79Å; S340-N343 WeakPolarHBondContact O-CA 3.38Å; S340-N343 WeakPolarHBondContact O-CB 3.33Å; S340-N343 PolarHBondContact O-N 3.16Å; F341-N343 PolarHBondContact O-N 2.88Å; N343-R497 PolarHBondContact O-NH2 2.63Å; N343-R497 PolarHBondContact OD1-NE 3.36Å; N343-R497 PolarHBondContact OD1-NH2 2.93Å; N343-T499 WeakPolarHBondContact ND2-CG2 3.4Å
344	S	49.1	Very low	46.8	Very low	61 Å²	61	82.1 Å²	82.1	43%	0.427	50%	0.5	S	S	.	.			trans	-103.9	65.9	-178.9	57.8	0	0	0	0	112.6	S340 F341 S346	S340-S344 PolarHBondContact O-N 2.85Å; S340-S344 PolarHBondContact O-OG 3.35Å; F341-S344 PolarHBondContact O-N 2.87Å; F341-S344 VanDerWaalsContact O-N 3.1Å; F341-S344 PolarHBondContact O-OG 3.47Å; S344-S346 PolarHBondContact O-N 3.16Å
345	G	42.4	Very low	45.3	Very low	87 Å²	87	83.6 Å²	83.6	90%	0.897	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	47.8	-175.8	0	0	0	0	0	116.4
346	S	34.7	Very low	43.6	Very low	99 Å²	99	92.8 Å²	92.8	69%	0.692	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.4	1.6	-175.5	-169.1	0	0	0	0	116.3	S344	S344-S346 PolarHBondContact O-N 3.16Å
347	Y	31.4	Very low	42	Very low	152 Å²	152	99.4 Å²	99.4	60%	0.596	58%	0.581	S	S	*	*			trans	-135.5	28.6	-167	-93.5	-80.5	0	0	0	116.9	N349	Y347-N349 PolarHBondContact O-N 3.16Å; Y347-N349 VanDerWaalsContact O-N 3.13Å
348	V	34.8	Very low	40.6	Very low	123 Å²	123	99.2 Å²	99.2	75%	0.745	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-23.8	-178.7	-177.7	0	0	0	0	113.7
349	N	34.5	Very low	39.3	Very low	156 Å²	156	102 Å²	102	83%	0.834	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	3.9	-167.9	-68.1	0.9	0	0	0	116.5	Y347	Y347-N349 PolarHBondContact O-N 3.16Å; Y347-N349 VanDerWaalsContact O-N 3.13Å
350	Q	35	Very low	38.6	Very low	143 Å²	143	105.3 Å²	105.3	67%	0.668	61%	0.613	S	S	*	*	S	Bend	trans	-120.9	-4.8	-175.4	-76.7	-171.2	-17.8	0	0	116.1	A352	Q350-A352 PolarHBondContact O-N 2.82Å; Q350-A352 VanDerWaalsContact O-N 3.15Å
351	V	32.1	Very low	38.5	Very low	106 Å²	106	107.8 Å²	107.8	64%	0.642	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-0.5	-175.9	-169.2	0	0	0	0	113	S353	V351-S353 VanDerWaalsContact C-N 3.27Å; V351-S353 PolarHBondContact O-N 3.49Å
352	A	29.3	Very low	39.4	Very low	98 Å²	98	103.2 Å²	103.2	81%	0.81	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-0.2	-177.7	0	0	0	0	0	115.6	Q350	Q350-A352 PolarHBondContact O-N 2.82Å; Q350-A352 VanDerWaalsContact O-N 3.15Å
353	S	31.5	Very low	40.2	Very low	94 Å²	94	100.6 Å²	100.6	66%	0.657	58%	0.583	S	S	*	*	S	Bend	trans	-132.7	61.4	-172.5	-60	0	0	0	0	114.3	V351 S355	V351-S353 VanDerWaalsContact C-N 3.27Å; V351-S353 PolarHBondContact O-N 3.49Å; S353-S355 PolarHBondContact O-N 2.78Å; S353-S355 PolarHBondContact O-OG 3.15Å
354	G	27.5	Very low	41.6	Very low	79 Å²	79	99 Å²	99	81%	0.814	57%	0.574	S	S	*	*			trans	57.9	0.2	144.3	0	0	0	0	0	120.8
355	S	27.8	Very low	42.9	Very low	105 Å²	105	98 Å²	98	73%	0.734	56%	0.563	S	S	*	*			trans	-103.6	115.9	-168.1	45	0	0	0	0	111.9	S353 M357	S353-S355 PolarHBondContact O-N 2.78Å; S353-S355 PolarHBondContact O-OG 3.15Å; S355-M357 PolarHBondContact O-N 3.27Å
356	Y	31.7	Very low	44.7	Very low	228 Å²	228	95.5 Å²	95.5	89%	0.894	53%	0.532	S	S	*	.			trans	-63.4	112	177.8	-69.9	-94.9	0	0	0	111.1	P358	Y356-P358 WeakPolarHBondContact O-CD 3.4Å
357	M	31.7	Very low	46.7	Very low	162 Å²	162	93.3 Å²	93.3	80%	0.798	52%	0.524	S	S	*	.			trans	-71.2	119.7	177.2	-107.2	-159.1	171.6	0	0	112	S355 I359	S355-M357 PolarHBondContact O-N 3.27Å; M357-I359 HydrophobicContact CB-CG1 4.33Å; M357-I359 PolarHBondContact O-N 3.33Å
358	P	32.7	Very low	48.9	Very low	82 Å²	82	89.9 Å²	89.9	53%	0.532	51%	0.513	S	S	.	.			trans	-92.4	79.4	-176.4	35.7	-32.4	0	0	0	111.7	Y356 R360	Y356-P358 WeakPolarHBondContact O-CD 3.4Å; P358-R360 PolarHBondContact O-N 2.82Å; P358-R360 VanDerWaalsContact O-N 3.1Å
359	I	37	Very low	51.2	Low	91 Å²	91	85.5 Å²	85.5	47%	0.467	49%	0.486	S	S	.	.			trans	-76.7	100.8	-172.3	-57.3	177.9	0	0	0	112.2	M357 Q553	M357-I359 HydrophobicContact CB-CG1 4.33Å; M357-I359 PolarHBondContact O-N 3.33Å; I359-Q553 PolarHBondContact O-NE2 2.85Å; I359-Q553 PolarHBondContact O-OE1 3.19Å
360	R	47.7	Very low	53.5	Low	69 Å²	69	78.3 Å²	78.3	26%	0.26	45%	0.448	S	S	.	.			trans	62.8	105.5	162.4	-61.4	-179.9	176.2	-162.3	-8.2	115.8	P358 V1855	P358-R360 PolarHBondContact O-N 2.82Å; P358-R360 VanDerWaalsContact O-N 3.1Å; R360-V1855 HydrophobicContact CG-CG1 4.37Å; R360-V1855 HydrophobicContact CG-CG2 4.5Å
361	R	55.8	Low	55.8	Low	89 Å²	89	72.2 Å²	72.2	34%	0.336	42%	0.42	S	S	.	.	S	Bend	trans	-101.4	25.4	-156	-62.3	177.1	171.6	145.8	-7.6	117.6	L324	L324-R361 WeakPolarHBondContact CB-O 3.44Å; L324-R361 WeakPolarHBondContact CD2-O 3.31Å
362	W	73.5	Confident	58.3	Low	22 Å²	22	67.2 Å²	67.2	8%	0.083	39%	0.389	C	S	.	.	S	Bend	trans	-131.2	28.4	175.7	-72.7	127.7	0	0	0	115.5	F322 L324 Q450 V452 T453 P1857	F322-W362 HydrophobicContact CB-CH2 3.51Å; F322-W362 HydrophobicContact CB-CZ2 3.59Å; F322-W362 WeakPolarHBondContact O-CZ2 3.33Å; L324-W362 HydrophobicContact CB-CE3 4.01Å; L324-W362 HydrophobicContact CB-CH2 4.04Å; L324-W362 HydrophobicContact CB-CZ3 3.63Å; L324-W362 HydrophobicContact CD2-CE3 4.07Å; L324-W362 HydrophobicContact CD2-CZ3 4.34Å; L324-W362 HydrophobicContact CG-CZ3 4.39Å; W362-Q450 HydrophobicContact CD2-CG 3.79Å; W362-Q450 HydrophobicContact CE3-CG 3.88Å; W362-Q450 HydrophobicContact CH2-CG 3.71Å; W362-Q450 HydrophobicContact CZ2-CG 3.53Å; W362-Q450 HydrophobicContact CZ3-CG 3.83Å; W362-Q450 VanDerWaalsContact NE1-CD 3.27Å; W362-V452 HydrophobicContact CE3-CG2 3.7Å; W362-V452 HydrophobicContact CZ3-CG2 4.15Å; W362-T453 PolarHBondContact O-N 2.88Å; W362-P1857 HydrophobicContact CZ2-CG 4.34Å; W362-P1857 VanDerWaalsContact NE1-CB 3.3Å
363	I	73.7	Confident	60.9	Low	32 Å²	32	64.2 Å²	64.2	16%	0.164	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.8	-174.2	-64.2	173.3	0	0	0	109.5	T453 Y455 N551 I554	I363-T453 WeakPolarHBondContact CA-O 3.2Å; I363-Y455 HydrophobicContact CD1-CE2 4.41Å; I363-Y455 HydrophobicContact CG1-CE2 4.4Å; I363-Y455 HydrophobicContact CG2-CD2 3.64Å; I363-Y455 HydrophobicContact CG2-CE2 3.83Å; I363-N551 HydrophobicContact CD1-CB 4.45Å; I363-N551 VanDerWaalsContact CD1-ND2 3.3Å; I363-N551 WeakPolarHBondContact CD1-ND2 3.45Å; I363-N551 WeakPolarHBondContact CD1-OD1 3Å; I363-I554 HydrophobicContact CG2-CD1 3.92Å
364	M	80.7	Confident	63.5	Low	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	152.7	174.8	-59	-161.1	-158.7	0	0	111.2	L324 Y370 I372 F401 V415 A417 V452 T453 I454 Y455	L324-M364 HydrophobicContact CD1-CE 3.45Å; L324-M364 VanDerWaalsContact CD1-CE 3.45Å; L324-M364 HydrophobicContact CD2-CE 4.05Å; L324-M364 HydrophobicContact CD2-CG 4.08Å; L324-M364 HydrophobicContact CG-CE 4.43Å; M364-Y370 WeakPolarHBondContact CA-OH 3.31Å; M364-Y370 HydrophobicContact CB-CD2 4.14Å; M364-Y370 HydrophobicContact CB-CE1 4.45Å; M364-Y370 HydrophobicContact CB-CE2 3.56Å; M364-Y370 HydrophobicContact CE-CG 4.47Å; M364-Y370 HydrophobicContact CG-CD1 4.22Å; M364-Y370 HydrophobicContact CG-CD2 3.8Å; M364-Y370 HydrophobicContact CG-CE1 4.15Å; M364-Y370 HydrophobicContact CG-CE2 3.7Å; M364-Y370 HydrophobicContact CG-CG 4.09Å; M364-Y370 HydrophobicContact SD-CD1 4.48Å; M364-Y370 HydrophobicContact SD-CD2 3.4Å; M364-Y370 WeakPolarHBondContact SD-CD2 3.26Å; M364-Y370 HydrophobicContact SD-CE2 3.86Å; M364-Y370 HydrophobicContact SD-CG 3.78Å; M364-I372 HydrophobicContact CE-CD1 4.26Å; M364-F401 HydrophobicContact CE-CE1 3.78Å; M364-F401 HydrophobicContact CE-CZ 4.25Å; M364-F401 HydrophobicContact SD-CE1 3.73Å; M364-V415 HydrophobicContact CE-CG2 4.39Å; M364-A417 HydrophobicContact CB-CB 4.23Å; M364-A417 HydrophobicContact SD-CB 3.99Å; M364-V452 HydrophobicContact CE-CG1 3.79Å; M364-V452 HydrophobicContact CG-CG1 4.03Å; M364-T453 PolarHBondContact N-O 3.34Å; M364-I454 HydrophobicContact CB-CG1 4.21Å; M364-I454 HydrophobicContact CB-CG2 4.31Å; M364-I454 CarbonylContact O-C 3.48Å; M364-I454 WeakPolarHBondContact O-CA 3.25Å; M364-Y455 PolarHBondContact O-N 2.93Å
365	E	76.5	Confident	66.2	Low	39 Å²	39	56.9 Å²	56.9	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.1	168.7	-177.9	-166.4	146.1	0	0	108.8	G367 K368 Y370 P457	E365-G367 PolarHBondContact O-N 3.09Å; E365-K368 HydrophobicContact CB-CG 3.79Å; E365-K368 HydrophobicContact CG-CG 4.2Å; E365-K368 PolarHBondContact O-N 2.91Å; E365-K368 VanDerWaalsContact O-N 3.1Å; E365-K368 WeakPolarHBondContact OE1-CE 3.14Å; E365-K368 IonicContact OE1-NZ 2.69Å; E365-K368 PolarHBondContact OE1-NZ 3.38Å; E365-K368 WeakPolarHBondContact OE2-CE 3.27Å; E365-K368 IonicContact OE2-NZ 3.18Å; E365-Y370 PolarHBondContact N-OH 2.85Å; E365-P457 HydrophobicContact CG-CB 4.3Å
366	S	80.4	Confident	68.9	Low	36 Å²	36	52 Å²	52	25%	0.252	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	126	174.4	168.2	0	0	0	0	111	F418 Y455	S366-F418 PolarHBondContact OG-O 3.27Å; S366-Y455 PolarHBondContact N-O 3.49Å
367	G	75.7	Confident	71.4	Confident	52 Å²	52	42 Å²	42	54%	0.536	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	-11.9	-178.3	0	0	0	0	0	115.8	E365 A417	E365-G367 PolarHBondContact O-N 3.09Å; G367-A417 PolarHBondContact N-O 3.23Å
368	K	78.2	Confident	73.8	Confident	80 Å²	80	34.7 Å²	34.7	35%	0.348	19%	0.185	S	C	.	.			trans	-86	165.1	176	-55.3	-67.7	-178.7	173.3	0	112.3	E365 Y370 A417	E365-K368 HydrophobicContact CB-CG 3.79Å; E365-K368 HydrophobicContact CG-CG 4.2Å; E365-K368 PolarHBondContact O-N 2.91Å; E365-K368 VanDerWaalsContact O-N 3.1Å; E365-K368 WeakPolarHBondContact OE1-CE 3.14Å; E365-K368 IonicContact OE1-NZ 2.69Å; E365-K368 PolarHBondContact OE1-NZ 3.38Å; E365-K368 WeakPolarHBondContact OE2-CE 3.27Å; E365-K368 IonicContact OE2-NZ 3.18Å; K368-Y370 HydrophobicContact CB-CD2 4.48Å; K368-Y370 HydrophobicContact CB-CE2 3.58Å; K368-A417 PolarHBondContact O-N 2.95Å
369	V	81.9	Confident	76	Confident	32 Å²	32	38.2 Å²	38.2	19%	0.194	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136.5	179.6	177.4	0	0	0	0	110.2	K327 L404 V414 V415 R416	K327-V369 HydrophobicContact CB-CB 4.4Å; K327-V369 HydrophobicContact CB-CG1 4.14Å; K327-V369 WeakPolarHBondContact CB-O 3.37Å; K327-V369 HydrophobicContact CD-CG1 4.16Å; K327-V369 PolarHBondContact N-O 2.94Å; V369-L404 HydrophobicContact CG1-CD1 3.89Å; V369-L404 HydrophobicContact CG2-CD1 4.21Å; V369-V414 HydrophobicContact CG1-CG1 4Å; V369-V415 WeakPolarHBondContact CA-O 3.38Å; V369-R416 HydrophobicContact CG2-CB 4.37Å; V369-R416 HydrophobicContact CG2-CG 4.46Å
370	Y	83.6	Confident	77.7	Confident	5 Å²	5	37.6 Å²	37.6	2%	0.02	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	159.1	-176	-63.4	-89.3	0	0	0	111.9	L324 I325 Q326 M364 E365 K368 V414 V415	L324-Y370 HydrophobicContact CD1-CD1 4.12Å; L324-Y370 HydrophobicContact CD1-CG 4.19Å; L324-Y370 HydrophobicContact CD2-CD1 4.4Å; L324-Y370 HydrophobicContact CG-CD1 4.19Å; I325-Y370 CarbonylContact O-C 3.57Å; I325-Y370 WeakPolarHBondContact O-CA 3.42Å; Q326-Y370 HydrophobicContact CB-CD1 3.89Å; Q326-Y370 HydrophobicContact CB-CE1 3.59Å; Q326-Y370 HydrophobicContact CG-CD1 4.22Å; Q326-Y370 HydrophobicContact CG-CE1 3.7Å; Q326-Y370 PolarHBondContact OE1-OH 3.11Å; M364-Y370 WeakPolarHBondContact CA-OH 3.31Å; M364-Y370 HydrophobicContact CB-CD2 4.14Å; M364-Y370 HydrophobicContact CB-CE1 4.45Å; M364-Y370 HydrophobicContact CB-CE2 3.56Å; M364-Y370 HydrophobicContact CE-CG 4.47Å; M364-Y370 HydrophobicContact CG-CD1 4.22Å; M364-Y370 HydrophobicContact CG-CD2 3.8Å; M364-Y370 HydrophobicContact CG-CE1 4.15Å; M364-Y370 HydrophobicContact CG-CE2 3.7Å; M364-Y370 HydrophobicContact CG-CG 4.09Å; M364-Y370 HydrophobicContact SD-CD1 4.48Å; M364-Y370 HydrophobicContact SD-CD2 3.4Å; M364-Y370 WeakPolarHBondContact SD-CD2 3.26Å; M364-Y370 HydrophobicContact SD-CE2 3.86Å; M364-Y370 HydrophobicContact SD-CG 3.78Å; E365-Y370 PolarHBondContact N-OH 2.85Å; K368-Y370 HydrophobicContact CB-CD2 4.48Å; K368-Y370 HydrophobicContact CB-CE2 3.58Å; Y370-V414 CarbonylContact O-C 3.08Å; Y370-V414 WeakPolarHBondContact O-CA 3.12Å; Y370-V414 WeakPolarHBondContact O-CG1 3.07Å; Y370-V415 PolarHBondContact N-O 3.28Å; Y370-V415 PolarHBondContact O-N 2.95Å
371	V	82.6	Confident	78.8	Confident	14 Å²	14	35 Å²	35	9%	0.085	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.2	171.1	-176.6	0	0	0	0	107.9	L324 I325 Y412 V413 V414	L324-V371 CarbonylContact C-O 3.58Å; L324-V371 WeakPolarHBondContact CA-O 3.04Å; I325-V371 HydrophobicContact CB-CB 4.41Å; I325-V371 PolarHBondContact N-O 3.04Å; I325-V371 PolarHBondContact O-N 2.82Å; V371-Y412 HydrophobicContact CG1-CD2 4.04Å; V371-Y412 HydrophobicContact CG1-CE1 4.43Å; V371-Y412 HydrophobicContact CG1-CE2 3.39Å; V371-V413 CarbonylContact C-O 3.54Å; V371-V413 WeakPolarHBondContact CA-O 3.24Å; V371-V414 HydrophobicContact CG2-CG1 4.48Å; V371-V414 HydrophobicContact CG2-CG2 4.31Å
372	I	84.8	Confident	79.9	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.3	177.5	-63.4	166	0	0	0	107.3	T323 L324 M364 F396 V413 V415 L425	T323-I372 VanDerWaalsContact O-CA 3.26Å; T323-I372 WeakPolarHBondContact O-CA 3.39Å; L324-I372 HydrophobicContact CD1-CD1 4.38Å; L324-I372 HydrophobicContact CD1-CG1 3.62Å; M364-I372 HydrophobicContact CE-CD1 4.26Å; I372-F396 HydrophobicContact CD1-CE1 3.78Å; I372-F396 HydrophobicContact CD1-CZ 4.43Å; I372-V413 PolarHBondContact N-O 2.62Å; I372-V413 PolarHBondContact O-N 3.26Å; I372-V415 HydrophobicContact CD1-CG1 4.26Å; I372-V415 HydrophobicContact CD1-CG2 3.78Å; I372-V415 HydrophobicContact CG1-CG2 4.44Å; I372-L425 HydrophobicContact CD1-CD1 3.93Å
373	N	84.2	Confident	80.3	Confident	36 Å²	36	39.2 Å²	39.2	19%	0.193	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	145.9	171.3	-26.9	-77.7	0	0	0	110.2	F322 T323 T411 Y412	F322-N373 CarbonylContact C-O 3.56Å; T323-N373 PolarHBondContact N-O 3.29Å; T323-N373 PolarHBondContact O-N 3.5Å; T323-N373 WeakPolarHBondContact OG1-CB 3.41Å; T323-N373 PolarHBondContact OG1-ND2 3.34Å; T323-N373 PolarHBondContact OG1-O 3.18Å; N373-T411 CarbonylContact C-O 3.37Å; N373-T411 VanDerWaalsContact CA-O 3.23Å; N373-T411 WeakPolarHBondContact CA-O 3.39Å; N373-Y412 WeakPolarHBondContact OD1-CD2 3.2Å
374	L	85.6	Confident	80.9	Confident	3 Å²	3	38 Å²	38	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140.2	170.2	-59.8	-177.3	0	0	0	111.2	G321 F322 L392 L394 T411 A427	G321-L374 VanDerWaalsContact O-CA 3.27Å; G321-L374 WeakPolarHBondContact O-CA 3.4Å; F322-L374 HydrophobicContact CB-CD2 4.29Å; F322-L374 HydrophobicContact CD1-CD2 3.25Å; F322-L374 HydrophobicContact CD2-CD2 4.42Å; F322-L374 HydrophobicContact CE1-CD2 3.6Å; F322-L374 HydrophobicContact CG-CD2 3.71Å; F322-L374 HydrophobicContact CZ-CD2 4.31Å; L374-L392 HydrophobicContact CD1-CD1 3.96Å; L374-L392 HydrophobicContact CD1-CD2 3.5Å; L374-L392 VanDerWaalsContact CD1-CD2 3.5Å; L374-L392 HydrophobicContact CD1-CG 4.4Å; L374-L394 HydrophobicContact CD1-CD1 3.76Å; L374-L394 HydrophobicContact CD1-CD2 3.91Å; L374-L394 HydrophobicContact CD1-CG 3.69Å; L374-L394 HydrophobicContact CD2-CD2 4.42Å; L374-L394 HydrophobicContact CG-CD1 4.18Å; L374-T411 PolarHBondContact N-O 3.21Å; L374-A427 HydrophobicContact CD1-CB 3.9Å; L374-A427 HydrophobicContact CD2-CB 4.48Å
375	D	83.8	Confident	81.1	Confident	16 Å²	16	42.1 Å²	42.1	9%	0.086	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	153.2	172	-70.5	-58.9	0	0	0	109.5	L320 G321 Y377 R383	L320-D375 WeakPolarHBondContact CA-O 3.3Å; G321-D375 PolarHBondContact N-O 3.41Å; G321-D375 PolarHBondContact O-N 3.09Å; D375-Y377 HydrophobicContact CB-CD2 4.37Å; D375-Y377 HydrophobicContact CB-CE2 3.44Å; D375-Y377 VanDerWaalsContact CB-CE2 3.44Å; D375-R383 IonicContact OD1-CZ 2.66Å; D375-R383 IonicContact OD1-NE 3.1Å; D375-R383 PolarHBondContact OD1-NE 3.44Å; D375-R383 IonicContact OD1-NH2 2.63Å; D375-R383 PolarHBondContact OD1-NH2 3.05Å; D375-R383 IonicContact OD2-NE 2.72Å; D375-R383 IonicContact OD2-NH2 3.35Å
376	I	85.7	Confident	81	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.015	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.2	176.9	-43.8	178.9	0	0	0	107.3	P317 L320 L384 L390 L392 L429	P317-I376 HydrophobicContact CB-CG2 4.16Å; L320-I376 HydrophobicContact CD2-CB 4.26Å; L320-I376 HydrophobicContact CD2-CG1 3.87Å; L320-I376 HydrophobicContact CD2-CG2 4.02Å; I376-L384 HydrophobicContact CB-CB 4.14Å; I376-L384 HydrophobicContact CB-CD1 4.27Å; I376-L384 HydrophobicContact CG2-CD1 3.72Å; I376-L384 WeakPolarHBondContact O-CB 3.23Å; I376-L384 PolarHBondContact O-N 2.69Å; I376-L390 HydrophobicContact CD1-CD1 3.88Å; I376-L390 HydrophobicContact CD1-CD2 4.23Å; I376-L392 HydrophobicContact CD1-CD1 4.17Å; I376-L392 HydrophobicContact CG1-CD1 4.28Å; I376-L429 HydrophobicContact CD1-CD1 4.14Å; I376-L429 HydrophobicContact CD1-CD2 4.2Å; I376-L429 HydrophobicContact CG2-CD2 3.9Å
377	Y	83.7	Confident	81	Confident	17 Å²	17	41 Å²	41	7%	0.067	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.2	-177.3	-63.7	-91.2	0	0	0	111.6	A318 Y319 D375 H382 R383 H1873	A318-Y377 PolarHBondContact N-O 3.05Å; Y319-Y377 AromaticContact CD2-CD2 3.95Å; Y319-Y377 HydrophobicContact CD2-CD2 3.95Å; Y319-Y377 HydrophobicContact CD2-CG 4.24Å; Y319-Y377 HydrophobicContact CE2-CD1 4.36Å; Y319-Y377 AromaticContact CE2-CD2 3.39Å; Y319-Y377 HydrophobicContact CE2-CD2 3.39Å; Y319-Y377 HydrophobicContact CE2-CE2 4.26Å; Y319-Y377 AromaticContact CE2-CG 3.44Å; Y319-Y377 HydrophobicContact CE2-CG 3.44Å; Y319-Y377 VanDerWaalsContact CE2-CG 3.44Å; Y319-Y377 AromaticContact CZ-CG 3.7Å; Y319-Y377 PolarHBondContact N-O 2.83Å; Y319-Y377 PolarHBondContact O-N 3.35Å; D375-Y377 HydrophobicContact CB-CD2 4.37Å; D375-Y377 HydrophobicContact CB-CE2 3.44Å; D375-Y377 VanDerWaalsContact CB-CE2 3.44Å; Y377-H382 VanDerWaalsContact CA-O 3.3Å; Y377-H382 WeakPolarHBondContact CA-O 3.4Å; Y377-R383 HydrophobicContact CD1-CB 4.09Å; Y377-R383 HydrophobicContact CE1-CB 3.64Å; Y377-R383 HydrophobicContact CE1-CG 3.98Å; Y377-H1873 AromaticContact CD1-CE1 3.64Å; Y377-H1873 AromaticContact CD1-NE2 3.59Å; Y377-H1873 AromaticContact CE1-CE1 3.15Å; Y377-H1873 WeakPolarHBondContact CE1-CE1 3.37Å; Y377-H1873 AromaticContact CE1-NE2 3.09Å; Y377-H1873 WeakPolarHBondContact CE1-NE2 3.42Å; Y377-H1873 AromaticContact CZ-CE1 3.52Å; Y377-H1873 AromaticContact CZ-NE2 3.86Å
378	D	82.2	Confident	81.2	Confident	8 Å²	8	44.4 Å²	44.4	4%	0.043	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-172.6	170.3	82.2	-9.2	0	0	0	112.1	V315 E316 A318 N380 N381 H382	V315-D378 HydrophobicContact CB-CB 4.21Å; V315-D378 HydrophobicContact CG2-CB 3.66Å; E316-D378 WeakPolarHBondContact O-CA 3.22Å; E316-D378 WeakPolarHBondContact O-CB 3.46Å; A318-D378 VanDerWaalsContact CB-C 3.44Å; A318-D378 WeakPolarHBondContact CB-O 3.49Å; D378-N380 PolarHBondContact O-N 3.33Å; D378-N380 VanDerWaalsContact OD1-C 3.23Å; D378-N380 WeakPolarHBondContact OD1-CA 3.46Å; D378-N380 PolarHBondContact OD1-N 2.66Å; D378-N381 PolarHBondContact OD1-N 3.19Å; D378-N381 VanDerWaalsContact OD1-N 3.17Å; D378-H382 PolarHBondContact N-O 2.91Å; D378-H382 VanDerWaalsContact N-O 3.11Å; D378-H382 WeakPolarHBondContact OD1-CB 3.43Å; D378-H382 IonicContact OD1-CG 3.83Å; D378-H382 PolarHBondContact OD1-N 3.38Å; D378-H382 IonicContact OD1-ND1 2.71Å; D378-H382 PolarHBondContact OD1-ND1 3.26Å; D378-H382 IonicContact OD2-CE1 2.88Å; D378-H382 IonicContact OD2-CG 2.73Å; D378-H382 IonicContact OD2-ND1 3.39Å; D378-H382 PolarHBondContact OD2-ND1 3.5Å
379	R	79.1	Confident	81.6	Confident	157 Å²	157	41.9 Å²	41.9	59%	0.592	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-10.9	-179.5	-60.5	-177.8	-176.7	-142.2	1.1	114.1	E316 A318	E316-R379 IonicContact OE1-CZ 2.69Å; E316-R379 IonicContact OE1-NE 2.68Å; E316-R379 IonicContact OE1-NH2 3.33Å; E316-R379 PolarHBondContact OE1-NH2 3.27Å; E316-R379 IonicContact OE2-CZ 2.74Å; E316-R379 IonicContact OE2-NE 3.87Å; E316-R379 PolarHBondContact OE2-NE 2.89Å; E316-R379 IonicContact OE2-NH2 3.27Å; E316-R379 PolarHBondContact OE2-NH2 3.26Å; A318-R379 HydrophobicContact CB-CB 4.36Å; A318-R379 HydrophobicContact CB-CG 3.74Å
380	N	72	Confident	81.8	Confident	77 Å²	77	40.5 Å²	40.5	41%	0.412	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	27.2	-174.6	-60.9	7.3	0	0	0	110.8	D378 H382 E1830	D378-N380 PolarHBondContact O-N 3.33Å; D378-N380 VanDerWaalsContact OD1-C 3.23Å; D378-N380 WeakPolarHBondContact OD1-CA 3.46Å; D378-N380 PolarHBondContact OD1-N 2.66Å; N380-H382 PolarHBondContact O-N 2.68Å; N380-H382 VanDerWaalsContact O-N 3.09Å; N380-E1830 WeakPolarHBondContact CA-OE1 3.29Å
381	N	71.2	Confident	81.8	Confident	15 Å²	15	44.8 Å²	44.8	8%	0.08	20%	0.204	C	C	.	.			trans	58.1	18.3	-179.8	-62.9	-18.9	0	0	0	116.2	Y319 D378 R383 E1830 R1872 H1873	Y319-N381 WeakPolarHBondContact CE1-OD1 3.21Å; Y319-N381 VanDerWaalsContact OH-CG 3.31Å; Y319-N381 PolarHBondContact OH-OD1 2.9Å; D378-N381 PolarHBondContact OD1-N 3.19Å; D378-N381 VanDerWaalsContact OD1-N 3.17Å; N381-R383 PolarHBondContact O-N 3.4Å; N381-E1830 WeakPolarHBondContact ND2-CG 3.18Å; N381-E1830 PolarHBondContact ND2-OE2 2.89Å; N381-R1872 VanDerWaalsContact ND2-C 3.29Å; N381-R1872 PolarHBondContact ND2-O 2.95Å; N381-R1872 PolarHBondContact OD1-O 3.26Å; N381-H1873 WeakPolarHBondContact ND2-CA 3.4Å; N381-H1873 PolarHBondContact O-NE2 2.87Å
382	H	78.1	Confident	81.9	Confident	54 Å²	54	44.3 Å²	44.3	25%	0.25	20%	0.201	C	C	.	.			trans	-76.4	126.2	173.7	-53.9	122.2	0	0	0	110.8	Y214 Y377 D378 N380 L384	Y214-H382 HydrophobicContact CD1-CB 3.5Å; Y214-H382 AromaticContact CD1-CG 3.76Å; Y214-H382 AromaticContact CD1-ND1 3.95Å; Y214-H382 HydrophobicContact CD2-CB 3.78Å; Y214-H382 HydrophobicContact CE1-CB 3.56Å; Y214-H382 AromaticContact CE1-CD2 3.67Å; Y214-H382 AromaticContact CE1-CE1 3.86Å; Y214-H382 AromaticContact CE1-CG 3.28Å; Y214-H382 AromaticContact CE1-ND1 3.43Å; Y214-H382 WeakPolarHBondContact CE1-ND1 3.5Å; Y214-H382 HydrophobicContact CE2-CB 3.82Å; Y214-H382 AromaticContact CE2-CD2 4Å; Y214-H382 HydrophobicContact CG-CB 3.63Å; Y214-H382 AromaticContact CZ-CD2 3.37Å; Y214-H382 AromaticContact CZ-CG 3.44Å; Y214-H382 VanDerWaalsContact CZ-CG 3.44Å; Y214-H382 AromaticContact CZ-ND1 3.99Å; Y214-H382 AromaticContact CZ-NE2 3.88Å; Y214-H382 PolarHBondContact OH-CD2 3.2Å; Y214-H382 VanDerWaalsContact OH-CD2 3.25Å; Y214-H382 PolarHBondContact OH-NE2 3.19Å; Y377-H382 VanDerWaalsContact CA-O 3.3Å; Y377-H382 WeakPolarHBondContact CA-O 3.4Å; D378-H382 PolarHBondContact N-O 2.91Å; D378-H382 VanDerWaalsContact N-O 3.11Å; D378-H382 WeakPolarHBondContact OD1-CB 3.43Å; D378-H382 IonicContact OD1-CG 3.83Å; D378-H382 PolarHBondContact OD1-N 3.38Å; D378-H382 IonicContact OD1-ND1 2.71Å; D378-H382 PolarHBondContact OD1-ND1 3.26Å; D378-H382 IonicContact OD2-CE1 2.88Å; D378-H382 IonicContact OD2-CG 2.73Å; D378-H382 IonicContact OD2-ND1 3.39Å; D378-H382 PolarHBondContact OD2-ND1 3.5Å; N380-H382 PolarHBondContact O-N 2.68Å; N380-H382 VanDerWaalsContact O-N 3.09Å; H382-L384 PolarHBondContact O-N 3.13Å
383	R	83.4	Confident	81.9	Confident	146 Å²	146	44.9 Å²	44.9	55%	0.551	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	111.4	176.1	-171.3	-177.7	179.7	-148.7	4.1	110	D375 Y377 N381	D375-R383 IonicContact OD1-CZ 2.66Å; D375-R383 IonicContact OD1-NE 3.1Å; D375-R383 PolarHBondContact OD1-NE 3.44Å; D375-R383 IonicContact OD1-NH2 2.63Å; D375-R383 PolarHBondContact OD1-NH2 3.05Å; D375-R383 IonicContact OD2-NE 2.72Å; D375-R383 IonicContact OD2-NH2 3.35Å; Y377-R383 HydrophobicContact CD1-CB 4.09Å; Y377-R383 HydrophobicContact CE1-CB 3.64Å; Y377-R383 HydrophobicContact CE1-CG 3.98Å; N381-R383 PolarHBondContact O-N 3.4Å
384	L	86	Confident	81.7	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	140.3	173.4	-78.5	161	0	0	0	110.7	V216 V315 P317 I376 H382	V216-L384 HydrophobicContact CG1-CD1 3.88Å; V216-L384 HydrophobicContact CG1-CD2 3.82Å; V216-L384 HydrophobicContact CG1-CG 4.48Å; V315-L384 HydrophobicContact CG2-CD2 3.65Å; V315-L384 HydrophobicContact CG2-CG 4.44Å; P317-L384 HydrophobicContact CB-CD1 3.73Å; I376-L384 HydrophobicContact CB-CB 4.14Å; I376-L384 HydrophobicContact CB-CD1 4.27Å; I376-L384 HydrophobicContact CG2-CD1 3.72Å; I376-L384 WeakPolarHBondContact O-CB 3.23Å; I376-L384 PolarHBondContact O-N 2.69Å; H382-L384 PolarHBondContact O-N 3.13Å
385	Y	84.5	Confident	81.6	Confident	87 Å²	87	49.5 Å²	49.5	34%	0.341	22%	0.222	S	C	.	.			trans	-69.4	126.1	177.7	-171.9	-90.3	0	0	0	110.2	Y214 L215 L221 S387	Y214-Y385 WeakPolarHBondContact O-CB 3.25Å; Y214-Y385 PolarHBondContact O-N 3.08Å; L215-Y385 HydrophobicContact CD2-CD1 4.4Å; L215-Y385 HydrophobicContact CD2-CG 4.45Å; L221-Y385 HydrophobicContact CD1-CD1 3.81Å; L221-Y385 HydrophobicContact CD1-CD2 3.8Å; L221-Y385 HydrophobicContact CD1-CE1 3.58Å; L221-Y385 HydrophobicContact CD1-CE2 3.56Å; L221-Y385 HydrophobicContact CD1-CG 3.92Å; L221-Y385 VanDerWaalsContact CD1-CZ 3.46Å; Y385-S387 VanDerWaalsContact C-N 3.3Å; Y385-S387 PolarHBondContact O-N 2.92Å
386	P	75	Confident	81.5	Confident	48 Å²	48	50.4 Å²	50.4	31%	0.312	23%	0.225	S	C	.	.			trans	-82.6	68.8	-170.1	34.1	-37.1	0	0	0	112.1	N409 T411	P386-N409 PolarHBondContact O-ND2 2.91Å; P386-T411 HydrophobicContact CB-CG2 4.29Å
387	S	80.4	Confident	81.2	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.021	24%	0.238	C	C	.	.			trans	-56.4	147.8	178.4	73.9	0	0	0	0	113.2	S219 L220 Y385 N389 L390 N409	S219-S387 WeakPolarHBondContact CB-OG 3.48Å; L220-S387 WeakPolarHBondContact O-CB 3.29Å; Y385-S387 VanDerWaalsContact C-N 3.3Å; Y385-S387 PolarHBondContact O-N 2.92Å; S387-N389 WeakPolarHBondContact CB-OD1 3.32Å; S387-N389 PolarHBondContact O-N 3.24Å; S387-N389 PolarHBondContact OG-OD1 3.33Å; S387-L390 PolarHBondContact O-N 3.35Å; S387-N409 PolarHBondContact O-ND2 2.7Å; S387-N409 VanDerWaalsContact O-ND2 3.13Å
388	D	80.3	Confident	80.9	Confident	124 Å²	124	60 Å²	60	66%	0.663	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-21	-178	-75.3	-47.1	0	0	0	113.6
389	N	86.1	Confident	80.8	Confident	27 Å²	27	63 Å²	63	14%	0.144	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	2.8	177.8	73.8	-33.8	0	0	0	114.6	N218 S387 V432 V433	N218-N389 PolarHBondContact O-ND2 2.61Å; S387-N389 WeakPolarHBondContact CB-OD1 3.32Å; S387-N389 PolarHBondContact O-N 3.24Å; S387-N389 PolarHBondContact OG-OD1 3.33Å; N389-V432 WeakPolarHBondContact ND2-CG1 3.46Å; N389-V433 HydrophobicContact CB-CB 4.39Å; N389-V433 PolarHBondContact ND2-O 3.4Å; N389-V433 VanDerWaalsContact ND2-O 3.11Å; N389-V433 PolarHBondContact O-N 3.16Å
390	L	84.8	Confident	80.9	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	135.2	169.4	-78.7	155.9	0	0	0	111.5	V216 I376 S387 N409 L429 V432 F442	V216-L390 HydrophobicContact CG2-CD2 3.96Å; I376-L390 HydrophobicContact CD1-CD1 3.88Å; I376-L390 HydrophobicContact CD1-CD2 4.23Å; S387-L390 PolarHBondContact O-N 3.35Å; L390-N409 WeakPolarHBondContact O-CB 3.23Å; L390-L429 HydrophobicContact CD2-CD1 4.08Å; L390-V432 HydrophobicContact CD2-CG2 4.23Å; L390-F442 HydrophobicContact CD2-CZ 4.45Å
391	R	85.1	Confident	81.5	Confident	95 Å²	95	54.3 Å²	54.3	36%	0.358	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	90.7	178.4	-148.7	79.3	-158.6	120.4	1.4	111.6	L408 R430 G431 V433 V439	R391-L408 PolarHBondContact NH1-O 3.04Å; R391-R430 PolarHBondContact O-N 2.89Å; R391-G431 PolarHBondContact N-O 3.46Å; R391-V433 HydrophobicContact CB-CG2 4.39Å; R391-V439 HydrophobicContact CB-CG1 4.44Å; R391-V439 HydrophobicContact CG-CG2 4.42Å
392	L	84.6	Confident	82.2	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	145.9	174.6	-147.6	163.5	0	0	0	110	L320 L374 I376 N409 A427 V428 L429	L320-L392 HydrophobicContact CD1-CD1 4.43Å; L320-L392 HydrophobicContact CD1-CD2 4.32Å; L320-L392 HydrophobicContact CD2-CD1 3.97Å; L374-L392 HydrophobicContact CD1-CD1 3.96Å; L374-L392 HydrophobicContact CD1-CD2 3.5Å; L374-L392 VanDerWaalsContact CD1-CD2 3.5Å; L374-L392 HydrophobicContact CD1-CG 4.4Å; I376-L392 HydrophobicContact CD1-CD1 4.17Å; I376-L392 HydrophobicContact CG1-CD1 4.28Å; L392-N409 WeakPolarHBondContact CB-O 3.41Å; L392-A427 HydrophobicContact CD2-CB 4.12Å; L392-V428 CarbonylContact C-O 3.42Å; L392-L429 HydrophobicContact CB-CD1 4.37Å; L392-L429 HydrophobicContact CG-CB 4.32Å; L392-L429 HydrophobicContact CG-CD1 4.35Å
393	S	83.4	Confident	82.5	Confident	14 Å²	14	59.5 Å²	59.5	10%	0.098	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.8	177.8	31.9	0	0	0	0	111.5	V428 R430	S393-V428 PolarHBondContact N-O 3.17Å; S393-V428 PolarHBondContact O-N 3.14Å; S393-V428 PolarHBondContact OG-O 3.15Å; S393-V428 VanDerWaalsContact OG-O 3.04Å; S393-R430 PolarHBondContact OG-NE 3.29Å; S393-R430 VanDerWaalsContact OG-NE 3.16Å
394	L	81.5	Confident	82.5	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.099	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	147.2	174.8	-93.6	168.2	0	0	0	112.1	F322 L374 F396 Q410 V413 K426 A427	F322-L394 HydrophobicContact CE1-CD2 4.44Å; L374-L394 HydrophobicContact CD1-CD1 3.76Å; L374-L394 HydrophobicContact CD1-CD2 3.91Å; L374-L394 HydrophobicContact CD1-CG 3.69Å; L374-L394 HydrophobicContact CD2-CD2 4.42Å; L374-L394 HydrophobicContact CG-CD1 4.18Å; L394-F396 HydrophobicContact CB-CD2 4.44Å; L394-F396 HydrophobicContact CB-CE2 3.78Å; L394-F396 HydrophobicContact CB-CZ 4.44Å; L394-F396 HydrophobicContact CD1-CE2 4.08Å; L394-F396 HydrophobicContact CD1-CZ 4.01Å; L394-F396 HydrophobicContact CD2-CE2 4.44Å; L394-F396 HydrophobicContact CD2-CZ 4.34Å; L394-F396 HydrophobicContact CG-CE2 4.34Å; L394-Q410 WeakPolarHBondContact CD1-O 3.37Å; L394-V413 HydrophobicContact CD1-CG2 3.55Å; L394-K426 CarbonylContact C-O 2.72Å; L394-A427 HydrophobicContact CD2-CB 3.92Å
395	Y	83.7	Confident	82.3	Confident	116 Å²	116	62.6 Å²	62.6	46%	0.455	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.8	178.2	-62.9	-90.9	0	0	0	109.9	K426 V428	Y395-K426 HydrophobicContact CD2-CG 4.44Å; Y395-K426 PolarHBondContact N-O 3.09Å; Y395-K426 PolarHBondContact O-N 2.91Å; Y395-V428 HydrophobicContact CD2-CG2 4.49Å; Y395-V428 HydrophobicContact CE2-CG2 4.06Å
396	F	80.5	Confident	82.2	Confident	36 Å²	36	61.6 Å²	61.6	16%	0.158	31%	0.311	C	S	.	.			trans	-122.8	137	177.7	-60.9	-93.1	0	0	0	108.8	I372 L394 E398 F401 I403 V413 V415 L425	I372-F396 HydrophobicContact CD1-CE1 3.78Å; I372-F396 HydrophobicContact CD1-CZ 4.43Å; L394-F396 HydrophobicContact CB-CD2 4.44Å; L394-F396 HydrophobicContact CB-CE2 3.78Å; L394-F396 HydrophobicContact CB-CZ 4.44Å; L394-F396 HydrophobicContact CD1-CE2 4.08Å; L394-F396 HydrophobicContact CD1-CZ 4.01Å; L394-F396 HydrophobicContact CD2-CE2 4.44Å; L394-F396 HydrophobicContact CD2-CZ 4.34Å; L394-F396 HydrophobicContact CG-CE2 4.34Å; F396-E398 PolarHBondContact O-N 3.36Å; F396-F401 HydrophobicContact CB-CD2 4.36Å; F396-F401 HydrophobicContact CD1-CD2 4.11Å; F396-I403 HydrophobicContact CB-CD1 4.46Å; F396-I403 HydrophobicContact CD2-CD1 3.59Å; F396-I403 HydrophobicContact CD2-CG1 4.36Å; F396-I403 HydrophobicContact CE2-CD1 4.05Å; F396-I403 HydrophobicContact CG-CD1 4.17Å; F396-V413 HydrophobicContact CE2-CG1 4.14Å; F396-V413 HydrophobicContact CZ-CB 4.23Å; F396-V413 HydrophobicContact CZ-CG1 3.87Å; F396-V413 HydrophobicContact CZ-CG2 4.37Å; F396-V415 HydrophobicContact CE1-CG1 4.09Å; F396-V415 HydrophobicContact CZ-CG1 4.43Å; F396-L425 HydrophobicContact CD1-CD2 3.47Å; F396-L425 VanDerWaalsContact CD1-CD2 3.47Å; F396-L425 HydrophobicContact CE1-CD2 3.77Å; F396-L425 HydrophobicContact CG-CD2 4.46Å
397	P	79.5	Confident	82.5	Confident	45 Å²	45	60.9 Å²	60.9	29%	0.292	31%	0.307	S	S	.	.			trans	-76.9	117.5	170.5	28.5	-30.4	0	0	0	110.8	S399 H400 F401 V423	P397-S399 PolarHBondContact O-N 3.22Å; P397-H400 PolarHBondContact O-N 2.83Å; P397-H400 VanDerWaalsContact O-N 3.08Å; P397-F401 PolarHBondContact O-N 3.35Å; P397-V423 HydrophobicContact CG-CG1 3.23Å
398	E	78.6	Confident	82.4	Confident	177 Å²	177	67.3 Å²	67.3	83%	0.827	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.6	-177.7	-58	180	162.4	0	0	113.4	F396 H400	F396-E398 PolarHBondContact O-N 3.36Å; E398-H400 PolarHBondContact O-N 3.11Å
399	S	79.4	Confident	82.1	Confident	71 Å²	71	61.6 Å²	61.6	50%	0.497	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-4.4	175.2	55.3	0	0	0	0	114.9	P397 F418 S419	P397-S399 PolarHBondContact O-N 3.22Å; S399-F418 VanDerWaalsContact O-CE1 3.27Å; S399-F418 WeakPolarHBondContact O-CE1 3.38Å; S399-F418 WeakPolarHBondContact O-CZ 3.29Å; S399-S419 PolarHBondContact O-OG 3.01Å
400	H	80.4	Confident	81.8	Confident	40 Å²	40	63 Å²	63	19%	0.185	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.2	-29.6	-178.8	-64.9	79.3	0	0	0	115.1	P397 E398 F418 S419 V423 I454	P397-H400 PolarHBondContact O-N 2.83Å; P397-H400 VanDerWaalsContact O-N 3.08Å; E398-H400 PolarHBondContact O-N 3.11Å; H400-F418 PolarHBondContact O-N 2.98Å; H400-F418 VanDerWaalsContact O-N 3.07Å; H400-S419 VanDerWaalsContact CA-OG 3.31Å; H400-S419 WeakPolarHBondContact CA-OG 3.27Å; H400-S419 PolarHBondContact CD2-OG 3.32Å; H400-S419 VanDerWaalsContact CG-OG 3.3Å; H400-V423 HydrophobicContact CB-CG1 4.38Å; H400-V423 HydrophobicContact CB-CG2 4.05Å; H400-V423 WeakPolarHBondContact CD2-CG2 3.28Å; H400-I454 HydrophobicContact CB-CD1 3.94Å
401	F	85.2	Confident	81.6	Confident	11 Å²	11	63.7 Å²	63.7	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138	-172.9	-58.6	-65.1	0	0	0	114.1	M364 F396 P397 V415 R416 A417 V423 L425 I454	M364-F401 HydrophobicContact CE-CE1 3.78Å; M364-F401 HydrophobicContact CE-CZ 4.25Å; M364-F401 HydrophobicContact SD-CE1 3.73Å; F396-F401 HydrophobicContact CB-CD2 4.36Å; F396-F401 HydrophobicContact CD1-CD2 4.11Å; P397-F401 PolarHBondContact O-N 3.35Å; F401-V415 HydrophobicContact CD1-CG2 4.43Å; F401-R416 WeakPolarHBondContact CA-O 3.22Å; F401-A417 HydrophobicContact CD1-CB 4.34Å; F401-A417 HydrophobicContact CE1-CB 4.31Å; F401-V423 HydrophobicContact CD2-CG1 4.5Å; F401-V423 HydrophobicContact CE2-CB 4.21Å; F401-V423 HydrophobicContact CE2-CG1 3.66Å; F401-V423 HydrophobicContact CZ-CB 4.38Å; F401-V423 HydrophobicContact CZ-CG1 4.31Å; F401-L425 HydrophobicContact CD2-CD2 4.2Å; F401-L425 HydrophobicContact CE2-CD2 3.59Å; F401-L425 HydrophobicContact CZ-CD2 4.19Å; F401-I454 HydrophobicContact CD1-CD1 4.49Å; F401-I454 HydrophobicContact CE1-CD1 3.75Å; F401-I454 HydrophobicContact CE1-CG1 4.36Å; F401-I454 HydrophobicContact CZ-CD1 3.92Å
402	E	85.7	Confident	81.6	Confident	84 Å²	84	63.5 Å²	63.5	39%	0.393	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	120.8	167.7	176.6	-168.4	159.5	0	0	109	L404 V415 R416	E402-L404 HydrophobicContact CG-CD2 4.18Å; E402-V415 CarbonylContact O-C 3.6Å; E402-V415 VanDerWaalsContact O-CA 3.27Å; E402-V415 WeakPolarHBondContact O-CA 3.24Å; E402-R416 HydrophobicContact CB-CB 4.31Å; E402-R416 PolarHBondContact N-O 3.39Å; E402-R416 PolarHBondContact O-N 3.29Å; E402-R416 IonicContact OE1-CZ 3.74Å; E402-R416 IonicContact OE1-NH1 4Å; E402-R416 PolarHBondContact OE1-NH1 3.13Å; E402-R416 WeakPolarHBondContact OE2-CD 3.36Å; E402-R416 IonicContact OE2-CZ 2.77Å; E402-R416 IonicContact OE2-NE 3.53Å; E402-R416 IonicContact OE2-NH1 2.68Å; E402-R416 PolarHBondContact OE2-NH1 3.27Å
403	I	83.8	Confident	81.7	Confident	93 Å²	93	63.6 Å²	63.6	48%	0.477	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	125.9	-177.9	-56	173.3	0	0	0	110	F396 V413 V415	F396-I403 HydrophobicContact CB-CD1 4.46Å; F396-I403 HydrophobicContact CD2-CD1 3.59Å; F396-I403 HydrophobicContact CD2-CG1 4.36Å; F396-I403 HydrophobicContact CE2-CD1 4.05Å; F396-I403 HydrophobicContact CG-CD1 4.17Å; I403-V413 HydrophobicContact CG2-CG1 3.83Å; I403-V415 HydrophobicContact CG1-CG1 4.29Å
404	L	84.5	Confident	81.9	Confident	75 Å²	75	63.3 Å²	63.3	39%	0.393	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-28.5	-174.1	-58.4	178.7	0	0	0	114.1	V369 E402 V414 R416	V369-L404 HydrophobicContact CG1-CD1 3.89Å; V369-L404 HydrophobicContact CG2-CD1 4.21Å; E402-L404 HydrophobicContact CG-CD2 4.18Å; L404-V414 HydrophobicContact CB-CB 4.32Å; L404-V414 HydrophobicContact CB-CG1 4.2Å; L404-V414 HydrophobicContact CD1-CG1 4.35Å; L404-V414 PolarHBondContact N-O 3.44Å; L404-R416 HydrophobicContact CD1-CB 4.35Å
405	K	81.5	Confident	82.2	Confident	142 Å²	142	62.4 Å²	62.4	62%	0.617	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-164.9	150.9	176.4	-173.2	176.3	178.7	-174.1	0	110.6	V413 V414	K405-V413 CarbonylContact O-C 3.53Å; K405-V413 WeakPolarHBondContact O-CA 3.11Å; K405-V414 HydrophobicContact CB-CB 4.22Å; K405-V414 HydrophobicContact CB-CG2 4.07Å; K405-V414 PolarHBondContact N-O 2.89Å; K405-V414 PolarHBondContact O-N 3.47Å
406	S	82.3	Confident	82.5	Confident	66 Å²	66	61.2 Å²	61.2	46%	0.462	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	163.1	169.9	60.1	0	0	0	0	113	Y412	S406-Y412 CarbonylContact C-O 3.53Å; S406-Y412 WeakPolarHBondContact CA-O 3.35Å
407	S	81.7	Confident	82.7	Confident	33 Å²	33	59.5 Å²	59.5	23%	0.231	30%	0.301	C	S	.	.			trans	-85.3	166.2	167.9	65.1	0	0	0	0	112.6	N409 Q410 T411 Y412	S407-N409 WeakPolarHBondContact CB-OD1 3.2Å; S407-N409 PolarHBondContact OG-OD1 3.47Å; S407-Q410 PolarHBondContact O-N 3.31Å; S407-Q410 VanDerWaalsContact O-N 3.14Å; S407-Q410 WeakPolarHBondContact OG-CA 3.34Å; S407-Q410 PolarHBondContact OG-N 2.76Å; S407-T411 PolarHBondContact OG-N 3.06Å; S407-Y412 PolarHBondContact N-O 2.64Å; S407-Y412 PolarHBondContact OG-N 2.98Å; S407-Y412 VanDerWaalsContact OG-N 3.11Å
408	L	78.1	Confident	82.7	Confident	139 Å²	139	62.9 Å²	62.9	73%	0.728	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-42.5	-178.8	-71.7	172.9	0	0	0	112.8	R391 Q410	R391-L408 PolarHBondContact NH1-O 3.04Å; L408-Q410 VanDerWaalsContact C-N 3.29Å
409	N	74.8	Confident	82.4	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	4.2	174.2	56.9	2.9	0	0	0	113.4	P386 S387 L390 L392 S407 T411	P386-N409 PolarHBondContact O-ND2 2.91Å; S387-N409 PolarHBondContact O-ND2 2.7Å; S387-N409 VanDerWaalsContact O-ND2 3.13Å; L390-N409 WeakPolarHBondContact O-CB 3.23Å; L392-N409 WeakPolarHBondContact CB-O 3.41Å; S407-N409 WeakPolarHBondContact CB-OD1 3.2Å; S407-N409 PolarHBondContact OG-OD1 3.47Å; N409-T411 HydrophobicContact CB-CG2 4.41Å; N409-T411 PolarHBondContact O-N 3Å; N409-T411 VanDerWaalsContact O-N 3.1Å; N409-T411 PolarHBondContact OD1-OG1 3.34Å
410	Q	79.2	Confident	82.3	Confident	56 Å²	56	55.7 Å²	55.7	26%	0.262	28%	0.28	S	S	.	.	S	Bend	trans	57.4	14.5	-178.8	-55.2	-167.8	-4.3	0	0	116.2	L394 S407 L408 Y412	L394-Q410 WeakPolarHBondContact CD1-O 3.37Å; S407-Q410 PolarHBondContact O-N 3.31Å; S407-Q410 VanDerWaalsContact O-N 3.14Å; S407-Q410 WeakPolarHBondContact OG-CA 3.34Å; S407-Q410 PolarHBondContact OG-N 2.76Å; L408-Q410 VanDerWaalsContact C-N 3.29Å; Q410-Y412 PolarHBondContact O-N 3.26Å
411	T	80.8	Confident	81.9	Confident	19 Å²	19	55 Å²	55	12%	0.117	28%	0.284	C	S	.	.	S	Bend	trans	-72.5	-10.9	174.8	58.1	0	0	0	0	114.3	N373 L374 P386 S407 N409	N373-T411 CarbonylContact C-O 3.37Å; N373-T411 VanDerWaalsContact CA-O 3.23Å; N373-T411 WeakPolarHBondContact CA-O 3.39Å; L374-T411 PolarHBondContact N-O 3.21Å; P386-T411 HydrophobicContact CB-CG2 4.29Å; S407-T411 PolarHBondContact OG-N 3.06Å; N409-T411 HydrophobicContact CB-CG2 4.41Å; N409-T411 PolarHBondContact O-N 3Å; N409-T411 VanDerWaalsContact O-N 3.1Å; N409-T411 PolarHBondContact OD1-OG1 3.34Å
412	Y	85	Confident	81.5	Confident	92 Å²	92	57.7 Å²	57.7	36%	0.361	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	124.9	176.7	178.1	-83.6	0	0	0	109.8	V371 N373 S406 S407 Q410 V414	V371-Y412 HydrophobicContact CG1-CD2 4.04Å; V371-Y412 HydrophobicContact CG1-CE1 4.43Å; V371-Y412 HydrophobicContact CG1-CE2 3.39Å; N373-Y412 WeakPolarHBondContact OD1-CD2 3.2Å; S406-Y412 CarbonylContact C-O 3.53Å; S406-Y412 WeakPolarHBondContact CA-O 3.35Å; S407-Y412 PolarHBondContact N-O 2.64Å; S407-Y412 PolarHBondContact OG-N 2.98Å; S407-Y412 VanDerWaalsContact OG-N 3.11Å; Q410-Y412 PolarHBondContact O-N 3.26Å; Y412-V414 HydrophobicContact CD1-CG2 4.48Å; Y412-V414 HydrophobicContact CE1-CG2 3.59Å
413	V	86.3	Confident	80.9	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.024	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.3	179.5	-172.5	0	0	0	0	110.7	V371 I372 L394 F396 I403 K405 V415	V371-V413 CarbonylContact C-O 3.54Å; V371-V413 WeakPolarHBondContact CA-O 3.24Å; I372-V413 PolarHBondContact N-O 2.62Å; I372-V413 PolarHBondContact O-N 3.26Å; L394-V413 HydrophobicContact CD1-CG2 3.55Å; F396-V413 HydrophobicContact CE2-CG1 4.14Å; F396-V413 HydrophobicContact CZ-CB 4.23Å; F396-V413 HydrophobicContact CZ-CG1 3.87Å; F396-V413 HydrophobicContact CZ-CG2 4.37Å; I403-V413 HydrophobicContact CG2-CG1 3.83Å; K405-V413 CarbonylContact O-C 3.53Å; K405-V413 WeakPolarHBondContact O-CA 3.11Å; V413-V415 HydrophobicContact CG1-CG1 3.96Å
414	V	87.8	Confident	80.5	Confident	8 Å²	8	51.7 Å²	51.7	5%	0.048	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.2	175.2	-171.8	0	0	0	0	108.6	V369 Y370 V371 L404 K405 Y412	V369-V414 HydrophobicContact CG1-CG1 4Å; Y370-V414 CarbonylContact O-C 3.08Å; Y370-V414 WeakPolarHBondContact O-CA 3.12Å; Y370-V414 WeakPolarHBondContact O-CG1 3.07Å; V371-V414 HydrophobicContact CG2-CG1 4.48Å; V371-V414 HydrophobicContact CG2-CG2 4.31Å; L404-V414 HydrophobicContact CB-CB 4.32Å; L404-V414 HydrophobicContact CB-CG1 4.2Å; L404-V414 HydrophobicContact CD1-CG1 4.35Å; L404-V414 PolarHBondContact N-O 3.44Å; K405-V414 HydrophobicContact CB-CB 4.22Å; K405-V414 HydrophobicContact CB-CG2 4.07Å; K405-V414 PolarHBondContact N-O 2.89Å; K405-V414 PolarHBondContact O-N 3.47Å; Y412-V414 HydrophobicContact CD1-CG2 4.48Å; Y412-V414 HydrophobicContact CE1-CG2 3.59Å
415	V	88	Confident	80.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	158.3	-174.9	-58.7	0	0	0	0	112.7	M364 V369 Y370 I372 F396 F401 E402 I403 V413	M364-V415 HydrophobicContact CE-CG2 4.39Å; V369-V415 WeakPolarHBondContact CA-O 3.38Å; Y370-V415 PolarHBondContact N-O 3.28Å; Y370-V415 PolarHBondContact O-N 2.95Å; I372-V415 HydrophobicContact CD1-CG1 4.26Å; I372-V415 HydrophobicContact CD1-CG2 3.78Å; I372-V415 HydrophobicContact CG1-CG2 4.44Å; F396-V415 HydrophobicContact CE1-CG1 4.09Å; F396-V415 HydrophobicContact CZ-CG1 4.43Å; F401-V415 HydrophobicContact CD1-CG2 4.43Å; E402-V415 CarbonylContact O-C 3.6Å; E402-V415 VanDerWaalsContact O-CA 3.27Å; E402-V415 WeakPolarHBondContact O-CA 3.24Å; I403-V415 HydrophobicContact CG1-CG1 4.29Å; V413-V415 HydrophobicContact CG1-CG1 3.96Å
416	R	89.5	Confident	80.6	Confident	92 Å²	92	46.1 Å²	46.1	35%	0.347	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.7	164.3	-179.5	-168.9	-64.6	141	3.6	108.5	V369 F401 E402 L404	V369-R416 HydrophobicContact CG2-CB 4.37Å; V369-R416 HydrophobicContact CG2-CG 4.46Å; F401-R416 WeakPolarHBondContact CA-O 3.22Å; E402-R416 HydrophobicContact CB-CB 4.31Å; E402-R416 PolarHBondContact N-O 3.39Å; E402-R416 PolarHBondContact O-N 3.29Å; E402-R416 IonicContact OE1-CZ 3.74Å; E402-R416 IonicContact OE1-NH1 4Å; E402-R416 PolarHBondContact OE1-NH1 3.13Å; E402-R416 WeakPolarHBondContact OE2-CD 3.36Å; E402-R416 IonicContact OE2-CZ 2.77Å; E402-R416 IonicContact OE2-NE 3.53Å; E402-R416 IonicContact OE2-NH1 2.68Å; E402-R416 PolarHBondContact OE2-NH1 3.27Å; L404-R416 HydrophobicContact CD1-CB 4.35Å
417	A	83.8	Confident	80.7	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	138.5	173.7	0	0	0	0	0	110.2	M364 G367 K368 F401 I454	M364-A417 HydrophobicContact CB-CB 4.23Å; M364-A417 HydrophobicContact SD-CB 3.99Å; G367-A417 PolarHBondContact N-O 3.23Å; K368-A417 PolarHBondContact O-N 2.95Å; F401-A417 HydrophobicContact CD1-CB 4.34Å; F401-A417 HydrophobicContact CE1-CB 4.31Å; A417-I454 HydrophobicContact CB-CD1 4.13Å; A417-I454 HydrophobicContact CB-CG1 4.35Å; A417-I454 HydrophobicContact CB-CG2 3.9Å
418	F	79.4	Confident	80.8	Confident	116 Å²	116	42.4 Å²	42.4	51%	0.509	23%	0.225	S	C	.	.			trans	-122.5	-44.5	-179.6	89.1	-95.9	0	0	0	114.9	S366 S399 H400	S366-F418 PolarHBondContact OG-O 3.27Å; S399-F418 VanDerWaalsContact O-CE1 3.27Å; S399-F418 WeakPolarHBondContact O-CE1 3.38Å; S399-F418 WeakPolarHBondContact O-CZ 3.29Å; H400-F418 PolarHBondContact O-N 2.98Å; H400-F418 VanDerWaalsContact O-N 3.07Å
419	S	74.3	Confident	81.2	Confident	28 Å²	28	35.8 Å²	35.8	20%	0.196	19%	0.191	C	C	.	.	S	Bend	trans	-98.5	147.2	178.9	55.1	0	0	0	0	111.3	S399 H400 I454	S399-S419 PolarHBondContact O-OG 3.01Å; H400-S419 VanDerWaalsContact CA-OG 3.31Å; H400-S419 WeakPolarHBondContact CA-OG 3.27Å; H400-S419 PolarHBondContact CD2-OG 3.32Å; H400-S419 VanDerWaalsContact CG-OG 3.3Å; S419-I454 WeakPolarHBondContact O-CB 2.98Å; S419-I454 WeakPolarHBondContact O-CD1 3.39Å; S419-I454 VanDerWaalsContact O-CG2 3.25Å; S419-I454 WeakPolarHBondContact O-CG2 3.15Å
420	S	76.3	Confident	81.6	Confident	68 Å²	68	40.8 Å²	40.8	48%	0.476	21%	0.209	S	C	.	.			trans	-86.9	130.2	177.8	56	0	0	0	0	111.3	I454 S456	S420-I454 CarbonylContact C-O 2.98Å; S420-I454 WeakPolarHBondContact CA-O 3.2Å; S420-I454 WeakPolarHBondContact CB-O 2.99Å; S420-S456 WeakPolarHBondContact CB-OG 3.19Å; S420-S456 PolarHBondContact OG-OG 3.35Å
421	G	72.7	Confident	81.8	Confident	25 Å²	25	38.1 Å²	38.1	26%	0.258	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	169.3	172.6	-178.2	0	0	0	0	0	112.7	I454	G421-I454 PolarHBondContact N-O 2.95Å; G421-I454 PolarHBondContact O-N 2.86Å
422	S	76	Confident	82	Confident	68 Å²	68	37.3 Å²	37.3	48%	0.476	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130	171.2	-67.9	0	0	0	0	109.7	T453	S422-T453 PolarHBondContact OG-OG1 3.1Å
423	V	73.7	Confident	82	Confident	11 Å²	11	34.7 Å²	34.7	7%	0.067	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	130.9	-162.9	-167.8	0	0	0	0	111	P397 H400 F401 D451 V452 I454	P397-V423 HydrophobicContact CG-CG1 3.23Å; H400-V423 HydrophobicContact CB-CG1 4.38Å; H400-V423 HydrophobicContact CB-CG2 4.05Å; H400-V423 WeakPolarHBondContact CD2-CG2 3.28Å; F401-V423 HydrophobicContact CD2-CG1 4.5Å; F401-V423 HydrophobicContact CE2-CB 4.21Å; F401-V423 HydrophobicContact CE2-CG1 3.66Å; F401-V423 HydrophobicContact CZ-CB 4.38Å; F401-V423 HydrophobicContact CZ-CG1 4.31Å; V423-D451 CarbonylContact O-C 3.56Å; V423-D451 WeakPolarHBondContact O-CA 3.18Å; V423-V452 PolarHBondContact N-O 2.84Å; V423-V452 PolarHBondContact O-N 2.99Å; V423-I454 HydrophobicContact CG2-CD1 3.96Å
424	S	75.4	Confident	81.5	Confident	40 Å²	40	36.8 Å²	36.8	28%	0.28	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	129.9	176.9	-154.3	0	0	0	0	112.3	D451	S424-D451 WeakPolarHBondContact CA-OD1 3.43Å; S424-D451 WeakPolarHBondContact CB-OD1 3.46Å; S424-D451 PolarHBondContact OG-OD1 3.4Å
425	L	84.4	Confident	80.9	Confident	1 Å²	1	44 Å²	44	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.4	170.4	-58.6	-179.8	0	0	0	109.3	F322 I372 F396 F401 N449 Q450 V452	F322-L425 HydrophobicContact CE1-CB 4.27Å; I372-L425 HydrophobicContact CD1-CD1 3.93Å; F396-L425 HydrophobicContact CD1-CD2 3.47Å; F396-L425 VanDerWaalsContact CD1-CD2 3.47Å; F396-L425 HydrophobicContact CE1-CD2 3.77Å; F396-L425 HydrophobicContact CG-CD2 4.46Å; F401-L425 HydrophobicContact CD2-CD2 4.2Å; F401-L425 HydrophobicContact CE2-CD2 3.59Å; F401-L425 HydrophobicContact CZ-CD2 4.19Å; L425-N449 CarbonylContact O-C 3.57Å; L425-N449 VanDerWaalsContact O-CA 3.23Å; L425-N449 WeakPolarHBondContact O-CA 3.14Å; L425-Q450 WeakPolarHBondContact CB-O 3.28Å; L425-Q450 PolarHBondContact N-O 3.41Å; L425-Q450 PolarHBondContact O-N 3.04Å; L425-V452 HydrophobicContact CD1-CG2 3.69Å; L425-V452 HydrophobicContact CG-CG2 3.9Å
426	K	82.2	Confident	80.2	Confident	99 Å²	99	51 Å²	51	43%	0.43	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.1	-179.3	175.8	167.7	-176.7	172.6	0	112	L394 Y395 N449	L394-K426 CarbonylContact C-O 2.72Å; Y395-K426 HydrophobicContact CD2-CG 4.44Å; Y395-K426 PolarHBondContact N-O 3.09Å; Y395-K426 PolarHBondContact O-N 2.91Å; K426-N449 WeakPolarHBondContact CG-OD1 3.38Å
427	A	85.1	Confident	79.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140	-179.4	0	0	0	0	0	111	L320 F322 L374 L392 L394 T447 G448	L320-A427 HydrophobicContact CD1-CB 3.59Å; F322-A427 HydrophobicContact CE1-CB 3.84Å; F322-A427 HydrophobicContact CZ-CB 3.56Å; L374-A427 HydrophobicContact CD1-CB 3.9Å; L374-A427 HydrophobicContact CD2-CB 4.48Å; L392-A427 HydrophobicContact CD2-CB 4.12Å; L394-A427 HydrophobicContact CD2-CB 3.92Å; A427-T447 CarbonylContact O-C 3.49Å; A427-T447 VanDerWaalsContact O-CA 3.31Å; A427-T447 WeakPolarHBondContact O-CA 3.42Å; A427-G448 PolarHBondContact N-O 2.7Å; A427-G448 PolarHBondContact O-N 2.85Å
428	V	84.7	Confident	79.4	Confident	22 Å²	22	53.7 Å²	53.7	13%	0.133	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	117.5	-178	-178.3	0	0	0	0	110.1	L392 S393 Y395 T447	L392-V428 CarbonylContact C-O 3.42Å; S393-V428 PolarHBondContact N-O 3.17Å; S393-V428 PolarHBondContact O-N 3.14Å; S393-V428 PolarHBondContact OG-O 3.15Å; S393-V428 VanDerWaalsContact OG-O 3.04Å; Y395-V428 HydrophobicContact CD2-CG2 4.49Å; Y395-V428 HydrophobicContact CE2-CG2 4.06Å; V428-T447 HydrophobicContact CB-CG2 4.48Å; V428-T447 HydrophobicContact CG1-CG2 4.18Å; V428-T447 HydrophobicContact CG2-CG2 3.98Å
429	L	86.4	Confident	79.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.8	171	177.4	64.6	0	0	0	109.5	P317 L320 I376 L390 L392 F442 I446	P317-L429 HydrophobicContact CB-CD2 4.15Å; P317-L429 HydrophobicContact CG-CD2 4.4Å; L320-L429 HydrophobicContact CD2-CB 4.34Å; I376-L429 HydrophobicContact CD1-CD1 4.14Å; I376-L429 HydrophobicContact CD1-CD2 4.2Å; I376-L429 HydrophobicContact CG2-CD2 3.9Å; L390-L429 HydrophobicContact CD2-CD1 4.08Å; L392-L429 HydrophobicContact CB-CD1 4.37Å; L392-L429 HydrophobicContact CG-CB 4.32Å; L392-L429 HydrophobicContact CG-CD1 4.35Å; L429-F442 HydrophobicContact CD1-CE2 4.05Å; L429-F442 HydrophobicContact CD2-CD2 4.32Å; L429-F442 HydrophobicContact CD2-CE2 3.81Å; L429-F442 HydrophobicContact CG-CD2 4.13Å; L429-F442 HydrophobicContact CG-CE2 3.73Å; L429-I446 HydrophobicContact CB-CB 4.29Å; L429-I446 HydrophobicContact CD2-CD1 4.35Å; L429-I446 PolarHBondContact N-O 3.25Å
430	R	82.9	Confident	79.6	Confident	108 Å²	108	52.9 Å²	52.9	41%	0.408	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-45.4	-175.4	-58.6	-174.1	-177.9	-148.5	-1.7	113.6	R391 S393 E441 F442	R391-R430 PolarHBondContact O-N 2.89Å; S393-R430 PolarHBondContact OG-NE 3.29Å; S393-R430 VanDerWaalsContact OG-NE 3.16Å; R430-E441 WeakPolarHBondContact O-CA 3.31Å; R430-F442 PolarHBondContact O-N 2.88Å; R430-F442 VanDerWaalsContact O-N 3.07Å
431	G	83.7	Confident	79.5	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173	-170.3	-167.1	0	0	0	0	0	113.4	R391 V440 F442	R391-G431 PolarHBondContact N-O 3.46Å; G431-V440 CarbonylContact C-O 3.51Å; G431-V440 WeakPolarHBondContact CA-O 3.45Å; G431-F442 VanDerWaalsContact CA-CE2 3.45Å
432	V	84.7	Confident	79.7	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.5	176.3	-174.5	0	0	0	0	109.1	V216 N218 N389 L390 V440 F442	V216-V432 HydrophobicContact CG2-CG2 3.75Å; N218-V432 HydrophobicContact CB-CB 4.47Å; N218-V432 HydrophobicContact CB-CG1 3.98Å; N389-V432 WeakPolarHBondContact ND2-CG1 3.46Å; L390-V432 HydrophobicContact CD2-CG2 4.23Å; V432-V440 PolarHBondContact N-O 2.99Å; V432-V440 PolarHBondContact O-N 3.1Å; V432-F442 HydrophobicContact CG2-CE1 4.02Å; V432-F442 HydrophobicContact CG2-CE2 4.47Å; V432-F442 HydrophobicContact CG2-CZ 3.59Å
433	V	84.2	Confident	79.4	Confident	37 Å²	37	62 Å²	62	22%	0.224	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	128	173.9	-171.5	0	0	0	0	109.4	N389 R391 N438 V439	N389-V433 HydrophobicContact CB-CB 4.39Å; N389-V433 PolarHBondContact ND2-O 3.4Å; N389-V433 VanDerWaalsContact ND2-O 3.11Å; N389-V433 PolarHBondContact O-N 3.16Å; R391-V433 HydrophobicContact CB-CG2 4.39Å; V433-N438 WeakPolarHBondContact CA-O 3.48Å; V433-V439 HydrophobicContact CG2-CG2 4.48Å
434	D	77.1	Confident	78.8	Confident	47 Å²	47	64.4 Å²	64.4	25%	0.251	35%	0.348	S	S	.	.			trans	-79.6	-172.1	176.6	71.3	17.6	0	0	0	112.7	D436 G437 N438 V440	D434-D436 VanDerWaalsContact C-N 3.33Å; D434-D436 WeakPolarHBondContact OD1-CA 3.46Å; D434-D436 PolarHBondContact OD1-N 2.66Å; D434-G437 PolarHBondContact OD1-N 2.75Å; D434-N438 PolarHBondContact N-O 2.98Å; D434-N438 PolarHBondContact OD1-N 3.22Å; D434-N438 PolarHBondContact OD1-ND2 3.05Å; D434-N438 WeakPolarHBondContact OD2-CB 3.36Å; D434-N438 PolarHBondContact OD2-ND2 2.94Å; D434-V440 HydrophobicContact CB-CG2 4.19Å
435	Q	73.6	Confident	78.5	Confident	161 Å²	161	67.5 Å²	67.5	75%	0.752	37%	0.365	S	S	*	.	S	Bend	trans	-81.1	-12.6	-179.7	-69.7	174.1	-68.6	0	0	113.5
436	D	75	Confident	78.1	Confident	146 Å²	146	68 Å²	68	78%	0.781	37%	0.368	S	S	*	.	S	Bend	trans	-97.2	-8.5	177.5	-64.8	-53.9	0	0	0	112.1	D434	D434-D436 VanDerWaalsContact C-N 3.33Å; D434-D436 WeakPolarHBondContact OD1-CA 3.46Å; D434-D436 PolarHBondContact OD1-N 2.66Å
437	G	75.1	Confident	78	Confident	54 Å²	54	67.1 Å²	67.1	56%	0.557	37%	0.37	S	S	*	.	S	Bend	trans	96.3	5.5	178.4	0	0	0	0	0	114.9	D434	D434-G437 PolarHBondContact OD1-N 2.75Å
438	N	80.3	Confident	77.3	Confident	94 Å²	94	67.6 Å²	67.6	50%	0.503	38%	0.376	S	S	.	.			trans	-80.3	151.3	176.5	-42	-76.4	0	0	0	110.6	V433 D434	V433-N438 WeakPolarHBondContact CA-O 3.48Å; D434-N438 PolarHBondContact N-O 2.98Å; D434-N438 PolarHBondContact OD1-N 3.22Å; D434-N438 PolarHBondContact OD1-ND2 3.05Å; D434-N438 WeakPolarHBondContact OD2-CB 3.36Å; D434-N438 PolarHBondContact OD2-ND2 2.94Å
439	V	77.6	Confident	77.2	Confident	62 Å²	62	68.9 Å²	68.9	38%	0.376	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	111.9	170.2	-176.6	0	0	0	0	108.5	R391 V433 E441	R391-V439 HydrophobicContact CB-CG1 4.44Å; R391-V439 HydrophobicContact CG-CG2 4.42Å; V433-V439 HydrophobicContact CG2-CG2 4.48Å; V439-E441 HydrophobicContact CG1-CG 4.08Å; V439-E441 PolarHBondContact O-N 3.39Å
440	V	79.7	Confident	76.9	Confident	65 Å²	65	69.2 Å²	69.2	39%	0.394	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	97.8	165.2	-176.8	0	0	0	0	106.9	G431 V432 D434	G431-V440 CarbonylContact C-O 3.51Å; G431-V440 WeakPolarHBondContact CA-O 3.45Å; V432-V440 PolarHBondContact N-O 2.99Å; V432-V440 PolarHBondContact O-N 3.1Å; D434-V440 HydrophobicContact CB-CG2 4.19Å
441	E	75.5	Confident	76.7	Confident	135 Å²	135	65.1 Å²	65.1	63%	0.631	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	145.1	179.4	-61	-167	141.9	0	0	111.4	R430 V439	R430-E441 WeakPolarHBondContact O-CA 3.31Å; V439-E441 HydrophobicContact CG1-CG 4.08Å; V439-E441 PolarHBondContact O-N 3.39Å
442	F	77.6	Confident	76.4	Confident	36 Å²	36	65.1 Å²	65.1	16%	0.158	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	147.7	173	-62.2	-65.4	0	0	0	110.6	V216 P317 L390 L429 R430 G431 V432 S444	V216-F442 HydrophobicContact CB-CE1 4.38Å; V216-F442 HydrophobicContact CB-CZ 4.41Å; V216-F442 HydrophobicContact CG2-CZ 4.18Å; P317-F442 HydrophobicContact CG-CD1 4.36Å; P317-F442 HydrophobicContact CG-CE1 4.15Å; P317-F442 HydrophobicContact CG-CE2 4.39Å; P317-F442 HydrophobicContact CG-CZ 4.17Å; L390-F442 HydrophobicContact CD2-CZ 4.45Å; L429-F442 HydrophobicContact CD1-CE2 4.05Å; L429-F442 HydrophobicContact CD2-CD2 4.32Å; L429-F442 HydrophobicContact CD2-CE2 3.81Å; L429-F442 HydrophobicContact CG-CD2 4.13Å; L429-F442 HydrophobicContact CG-CE2 3.73Å; R430-F442 PolarHBondContact O-N 2.88Å; R430-F442 VanDerWaalsContact O-N 3.07Å; G431-F442 VanDerWaalsContact CA-CE2 3.45Å; V432-F442 HydrophobicContact CG2-CE1 4.02Å; V432-F442 HydrophobicContact CG2-CE2 4.47Å; V432-F442 HydrophobicContact CG2-CZ 3.59Å; F442-S444 WeakPolarHBondContact CB-O 3.45Å; F442-S444 PolarHBondContact O-N 3.46Å
443	N	68.3	Low	76.2	Confident	181 Å²	181	66.5 Å²	66.5	97%	0.968	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.9	-16.8	179.6	-71.6	-8.9	0	0	0	114.1
444	S	60.9	Low	76	Confident	63 Å²	63	64.9 Å²	64.9	44%	0.441	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	142.1	170	57.2	0	0	0	0	109.5	F442	F442-S444 WeakPolarHBondContact CB-O 3.45Å; F442-S444 PolarHBondContact O-N 3.46Å
445	T	69.7	Low	76.1	Confident	105 Å²	105	64.9 Å²	64.9	64%	0.644	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.5	175.9	48.1	0	0	0	0	110.2
446	I	76.8	Confident	76.4	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.056	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.2	-174.8	-66.8	162.1	0	0	0	108.8	P317 A318 L320 L429	P317-I446 VanDerWaalsContact C-CD1 3.45Å; P317-I446 HydrophobicContact CB-CD1 3.64Å; P317-I446 HydrophobicContact CG-CD1 3.62Å; P317-I446 WeakPolarHBondContact O-CD1 3.3Å; A318-I446 WeakPolarHBondContact O-CG2 3.3Å; L320-I446 HydrophobicContact CG-CG2 4.26Å; L429-I446 HydrophobicContact CB-CB 4.29Å; L429-I446 HydrophobicContact CD2-CD1 4.35Å; L429-I446 PolarHBondContact N-O 3.25Å
447	T	79.9	Confident	76.5	Confident	80 Å²	80	54.8 Å²	54.8	49%	0.491	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.1	-174.5	66.5	0	0	0	0	111.4	A427 V428	A427-T447 CarbonylContact O-C 3.49Å; A427-T447 VanDerWaalsContact O-CA 3.31Å; A427-T447 WeakPolarHBondContact O-CA 3.42Å; V428-T447 HydrophobicContact CB-CG2 4.48Å; V428-T447 HydrophobicContact CG1-CG2 4.18Å; V428-T447 HydrophobicContact CG2-CG2 3.98Å
448	G	70.7	Confident	76.8	Confident	11 Å²	11	52.7 Å²	52.7	11%	0.113	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	150.8	169.1	0	0	0	0	0	111	A427	A427-G448 PolarHBondContact N-O 2.7Å; A427-G448 PolarHBondContact O-N 2.85Å
449	N	80.7	Confident	76.7	Confident	48 Å²	48	54 Å²	54	26%	0.257	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	158.5	168.1	-65.5	-19	0	0	0	109.4	F322 L425 K426 W1861	F322-N449 WeakPolarHBondContact CE2-O 3.34Å; L425-N449 CarbonylContact O-C 3.57Å; L425-N449 VanDerWaalsContact O-CA 3.23Å; L425-N449 WeakPolarHBondContact O-CA 3.14Å; K426-N449 WeakPolarHBondContact CG-OD1 3.38Å; N449-W1861 VanDerWaalsContact O-CZ2 3.29Å; N449-W1861 WeakPolarHBondContact O-CZ2 3.41Å; N449-W1861 PolarHBondContact O-NE1 3.06Å
450	Q	80.6	Confident	76.8	Confident	8 Å²	8	51.2 Å²	51.2	4%	0.037	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	118	172	178.1	58.9	74.9	0	0	110.7	F322 W362 L425	F322-Q450 HydrophobicContact CB-CB 4.06Å; F322-Q450 HydrophobicContact CB-CG 3.98Å; F322-Q450 HydrophobicContact CD1-CB 3.7Å; F322-Q450 HydrophobicContact CD1-CG 4.4Å; F322-Q450 HydrophobicContact CD2-CB 3.72Å; F322-Q450 HydrophobicContact CD2-CG 4.48Å; F322-Q450 HydrophobicContact CE1-CB 3.97Å; F322-Q450 HydrophobicContact CE2-CB 3.99Å; F322-Q450 HydrophobicContact CG-CB 3.59Å; F322-Q450 HydrophobicContact CG-CG 4.09Å; F322-Q450 HydrophobicContact CZ-CB 4.11Å; W362-Q450 HydrophobicContact CD2-CG 3.79Å; W362-Q450 HydrophobicContact CE3-CG 3.88Å; W362-Q450 HydrophobicContact CH2-CG 3.71Å; W362-Q450 HydrophobicContact CZ2-CG 3.53Å; W362-Q450 HydrophobicContact CZ3-CG 3.83Å; W362-Q450 VanDerWaalsContact NE1-CD 3.27Å; L425-Q450 WeakPolarHBondContact CB-O 3.28Å; L425-Q450 PolarHBondContact N-O 3.41Å; L425-Q450 PolarHBondContact O-N 3.04Å
451	D	79.1	Confident	76.4	Confident	21 Å²	21	52.3 Å²	52.3	11%	0.112	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	143.5	177.7	-64.1	-13.4	0	0	0	111.3	V423 S424 P1864 L1865	V423-D451 CarbonylContact O-C 3.56Å; V423-D451 WeakPolarHBondContact O-CA 3.18Å; S424-D451 WeakPolarHBondContact CA-OD1 3.43Å; S424-D451 WeakPolarHBondContact CB-OD1 3.46Å; S424-D451 PolarHBondContact OG-OD1 3.4Å; D451-P1864 HydrophobicContact CB-CG 3.59Å; D451-P1864 WeakPolarHBondContact OD2-CD 3.42Å; D451-P1864 VanDerWaalsContact OD2-CG 3.24Å; D451-P1864 WeakPolarHBondContact OD2-CG 3.49Å; D451-L1865 WeakPolarHBondContact OD2-CG 3.26Å; D451-L1865 PolarHBondContact OD2-N 2.94Å; D451-L1865 VanDerWaalsContact OD2-N 3.14Å
452	V	78.1	Confident	76.1	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	134.3	-174.4	-172.3	0	0	0	0	109.3	W362 M364 V423 L425	W362-V452 HydrophobicContact CE3-CG2 3.7Å; W362-V452 HydrophobicContact CZ3-CG2 4.15Å; M364-V452 HydrophobicContact CE-CG1 3.79Å; M364-V452 HydrophobicContact CG-CG1 4.03Å; V423-V452 PolarHBondContact N-O 2.84Å; V423-V452 PolarHBondContact O-N 2.99Å; L425-V452 HydrophobicContact CD1-CG2 3.69Å; L425-V452 HydrophobicContact CG-CG2 3.9Å
453	T	79.7	Confident	75.7	Confident	30 Å²	30	49.8 Å²	49.8	18%	0.184	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.8	176.5	-54.6	0	0	0	0	111	W362 I363 M364 S422 Y455	W362-T453 PolarHBondContact O-N 2.88Å; I363-T453 WeakPolarHBondContact CA-O 3.2Å; M364-T453 PolarHBondContact N-O 3.34Å; S422-T453 PolarHBondContact OG-OG1 3.1Å; T453-Y455 HydrophobicContact CG2-CD1 4.43Å; T453-Y455 HydrophobicContact CG2-CD2 4.28Å; T453-Y455 HydrophobicContact CG2-CE1 3.98Å; T453-Y455 HydrophobicContact CG2-CE2 3.82Å
454	I	80.9	Confident	76.1	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	112.3	176.5	-48.6	165.7	0	0	0	108.4	M364 H400 F401 A417 S419 S420 G421 V423	M364-I454 HydrophobicContact CB-CG1 4.21Å; M364-I454 HydrophobicContact CB-CG2 4.31Å; M364-I454 CarbonylContact O-C 3.48Å; M364-I454 WeakPolarHBondContact O-CA 3.25Å; H400-I454 HydrophobicContact CB-CD1 3.94Å; F401-I454 HydrophobicContact CD1-CD1 4.49Å; F401-I454 HydrophobicContact CE1-CD1 3.75Å; F401-I454 HydrophobicContact CE1-CG1 4.36Å; F401-I454 HydrophobicContact CZ-CD1 3.92Å; A417-I454 HydrophobicContact CB-CD1 4.13Å; A417-I454 HydrophobicContact CB-CG1 4.35Å; A417-I454 HydrophobicContact CB-CG2 3.9Å; S419-I454 WeakPolarHBondContact O-CB 2.98Å; S419-I454 WeakPolarHBondContact O-CD1 3.39Å; S419-I454 VanDerWaalsContact O-CG2 3.25Å; S419-I454 WeakPolarHBondContact O-CG2 3.15Å; S420-I454 CarbonylContact C-O 2.98Å; S420-I454 WeakPolarHBondContact CA-O 3.2Å; S420-I454 WeakPolarHBondContact CB-O 2.99Å; G421-I454 PolarHBondContact N-O 2.95Å; G421-I454 PolarHBondContact O-N 2.86Å; V423-I454 HydrophobicContact CG2-CD1 3.96Å
455	Y	79.2	Confident	76.9	Confident	47 Å²	47	41.4 Å²	41.4	18%	0.184	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	151.1	176.3	-67	-75.9	0	0	0	112.5	I363 M364 S366 T453 G492 C493 I554	I363-Y455 HydrophobicContact CD1-CE2 4.41Å; I363-Y455 HydrophobicContact CG1-CE2 4.4Å; I363-Y455 HydrophobicContact CG2-CD2 3.64Å; I363-Y455 HydrophobicContact CG2-CE2 3.83Å; M364-Y455 PolarHBondContact O-N 2.93Å; S366-Y455 PolarHBondContact N-O 3.49Å; T453-Y455 HydrophobicContact CG2-CD1 4.43Å; T453-Y455 HydrophobicContact CG2-CD2 4.28Å; T453-Y455 HydrophobicContact CG2-CE1 3.98Å; T453-Y455 HydrophobicContact CG2-CE2 3.82Å; Y455-G492 VanDerWaalsContact CD1-O 3.32Å; Y455-G492 WeakPolarHBondContact CD1-O 3.44Å; Y455-C493 HydrophobicContact CE1-CB 4.35Å; Y455-I554 HydrophobicContact CD2-CD1 3.68Å; Y455-I554 HydrophobicContact CE2-CD1 4.47Å; Y455-I554 HydrophobicContact CG-CD1 4.16Å
456	S	79	Confident	77.6	Confident	49 Å²	49	36.9 Å²	36.9	34%	0.343	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-72.8	142.4	165	-60.7	0	0	0	0	110.8	S420 G492	S420-S456 WeakPolarHBondContact CB-OG 3.19Å; S420-S456 PolarHBondContact OG-OG 3.35Å; S456-G492 PolarHBondContact O-N 3.07Å
457	P	78.2	Confident	77.7	Confident	46 Å²	46	37 Å²	37	30%	0.299	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-62.7	146.1	176.1	26	-34.9	0	0	0	112	E365	E365-P457 HydrophobicContact CG-CB 4.3Å
458	I	80.4	Confident	77.5	Confident	11 Å²	11	34.2 Å²	34.2	6%	0.056	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-75	130.7	-178.5	-67.3	173.1	0	0	0	110.7	A489 N490 Y496 A546 I554	I458-A489 HydrophobicContact CG2-CB 4.46Å; I458-N490 WeakPolarHBondContact CA-O 3.02Å; I458-Y496 HydrophobicContact CD1-CD1 4.06Å; I458-Y496 HydrophobicContact CD1-CE1 4Å; I458-Y496 HydrophobicContact CG1-CE1 4.13Å; I458-Y496 HydrophobicContact CG2-CD1 4.34Å; I458-Y496 HydrophobicContact CG2-CE1 4.14Å; I458-A546 HydrophobicContact CG2-CB 4.22Å; I458-I554 HydrophobicContact CD1-CG2 3.96Å; I458-I554 WeakPolarHBondContact CD1-O 2.93Å; I458-I554 HydrophobicContact CG1-CG2 4.02Å
459	K	78.2	Confident	77.6	Confident	120 Å²	120	38 Å²	38	52%	0.522	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132	173.6	-62.2	178.4	-175.2	177.1	0	109.3	Y461 A489 N490	K459-Y461 HydrophobicContact CB-CD2 4.45Å; K459-Y461 HydrophobicContact CB-CE2 3.62Å; K459-A489 CarbonylContact O-C 3.53Å; K459-A489 WeakPolarHBondContact O-CA 3.35Å; K459-N490 PolarHBondContact N-O 3.27Å; K459-N490 PolarHBondContact O-N 3.03Å
460	I	79.6	Confident	76.6	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	148.9	176.7	-58.3	178.4	0	0	0	108.8	T463 L487 R488 A489 W498 A546 T558	I460-T463 HydrophobicContact CB-CG2 4.41Å; I460-T463 WeakPolarHBondContact O-CG2 3.36Å; I460-L487 HydrophobicContact CG2-CB 4.38Å; I460-L487 HydrophobicContact CG2-CD1 3.88Å; I460-L487 HydrophobicContact CG2-CD2 4.02Å; I460-L487 HydrophobicContact CG2-CG 4.35Å; I460-R488 CarbonylContact C-O 2.83Å; I460-R488 WeakPolarHBondContact CA-O 3.44Å; I460-A489 HydrophobicContact CG1-CB 4.38Å; I460-W498 HydrophobicContact CD1-CZ3 4.09Å; I460-W498 HydrophobicContact CG1-CZ3 4.47Å; I460-W498 HydrophobicContact CG2-CZ3 4.4Å; I460-A546 HydrophobicContact CD1-CB 3.63Å; I460-A546 HydrophobicContact CG1-CB 3.91Å; I460-T558 HydrophobicContact CB-CG2 4.3Å; I460-T558 HydrophobicContact CD1-CG2 4.02Å; I460-T558 HydrophobicContact CG2-CG2 3.68Å
461	Y	72.3	Confident	75.2	Confident	88 Å²	88	41.9 Å²	41.9	35%	0.345	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	137.7	-179.8	-66.9	-84.1	0	0	0	111.6	K459 R488 N490	K459-Y461 HydrophobicContact CB-CD2 4.45Å; K459-Y461 HydrophobicContact CB-CE2 3.62Å; Y461-R488 PolarHBondContact N-O 3.1Å; Y461-R488 PolarHBondContact O-N 2.94Å; Y461-N490 HydrophobicContact CD2-CB 4.44Å; Y461-N490 HydrophobicContact CE2-CB 4.14Å
462	P	69.2	Low	73.8	Confident	38 Å²	38	42.9 Å²	42.9	25%	0.247	24%	0.242	C	C	.	.	S	Bend	cis	-71.2	167.4	-11.7	27.1	-28.4	0	0	0	113.1	V465 Y485 T635	P462-V465 HydrophobicContact CG-CG2 4.21Å; P462-Y485 HydrophobicContact CG-CE1 4.03Å; P462-Y485 VanDerWaalsContact CG-OH 3.31Å; P462-Y485 WeakPolarHBondContact CG-OH 3.44Å; P462-T635 HydrophobicContact CG-CG2 4.01Å
463	T	69.3	Low	72.1	Confident	80 Å²	80	49.9 Å²	49.9	49%	0.491	28%	0.279	S	S	.	.	S	Bend	trans	-141.3	117.6	178.9	46.2	0	0	0	0	108.3	I460 T558	I460-T463 HydrophobicContact CB-CG2 4.41Å; I460-T463 WeakPolarHBondContact O-CG2 3.36Å; T463-T558 WeakPolarHBondContact CG2-OG1 3.44Å
464	P	75.7	Confident	70.1	Confident	68 Å²	68	56.6 Å²	56.6	44%	0.442	31%	0.312	S	S	.	.	S	Bend	cis	-74	-174.4	-7	35	-37.6	0	0	0	112.8	Y561	P464-Y561 HydrophobicContact CB-CD2 4.14Å; P464-Y561 HydrophobicContact CB-CE2 3.8Å; P464-Y561 HydrophobicContact CG-CE2 4.45Å
465	V	78.1	Confident	67.9	Low	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.6	170	-177.8	0	0	0	0	110.2	P462 L467 Y485 L487 V559 V560 Y561 T635	P462-V465 HydrophobicContact CG-CG2 4.21Å; V465-L467 HydrophobicContact CG1-CD2 4.06Å; V465-L467 HydrophobicContact CG1-CG 4.14Å; V465-Y485 HydrophobicContact CG1-CD1 3.73Å; V465-Y485 HydrophobicContact CG1-CE1 3.83Å; V465-Y485 HydrophobicContact CG2-CE1 4.25Å; V465-L487 HydrophobicContact CG2-CD2 3.69Å; V465-V559 PolarHBondContact N-O 3.28Å; V465-V560 HydrophobicContact CB-CG2 4.41Å; V465-Y561 PolarHBondContact O-N 3.1Å; V465-T635 WeakPolarHBondContact CG1-OG1 3.47Å
466	I	83.5	Confident	65.7	Low	10 Å²	10	63.5 Å²	63.5	5%	0.051	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	118.9	179.7	-55.7	175.2	0	0	0	109.1	Y561 R563 Q632 T635	I466-Y561 HydrophobicContact CG1-CD2 4.5Å; I466-R563 HydrophobicContact CG2-CB 4.41Å; I466-Q632 HydrophobicContact CD1-CB 3.98Å; I466-T635 PolarHBondContact N-OG1 2.93Å; I466-T635 PolarHBondContact O-N 3.38Å; I466-T635 PolarHBondContact O-OG1 3.3Å
467	L	80.4	Confident	63.4	Low	12 Å²	12	68 Å²	68	6%	0.063	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.3	-178.3	-63	-177.6	0	0	0	112.8	V465 Y485 I534 V560 Y561 R563 D636	V465-L467 HydrophobicContact CG1-CD2 4.06Å; V465-L467 HydrophobicContact CG1-CG 4.14Å; L467-Y485 HydrophobicContact CD2-CG 4.21Å; L467-I534 HydrophobicContact CD1-CB 4.39Å; L467-I534 HydrophobicContact CD1-CG2 3.4Å; L467-I534 VanDerWaalsContact CD1-CG2 3.4Å; L467-V560 HydrophobicContact CD1-CG1 4.41Å; L467-Y561 PolarHBondContact N-O 3.47Å; L467-R563 PolarHBondContact O-N 3.06Å; L467-D636 HydrophobicContact CD2-CB 4.49Å
468	P	75.7	Confident	61.3	Low	23 Å²	23	71.9 Å²	71.9	15%	0.149	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	138.6	175.6	25.8	-32.6	0	0	0	112.8	R563 M634 D636 L640	P468-R563 CarbonylContact C-O 3.52Å; P468-R563 VanDerWaalsContact CA-O 3.27Å; P468-R563 WeakPolarHBondContact CA-O 3.44Å; P468-M634 HydrophobicContact CB-CE 4.08Å; P468-M634 HydrophobicContact CB-SD 3.86Å; P468-M634 HydrophobicContact CG-SD 4.43Å; P468-D636 WeakPolarHBondContact CD-O 3.43Å; P468-L640 HydrophobicContact CB-CD1 4.35Å; P468-L640 HydrophobicContact CB-CD2 3.76Å; P468-L640 HydrophobicContact CB-CG 4.14Å; P468-L640 HydrophobicContact CG-CD2 4.33Å; P468-L640 HydrophobicContact CG-CG 4.25Å
469	W	72.4	Confident	59	Low	89 Å²	89	78.5 Å²	78.5	34%	0.337	44%	0.444	S	S	.	.			trans	-82	127.4	166.8	-179.2	-112.7	0	0	0	111.4	V562 R563	W469-V562 HydrophobicContact CB-CG1 4.26Å; W469-V562 HydrophobicContact CE3-CG1 3.77Å; W469-R563 PolarHBondContact N-O 3.48Å
470	S	59.9	Low	57.3	Low	55 Å²	55	80.7 Å²	80.7	39%	0.385	46%	0.456	S	S	.	.			trans	-105.8	132.1	-179.3	-180	0	0	0	0	112.4	G472	S470-G472 PolarHBondContact OG-N 3.16Å
471	T	51.1	Low	55.4	Low	84 Å²	84	84 Å²	84	52%	0.515	48%	0.48	S	S	.	.	S	Bend	trans	-91.7	4.1	176.9	50.8	0	0	0	0	113.6
472	G	48.6	Very low	54.2	Low	41 Å²	41	84.1 Å²	84.1	42%	0.423	49%	0.486	S	S	.	.			trans	-84.2	-11	-170	0	0	0	0	0	117.3	S470 L474	S470-G472 PolarHBondContact OG-N 3.16Å; G472-L474 PolarHBondContact O-N 3.38Å
473	L	42.7	Very low	53.4	Low	148 Å²	148	87.8 Å²	87.8	78%	0.775	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	15.8	-168.7	-78.3	163.4	0	0	0	116
474	L	38.2	Very low	52.9	Low	171 Å²	171	84.7 Å²	84.7	90%	0.895	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	13.3	-179.4	-72.6	170.1	0	0	0	114.1	G472	G472-L474 PolarHBondContact O-N 3.38Å
475	S	35.2	Very low	52.6	Low	72 Å²	72	83.3 Å²	83.3	50%	0.503	47%	0.47	S	S	.	.			trans	-117	123.1	174.4	70.1	0	0	0	0	111.6	N477	S475-N477 VanDerWaalsContact C-N 3.28Å; S475-N477 PolarHBondContact O-N 3.07Å
476	P	32.6	Very low	52.4	Low	124 Å²	124	87 Å²	87	81%	0.805	49%	0.487	S	S	*	.	S	Bend	trans	-82.3	6.5	-169.7	32.4	-37	0	0	0	115.2
477	N	31.4	Very low	52.1	Low	144 Å²	144	86.6 Å²	86.6	77%	0.77	49%	0.485	S	S	*	.			trans	-126	27.4	-159.5	-79.2	1.3	0	0	0	115.4	S475	S475-N477 VanDerWaalsContact C-N 3.28Å; S475-N477 PolarHBondContact O-N 3.07Å
478	L	33.7	Very low	51.9	Low	126 Å²	126	92.1 Å²	92.1	66%	0.66	51%	0.505	S	S	*	.			trans	-127.9	115.6	171.2	-81.6	93.6	0	0	0	112.9	H480	L478-H480 VanDerWaalsContact C-N 3.27Å; L478-H480 PolarHBondContact O-N 2.73Å; L478-H480 VanDerWaalsContact O-N 3.12Å
479	T	31.4	Very low	51.9	Low	150 Å²	150	91.5 Å²	91.5	92%	0.92	50%	0.502	S	S	*	.			trans	-86	56.2	177.2	55.1	0	0	0	0	112.1
480	H	42	Very low	52	Low	167 Å²	167	91.7 Å²	91.7	77%	0.773	51%	0.509	S	S	*	.			trans	-92.6	124.5	166.9	-87.8	-91.9	0	0	0	109.8	L478 D482	L478-H480 VanDerWaalsContact C-N 3.27Å; L478-H480 PolarHBondContact O-N 2.73Å; L478-H480 VanDerWaalsContact O-N 3.12Å; H480-D482 PolarHBondContact O-N 2.98Å
481	S	41	Very low	52.5	Low	75 Å²	75	90.2 Å²	90.2	52%	0.524	50%	0.502	S	S	.	.			trans	-68.2	123.8	173.4	41.7	0	0	0	0	110.3	H483	S481-H483 PolarHBondContact O-CD2 3.27Å; S481-H483 PolarHBondContact O-N 3.41Å; S481-H483 PolarHBondContact OG-NE2 3.33Å; S481-H483 VanDerWaalsContact OG-NE2 3.08Å
482	D	47.1	Very low	53.4	Low	89 Å²	89	86.8 Å²	86.8	48%	0.476	48%	0.484	S	S	.	.			trans	-70.5	98.2	179.4	-172.6	39.6	0	0	0	110.7	H480 G484 S535 N639	H480-D482 PolarHBondContact O-N 2.98Å; D482-G484 PolarHBondContact O-N 3.26Å; D482-S535 WeakPolarHBondContact OD2-CB 3.43Å; D482-S535 PolarHBondContact OD2-OG 3.28Å; D482-N639 PolarHBondContact OD1-ND2 3.43Å
483	H	52.6	Low	54.2	Low	115 Å²	115	86.1 Å²	86.1	53%	0.532	47%	0.473	S	S	.	.			trans	-80.8	64	-176.4	-71.5	-89.9	0	0	0	111.6	S481 R638	S481-H483 PolarHBondContact O-CD2 3.27Å; S481-H483 PolarHBondContact O-N 3.41Å; S481-H483 PolarHBondContact OG-NE2 3.33Å; S481-H483 VanDerWaalsContact OG-NE2 3.08Å; H483-R638 PolarHBondContact O-NH2 2.69Å
484	G	57.3	Low	55.4	Low	15 Å²	15	81.5 Å²	81.5	16%	0.155	46%	0.46	C	S	.	.			trans	-53.4	170.9	-176.8	0	0	0	0	0	116.1	D482 V533 I534	D482-G484 PolarHBondContact O-N 3.26Å; G484-V533 VanDerWaalsContact C-CG1 3.48Å; G484-V533 WeakPolarHBondContact O-CG1 3.39Å; G484-I534 CarbonylContact C-O 3.56Å; G484-I534 VanDerWaalsContact CA-O 3.24Å; G484-I534 WeakPolarHBondContact CA-O 3.46Å
485	Y	70.1	Confident	56.7	Low	39 Å²	39	74.1 Å²	74.1	15%	0.153	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	124.6	-170.2	-169.4	-112.9	0	0	0	112.9	P462 V465 L467 L487 V533 I534 T635 D636	P462-Y485 HydrophobicContact CG-CE1 4.03Å; P462-Y485 VanDerWaalsContact CG-OH 3.31Å; P462-Y485 WeakPolarHBondContact CG-OH 3.44Å; V465-Y485 HydrophobicContact CG1-CD1 3.73Å; V465-Y485 HydrophobicContact CG1-CE1 3.83Å; V465-Y485 HydrophobicContact CG2-CE1 4.25Å; L467-Y485 HydrophobicContact CD2-CG 4.21Å; Y485-L487 PolarHBondContact O-N 3.37Å; Y485-V533 CarbonylContact O-C 3.52Å; Y485-V533 WeakPolarHBondContact O-CA 3.49Å; Y485-I534 PolarHBondContact N-O 2.68Å; Y485-I534 PolarHBondContact O-N 3.45Å; Y485-T635 WeakPolarHBondContact CE2-O 3.2Å; Y485-D636 HydrophobicContact CD2-CB 3.62Å; Y485-D636 WeakPolarHBondContact CD2-OD2 3.46Å; Y485-D636 HydrophobicContact CE2-CB 4.04Å; Y485-D636 HydrophobicContact CG-CB 4.46Å
486	H	73.5	Confident	58.6	Low	79 Å²	79	72.5 Å²	72.5	37%	0.366	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	105.7	-176.2	-172.4	-17.8	0	0	0	111.6	T531 V533 K1905	H486-T531 PolarHBondContact CE1-O 3.23Å; H486-T531 VanDerWaalsContact CE1-O 3.29Å; H486-V533 HydrophobicContact CB-CG2 4.31Å; H486-K1905 PolarHBondContact NE2-NZ 3.47Å
487	L	77.4	Confident	60.6	Low	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.389	C	S	.	.			trans	-63	144.7	169.1	-73.2	-177.1	0	0	0	111.6	I460 V465 Y485 W498 I528 G532 I534 I544 T558	I460-L487 HydrophobicContact CG2-CB 4.38Å; I460-L487 HydrophobicContact CG2-CD1 3.88Å; I460-L487 HydrophobicContact CG2-CD2 4.02Å; I460-L487 HydrophobicContact CG2-CG 4.35Å; V465-L487 HydrophobicContact CG2-CD2 3.69Å; Y485-L487 PolarHBondContact O-N 3.37Å; L487-W498 HydrophobicContact CB-CH2 3.61Å; L487-W498 HydrophobicContact CB-CZ2 4.42Å; L487-W498 HydrophobicContact CB-CZ3 3.87Å; L487-W498 HydrophobicContact CD1-CE3 4.14Å; L487-W498 HydrophobicContact CD1-CH2 4.09Å; L487-W498 HydrophobicContact CD1-CZ3 3.45Å; L487-W498 VanDerWaalsContact CD1-CZ3 3.45Å; L487-W498 HydrophobicContact CG-CZ3 4.34Å; L487-I528 HydrophobicContact CD1-CD1 4.35Å; L487-G532 PolarHBondContact N-O 2.99Å; L487-I534 HydrophobicContact CD1-CD1 3.62Å; L487-I534 HydrophobicContact CD1-CG1 4.37Å; L487-I534 HydrophobicContact CD2-CD1 4.04Å; L487-I534 HydrophobicContact CG-CD1 3.58Å; L487-I534 HydrophobicContact CG-CG1 4.28Å; L487-I544 HydrophobicContact CD1-CB 4.41Å; L487-I544 HydrophobicContact CD1-CG2 3.74Å; L487-T558 HydrophobicContact CD1-CG2 4.01Å
488	R	76.3	Confident	62.9	Low	129 Å²	129	67 Å²	67	49%	0.487	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	148.5	165.4	-58.8	-177.9	-177.3	-159.6	-2.5	108.8	I460 Y461	I460-R488 CarbonylContact C-O 2.83Å; I460-R488 WeakPolarHBondContact CA-O 3.44Å; Y461-R488 PolarHBondContact N-O 3.1Å; Y461-R488 PolarHBondContact O-N 2.94Å
489	A	74.6	Confident	64.9	Low	10 Å²	10	62 Å²	62	8%	0.083	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.7	169.7	0	0	0	0	0	109.4	I458 K459 I460 Y496 W498 A546	I458-A489 HydrophobicContact CG2-CB 4.46Å; K459-A489 CarbonylContact O-C 3.53Å; K459-A489 WeakPolarHBondContact O-CA 3.35Å; I460-A489 HydrophobicContact CG1-CB 4.38Å; A489-Y496 VanDerWaalsContact C-OH 3.24Å; A489-Y496 HydrophobicContact CB-CD1 3.89Å; A489-Y496 HydrophobicContact CB-CD2 3.75Å; A489-Y496 HydrophobicContact CB-CE1 3.83Å; A489-Y496 HydrophobicContact CB-CE2 3.67Å; A489-Y496 HydrophobicContact CB-CG 3.85Å; A489-Y496 WeakPolarHBondContact O-CE2 3.25Å; A489-Y496 PolarHBondContact O-OH 3.22Å; A489-W498 HydrophobicContact CB-CH2 3.83Å; A489-W498 HydrophobicContact CB-CZ2 4.18Å; A489-A546 HydrophobicContact CB-CB 4.38Å
490	N	75.2	Confident	67	Low	93 Å²	93	56.6 Å²	56.6	50%	0.497	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.7	-176.1	-59.5	-8.7	0	0	0	108.9	I458 K459 Y461 Y496	I458-N490 WeakPolarHBondContact CA-O 3.02Å; K459-N490 PolarHBondContact N-O 3.27Å; K459-N490 PolarHBondContact O-N 3.03Å; Y461-N490 HydrophobicContact CD2-CB 4.44Å; Y461-N490 HydrophobicContact CE2-CB 4.14Å; N490-Y496 WeakPolarHBondContact CA-OH 3.46Å; N490-Y496 PolarHBondContact N-OH 3.35Å
491	G	71.3	Confident	68.5	Low	23 Å²	23	49.1 Å²	49.1	24%	0.237	27%	0.268	C	S	.	.	S	Bend	trans	105.1	-178.3	-174.9	0	0	0	0	0	112.6	Y496	G491-Y496 PolarHBondContact N-OH 3.2Å; G491-Y496 WeakPolarHBondContact O-CE1 3.39Å; G491-Y496 PolarHBondContact O-OH 2.82Å
492	G	70.1	Confident	69.7	Low	13 Å²	13	46.2 Å²	46.2	13%	0.134	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	-144.2	-171.3	0	0	0	0	0	112.3	Y455 S456	Y455-G492 VanDerWaalsContact CD1-O 3.32Å; Y455-G492 WeakPolarHBondContact CD1-O 3.44Å; S456-G492 PolarHBondContact O-N 3.07Å
493	C	65.7	Low	70.4	Confident	27 Å²	27	43.9 Å²	43.9	18%	0.182	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	7	-178.1	68.7	0	0	0	0	115	Y455 Q495 S548	Y455-C493 HydrophobicContact CE1-CB 4.35Å; C493-Q495 PolarHBondContact O-N 3.36Å; C493-S548 PolarHBondContact SG-OG 3.05Å
494	G	66	Low	70.8	Confident	50 Å²	50	47 Å²	47	52%	0.515	24%	0.243	S	C	.	.	S	Bend	trans	80.1	-13.2	-176.3	0	0	0	0	0	115.7	Y496	G494-Y496 VanDerWaalsContact O-CE2 3.26Å; G494-Y496 WeakPolarHBondContact O-CE2 3.47Å
495	Q	66.8	Low	70.5	Confident	16 Å²	16	46.9 Å²	46.9	8%	0.075	24%	0.242	C	C	.	.			trans	-100.5	143.5	165.6	-71.7	176.5	-70.3	0	0	111.5	C493 S549 E1907 P1908	C493-Q495 PolarHBondContact O-N 3.36Å; Q495-S549 WeakPolarHBondContact CB-OG 3.46Å; Q495-S549 PolarHBondContact O-N 3.41Å; Q495-S549 PolarHBondContact OE1-OG 2.91Å; Q495-E1907 HydrophobicContact CG-CB 4.33Å; Q495-E1907 HydrophobicContact CG-CG 4.23Å; Q495-E1907 PolarHBondContact NE2-OE2 3.03Å; Q495-P1908 HydrophobicContact CG-CB 4.27Å; Q495-P1908 VanDerWaalsContact CG-CD 3.43Å; Q495-P1908 HydrophobicContact CG-CG 3.82Å; Q495-P1908 PolarHBondContact NE2-O 2.91Å; Q495-P1908 PolarHBondContact OE1-O 3.13Å
496	Y	74	Confident	69.6	Low	39 Å²	39	47.6 Å²	47.6	15%	0.153	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	120.3	-176.9	-48.9	-70.7	0	0	0	110.9	I458 A489 N490 G491 G494 W498 A546 S547	I458-Y496 HydrophobicContact CD1-CD1 4.06Å; I458-Y496 HydrophobicContact CD1-CE1 4Å; I458-Y496 HydrophobicContact CG1-CE1 4.13Å; I458-Y496 HydrophobicContact CG2-CD1 4.34Å; I458-Y496 HydrophobicContact CG2-CE1 4.14Å; A489-Y496 VanDerWaalsContact C-OH 3.24Å; A489-Y496 HydrophobicContact CB-CD1 3.89Å; A489-Y496 HydrophobicContact CB-CD2 3.75Å; A489-Y496 HydrophobicContact CB-CE1 3.83Å; A489-Y496 HydrophobicContact CB-CE2 3.67Å; A489-Y496 HydrophobicContact CB-CG 3.85Å; A489-Y496 WeakPolarHBondContact O-CE2 3.25Å; A489-Y496 PolarHBondContact O-OH 3.22Å; N490-Y496 WeakPolarHBondContact CA-OH 3.46Å; N490-Y496 PolarHBondContact N-OH 3.35Å; G491-Y496 PolarHBondContact N-OH 3.2Å; G491-Y496 WeakPolarHBondContact O-CE1 3.39Å; G491-Y496 PolarHBondContact O-OH 2.82Å; G494-Y496 VanDerWaalsContact O-CE2 3.26Å; G494-Y496 WeakPolarHBondContact O-CE2 3.47Å; Y496-W498 HydrophobicContact CD2-CZ2 4.41Å; Y496-W498 HydrophobicContact CG-CZ2 4.42Å; Y496-W498 PolarHBondContact O-NE1 2.99Å; Y496-A546 HydrophobicContact CD1-CB 4.38Å; Y496-S547 CarbonylContact C-O 3.46Å; Y496-S547 WeakPolarHBondContact CA-O 3.15Å
497	R	75.5	Confident	68.6	Low	125 Å²	125	50.4 Å²	50.4	47%	0.472	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	111.8	166	-178.2	166.6	179.8	170.1	-8	108.1	N343 S547	N343-R497 PolarHBondContact O-NH2 2.63Å; N343-R497 PolarHBondContact OD1-NE 3.36Å; N343-R497 PolarHBondContact OD1-NH2 2.93Å; R497-S547 PolarHBondContact N-O 3.31Å; R497-S547 PolarHBondContact O-N 2.62Å; R497-S547 PolarHBondContact O-OG 3.13Å
498	W	79	Confident	67.2	Low	28 Å²	28	57.3 Å²	57.3	11%	0.106	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	139.9	-173.4	-58.4	89.1	0	0	0	112.1	I460 L487 A489 Y496 I528 K530 G532 I544 V545 A546	I460-W498 HydrophobicContact CD1-CZ3 4.09Å; I460-W498 HydrophobicContact CG1-CZ3 4.47Å; I460-W498 HydrophobicContact CG2-CZ3 4.4Å; L487-W498 HydrophobicContact CB-CH2 3.61Å; L487-W498 HydrophobicContact CB-CZ2 4.42Å; L487-W498 HydrophobicContact CB-CZ3 3.87Å; L487-W498 HydrophobicContact CD1-CE3 4.14Å; L487-W498 HydrophobicContact CD1-CH2 4.09Å; L487-W498 HydrophobicContact CD1-CZ3 3.45Å; L487-W498 VanDerWaalsContact CD1-CZ3 3.45Å; L487-W498 HydrophobicContact CG-CZ3 4.34Å; A489-W498 HydrophobicContact CB-CH2 3.83Å; A489-W498 HydrophobicContact CB-CZ2 4.18Å; Y496-W498 HydrophobicContact CD2-CZ2 4.41Å; Y496-W498 HydrophobicContact CG-CZ2 4.42Å; Y496-W498 PolarHBondContact O-NE1 2.99Å; W498-I528 HydrophobicContact CB-CD1 3.89Å; W498-I528 HydrophobicContact CB-CG1 4.07Å; W498-I528 HydrophobicContact CB-CG2 4.36Å; W498-I528 HydrophobicContact CD2-CD1 4.04Å; W498-I528 HydrophobicContact CE3-CD1 3.7Å; W498-I528 HydrophobicContact CG-CD1 4.15Å; W498-I528 HydrophobicContact CG-CG1 4.49Å; W498-K530 VanDerWaalsContact CD1-O 3.28Å; W498-G532 VanDerWaalsContact CE2-CA 3.43Å; W498-I544 HydrophobicContact CE3-CG2 3.81Å; W498-I544 HydrophobicContact CZ3-CG2 4.16Å; W498-V545 WeakPolarHBondContact CA-O 3.47Å; W498-A546 HydrophobicContact CD2-CB 4.4Å; W498-A546 HydrophobicContact CE3-CB 3.86Å; W498-A546 HydrophobicContact CH2-CB 4.13Å; W498-A546 HydrophobicContact CZ3-CB 3.71Å
499	T	76.1	Confident	65.6	Low	19 Å²	19	54.5 Å²	54.5	12%	0.117	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	136.6	172.5	38.3	0	0	0	0	110.9	N343 V545	N343-T499 WeakPolarHBondContact ND2-CG2 3.4Å; T499-V545 PolarHBondContact N-O 3.44Å; T499-V545 PolarHBondContact O-N 3.11Å
500	A	75.8	Confident	64	Low	37 Å²	37	59.2 Å²	59.2	31%	0.306	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	136.6	170.7	0	0	0	0	0	110.5	I528 I544	A500-I528 HydrophobicContact CB-CG2 4.05Å; A500-I544 HydrophobicContact CB-CD1 3.54Å
501	L	72.2	Confident	62.8	Low	10 Å²	10	59.6 Å²	59.6	5%	0.052	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.1	176.6	-59	176.3	0	0	0	109.7	I335 L342 S542 I543 V545	I335-L501 HydrophobicContact CG2-CD1 4.16Å; L342-L501 HydrophobicContact CD1-CD2 3.5Å; L501-S542 PolarHBondContact O-OG 3.29Å; L501-I543 HydrophobicContact CB-CB 4.33Å; L501-I543 PolarHBondContact N-O 2.88Å; L501-I543 PolarHBondContact O-N 3.47Å; L501-V545 HydrophobicContact CD1-CG2 3.75Å; L501-V545 HydrophobicContact CG-CG2 4.35Å
502	S	66.3	Low	61.2	Low	14 Å²	14	65.1 Å²	65.1	10%	0.098	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.6	171.5	-163.3	0	0	0	0	109.8	R504 A505 N523	S502-R504 PolarHBondContact O-N 3.23Å; S502-A505 WeakPolarHBondContact O-CB 3.46Å; S502-A505 PolarHBondContact O-N 2.78Å; S502-N523 PolarHBondContact OG-O 3.12Å
503	V	61.8	Low	59.6	Low	41 Å²	41	68.1 Å²	68.1	25%	0.248	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-56.8	-37.5	-178.3	-179.9	0	0	0	0	111.5	A505 L506 E541 I543	V503-A505 PolarHBondContact O-N 3.22Å; V503-A505 VanDerWaalsContact O-N 3.09Å; V503-L506 PolarHBondContact O-N 2.86Å; V503-L506 VanDerWaalsContact O-N 3.08Å; V503-E541 HydrophobicContact CG2-CB 3.96Å; V503-I543 HydrophobicContact CG2-CD1 4.33Å; V503-I543 HydrophobicContact CG2-CG1 4.3Å
504	R	61.3	Low	58.3	Low	179 Å²	179	74.1 Å²	74.1	68%	0.675	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-58.8	-21.2	177.6	-65.2	-178.4	-178.1	165.6	2.7	114.4	S502 L506	S502-R504 PolarHBondContact O-N 3.23Å; R504-L506 VanDerWaalsContact C-N 3.33Å
505	A	51.1	Low	57.3	Low	14 Å²	14	78.9 Å²	78.9	12%	0.116	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-74	-23.2	178.3	0	0	0	0	0	113	S502 V503 L521	S502-A505 WeakPolarHBondContact O-CB 3.46Å; S502-A505 PolarHBondContact O-N 2.78Å; V503-A505 PolarHBondContact O-N 3.22Å; V503-A505 VanDerWaalsContact O-N 3.09Å; A505-L521 HydrophobicContact CB-CD2 4.04Å
506	L	51.6	Low	56.3	Low	53 Å²	53	80.1 Å²	80.1	28%	0.277	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-27.4	178.2	-68.6	168	0	0	0	112.3	L338 V503 R504 H508 H509 I543	L338-L506 HydrophobicContact CD2-CD2 4.16Å; V503-L506 PolarHBondContact O-N 2.86Å; V503-L506 VanDerWaalsContact O-N 3.08Å; R504-L506 VanDerWaalsContact C-N 3.33Å; L506-H508 PolarHBondContact O-N 3.01Å; L506-H508 VanDerWaalsContact O-N 3.16Å; L506-H509 PolarHBondContact O-N 3.04Å; L506-I543 HydrophobicContact CD1-CD1 3.46Å; L506-I543 VanDerWaalsContact CD1-CD1 3.46Å
507	E	53.3	Low	55	Low	138 Å²	138	83.9 Å²	83.9	65%	0.645	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-3.1	-178.6	-60.2	-176.6	125.7	0	0	114.3
508	H	48.2	Very low	53.3	Low	146 Å²	146	82.5 Å²	82.5	68%	0.676	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.4	4.8	177	-81.3	19.4	0	0	0	113.8	L506 S510	L506-H508 PolarHBondContact O-N 3.01Å; L506-H508 VanDerWaalsContact O-N 3.16Å; H508-S510 VanDerWaalsContact C-N 3.28Å; H508-S510 PolarHBondContact O-N 2.8Å
509	H	41.5	Very low	51.6	Low	70 Å²	70	89.1 Å²	89.1	32%	0.324	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	35.7	-175.1	-129.4	26.7	0	0	0	113.9	L338 L506	L338-H509 WeakPolarHBondContact CD1-NE2 3.24Å; L506-H509 PolarHBondContact O-N 3.04Å
510	S	42.4	Very low	50.2	Low	108 Å²	108	92.9 Å²	92.9	76%	0.755	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-10.5	178.2	43.8	0	0	0	0	114.4	H508	H508-S510 VanDerWaalsContact C-N 3.28Å; H508-S510 PolarHBondContact O-N 2.8Å
511	D	48.1	Very low	48.8	Very low	101 Å²	101	93.6 Å²	93.6	54%	0.54	51%	0.509	S	S	.	.	S	Bend	trans	-110.5	104.8	-175.7	-129.7	2.7	0	0	0	110.5	G513	D511-G513 PolarHBondContact O-N 3.01Å
512	P	38.1	Very low	47.5	Very low	140 Å²	140	97.4 Å²	97.4	91%	0.909	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	69.9	-176.5	32.7	-36	0	0	0	111.5
513	G	36	Very low	46.5	Very low	76 Å²	76	101.2 Å²	101.2	78%	0.784	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	176	-4.8	-179.1	0	0	0	0	0	116.5	D511	D511-G513 PolarHBondContact O-N 3.01Å
514	K	38.3	Very low	46.2	Very low	152 Å²	152	102.8 Å²	102.8	66%	0.661	56%	0.562	S	S	*	*			trans	-122.2	129.4	175.1	-77.4	178.2	175.5	171.7	0	111.6
515	L	45.9	Very low	46.6	Very low	150 Å²	150	95.1 Å²	95.1	79%	0.785	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-73.7	138.7	162.4	-108.8	68.6	0	0	0	109.3
516	P	45.1	Very low	47.6	Very low	42 Å²	42	94.6 Å²	94.6	27%	0.273	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-73.5	150.4	169.2	30.9	-33.6	0	0	0	111.3	L521	P516-L521 HydrophobicContact CG-CD1 4.38Å
517	D	47	Very low	48.7	Very low	119 Å²	119	94.4 Å²	94.4	64%	0.636	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-63.4	144.1	-175.9	-63.5	-63.3	0	0	0	113.3	E519 L520	D517-E519 PolarHBondContact O-N 2.93Å; D517-L520 HydrophobicContact CB-CD1 4.45Å; D517-L520 PolarHBondContact O-N 3.16Å
518	S	40.6	Very low	49.8	Very low	96 Å²	96	89.6 Å²	89.6	67%	0.671	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.2	-173	-167.9	0	0	0	0	114.6	T522	S518-T522 PolarHBondContact O-OG1 2.81Å
519	E	42.4	Very low	51.1	Low	166 Å²	166	85.6 Å²	85.6	78%	0.776	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-23.7	179	-60	-173.6	156.4	0	0	113.1	D517 T522	D517-E519 PolarHBondContact O-N 2.93Å; E519-T522 WeakPolarHBondContact CA-OG1 3.36Å; E519-T522 PolarHBondContact O-OG1 3.13Å
520	L	46.6	Very low	52.2	Low	98 Å²	98	91.1 Å²	91.1	51%	0.513	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-29.5	176.1	-83.2	157.1	0	0	0	111.9	D517 T522	D517-L520 HydrophobicContact CB-CD1 4.45Å; D517-L520 PolarHBondContact O-N 3.16Å; L520-T522 VanDerWaalsContact C-N 3.29Å; L520-T522 PolarHBondContact O-N 3.04Å
521	L	46.7	Very low	53.5	Low	52 Å²	52	90 Å²	90	27%	0.272	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-20	175.2	-74.1	158.4	0	0	0	113.4	L342 A505 P516	L342-L521 HydrophobicContact CD1-CD2 4.44Å; L342-L521 HydrophobicContact CD2-CD1 4.26Å; L342-L521 HydrophobicContact CD2-CD2 4.46Å; A505-L521 HydrophobicContact CB-CD2 4.04Å; P516-L521 HydrophobicContact CG-CD1 4.38Å
522	T	44.5	Very low	54.6	Low	91 Å²	91	85.2 Å²	85.2	56%	0.558	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	2.2	-171.7	41.9	0	0	0	0	116.2	S518 E519 L520 T524	S518-T522 PolarHBondContact O-OG1 2.81Å; E519-T522 WeakPolarHBondContact CA-OG1 3.36Å; E519-T522 PolarHBondContact O-OG1 3.13Å; L520-T522 VanDerWaalsContact C-N 3.29Å; L520-T522 PolarHBondContact O-N 3.04Å; T522-T524 PolarHBondContact O-N 2.78Å
523	N	46.1	Very low	56.4	Low	94 Å²	94	80 Å²	80	50%	0.503	45%	0.45	S	S	.	.			trans	-72.7	87.5	177.1	-97.4	-63.4	0	0	0	111.9	S502 V525	S502-N523 PolarHBondContact OG-O 3.12Å; N523-V525 PolarHBondContact O-N 3.08Å
524	T	56.5	Low	58.5	Low	73 Å²	73	76.5 Å²	76.5	45%	0.448	41%	0.413	S	S	.	.			trans	-87.9	106.1	-174	42.9	0	0	0	0	112.6	T522 V526 N538	T522-T524 PolarHBondContact O-N 2.78Å; T524-V526 VanDerWaalsContact C-N 3.32Å; T524-N538 PolarHBondContact O-ND2 3.22Å
525	V	68.9	Low	60.3	Low	19 Å²	19	70.3 Å²	70.3	12%	0.115	39%	0.389	C	S	.	.	S	Bend	trans	-71.9	-32.3	167	179.7	0	0	0	0	110.8	N523 L537 N538 G540 E541 V562	N523-V525 PolarHBondContact O-N 3.08Å; V525-L537 PolarHBondContact O-N 2.88Å; V525-N538 VanDerWaalsContact CG1-O 3.23Å; V525-N538 WeakPolarHBondContact CG1-O 3.48Å; V525-N538 PolarHBondContact O-N 3.09Å; V525-G540 VanDerWaalsContact CG1-C 3.49Å; V525-E541 WeakPolarHBondContact CG2-O 3.36Å; V525-V562 HydrophobicContact CG1-CG2 4.23Å
526	V	71.8	Confident	61.6	Low	2 Å²	2	64.6 Å²	64.6	1%	0.012	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	141.2	-171.2	162.4	0	0	0	0	109.2	T524 I534 I544 V560 V562	T524-V526 VanDerWaalsContact C-N 3.32Å; V526-I534 HydrophobicContact CG1-CG2 3.71Å; V526-I544 HydrophobicContact CG1-CD1 4.03Å; V526-V560 HydrophobicContact CG2-CB 4.4Å; V526-V560 HydrophobicContact CG2-CG1 3.94Å; V526-V562 HydrophobicContact CG2-CG2 4.26Å
527	S	75.2	Confident	62.9	Low	49 Å²	49	66.2 Å²	66.2	34%	0.343	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	143.7	161.3	56	0	0	0	0	110.7	I534 S535	S527-I534 WeakPolarHBondContact O-CA 3.39Å; S527-S535 PolarHBondContact N-O 3.32Å; S527-S535 PolarHBondContact O-N 3.26Å; S527-S535 PolarHBondContact OG-O 3.25Å
528	I	76.1	Confident	64	Low	38 Å²	38	64.6 Å²	64.6	20%	0.195	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	135.2	174.8	-168.6	160.4	0	0	0	111.9	L487 W498 A500 V533 I534 I544	L487-I528 HydrophobicContact CD1-CD1 4.35Å; W498-I528 HydrophobicContact CB-CD1 3.89Å; W498-I528 HydrophobicContact CB-CG1 4.07Å; W498-I528 HydrophobicContact CB-CG2 4.36Å; W498-I528 HydrophobicContact CD2-CD1 4.04Å; W498-I528 HydrophobicContact CE3-CD1 3.7Å; W498-I528 HydrophobicContact CG-CD1 4.15Å; W498-I528 HydrophobicContact CG-CG1 4.49Å; A500-I528 HydrophobicContact CB-CG2 4.05Å; I528-V533 CarbonylContact C-O 3.48Å; I528-V533 WeakPolarHBondContact CA-O 3.44Å; I528-I534 HydrophobicContact CD1-CG1 4.07Å; I528-I534 HydrophobicContact CG1-CG1 4.33Å; I528-I544 HydrophobicContact CB-CD1 4.44Å; I528-I544 HydrophobicContact CD1-CD1 4.15Å; I528-I544 HydrophobicContact CD1-CG1 4.4Å; I528-I544 HydrophobicContact CD1-CG2 3.41Å; I528-I544 VanDerWaalsContact CD1-CG2 3.41Å; I528-I544 HydrophobicContact CG2-CD1 4.45Å
529	T	75.2	Confident	65.6	Low	62 Å²	62	64 Å²	64	38%	0.38	35%	0.354	S	S	.	.			trans	-83	166.6	177.5	72.8	0	0	0	0	112.1	T531 G532 V533	T529-T531 PolarHBondContact O-N 2.85Å; T529-T531 VanDerWaalsContact O-N 3.11Å; T529-T531 PolarHBondContact OG1-N 3.04Å; T529-T531 PolarHBondContact OG1-OG1 2.78Å; T529-G532 PolarHBondContact O-N 3.23Å; T529-G532 PolarHBondContact OG1-N 3.2Å; T529-V533 HydrophobicContact CG2-CB 3.9Å; T529-V533 PolarHBondContact N-O 2.71Å; T529-V533 WeakPolarHBondContact OG1-CB 3.31Å; T529-V533 PolarHBondContact OG1-N 3.21Å
530	K	65.5	Low	67.2	Low	185 Å²	185	57.5 Å²	57.5	80%	0.804	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.5	170.5	-63.7	-176.7	-179.3	179.8	0	113.8	W498	W498-K530 VanDerWaalsContact CD1-O 3.28Å
531	T	69.6	Low	68.8	Low	85 Å²	85	57.5 Å²	57.5	52%	0.521	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	1.6	-179.9	51.6	0	0	0	0	113.9	H486 T529	H486-T531 PolarHBondContact CE1-O 3.23Å; H486-T531 VanDerWaalsContact CE1-O 3.29Å; T529-T531 PolarHBondContact O-N 2.85Å; T529-T531 VanDerWaalsContact O-N 3.11Å; T529-T531 PolarHBondContact OG1-N 3.04Å; T529-T531 PolarHBondContact OG1-OG1 2.78Å
532	G	71	Confident	70.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	32%	0.318	C	S	.	.			trans	82.1	22.8	-178.2	0	0	0	0	0	114.2	L487 W498 T529	L487-G532 PolarHBondContact N-O 2.99Å; W498-G532 VanDerWaalsContact CE2-CA 3.43Å; T529-G532 PolarHBondContact O-N 3.23Å; T529-G532 PolarHBondContact OG1-N 3.2Å
533	V	76.4	Confident	72.1	Confident	32 Å²	32	51.8 Å²	51.8	19%	0.194	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	128.3	173.6	179.6	0	0	0	0	109.6	G484 Y485 H486 I528 T529	G484-V533 VanDerWaalsContact C-CG1 3.48Å; G484-V533 WeakPolarHBondContact O-CG1 3.39Å; Y485-V533 CarbonylContact O-C 3.52Å; Y485-V533 WeakPolarHBondContact O-CA 3.49Å; H486-V533 HydrophobicContact CB-CG2 4.31Å; I528-V533 CarbonylContact C-O 3.48Å; I528-V533 WeakPolarHBondContact CA-O 3.44Å; T529-V533 HydrophobicContact CG2-CB 3.9Å; T529-V533 PolarHBondContact N-O 2.71Å; T529-V533 WeakPolarHBondContact OG1-CB 3.31Å; T529-V533 PolarHBondContact OG1-N 3.21Å
534	I	79.1	Confident	74	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.6	-178.4	-67.8	177.9	0	0	0	110.3	L467 G484 Y485 L487 V526 S527 I528 I544 V560	L467-I534 HydrophobicContact CD1-CB 4.39Å; L467-I534 HydrophobicContact CD1-CG2 3.4Å; L467-I534 VanDerWaalsContact CD1-CG2 3.4Å; G484-I534 CarbonylContact C-O 3.56Å; G484-I534 VanDerWaalsContact CA-O 3.24Å; G484-I534 WeakPolarHBondContact CA-O 3.46Å; Y485-I534 PolarHBondContact N-O 2.68Å; Y485-I534 PolarHBondContact O-N 3.45Å; L487-I534 HydrophobicContact CD1-CD1 3.62Å; L487-I534 HydrophobicContact CD1-CG1 4.37Å; L487-I534 HydrophobicContact CD2-CD1 4.04Å; L487-I534 HydrophobicContact CG-CD1 3.58Å; L487-I534 HydrophobicContact CG-CG1 4.28Å; V526-I534 HydrophobicContact CG1-CG2 3.71Å; S527-I534 WeakPolarHBondContact O-CA 3.39Å; I528-I534 HydrophobicContact CD1-CG1 4.07Å; I528-I534 HydrophobicContact CG1-CG1 4.33Å; I534-I544 HydrophobicContact CD1-CG1 4.32Å; I534-V560 HydrophobicContact CD1-CG2 3.8Å; I534-V560 HydrophobicContact CG2-CG1 4.38Å
535	S	75.9	Confident	75.3	Confident	23 Å²	23	43.8 Å²	43.8	16%	0.161	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	140.5	162.2	-69.7	0	0	0	0	110.3	D482 S527	D482-S535 WeakPolarHBondContact OD2-CB 3.43Å; D482-S535 PolarHBondContact OD2-OG 3.28Å; S527-S535 PolarHBondContact N-O 3.32Å; S527-S535 PolarHBondContact O-N 3.26Å; S527-S535 PolarHBondContact OG-O 3.25Å
536	A	74	Confident	76	Confident	29 Å²	29	42.9 Å²	42.9	24%	0.24	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.1	177.9	0	0	0	0	0	110.7	V562	A536-V562 HydrophobicContact CB-CG1 3.91Å; A536-V562 HydrophobicContact CB-CG2 3.81Å
537	L	72.3	Confident	76.3	Confident	77 Å²	77	42.9 Å²	42.9	40%	0.403	24%	0.244	S	C	.	.			trans	-109.9	-40.3	178.1	-69.8	175.4	0	0	0	112.4	V525	V525-L537 PolarHBondContact O-N 2.88Å
538	N	69.5	Low	76.2	Confident	85 Å²	85	40.5 Å²	40.5	46%	0.455	23%	0.228	S	C	.	.	S	Bend	trans	-141	156.1	179.4	-66.6	-78.9	0	0	0	110	T524 V525	T524-N538 PolarHBondContact O-ND2 3.22Å; V525-N538 VanDerWaalsContact CG1-O 3.23Å; V525-N538 WeakPolarHBondContact CG1-O 3.48Å; V525-N538 PolarHBondContact O-N 3.09Å
539	P	73.6	Confident	75.7	Confident	83 Å²	83	40.8 Å²	40.8	54%	0.539	23%	0.233	S	C	.	.	S	Bend	trans	-65.8	137.3	168	28.6	-34.9	0	0	0	110.9
540	G	76.5	Confident	75	Confident	30 Å²	30	38.8 Å²	38.8	31%	0.309	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	150.1	-155.8	179.7	0	0	0	0	0	114.1	V525 V562	V525-G540 VanDerWaalsContact CG1-C 3.49Å; G540-V562 PolarHBondContact O-N 3.15Å
541	E	81.1	Confident	74.9	Confident	98 Å²	98	30.6 Å²	30.6	46%	0.458	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	140.6	-177.4	-55.7	-175	170.1	0	0	111.3	V503 V525 V560 Y561	V503-E541 HydrophobicContact CG2-CB 3.96Å; V525-E541 WeakPolarHBondContact CG2-O 3.36Å; E541-V560 WeakPolarHBondContact CA-O 3.48Å; E541-Y561 HydrophobicContact CG-CD1 3.9Å; E541-Y561 HydrophobicContact CG-CE1 3.93Å; E541-Y561 WeakPolarHBondContact OE1-CE1 3.37Å
542	S	78.8	Confident	74.6	Confident	4 Å²	4	28.7 Å²	28.7	3%	0.028	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	146.1	172.3	-176.9	0	0	0	0	111.8	L501 V560	L501-S542 PolarHBondContact O-OG 3.29Å; S542-V560 PolarHBondContact N-O 3.14Å; S542-V560 VanDerWaalsContact N-O 3.13Å; S542-V560 PolarHBondContact O-N 2.92Å
543	I	82	Confident	74.1	Confident	18 Å²	18	32.7 Å²	32.7	9%	0.092	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.5	173.6	-65.2	163.6	0	0	0	107.9	L501 V503 L506 V545 Y557 T558 V559	L501-I543 HydrophobicContact CB-CB 4.33Å; L501-I543 PolarHBondContact N-O 2.88Å; L501-I543 PolarHBondContact O-N 3.47Å; V503-I543 HydrophobicContact CG2-CD1 4.33Å; V503-I543 HydrophobicContact CG2-CG1 4.3Å; L506-I543 HydrophobicContact CD1-CD1 3.46Å; L506-I543 VanDerWaalsContact CD1-CD1 3.46Å; I543-V545 HydrophobicContact CG2-CG2 4.17Å; I543-Y557 HydrophobicContact CG2-CD2 4.37Å; I543-T558 WeakPolarHBondContact CA-O 3.47Å; I543-V559 HydrophobicContact CG1-CG2 4.5Å
544	I	84.6	Confident	74	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126	173.7	-61.3	-56.2	0	0	0	108.8	L487 W498 A500 V526 I528 I534 Y557 T558 V560	L487-I544 HydrophobicContact CD1-CB 4.41Å; L487-I544 HydrophobicContact CD1-CG2 3.74Å; W498-I544 HydrophobicContact CE3-CG2 3.81Å; W498-I544 HydrophobicContact CZ3-CG2 4.16Å; A500-I544 HydrophobicContact CB-CD1 3.54Å; V526-I544 HydrophobicContact CG1-CD1 4.03Å; I528-I544 HydrophobicContact CB-CD1 4.44Å; I528-I544 HydrophobicContact CD1-CD1 4.15Å; I528-I544 HydrophobicContact CD1-CG1 4.4Å; I528-I544 HydrophobicContact CD1-CG2 3.41Å; I528-I544 VanDerWaalsContact CD1-CG2 3.41Å; I528-I544 HydrophobicContact CG2-CD1 4.45Å; I534-I544 HydrophobicContact CD1-CG1 4.32Å; I544-Y557 CarbonylContact O-C 3.58Å; I544-Y557 WeakPolarHBondContact O-CA 3.06Å; I544-Y557 WeakPolarHBondContact O-CB 3.45Å; I544-T558 HydrophobicContact CB-CG2 3.85Å; I544-T558 HydrophobicContact CG2-CG2 4.39Å; I544-T558 PolarHBondContact N-O 3.13Å; I544-T558 PolarHBondContact O-N 3.17Å; I544-V560 HydrophobicContact CG1-CG2 3.56Å
545	V	85	Confident	74	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.8	177	-174.2	0	0	0	0	109.6	I335 A339 W498 T499 L501 I543 C555 G556	I335-V545 HydrophobicContact CG2-CG2 3.59Å; A339-V545 HydrophobicContact CB-CB 4.22Å; A339-V545 HydrophobicContact CB-CG1 3.86Å; A339-V545 HydrophobicContact CB-CG2 4.43Å; W498-V545 WeakPolarHBondContact CA-O 3.47Å; T499-V545 PolarHBondContact N-O 3.44Å; T499-V545 PolarHBondContact O-N 3.11Å; L501-V545 HydrophobicContact CD1-CG2 3.75Å; L501-V545 HydrophobicContact CG-CG2 4.35Å; I543-V545 HydrophobicContact CG2-CG2 4.17Å; V545-C555 HydrophobicContact CG1-CB 4Å; V545-G556 WeakPolarHBondContact CA-O 3.38Å
546	A	83.4	Confident	74	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	109.3	170.1	0	0	0	0	0	108.7	I458 I460 A489 Y496 W498 C555 G556	I458-A546 HydrophobicContact CG2-CB 4.22Å; I460-A546 HydrophobicContact CD1-CB 3.63Å; I460-A546 HydrophobicContact CG1-CB 3.91Å; A489-A546 HydrophobicContact CB-CB 4.38Å; Y496-A546 HydrophobicContact CD1-CB 4.38Å; W498-A546 HydrophobicContact CD2-CB 4.4Å; W498-A546 HydrophobicContact CE3-CB 3.86Å; W498-A546 HydrophobicContact CH2-CB 4.13Å; W498-A546 HydrophobicContact CZ3-CB 3.71Å; A546-C555 CarbonylContact O-C 3.59Å; A546-C555 VanDerWaalsContact O-CA 3.26Å; A546-C555 WeakPolarHBondContact O-CA 3.08Å; A546-C555 WeakPolarHBondContact O-CB 3.32Å; A546-G556 PolarHBondContact N-O 2.82Å; A546-G556 PolarHBondContact O-N 3.27Å
547	S	78.1	Confident	74.5	Confident	1 Å²	1	37 Å²	37	1%	0.007	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	143.2	177.6	61.9	0	0	0	0	111	Y496 R497 S549	Y496-S547 CarbonylContact C-O 3.46Å; Y496-S547 WeakPolarHBondContact CA-O 3.15Å; R497-S547 PolarHBondContact N-O 3.31Å; R497-S547 PolarHBondContact O-N 2.62Å; R497-S547 PolarHBondContact O-OG 3.13Å; S547-S549 PolarHBondContact O-N 3.15Å
548	S	72.8	Confident	74.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	123.3	175.6	170.8	0	0	0	0	110.3	C493 S550 N551 P552 I554	C493-S548 PolarHBondContact SG-OG 3.05Å; S548-S550 VanDerWaalsContact C-N 3.26Å; S548-S550 PolarHBondContact O-N 2.9Å; S548-N551 WeakPolarHBondContact CB-O 3.39Å; S548-N551 CarbonylContact O-C 3.37Å; S548-N551 VanDerWaalsContact O-C 3.25Å; S548-N551 PolarHBondContact O-N 3.2Å; S548-N551 VanDerWaalsContact O-N 3.14Å; S548-P552 VanDerWaalsContact O-CA 3.28Å; S548-P552 WeakPolarHBondContact O-CA 3.42Å; S548-P552 VanDerWaalsContact O-N 3.13Å; S548-I554 WeakPolarHBondContact CB-O 3.29Å; S548-I554 PolarHBondContact N-O 3.48Å
549	S	65.4	Low	75.6	Confident	43 Å²	43	31.4 Å²	31.4	30%	0.301	18%	0.176	S	C	.	.	S	Bend	trans	-54	-41.1	-173.8	62	0	0	0	0	113.4	Q495 S547	Q495-S549 WeakPolarHBondContact CB-OG 3.46Å; Q495-S549 PolarHBondContact O-N 3.41Å; Q495-S549 PolarHBondContact OE1-OG 2.91Å; S547-S549 PolarHBondContact O-N 3.15Å
550	S	60.2	Low	76	Confident	21 Å²	21	27.5 Å²	27.5	15%	0.147	15%	0.151	C	C	.	.	S	Bend	trans	-86	-23.1	-175.9	60.5	0	0	0	0	113	S548	S548-S550 VanDerWaalsContact C-N 3.26Å; S548-S550 PolarHBondContact O-N 2.9Å
551	N	63.6	Low	76.3	Confident	12 Å²	12	29.1 Å²	29.1	6%	0.064	15%	0.148	C	C	.	.			trans	-146.7	67.9	-169.4	-67.5	-62.4	0	0	0	111	I363 S548 Q553 I554	I363-N551 HydrophobicContact CD1-CB 4.45Å; I363-N551 VanDerWaalsContact CD1-ND2 3.3Å; I363-N551 WeakPolarHBondContact CD1-ND2 3.45Å; I363-N551 WeakPolarHBondContact CD1-OD1 3Å; S548-N551 WeakPolarHBondContact CB-O 3.39Å; S548-N551 CarbonylContact O-C 3.37Å; S548-N551 VanDerWaalsContact O-C 3.25Å; S548-N551 PolarHBondContact O-N 3.2Å; S548-N551 VanDerWaalsContact O-N 3.14Å; N551-Q553 PolarHBondContact O-N 3.32Å; N551-I554 HydrophobicContact CB-CD1 4.41Å; N551-I554 PolarHBondContact O-N 3.35Å
552	P	62.9	Low	76.3	Confident	46 Å²	46	24.9 Å²	24.9	30%	0.299	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.6	-165.6	22.6	-34.8	0	0	0	115.6	S548 I554	S548-P552 VanDerWaalsContact O-CA 3.28Å; S548-P552 WeakPolarHBondContact O-CA 3.42Å; S548-P552 VanDerWaalsContact O-N 3.13Å; P552-I554 PolarHBondContact O-N 2.69Å
553	Q	61.8	Low	76.5	Confident	84 Å²	84	27.6 Å²	27.6	39%	0.393	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.5	169.4	60.1	-146.7	18.6	0	0	114	I359 N551	I359-Q553 PolarHBondContact O-NE2 2.85Å; I359-Q553 PolarHBondContact O-OE1 3.19Å; N551-Q553 PolarHBondContact O-N 3.32Å
554	I	73.1	Confident	76.2	Confident	9 Å²	9	30.4 Å²	30.4	5%	0.046	16%	0.158	C	C	.	.	S	Bend	trans	-85.8	109.4	165.7	-53.5	175.6	0	0	0	107.1	I363 Y455 I458 S548 N551 P552	I363-I554 HydrophobicContact CG2-CD1 3.92Å; Y455-I554 HydrophobicContact CD2-CD1 3.68Å; Y455-I554 HydrophobicContact CE2-CD1 4.47Å; Y455-I554 HydrophobicContact CG-CD1 4.16Å; I458-I554 HydrophobicContact CD1-CG2 3.96Å; I458-I554 WeakPolarHBondContact CD1-O 2.93Å; I458-I554 HydrophobicContact CG1-CG2 4.02Å; S548-I554 WeakPolarHBondContact CB-O 3.29Å; S548-I554 PolarHBondContact N-O 3.48Å; N551-I554 HydrophobicContact CB-CD1 4.41Å; N551-I554 PolarHBondContact O-N 3.35Å; P552-I554 PolarHBondContact O-N 2.69Å
555	C	78.5	Confident	75.9	Confident	20 Å²	20	31.8 Å²	31.8	14%	0.135	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	162.3	176.3	98.4	0	0	0	0	113.3	C336 V545 A546	C336-C555 WeakPolarHBondContact CA-SG 3.45Å; C336-C555 HydrophobicContact CB-CB 3.73Å; C336-C555 WeakPolarHBondContact CB-SG 3.32Å; C336-C555 WeakPolarHBondContact SG-CB 3.48Å; C336-C555 CovalentContact SG-SG 2.03Å; C336-C555 PolarHBondContact SG-SG 2.88Å; V545-C555 HydrophobicContact CG1-CB 4Å; A546-C555 CarbonylContact O-C 3.59Å; A546-C555 VanDerWaalsContact O-CA 3.26Å; A546-C555 WeakPolarHBondContact O-CA 3.08Å; A546-C555 WeakPolarHBondContact O-CB 3.32Å
556	G	77.8	Confident	75.7	Confident	6 Å²	6	34.4 Å²	34.4	6%	0.062	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	164.9	166.9	0	0	0	0	0	110.2	V545 A546	V545-G556 WeakPolarHBondContact CA-O 3.38Å; A546-G556 PolarHBondContact N-O 2.82Å; A546-G556 PolarHBondContact O-N 3.27Å
557	Y	82.8	Confident	75.6	Confident	139 Å²	139	39.7 Å²	39.7	55%	0.545	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	159.3	-177.6	68.2	-87.1	0	0	0	113.3	I335 I543 I544	I335-Y557 HydrophobicContact CD1-CD1 4.37Å; I335-Y557 HydrophobicContact CD1-CE1 4.3Å; I543-Y557 HydrophobicContact CG2-CD2 4.37Å; I544-Y557 CarbonylContact O-C 3.58Å; I544-Y557 WeakPolarHBondContact O-CA 3.06Å; I544-Y557 WeakPolarHBondContact O-CB 3.45Å
558	T	82.2	Confident	75.9	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	165.8	173.7	-170.7	0	0	0	0	110.2	I460 T463 L487 I543 I544	I460-T558 HydrophobicContact CB-CG2 4.3Å; I460-T558 HydrophobicContact CD1-CG2 4.02Å; I460-T558 HydrophobicContact CG2-CG2 3.68Å; T463-T558 WeakPolarHBondContact CG2-OG1 3.44Å; L487-T558 HydrophobicContact CD1-CG2 4.01Å; I543-T558 WeakPolarHBondContact CA-O 3.47Å; I544-T558 HydrophobicContact CB-CG2 3.85Å; I544-T558 HydrophobicContact CG2-CG2 4.39Å; I544-T558 PolarHBondContact N-O 3.13Å; I544-T558 PolarHBondContact O-N 3.17Å
559	V	82.5	Confident	76.4	Confident	41 Å²	41	47 Å²	47	25%	0.248	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135.8	176	-175.4	0	0	0	0	109.4	V465 I543 Y561	V465-V559 PolarHBondContact N-O 3.28Å; I543-V559 HydrophobicContact CG1-CG2 4.5Å; V559-Y561 HydrophobicContact CB-CE2 4.38Å; V559-Y561 HydrophobicContact CG1-CE1 4.17Å; V559-Y561 HydrophobicContact CG1-CE2 3.89Å
560	V	82	Confident	77.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.8	-179.4	-176.3	0	0	0	0	109.5	V465 L467 V526 I534 E541 S542 I544	V465-V560 HydrophobicContact CB-CG2 4.41Å; L467-V560 HydrophobicContact CD1-CG1 4.41Å; V526-V560 HydrophobicContact CG2-CB 4.4Å; V526-V560 HydrophobicContact CG2-CG1 3.94Å; I534-V560 HydrophobicContact CD1-CG2 3.8Å; I534-V560 HydrophobicContact CG2-CG1 4.38Å; E541-V560 WeakPolarHBondContact CA-O 3.48Å; S542-V560 PolarHBondContact N-O 3.14Å; S542-V560 VanDerWaalsContact N-O 3.13Å; S542-V560 PolarHBondContact O-N 2.92Å; I544-V560 HydrophobicContact CG1-CG2 3.56Å
561	Y	83.6	Confident	78.1	Confident	64 Å²	64	47.7 Å²	47.7	25%	0.251	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	138.2	177.5	-59.3	-81.9	0	0	0	110.8	P464 V465 I466 L467 E541 V559	P464-Y561 HydrophobicContact CB-CD2 4.14Å; P464-Y561 HydrophobicContact CB-CE2 3.8Å; P464-Y561 HydrophobicContact CG-CE2 4.45Å; V465-Y561 PolarHBondContact O-N 3.1Å; I466-Y561 HydrophobicContact CG1-CD2 4.5Å; L467-Y561 PolarHBondContact N-O 3.47Å; E541-Y561 HydrophobicContact CG-CD1 3.9Å; E541-Y561 HydrophobicContact CG-CE1 3.93Å; E541-Y561 WeakPolarHBondContact OE1-CE1 3.37Å; V559-Y561 HydrophobicContact CB-CE2 4.38Å; V559-Y561 HydrophobicContact CG1-CE1 4.17Å; V559-Y561 HydrophobicContact CG1-CE2 3.89Å
562	V	80.7	Confident	78.1	Confident	10 Å²	10	55.3 Å²	55.3	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	114.7	175.4	179.6	0	0	0	0	109.2	W469 V525 V526 A536 G540	W469-V562 HydrophobicContact CB-CG1 4.26Å; W469-V562 HydrophobicContact CE3-CG1 3.77Å; V525-V562 HydrophobicContact CG1-CG2 4.23Å; V526-V562 HydrophobicContact CG2-CG2 4.26Å; A536-V562 HydrophobicContact CB-CG1 3.91Å; A536-V562 HydrophobicContact CB-CG2 3.81Å; G540-V562 PolarHBondContact O-N 3.15Å
563	R	82.5	Confident	78.2	Confident	60 Å²	60	59 Å²	59	23%	0.226	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.8	-165.9	-69.6	-178.1	168.8	-160.4	-14	113.2	I466 L467 P468 W469 D628 D630	I466-R563 HydrophobicContact CG2-CB 4.41Å; L467-R563 PolarHBondContact O-N 3.06Å; P468-R563 CarbonylContact C-O 3.52Å; P468-R563 VanDerWaalsContact CA-O 3.27Å; P468-R563 WeakPolarHBondContact CA-O 3.44Å; W469-R563 PolarHBondContact N-O 3.48Å; R563-D628 WeakPolarHBondContact CD-OD2 3.36Å; R563-D628 IonicContact CZ-OD2 3.67Å; R563-D628 IonicContact NE-OD2 2.63Å; R563-D628 IonicContact NH1-OD2 2.62Å; R563-D628 PolarHBondContact NH1-OD2 2.75Å; R563-D630 IonicContact CZ-OD2 3.27Å; R563-D630 IonicContact NH1-OD1 3.07Å; R563-D630 IonicContact NH1-OD2 2.98Å; R563-D630 PolarHBondContact NH1-OD2 3.22Å; R563-D630 IonicContact NH2-OD2 3.98Å; R563-D630 PolarHBondContact NH2-OD2 2.96Å
564	P	77.2	Confident	78.7	Confident	78 Å²	78	59.8 Å²	59.8	51%	0.506	28%	0.284	S	S	.	.			trans	-85.2	153.3	175.1	34.2	-34.8	0	0	0	113.7
565	P	77.8	Confident	78.8	Confident	28 Å²	28	61.3 Å²	61.3	18%	0.182	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	159.3	179.9	33.5	-35.9	0	0	0	114.7	V626 L627 M634 L640 Y696	P565-V626 HydrophobicContact CB-CG1 3.85Å; P565-L627 CarbonylContact C-O 3.53Å; P565-L627 WeakPolarHBondContact CA-O 3.35Å; P565-M634 HydrophobicContact CB-CE 3.89Å; P565-M634 HydrophobicContact CB-SD 3.97Å; P565-L640 HydrophobicContact CG-CD2 4.29Å; P565-Y696 HydrophobicContact CG-CE1 3.93Å
566	S	80.1	Confident	79	Confident	56 Å²	56	61 Å²	61	39%	0.392	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	-38.5	-172.2	68.9	0	0	0	0	117.7	L627 D628 I710	S566-L627 PolarHBondContact N-O 2.64Å; S566-L627 VanDerWaalsContact OG-C 3.24Å; S566-L627 PolarHBondContact OG-O 2.6Å; S566-L627 VanDerWaalsContact OG-O 3.12Å; S566-D628 WeakPolarHBondContact CB-O 3.31Å; S566-D628 VanDerWaalsContact OG-C 3.3Å; S566-D628 PolarHBondContact OG-O 2.76Å; S566-I710 WeakPolarHBondContact O-CD1 3.31Å
567	E	82.7	Confident	79.2	Confident	110 Å²	110	61 Å²	61	51%	0.514	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	164.3	-173.7	-153.4	-168.2	133.7	0	0	112.2	V626 L627	E567-V626 CarbonylContact O-C 3.43Å; E567-V626 VanDerWaalsContact O-CA 3.25Å; E567-V626 WeakPolarHBondContact O-CA 3.18Å; E567-V626 WeakPolarHBondContact O-CG1 2.96Å; E567-L627 HydrophobicContact CB-CB 4.14Å; E567-L627 HydrophobicContact CB-CD1 4.09Å; E567-L627 HydrophobicContact CB-CG 4.2Å; E567-L627 PolarHBondContact O-N 2.91Å
568	M	84.7	Confident	79	Confident	12 Å²	12	54.8 Å²	54.8	6%	0.059	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	145.6	178.4	-61.5	-160.3	-64	0	0	115.4	A625 V626 I642 I710	M568-A625 CarbonylContact C-O 3.26Å; M568-A625 VanDerWaalsContact CA-O 3.26Å; M568-A625 WeakPolarHBondContact CA-O 3.49Å; M568-V626 HydrophobicContact CG-CB 4.49Å; M568-V626 HydrophobicContact CG-CG1 4.28Å; M568-V626 HydrophobicContact CG-CG2 3.97Å; M568-V626 HydrophobicContact SD-CG2 4.13Å; M568-I642 HydrophobicContact SD-CD1 4.09Å; M568-I642 HydrophobicContact SD-CG1 4.21Å; M568-I642 HydrophobicContact SD-CG2 4.38Å; M568-I710 HydrophobicContact CB-CG2 3.91Å; M568-I710 HydrophobicContact CE-CB 4.1Å; M568-I710 HydrophobicContact CE-CG2 4.08Å; M568-I710 VanDerWaalsContact CE-O 3.26Å; M568-I710 WeakPolarHBondContact CE-O 3.21Å; M568-I710 HydrophobicContact CG-CB 4.46Å; M568-I710 HydrophobicContact CG-CG2 3.73Å
569	K	83.3	Confident	78.8	Confident	142 Å²	142	55.7 Å²	55.7	62%	0.617	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.6	149.6	-174.4	-173.7	176.9	175.9	-175.7	0	115	L624 A625	K569-L624 CarbonylContact O-C 3.59Å; K569-L624 WeakPolarHBondContact O-CA 3.03Å; K569-L624 WeakPolarHBondContact O-CD1 3.15Å; K569-A625 PolarHBondContact N-O 2.97Å; K569-A625 PolarHBondContact O-N 3.08Å
570	F	82.8	Confident	78	Confident	14 Å²	14	56.3 Å²	56.3	6%	0.061	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	160.9	177.7	-86.1	-72.5	0	0	0	115.2	I622 G623 L624 F680 I692 A694 R713 V714	F570-I622 HydrophobicContact CD1-CG2 3.79Å; F570-I622 HydrophobicContact CE1-CG2 3.83Å; F570-G623 WeakPolarHBondContact CD1-O 3.4Å; F570-L624 HydrophobicContact CD1-CD1 4.01Å; F570-L624 HydrophobicContact CD2-CD1 4.31Å; F570-L624 HydrophobicContact CE1-CD1 4.05Å; F570-L624 HydrophobicContact CE2-CD1 4.34Å; F570-L624 HydrophobicContact CG-CD1 4.14Å; F570-L624 HydrophobicContact CZ-CD1 4.22Å; F570-F680 AromaticContact CE1-CE1 3.87Å; F570-F680 HydrophobicContact CE1-CE1 3.87Å; F570-F680 AromaticContact CE1-CZ 3.92Å; F570-F680 HydrophobicContact CE1-CZ 3.92Å; F570-I692 HydrophobicContact CZ-CG2 4.49Å; F570-A694 HydrophobicContact CE2-CB 4.27Å; F570-A694 HydrophobicContact CZ-CB 4.12Å; F570-R713 WeakPolarHBondContact CD2-O 3.22Å; F570-V714 HydrophobicContact CD1-CG1 4.27Å; F570-V714 HydrophobicContact CE1-CG1 4.09Å; F570-V714 HydrophobicContact CE2-CG1 4.43Å; F570-V714 HydrophobicContact CZ-CG1 4.18Å
571	V	76.6	Confident	76.8	Confident	65 Å²	65	60.6 Å²	60.6	39%	0.394	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.5	175.7	-171.5	0	0	0	0	111.1	G623 E676	V571-G623 PolarHBondContact N-O 3.46Å; V571-E676 HydrophobicContact CG2-CB 4.31Å
572	Y	65	Low	75.4	Confident	173 Å²	173	66 Å²	66	68%	0.678	32%	0.321	S	S	*	.			trans	-118.9	140.1	-167	-66.3	-89.6	0	0	0	115	V714	Y572-V714 HydrophobicContact CD1-CG2 4.38Å; Y572-V714 HydrophobicContact CE1-CG2 4.03Å
573	E	64.9	Low	73.6	Confident	123 Å²	123	77.4 Å²	77.4	58%	0.575	36%	0.363	S	S	*	.			trans	-140.5	-78.6	171.1	-71.6	-171.9	171.4	0	0	115.1	R662	E573-R662 IonicContact OE1-CZ 3.63Å; E573-R662 IonicContact OE1-NH1 3.16Å; E573-R662 PolarHBondContact OE1-NH1 2.74Å; E573-R662 IonicContact OE2-CZ 3.76Å; E573-R662 IonicContact OE2-NH1 3.78Å; E573-R662 PolarHBondContact OE2-NH1 2.91Å; E573-R662 IonicContact OE2-NH2 3.41Å
574	R	71.5	Confident	71.4	Confident	100 Å²	100	79.5 Å²	79.5	38%	0.377	38%	0.379	S	S	.	.			trans	-129.8	152.3	-175.3	174.6	-178.2	-104.4	-164.9	-3	110.8	L620	R574-L620 HydrophobicContact CB-CD1 3.99Å; R574-L620 HydrophobicContact CG-CD1 4.19Å; R574-L620 WeakPolarHBondContact O-CD1 3.41Å
575	N	75.8	Confident	69.4	Low	42 Å²	42	77.5 Å²	77.5	23%	0.225	37%	0.368	C	S	.	.			trans	-124	-2.9	-166.4	-59.7	-13.7	0	0	0	116.3	A717 W751 S841	N575-A717 PolarHBondContact O-N 3.05Å; N575-A717 VanDerWaalsContact O-N 3.07Å; N575-W751 HydrophobicContact CB-CH2 4.19Å; N575-S841 PolarHBondContact ND2-O 2.4Å
576	E	81.9	Confident	67.2	Low	14 Å²	14	85.3 Å²	85.3	7%	0.065	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.7	-176.4	-68.9	-175.8	141.3	0	0	112.3	A717 Y719 W751 N842	E576-A717 WeakPolarHBondContact CA-O 3.48Å; E576-Y719 HydrophobicContact CB-CE2 4.44Å; E576-Y719 HydrophobicContact CG-CE2 4.13Å; E576-Y719 VanDerWaalsContact OE1-CE2 3.23Å; E576-Y719 WeakPolarHBondContact OE1-CE2 3.44Å; E576-Y719 PolarHBondContact OE1-OH 2.9Å; E576-W751 HydrophobicContact CG-CE3 4.26Å; E576-W751 HydrophobicContact CG-CH2 4.42Å; E576-W751 HydrophobicContact CG-CZ3 3.64Å; E576-W751 WeakPolarHBondContact OE1-CZ3 3.12Å; E576-N842 PolarHBondContact OE1-ND2 2.72Å; E576-N842 PolarHBondContact OE2-ND2 3.25Å
577	V	82.5	Confident	65	Low	4 Å²	4	89.4 Å²	89.4	2%	0.024	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.2	-179.5	73.9	0	0	0	0	113.4	L617 A717 A718 Y719	V577-L617 VanDerWaalsContact CG2-O 3.31Å; V577-L617 WeakPolarHBondContact CG2-O 3.29Å; V577-A717 PolarHBondContact N-O 3.33Å; V577-A717 VanDerWaalsContact N-O 3.1Å; V577-A718 HydrophobicContact CG1-CB 3.8Å; V577-A718 VanDerWaalsContact O-CA 3.26Å; V577-A718 WeakPolarHBondContact O-CA 3.38Å; V577-Y719 PolarHBondContact O-N 2.99Å; V577-Y719 VanDerWaalsContact O-N 3.09Å
578	L	79.5	Confident	62.8	Low	10 Å²	10	87.6 Å²	87.6	5%	0.052	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	145	175.9	-108.4	157.5	0	0	0	112.1	L617 E618 K721 M846	L578-L617 HydrophobicContact CB-CB 4.42Å; L578-L617 WeakPolarHBondContact CB-O 3.02Å; L578-L617 HydrophobicContact CD1-CB 3.97Å; L578-L617 HydrophobicContact CD1-CD1 4.31Å; L578-L617 PolarHBondContact N-O 3.36Å; L578-E618 HydrophobicContact CB-CG 4.48Å; L578-K721 HydrophobicContact CD2-CG 4.12Å; L578-M846 HydrophobicContact CD1-CE 3.7Å; L578-M846 HydrophobicContact CD1-SD 4.09Å; L578-M846 HydrophobicContact CD2-CE 3.89Å; L578-M846 HydrophobicContact CG-CE 3.64Å; L578-M846 HydrophobicContact CG-SD 4.08Å
579	I	77.3	Confident	60.6	Low	23 Å²	23	91.9 Å²	91.9	12%	0.118	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-93.6	124.4	177.4	-59.8	160.5	0	0	0	109.5	N686 V687 A718 Y719 R720	I579-N686 WeakPolarHBondContact CD1-O 3.41Å; I579-V687 HydrophobicContact CD1-CB 4.38Å; I579-V687 HydrophobicContact CD1-CG2 3.58Å; I579-A718 HydrophobicContact CD1-CB 4.3Å; I579-A718 HydrophobicContact CG1-CB 4.15Å; I579-Y719 WeakPolarHBondContact CB-O 3.48Å; I579-Y719 WeakPolarHBondContact CD1-O 3.25Å; I579-Y719 VanDerWaalsContact CG1-O 3.27Å; I579-Y719 WeakPolarHBondContact CG1-O 3.34Å; I579-Y719 PolarHBondContact N-O 3.47Å; I579-R720 HydrophobicContact CB-CG 4.25Å; I579-R720 HydrophobicContact CD1-CG 3.81Å
580	P	65.4	Low	58.3	Low	55 Å²	55	89.8 Å²	89.8	36%	0.357	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-69.9	151.3	-173.4	26.4	-34.8	0	0	0	113.8
581	P	57.6	Low	55.8	Low	90 Å²	90	94.7 Å²	94.7	58%	0.584	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-74.2	128	-173.9	28.4	-34.6	0	0	0	113.4	R583	P581-R583 PolarHBondContact O-N 2.93Å
582	R	52.8	Low	54	Low	177 Å²	177	96.4 Å²	96.4	67%	0.668	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-60.5	-5.3	-174.8	-75.9	-172.5	176.3	-178.6	-0.5	116.8	N584 A585	R582-N584 VanDerWaalsContact C-N 3.26Å; R582-N584 PolarHBondContact O-N 3.33Å; R582-A585 HydrophobicContact CB-CB 4.38Å; R582-A585 WeakPolarHBondContact O-CB 3.31Å; R582-A585 PolarHBondContact O-N 3.37Å
583	R	43.1	Very low	52.6	Low	250 Å²	250	93.2 Å²	93.2	94%	0.943	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-66.2	-22.7	-176.3	-82	-171.6	176.2	172.3	1.6	114.3	P581	P581-R583 PolarHBondContact O-N 2.93Å
584	N	36.5	Very low	51	Low	104 Å²	104	92 Å²	92	56%	0.556	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-101	8	170.4	-74.3	4.6	0	0	0	113.8	R582 K586 F587 I588	R582-N584 VanDerWaalsContact C-N 3.26Å; R582-N584 PolarHBondContact O-N 3.33Å; N584-K586 VanDerWaalsContact C-N 3.27Å; N584-K586 PolarHBondContact O-N 3.2Å; N584-K586 VanDerWaalsContact O-N 3.13Å; N584-F587 PolarHBondContact O-N 3.08Å; N584-I588 HydrophobicContact CB-CD1 3.76Å; N584-I588 HydrophobicContact CB-CG1 4.13Å; N584-I588 WeakPolarHBondContact O-CG1 3.31Å; N584-I588 PolarHBondContact O-N 3.35Å
585	A	35.1	Very low	49	Very low	35 Å²	35	90.4 Å²	90.4	29%	0.289	44%	0.441	S	S	.	.	H	α-helix	trans	-60.6	-29.6	-170.3	0	0	0	0	0	114.6	R582 F587 D589	R582-A585 HydrophobicContact CB-CB 4.38Å; R582-A585 WeakPolarHBondContact O-CB 3.31Å; R582-A585 PolarHBondContact O-N 3.37Å; A585-F587 VanDerWaalsContact C-N 3.35Å; A585-D589 PolarHBondContact O-N 2.03Å
586	K	32.9	Very low	46.7	Very low	193 Å²	193	96.9 Å²	96.9	84%	0.839	46%	0.464	S	S	*	.	H	α-helix	trans	-73.7	-21.6	173.8	-84.4	-164.6	172	-170.2	0	114.6	N584	N584-K586 VanDerWaalsContact C-N 3.27Å; N584-K586 PolarHBondContact O-N 3.2Å; N584-K586 VanDerWaalsContact O-N 3.13Å
587	F	33.4	Very low	44.2	Very low	141 Å²	141	100.2 Å²	100.2	62%	0.618	49%	0.489	S	S	*	.	H	α-helix	trans	-82.9	-53	168.4	-83.9	-96.9	0	0	0	109.3	N584 A585 D589 E590 E591	N584-F587 PolarHBondContact O-N 3.08Å; A585-F587 VanDerWaalsContact C-N 3.35Å; F587-D589 PolarHBondContact O-N 3.12Å; F587-E590 PolarHBondContact O-N 3Å; F587-E590 VanDerWaalsContact O-N 3.12Å; F587-E591 WeakPolarHBondContact O-CB 2.95Å; F587-E591 PolarHBondContact O-N 3.01Å
588	I	36.9	Very low	41.6	Very low	72 Å²	72	105.1 Å²	105.1	37%	0.369	52%	0.515	S	S	.	.	H	α-helix	trans	-54.7	-44.9	-173.3	-65.9	167.4	0	0	0	113	N584 L592	N584-I588 HydrophobicContact CB-CD1 3.76Å; N584-I588 HydrophobicContact CB-CG1 4.13Å; N584-I588 WeakPolarHBondContact O-CG1 3.31Å; N584-I588 PolarHBondContact O-N 3.35Å; I588-L592 HydrophobicContact CG2-CD1 4.19Å; I588-L592 WeakPolarHBondContact O-CB 3.46Å; I588-L592 PolarHBondContact O-N 2.97Å
589	D	37.7	Very low	39.1	Very low	102 Å²	102	112.8 Å²	112.8	55%	0.545	55%	0.55	S	S	.	*	H	α-helix	trans	-76.7	-26.3	-179.4	-84.5	-42	0	0	0	114.3	A585 F587 T593	A585-D589 PolarHBondContact O-N 2.03Å; F587-D589 PolarHBondContact O-N 3.12Å; D589-T593 WeakPolarHBondContact O-CB 3.37Å; D589-T593 VanDerWaalsContact O-CG2 3.24Å; D589-T593 WeakPolarHBondContact O-CG2 3.03Å; D589-T593 PolarHBondContact O-OG1 3.1Å
590	E	34.4	Very low	36.7	Very low	98 Å²	98	115.8 Å²	115.8	46%	0.458	57%	0.572	S	S	.	*	H	α-helix	trans	-86.9	-26.8	173.4	-70.4	-150.6	150.7	0	0	112.6	F587 T593 R594	F587-E590 PolarHBondContact O-N 3Å; F587-E590 VanDerWaalsContact O-N 3.12Å; E590-T593 PolarHBondContact O-OG1 3.03Å; E590-R594 VanDerWaalsContact CD-NH1 3.34Å; E590-R594 VanDerWaalsContact O-CB 3.31Å; E590-R594 WeakPolarHBondContact O-CB 2.82Å; E590-R594 VanDerWaalsContact O-CG 3.31Å; E590-R594 WeakPolarHBondContact O-CG 3.07Å; E590-R594 PolarHBondContact O-N 3.09Å; E590-R594 VanDerWaalsContact O-N 3.13Å; E590-R594 IonicContact OE1-CZ 2.85Å; E590-R594 IonicContact OE1-NH1 3.61Å; E590-R594 IonicContact OE1-NH2 3.46Å; E590-R594 PolarHBondContact OE1-NH2 3.16Å; E590-R594 IonicContact OE2-CZ 3.77Å; E590-R594 IonicContact OE2-NH1 2.75Å; E590-R594 PolarHBondContact OE2-NH1 2.98Å; E590-R594 IonicContact OE2-NH2 3.23Å; E590-R594 PolarHBondContact OE2-NH2 2.98Å
591	E	31.4	Very low	34.9	Very low	118 Å²	118	118.3 Å²	118.3	55%	0.551	59%	0.586	S	S	*	*	H	α-helix	trans	-87	-41.1	-174.6	-163.6	158.3	-146	0	0	111.4	F587 T593 R594 S595	F587-E591 WeakPolarHBondContact O-CB 2.95Å; F587-E591 PolarHBondContact O-N 3.01Å; E591-T593 VanDerWaalsContact C-N 3.29Å; E591-T593 PolarHBondContact O-N 3.25Å; E591-R594 PolarHBondContact O-N 2.68Å; E591-S595 WeakPolarHBondContact O-CB 3.24Å; E591-S595 PolarHBondContact O-N 3.45Å; E591-S595 PolarHBondContact O-OG 3.31Å
592	L	38	Very low	33.6	Very low	100 Å²	100	119.4 Å²	119.4	52%	0.524	59%	0.587	S	S	.	*	H	α-helix	trans	-66.9	-29	169.9	-89.9	69.4	0	0	0	112.6	I588	I588-L592 HydrophobicContact CG2-CD1 4.19Å; I588-L592 WeakPolarHBondContact O-CB 3.46Å; I588-L592 PolarHBondContact O-N 2.97Å
593	T	35.8	Very low	32.4	Very low	106 Å²	106	115.9 Å²	115.9	65%	0.65	58%	0.578	S	S	*	*	H	α-helix	trans	-85.4	-20	179.1	56.3	0	0	0	0	114.2	D589 E590 E591	D589-T593 WeakPolarHBondContact O-CB 3.37Å; D589-T593 VanDerWaalsContact O-CG2 3.24Å; D589-T593 WeakPolarHBondContact O-CG2 3.03Å; D589-T593 PolarHBondContact O-OG1 3.1Å; E590-T593 PolarHBondContact O-OG1 3.03Å; E591-T593 VanDerWaalsContact C-N 3.29Å; E591-T593 PolarHBondContact O-N 3.25Å
594	R	31.8	Very low	31.7	Very low	98 Å²	98	111.5 Å²	111.5	37%	0.37	57%	0.568	S	S	.	*	H	α-helix	trans	-100	-15.9	173.5	-65.9	-179.3	-174.8	131.9	9.3	114.6	E590 E591 Y1258	E590-R594 VanDerWaalsContact CD-NH1 3.34Å; E590-R594 VanDerWaalsContact O-CB 3.31Å; E590-R594 WeakPolarHBondContact O-CB 2.82Å; E590-R594 VanDerWaalsContact O-CG 3.31Å; E590-R594 WeakPolarHBondContact O-CG 3.07Å; E590-R594 PolarHBondContact O-N 3.09Å; E590-R594 VanDerWaalsContact O-N 3.13Å; E590-R594 IonicContact OE1-CZ 2.85Å; E590-R594 IonicContact OE1-NH1 3.61Å; E590-R594 IonicContact OE1-NH2 3.46Å; E590-R594 PolarHBondContact OE1-NH2 3.16Å; E590-R594 IonicContact OE2-CZ 3.77Å; E590-R594 IonicContact OE2-NH1 2.75Å; E590-R594 PolarHBondContact OE2-NH1 2.98Å; E590-R594 IonicContact OE2-NH2 3.23Å; E590-R594 PolarHBondContact OE2-NH2 2.98Å; E591-R594 PolarHBondContact O-N 2.68Å; R594-Y1258 HydrophobicContact CG-CE1 4.36Å
595	S	29.8	Very low	31.3	Very low	66 Å²	66	115.9 Å²	115.9	46%	0.462	58%	0.577	S	S	.	*	H	α-helix	trans	-89.1	-36	177.3	58.8	0	0	0	0	114.3	E591 S597	E591-S595 WeakPolarHBondContact O-CB 3.24Å; E591-S595 PolarHBondContact O-N 3.45Å; E591-S595 PolarHBondContact O-OG 3.31Å; S595-S597 PolarHBondContact O-N 3.11Å
596	Y	27.1	Very low	31	Very low	179 Å²	179	118 Å²	118	70%	0.702	59%	0.59	S	S	*	*	S	Bend	trans	-83.2	59.6	-176.4	-81.7	-89.5	0	0	0	113.8
597	S	28.7	Very low	30.8	Very low	83 Å²	83	114.4 Å²	114.4	58%	0.58	58%	0.584	S	S	*	*	S	Bend	trans	-137.5	27.7	166	92	0	0	0	0	113.1	S595	S595-S597 PolarHBondContact O-N 3.11Å
598	N	28	Very low	30.6	Very low	108 Å²	108	115.1 Å²	115.1	58%	0.578	58%	0.582	S	S	*	*	S	Bend	trans	-149.6	143	168.7	-95.4	-17.2	0	0	0	109.4
599	Q	28.1	Very low	30.2	Very low	170 Å²	170	116.2 Å²	116.2	79%	0.794	59%	0.589	S	S	*	*			trans	-19.2	122.5	-174.6	-69.1	173.8	-43	0	0	119.2
600	P	25.9	Very low	29.8	Very low	87 Å²	87	117.2 Å²	117.2	57%	0.565	60%	0.601	S	S	*	*			trans	-91.9	158.7	166.9	37.8	-34.2	0	0	0	113.2
601	T	26.9	Very low	29.6	Very low	108 Å²	108	116.8 Å²	116.8	66%	0.663	61%	0.609	S	S	*	*			trans	64.2	150.6	172	78.6	0	0	0	0	117
602	N	31.1	Very low	29.6	Very low	112 Å²	112	113 Å²	113	60%	0.599	60%	0.598	S	S	*	*			cis	-117	135.1	6.6	-57.2	-72.9	0	0	0	111.2	N1903	N602-N1903 VanDerWaalsContact O-CB 3.28Å; N602-N1903 WeakPolarHBondContact O-CB 3.34Å; N602-N1903 PolarHBondContact O-ND2 3.45Å
603	E	27.8	Very low	29.5	Very low	103 Å²	103	113.1 Å²	113.1	48%	0.481	60%	0.602	S	S	.	*			trans	-133.2	112.5	155	-166	169.2	-100.1	0	0	105.5	W605 S1902	E603-W605 PolarHBondContact O-N 2.7Å; E603-S1902 WeakPolarHBondContact OE1-CB 3.46Å; E603-S1902 PolarHBondContact OE1-N 3.21Å; E603-S1902 PolarHBondContact OE1-OG 3.06Å
604	E	28.1	Very low	29.6	Very low	158 Å²	158	113.9 Å²	113.9	74%	0.738	60%	0.599	S	S	*	*			trans	-72.9	115.2	-174.5	-73.6	178.4	137.7	0	0	109.1	S606	E604-S606 VanDerWaalsContact C-N 3.25Å; E604-S606 PolarHBondContact O-N 3.39Å
605	W	28.3	Very low	30.1	Very low	196 Å²	196	116.1 Å²	116.1	74%	0.742	61%	0.611	S	S	*	*			trans	-67	77.2	179.8	-74.1	2.5	0	0	0	111.8	E603 V607	E603-W605 PolarHBondContact O-N 2.7Å; W605-V607 PolarHBondContact O-N 2.92Å
606	S	29	Very low	31.1	Very low	81 Å²	81	118.5 Å²	118.5	57%	0.566	62%	0.619	S	S	*	*			trans	-74.1	92.5	173.8	76.7	0	0	0	0	110	E604 R608	E604-S606 VanDerWaalsContact C-N 3.25Å; E604-S606 PolarHBondContact O-N 3.39Å; S606-R608 PolarHBondContact O-N 2.88Å
607	V	29.3	Very low	32.4	Very low	117 Å²	117	112.6 Å²	112.6	71%	0.709	60%	0.599	S	S	*	*			trans	-52.3	119.9	177.6	-179.9	0	0	0	0	110.2	W605	W605-V607 PolarHBondContact O-N 2.92Å
608	R	28.8	Very low	34.1	Very low	155 Å²	155	110.9 Å²	110.9	59%	0.585	58%	0.582	S	S	*	*			trans	-146.3	17.2	179.2	-141.2	-177.6	-57.2	-161.8	6	114.4	S606	S606-R608 PolarHBondContact O-N 2.88Å
609	D	27.3	Very low	36.1	Very low	96 Å²	96	111.9 Å²	111.9	51%	0.513	58%	0.578	S	S	.	*			trans	-126.7	114.7	179.7	-156.6	-42.4	0	0	0	109.2	S611 A612	D609-S611 VanDerWaalsContact CG-OG 3.25Å; D609-S611 PolarHBondContact O-N 2.86Å; D609-S611 WeakPolarHBondContact OD1-CB 3.39Å; D609-S611 PolarHBondContact OD1-N 2.94Å; D609-S611 PolarHBondContact OD1-OG 3.14Å; D609-A612 WeakPolarHBondContact O-CB 3.4Å; D609-A612 PolarHBondContact O-N 2.93Å; D609-A612 VanDerWaalsContact O-N 3.15Å
610	P	29.3	Very low	38.4	Very low	123 Å²	123	104.4 Å²	104.4	80%	0.799	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-14	-178.3	-23.8	34.5	0	0	0	114.3
611	S	30.9	Very low	40.8	Very low	88 Å²	88	101 Å²	101	62%	0.615	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-15.3	177.9	64.6	0	0	0	0	114.3	D609 V613	D609-S611 VanDerWaalsContact CG-OG 3.25Å; D609-S611 PolarHBondContact O-N 2.86Å; D609-S611 WeakPolarHBondContact OD1-CB 3.39Å; D609-S611 PolarHBondContact OD1-N 2.94Å; D609-S611 PolarHBondContact OD1-OG 3.14Å; S611-V613 PolarHBondContact O-N 3Å; S611-V613 VanDerWaalsContact O-N 3.13Å
612	A	31.9	Very low	43.3	Very low	38 Å²	38	96.7 Å²	96.7	31%	0.314	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-72.5	-6.1	-170.4	0	0	0	0	0	115.4	D609 E614 F615	D609-A612 WeakPolarHBondContact O-CB 3.4Å; D609-A612 PolarHBondContact O-N 2.93Å; D609-A612 VanDerWaalsContact O-N 3.15Å; A612-E614 PolarHBondContact O-N 3.03Å; A612-E614 VanDerWaalsContact O-N 3.13Å; A612-F615 PolarHBondContact O-N 3.36Å
613	V	34.8	Very low	45.5	Very low	103 Å²	103	91.6 Å²	91.6	62%	0.624	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-62.2	-23	-170.9	-175.7	0	0	0	0	113.7	S611 F615	S611-V613 PolarHBondContact O-N 3Å; S611-V613 VanDerWaalsContact O-N 3.13Å; V613-F615 VanDerWaalsContact C-N 3.32Å; V613-F615 PolarHBondContact O-N 2.94Å
614	E	39.2	Very low	48.3	Very low	123 Å²	123	86.7 Å²	86.7	58%	0.575	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-68.2	-26.2	172.8	-82.6	-158.7	103.7	0	0	113.7	A612 L617 K721	A612-E614 PolarHBondContact O-N 3.03Å; A612-E614 VanDerWaalsContact O-N 3.13Å; E614-L617 PolarHBondContact O-N 3.08Å; E614-K721 IonicContact OE1-NZ 3.88Å; E614-K721 PolarHBondContact OE1-NZ 3.27Å
615	F	41.2	Very low	51	Low	145 Å²	145	79.5 Å²	79.5	64%	0.636	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-75.3	-33.4	-177.3	-82.5	-82.3	0	0	0	113.6	A612 V613 L617 E618	A612-F615 PolarHBondContact O-N 3.36Å; V613-F615 VanDerWaalsContact C-N 3.32Å; V613-F615 PolarHBondContact O-N 2.94Å; F615-L617 PolarHBondContact O-N 3.39Å; F615-L617 VanDerWaalsContact O-N 3.14Å; F615-E618 PolarHBondContact O-N 3.14Å
616	D	51	Low	53.6	Low	116 Å²	116	70.3 Å²	70.3	62%	0.62	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-68.5	-6.5	176.4	-86.3	-23.9	0	0	0	113.5
617	L	55.7	Low	56.1	Low	54 Å²	54	68.3 Å²	68.3	28%	0.283	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-91.5	-19.4	174.4	-71.8	164.6	0	0	0	113	V577 L578 E614 F615	V577-L617 VanDerWaalsContact CG2-O 3.31Å; V577-L617 WeakPolarHBondContact CG2-O 3.29Å; L578-L617 HydrophobicContact CB-CB 4.42Å; L578-L617 WeakPolarHBondContact CB-O 3.02Å; L578-L617 HydrophobicContact CD1-CB 3.97Å; L578-L617 HydrophobicContact CD1-CD1 4.31Å; L578-L617 PolarHBondContact N-O 3.36Å; E614-L617 PolarHBondContact O-N 3.08Å; F615-L617 PolarHBondContact O-N 3.39Å; F615-L617 VanDerWaalsContact O-N 3.14Å
618	E	63.1	Low	58.5	Low	48 Å²	48	62.9 Å²	62.9	22%	0.224	33%	0.329	C	S	.	.	S	Bend	trans	-94.5	-5.4	-176.5	-61.1	-164.3	152.2	0	0	114	L578 F615	L578-E618 HydrophobicContact CB-CG 4.48Å; F615-E618 PolarHBondContact O-N 3.14Å
619	R	69.8	Low	60.9	Low	128 Å²	128	59.5 Å²	59.5	48%	0.483	33%	0.329	S	S	.	.			trans	-141.2	132.8	-179.3	-57.1	-177.2	-173.2	-170.8	2.5	111.6	I683	R619-I683 HydrophobicContact CG-CG2 4.27Å
620	L	77.4	Confident	63.2	Low	14 Å²	14	59.3 Å²	59.3	7%	0.073	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	152.6	177.8	-174.9	65.7	0	0	0	111.4	R574 Y681 V682 V716	R574-L620 HydrophobicContact CB-CD1 3.99Å; R574-L620 HydrophobicContact CG-CD1 4.19Å; R574-L620 WeakPolarHBondContact O-CD1 3.41Å; L620-Y681 CarbonylContact O-C 3.56Å; L620-Y681 WeakPolarHBondContact O-CA 3.45Å; L620-V682 HydrophobicContact CB-CB 4.2Å; L620-V682 PolarHBondContact N-O 3.29Å; L620-V682 PolarHBondContact O-N 3.34Å; L620-V716 HydrophobicContact CD2-CG1 3.73Å; L620-V716 HydrophobicContact CD2-CG2 4.16Å
621	A	75.3	Confident	65.3	Low	16 Å²	16	56 Å²	56	13%	0.132	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145	-178.4	0	0	0	0	0	112.3	F680 Y681	A621-F680 WeakPolarHBondContact CA-O 3.16Å; A621-Y681 HydrophobicContact CB-CD1 4.03Å; A621-Y681 HydrophobicContact CB-CE1 3.99Å
622	I	79.1	Confident	67.4	Low	16 Å²	16	56 Å²	56	8%	0.082	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	136.2	-174.1	-54.1	-179.8	0	0	0	110.8	F570 H679 F680 V682 I692 V714 V716	F570-I622 HydrophobicContact CD1-CG2 3.79Å; F570-I622 HydrophobicContact CE1-CG2 3.83Å; I622-H679 CarbonylContact O-C 3.47Å; I622-H679 VanDerWaalsContact O-CA 3.25Å; I622-H679 WeakPolarHBondContact O-CA 3.28Å; I622-H679 VanDerWaalsContact O-CB 3.32Å; I622-H679 WeakPolarHBondContact O-CB 3.48Å; I622-F680 HydrophobicContact CB-CD1 4.48Å; I622-F680 HydrophobicContact CB-CE1 3.87Å; I622-F680 HydrophobicContact CB-CE2 4.06Å; I622-F680 HydrophobicContact CB-CZ 3.64Å; I622-F680 HydrophobicContact CD1-CE2 4.19Å; I622-F680 HydrophobicContact CD1-CZ 4.19Å; I622-F680 HydrophobicContact CG1-CZ 4.42Å; I622-F680 HydrophobicContact CG2-CE1 3.88Å; I622-F680 HydrophobicContact CG2-CZ 3.72Å; I622-F680 PolarHBondContact N-O 3.04Å; I622-F680 VanDerWaalsContact O-CD1 3.29Å; I622-F680 WeakPolarHBondContact O-CD1 3.45Å; I622-F680 PolarHBondContact O-N 3.15Å; I622-V682 HydrophobicContact CD1-CG2 3.94Å; I622-V682 HydrophobicContact CG1-CG2 4.28Å; I622-I692 HydrophobicContact CD1-CD1 3.63Å; I622-V714 HydrophobicContact CD1-CG1 4.33Å; I622-V714 HydrophobicContact CG2-CG1 4.37Å; I622-V716 HydrophobicContact CD1-CG2 4.13Å
623	G	79	Confident	69.4	Low	5 Å²	5	55.7 Å²	55.7	5%	0.052	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	154.1	-175.5	0	0	0	0	0	115.9	F570 V571	F570-G623 WeakPolarHBondContact CD1-O 3.4Å; V571-G623 PolarHBondContact N-O 3.46Å
624	L	85.7	Confident	71.5	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	144.9	-174.7	-168.7	79.2	0	0	0	112.2	K569 F570 I642 E676 C677 L678 A694	K569-L624 CarbonylContact O-C 3.59Å; K569-L624 WeakPolarHBondContact O-CA 3.03Å; K569-L624 WeakPolarHBondContact O-CD1 3.15Å; F570-L624 HydrophobicContact CD1-CD1 4.01Å; F570-L624 HydrophobicContact CD2-CD1 4.31Å; F570-L624 HydrophobicContact CE1-CD1 4.05Å; F570-L624 HydrophobicContact CE2-CD1 4.34Å; F570-L624 HydrophobicContact CG-CD1 4.14Å; F570-L624 HydrophobicContact CZ-CD1 4.22Å; L624-I642 HydrophobicContact CD2-CD1 4.39Å; L624-I642 HydrophobicContact CD2-CG2 4.13Å; L624-E676 CarbonylContact O-C 3.26Å; L624-E676 WeakPolarHBondContact O-CA 3.27Å; L624-C677 PolarHBondContact O-N 3.1Å; L624-L678 HydrophobicContact CB-CD1 3.7Å; L624-L678 HydrophobicContact CB-CG 4.16Å; L624-L678 HydrophobicContact CD2-CD1 4.03Å; L624-L678 HydrophobicContact CD2-CD2 4.43Å; L624-L678 HydrophobicContact CD2-CG 4.32Å; L624-L678 PolarHBondContact N-O 2.86Å; L624-L678 PolarHBondContact O-N 2.72Å; L624-A694 HydrophobicContact CD1-CB 4.25Å; L624-A694 HydrophobicContact CD2-CB 4.43Å
625	A	84	Confident	73.4	Confident	7 Å²	7	46.6 Å²	46.6	6%	0.058	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	151.5	178.1	0	0	0	0	0	112.3	M568 K569 N675	M568-A625 CarbonylContact C-O 3.26Å; M568-A625 VanDerWaalsContact CA-O 3.26Å; M568-A625 WeakPolarHBondContact CA-O 3.49Å; K569-A625 PolarHBondContact N-O 2.97Å; K569-A625 PolarHBondContact O-N 3.08Å; A625-N675 WeakPolarHBondContact CB-O 3.26Å
626	V	83.5	Confident	74.8	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	135.2	174.9	-174.1	0	0	0	0	109.7	P565 E567 M568 S633 M634 C637 L640 I642 C677	P565-V626 HydrophobicContact CB-CG1 3.85Å; E567-V626 CarbonylContact O-C 3.43Å; E567-V626 VanDerWaalsContact O-CA 3.25Å; E567-V626 WeakPolarHBondContact O-CA 3.18Å; E567-V626 WeakPolarHBondContact O-CG1 2.96Å; M568-V626 HydrophobicContact CG-CB 4.49Å; M568-V626 HydrophobicContact CG-CG1 4.28Å; M568-V626 HydrophobicContact CG-CG2 3.97Å; M568-V626 HydrophobicContact SD-CG2 4.13Å; V626-S633 WeakPolarHBondContact O-CA 3.28Å; V626-S633 PolarHBondContact O-OG 2.9Å; V626-M634 HydrophobicContact CG1-SD 4.28Å; V626-M634 PolarHBondContact O-N 3.31Å; V626-C637 VanDerWaalsContact CB-SG 3.52Å; V626-C637 HydrophobicContact CG2-CB 4.06Å; V626-C637 WeakPolarHBondContact CG2-SG 3.42Å; V626-L640 HydrophobicContact CG1-CD1 4.18Å; V626-L640 HydrophobicContact CG2-CD1 4.42Å; V626-I642 HydrophobicContact CG2-CD1 4.05Å; V626-C677 PolarHBondContact N-SG 2.95Å; V626-C677 VanDerWaalsContact N-SG 3.4Å
627	L	82.6	Confident	76.1	Confident	40 Å²	40	35 Å²	35	21%	0.209	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	163.4	-176.9	-53	-174.3	0	0	0	113.4	P565 S566 E567 Q632	P565-L627 CarbonylContact C-O 3.53Å; P565-L627 WeakPolarHBondContact CA-O 3.35Å; S566-L627 PolarHBondContact N-O 2.64Å; S566-L627 VanDerWaalsContact OG-C 3.24Å; S566-L627 PolarHBondContact OG-O 2.6Å; S566-L627 VanDerWaalsContact OG-O 3.12Å; E567-L627 HydrophobicContact CB-CB 4.14Å; E567-L627 HydrophobicContact CB-CD1 4.09Å; E567-L627 HydrophobicContact CB-CG 4.2Å; E567-L627 PolarHBondContact O-N 2.91Å; L627-Q632 CarbonylContact C-O 3.57Å; L627-Q632 WeakPolarHBondContact CA-O 3.4Å
628	D	78.8	Confident	77.1	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.011	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-171.9	173.8	88.7	-19.5	0	0	0	113.7	R563 S566 D630 G631 Q632 M634	R563-D628 WeakPolarHBondContact CD-OD2 3.36Å; R563-D628 IonicContact CZ-OD2 3.67Å; R563-D628 IonicContact NE-OD2 2.63Å; R563-D628 IonicContact NH1-OD2 2.62Å; R563-D628 PolarHBondContact NH1-OD2 2.75Å; S566-D628 WeakPolarHBondContact CB-O 3.31Å; S566-D628 VanDerWaalsContact OG-C 3.3Å; S566-D628 PolarHBondContact OG-O 2.76Å; D628-D630 PolarHBondContact O-N 3.2Å; D628-D630 WeakPolarHBondContact OD1-CA 3.27Å; D628-D630 PolarHBondContact OD1-N 2.9Å; D628-G631 PolarHBondContact O-N 2.85Å; D628-G631 PolarHBondContact OD1-N 2.95Å; D628-Q632 PolarHBondContact N-O 2.07Å; D628-Q632 PolarHBondContact OD1-N 3.08Å; D628-M634 HydrophobicContact CB-CE 4.21Å
629	S	78.8	Confident	77.1	Confident	84 Å²	84	38.3 Å²	38.3	59%	0.587	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.4	179.8	58	0	0	0	0	115
630	D	76.9	Confident	77.3	Confident	93 Å²	93	33 Å²	33	50%	0.497	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	5.6	-174.6	-57.7	6.3	0	0	0	110.8	R563 D628 Q632	R563-D630 IonicContact CZ-OD2 3.27Å; R563-D630 IonicContact NH1-OD1 3.07Å; R563-D630 IonicContact NH1-OD2 2.98Å; R563-D630 PolarHBondContact NH1-OD2 3.22Å; R563-D630 IonicContact NH2-OD2 3.98Å; R563-D630 PolarHBondContact NH2-OD2 2.96Å; D628-D630 PolarHBondContact O-N 3.2Å; D628-D630 WeakPolarHBondContact OD1-CA 3.27Å; D628-D630 PolarHBondContact OD1-N 2.9Å; D630-Q632 HydrophobicContact CB-CG 4.42Å
631	G	73.1	Confident	77	Confident	52 Å²	52	38.6 Å²	38.6	54%	0.536	23%	0.225	S	C	.	.	S	Bend	trans	80.2	13.6	-178.5	0	0	0	0	0	114.5	D628	D628-G631 PolarHBondContact O-N 2.85Å; D628-G631 PolarHBondContact OD1-N 2.95Å
632	Q	74.2	Confident	77	Confident	88 Å²	88	38.1 Å²	38.1	41%	0.411	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-90.5	139.2	-178.3	-59.1	-179.4	52.8	0	0	110.3	I466 L627 D628 D630	I466-Q632 HydrophobicContact CD1-CB 3.98Å; L627-Q632 CarbonylContact C-O 3.57Å; L627-Q632 WeakPolarHBondContact CA-O 3.4Å; D628-Q632 PolarHBondContact N-O 2.07Å; D628-Q632 PolarHBondContact OD1-N 3.08Å; D630-Q632 HydrophobicContact CB-CG 4.42Å
633	S	74.2	Confident	77	Confident	33 Å²	33	41.2 Å²	41.2	23%	0.231	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-72.3	134.5	177.3	-159.7	0	0	0	0	110.8	V626 N675	V626-S633 WeakPolarHBondContact O-CA 3.28Å; V626-S633 PolarHBondContact O-OG 2.9Å; S633-N675 PolarHBondContact OG-O 3.28Å
634	M	79.5	Confident	77.1	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.015	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-70.6	137.2	-179.3	-70.1	-171.3	151.9	0	0	111.4	P468 P565 V626 D628 D636 C677	P468-M634 HydrophobicContact CB-CE 4.08Å; P468-M634 HydrophobicContact CB-SD 3.86Å; P468-M634 HydrophobicContact CG-SD 4.43Å; P565-M634 HydrophobicContact CB-CE 3.89Å; P565-M634 HydrophobicContact CB-SD 3.97Å; V626-M634 HydrophobicContact CG1-SD 4.28Å; V626-M634 PolarHBondContact O-N 3.31Å; D628-M634 HydrophobicContact CB-CE 4.21Å; M634-D636 VanDerWaalsContact C-N 3.27Å; M634-D636 PolarHBondContact O-N 3.25Å; M634-C677 WeakPolarHBondContact O-CB 3.4Å
635	T	78.3	Confident	76.9	Confident	32 Å²	32	49.1 Å²	49.1	20%	0.196	26%	0.264	C	S	.	.	S	Bend	trans	-71	-17.3	-176.1	15.6	0	0	0	0	114.9	P462 V465 I466 Y485	P462-T635 HydrophobicContact CG-CG2 4.01Å; V465-T635 WeakPolarHBondContact CG1-OG1 3.47Å; I466-T635 PolarHBondContact N-OG1 2.93Å; I466-T635 PolarHBondContact O-N 3.38Å; I466-T635 PolarHBondContact O-OG1 3.3Å; Y485-T635 WeakPolarHBondContact CE2-O 3.2Å
636	D	71.4	Confident	76.7	Confident	16 Å²	16	49.4 Å²	49.4	9%	0.086	27%	0.267	C	S	.	.			trans	-155.4	134	173.1	-163.4	-23.2	0	0	0	110.7	L467 P468 Y485 M634 R638	L467-D636 HydrophobicContact CD2-CB 4.49Å; P468-D636 WeakPolarHBondContact CD-O 3.43Å; Y485-D636 HydrophobicContact CD2-CB 3.62Å; Y485-D636 WeakPolarHBondContact CD2-OD2 3.46Å; Y485-D636 HydrophobicContact CE2-CB 4.04Å; Y485-D636 HydrophobicContact CG-CB 4.46Å; M634-D636 VanDerWaalsContact C-N 3.27Å; M634-D636 PolarHBondContact O-N 3.25Å; D636-R638 WeakPolarHBondContact OD1-CB 3.09Å; D636-R638 VanDerWaalsContact OD1-CG 3.28Å; D636-R638 WeakPolarHBondContact OD1-CG 3.32Å; D636-R638 IonicContact OD1-CZ 3.92Å; D636-R638 PolarHBondContact OD1-N 2.64Å; D636-R638 IonicContact OD1-NE 3.87Å; D636-R638 PolarHBondContact OD1-NE 2.82Å; D636-R638 IonicContact OD1-NH2 3.15Å; D636-R638 IonicContact OD2-CZ 3.34Å; D636-R638 VanDerWaalsContact OD2-CZ 3.3Å; D636-R638 IonicContact OD2-NE 2.69Å; D636-R638 PolarHBondContact OD2-NE 3.25Å; D636-R638 VanDerWaalsContact OD2-NE 3.12Å; D636-R638 IonicContact OD2-NH2 2.91Å; D636-R638 PolarHBondContact OD2-NH2 2.76Å
637	C	78	Confident	76.5	Confident	1 Å²	1	53 Å²	53	1%	0.007	29%	0.288	C	S	.	.			trans	-121.1	-2	-176.8	-62.9	0	0	0	0	113.7	V626 N639 L640 I642 C677 L678	V626-C637 VanDerWaalsContact CB-SG 3.52Å; V626-C637 HydrophobicContact CG2-CB 4.06Å; V626-C637 WeakPolarHBondContact CG2-SG 3.42Å; C637-N639 PolarHBondContact O-N 3.32Å; C637-L640 HydrophobicContact CB-CD1 4.3Å; C637-L640 WeakPolarHBondContact O-CB 3.35Å; C637-L640 PolarHBondContact O-N 2.56Å; C637-I642 HydrophobicContact CB-CD1 4.49Å; C637-C677 HydrophobicContact CB-CB 3.89Å; C637-C677 WeakPolarHBondContact CB-SG 3.26Å; C637-C677 PolarHBondContact N-O 2.84Å; C637-C677 WeakPolarHBondContact SG-CB 3.11Å; C637-C677 CovalentContact SG-SG 2.03Å; C637-C677 PolarHBondContact SG-SG 3.24Å; C637-L678 HydrophobicContact CB-CD2 4.04Å
638	R	76	Confident	76.2	Confident	69 Å²	69	54 Å²	54	26%	0.26	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.4	-169	-63.2	172.8	-61.7	132.4	5.1	114.6	H483 D636 F658 L678	H483-R638 PolarHBondContact O-NH2 2.69Å; D636-R638 WeakPolarHBondContact OD1-CB 3.09Å; D636-R638 VanDerWaalsContact OD1-CG 3.28Å; D636-R638 WeakPolarHBondContact OD1-CG 3.32Å; D636-R638 IonicContact OD1-CZ 3.92Å; D636-R638 PolarHBondContact OD1-N 2.64Å; D636-R638 IonicContact OD1-NE 3.87Å; D636-R638 PolarHBondContact OD1-NE 2.82Å; D636-R638 IonicContact OD1-NH2 3.15Å; D636-R638 IonicContact OD2-CZ 3.34Å; D636-R638 VanDerWaalsContact OD2-CZ 3.3Å; D636-R638 IonicContact OD2-NE 2.69Å; D636-R638 PolarHBondContact OD2-NE 3.25Å; D636-R638 VanDerWaalsContact OD2-NE 3.12Å; D636-R638 IonicContact OD2-NH2 2.91Å; D636-R638 PolarHBondContact OD2-NH2 2.76Å; R638-F658 HydrophobicContact CG-CB 4.41Å; R638-L678 HydrophobicContact CG-CB 4.38Å
639	N	63.7	Low	76.1	Confident	103 Å²	103	57.7 Å²	57.7	55%	0.551	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	0.3	-179.1	-130	24.8	0	0	0	113.5	D482 C637	D482-N639 PolarHBondContact OD1-ND2 3.43Å; C637-N639 PolarHBondContact O-N 3.32Å
640	L	74	Confident	75.8	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.089	32%	0.317	C	S	.	.	S	Bend	trans	-80.6	142.9	171	-68.3	172	0	0	0	109.6	P468 P565 V626 C637 I642 Y696	P468-L640 HydrophobicContact CB-CD1 4.35Å; P468-L640 HydrophobicContact CB-CD2 3.76Å; P468-L640 HydrophobicContact CB-CG 4.14Å; P468-L640 HydrophobicContact CG-CD2 4.33Å; P468-L640 HydrophobicContact CG-CG 4.25Å; P565-L640 HydrophobicContact CG-CD2 4.29Å; V626-L640 HydrophobicContact CG1-CD1 4.18Å; V626-L640 HydrophobicContact CG2-CD1 4.42Å; C637-L640 HydrophobicContact CB-CD1 4.3Å; C637-L640 WeakPolarHBondContact O-CB 3.35Å; C637-L640 PolarHBondContact O-N 2.56Å; L640-I642 HydrophobicContact CB-CD1 3.95Å; L640-I642 HydrophobicContact CB-CG1 3.87Å; L640-I642 HydrophobicContact CD1-CD1 4.36Å; L640-I642 PolarHBondContact O-N 2.64Å; L640-Y696 HydrophobicContact CB-CD2 4.38Å; L640-Y696 HydrophobicContact CB-CE2 4.14Å; L640-Y696 HydrophobicContact CD2-CE2 3.92Å
641	N	71.7	Confident	75.6	Confident	130 Å²	130	54.2 Å²	54.2	70%	0.695	30%	0.295	S	S	*	.			trans	-75.6	70.5	176.7	-172.4	28.4	0	0	0	111
642	I	74.9	Confident	75.9	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.036	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	121.4	178.5	-59.6	170.5	0	0	0	108.4	M568 L624 V626 C637 L640 I644 F658 L678 I695 Y696	M568-I642 HydrophobicContact SD-CD1 4.09Å; M568-I642 HydrophobicContact SD-CG1 4.21Å; M568-I642 HydrophobicContact SD-CG2 4.38Å; L624-I642 HydrophobicContact CD2-CD1 4.39Å; L624-I642 HydrophobicContact CD2-CG2 4.13Å; V626-I642 HydrophobicContact CG2-CD1 4.05Å; C637-I642 HydrophobicContact CB-CD1 4.49Å; L640-I642 HydrophobicContact CB-CD1 3.95Å; L640-I642 HydrophobicContact CB-CG1 3.87Å; L640-I642 HydrophobicContact CD1-CD1 4.36Å; L640-I642 PolarHBondContact O-N 2.64Å; I642-I644 HydrophobicContact CG2-CG1 4.41Å; I642-F658 WeakPolarHBondContact O-CZ 3.36Å; I642-L678 HydrophobicContact CD1-CD2 4.03Å; I642-I695 CarbonylContact C-O 3.29Å; I642-I695 WeakPolarHBondContact CA-O 3.48Å; I642-Y696 HydrophobicContact CG1-CD2 4.23Å
643	E	79.5	Confident	76.1	Confident	80 Å²	80	52.9 Å²	52.9	37%	0.374	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	119.3	177.3	169.9	161.8	-116.8	0	0	110.5	R645 A694 I695	E643-R645 VanDerWaalsContact CD-CZ 3.43Å; E643-R645 HydrophobicContact CG-CG 3.96Å; E643-R645 IonicContact OE1-CZ 3.96Å; E643-R645 IonicContact OE1-NE 3.55Å; E643-R645 PolarHBondContact OE1-NE 2.62Å; E643-R645 IonicContact OE1-NH2 2.68Å; E643-R645 PolarHBondContact OE1-NH2 3Å; E643-R645 IonicContact OE2-CZ 3.5Å; E643-R645 VanDerWaalsContact OE2-CZ 3.25Å; E643-R645 IonicContact OE2-NE 3.75Å; E643-R645 PolarHBondContact OE2-NE 2.7Å; E643-R645 IonicContact OE2-NH2 3.97Å; E643-R645 PolarHBondContact OE2-NH2 3.05Å; E643-A694 CarbonylContact O-C 3.47Å; E643-A694 VanDerWaalsContact O-CA 3.3Å; E643-A694 WeakPolarHBondContact O-CA 3.39Å; E643-I695 HydrophobicContact CB-CB 4.4Å; E643-I695 PolarHBondContact N-O 3.1Å; E643-I695 PolarHBondContact O-N 3.47Å
644	I	80.4	Confident	76.2	Confident	26 Å²	26	53.2 Å²	53.2	13%	0.133	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130	172	-53.9	-171.6	0	0	0	109.8	I642 I654 F658 F680 I692 K693 A694	I642-I644 HydrophobicContact CG2-CG1 4.41Å; I644-I654 HydrophobicContact CG2-CD1 3.85Å; I644-F658 HydrophobicContact CD1-CE1 3.69Å; I644-F658 HydrophobicContact CG1-CE1 3.98Å; I644-F658 HydrophobicContact CG1-CZ 4.36Å; I644-F680 HydrophobicContact CD1-CD1 3.53Å; I644-F680 HydrophobicContact CD1-CE1 3.57Å; I644-F680 HydrophobicContact CD1-CG 4.06Å; I644-F680 HydrophobicContact CD1-CZ 4.12Å; I644-F680 HydrophobicContact CG2-CE2 4.18Å; I644-F680 HydrophobicContact CG2-CZ 4.14Å; I644-I692 HydrophobicContact CG2-CG2 3.76Å; I644-K693 CarbonylContact C-O 3.49Å; I644-K693 VanDerWaalsContact CA-O 3.3Å; I644-K693 WeakPolarHBondContact CA-O 3.37Å; I644-A694 HydrophobicContact CG1-CB 4.24Å
645	R	82.5	Confident	75.8	Confident	145 Å²	145	55.6 Å²	55.6	55%	0.547	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	136.3	177	-63.1	-176.1	-178.7	177.1	7.9	111.2	E643 K693	E643-R645 VanDerWaalsContact CD-CZ 3.43Å; E643-R645 HydrophobicContact CG-CG 3.96Å; E643-R645 IonicContact OE1-CZ 3.96Å; E643-R645 IonicContact OE1-NE 3.55Å; E643-R645 PolarHBondContact OE1-NE 2.62Å; E643-R645 IonicContact OE1-NH2 2.68Å; E643-R645 PolarHBondContact OE1-NH2 3Å; E643-R645 IonicContact OE2-CZ 3.5Å; E643-R645 VanDerWaalsContact OE2-CZ 3.25Å; E643-R645 IonicContact OE2-NE 3.75Å; E643-R645 PolarHBondContact OE2-NE 2.7Å; E643-R645 IonicContact OE2-NH2 3.97Å; E643-R645 PolarHBondContact OE2-NH2 3.05Å; R645-K693 PolarHBondContact N-O 2.89Å; R645-K693 PolarHBondContact O-N 2.74Å
646	A	78.3	Confident	75.1	Confident	13 Å²	13	60 Å²	60	11%	0.107	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	145.7	162.1	0	0	0	0	0	109.3	I654	A646-I654 HydrophobicContact CB-CD1 4.31Å
647	V	79.9	Confident	74.3	Confident	78 Å²	78	60.7 Å²	60.7	47%	0.473	32%	0.324	S	S	.	.	S	Bend	trans	-77.6	-40.4	178	176.4	0	0	0	0	110.8	E691 K693	V647-E691 HydrophobicContact CB-CB 3.81Å; V647-E691 HydrophobicContact CG2-CB 3.43Å; V647-E691 VanDerWaalsContact CG2-CB 3.43Å; V647-E691 PolarHBondContact N-O 2.91Å; V647-K693 HydrophobicContact CG2-CD 3.66Å; V647-K693 HydrophobicContact CG2-CG 3.98Å; V647-K693 VanDerWaalsContact CG2-NZ 3.33Å
648	D	77.1	Confident	73.9	Confident	63 Å²	63	64.7 Å²	64.7	34%	0.337	34%	0.341	S	S	.	.	S	Bend	trans	-118.7	106	161.9	-170.3	-8.6	0	0	0	109.8	N650 V651 T690	D648-N650 PolarHBondContact O-N 3.29Å; D648-N650 WeakPolarHBondContact OD1-CB 3.42Å; D648-N650 PolarHBondContact OD1-N 2.79Å; D648-N650 PolarHBondContact OD1-ND2 2.61Å; D648-V651 HydrophobicContact CB-CG2 4.37Å; D648-T690 WeakPolarHBondContact CB-OG1 3.23Å; D648-T690 PolarHBondContact N-OG1 2.96Å; D648-T690 PolarHBondContact O-OG1 2.85Å; D648-T690 VanDerWaalsContact O-OG1 3.05Å
649	S	75.9	Confident	73.4	Confident	79 Å²	79	64 Å²	64	55%	0.552	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-9.4	177.2	-50.5	0	0	0	0	113.7	V652	S649-V652 CarbonylContact C-O 3.54Å; S649-V652 WeakPolarHBondContact CA-O 3.44Å
650	N	73.1	Confident	73.3	Confident	97 Å²	97	61.7 Å²	61.7	52%	0.519	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-36.5	179.6	-56.2	-73.2	0	0	0	111.1	D648 V685 N686	D648-N650 PolarHBondContact O-N 3.29Å; D648-N650 WeakPolarHBondContact OD1-CB 3.42Å; D648-N650 PolarHBondContact OD1-N 2.79Å; D648-N650 PolarHBondContact OD1-ND2 2.61Å; N650-V685 WeakPolarHBondContact O-CB 3.26Å; N650-V685 WeakPolarHBondContact O-CG1 3.18Å; N650-N686 VanDerWaalsContact O-CB 3.27Å; N650-N686 WeakPolarHBondContact O-CB 3.38Å; N650-N686 PolarHBondContact O-N 3.13Å; N650-N686 PolarHBondContact O-ND2 2.84Å
651	V	72.7	Confident	72.7	Confident	7 Å²	7	62.3 Å²	62.3	4%	0.042	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-47.4	172.8	-171.4	0	0	0	0	110	D648 V685 N686 T690	D648-V651 HydrophobicContact CB-CG2 4.37Å; V651-V685 PolarHBondContact O-N 2.56Å; V651-N686 PolarHBondContact O-N 2.69Å; V651-T690 HydrophobicContact CB-CG2 4.28Å
652	V	78.1	Confident	72	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	131.6	-167.4	174.9	0	0	0	0	111.2	S649 V682 I683 T690 V716	S649-V652 CarbonylContact C-O 3.54Å; S649-V652 WeakPolarHBondContact CA-O 3.44Å; V652-V682 HydrophobicContact CG1-CG1 3.14Å; V652-I683 WeakPolarHBondContact CA-O 3.04Å; V652-T690 HydrophobicContact CB-CG2 3.77Å; V652-T690 HydrophobicContact CG2-CG2 3.47Å; V652-T690 VanDerWaalsContact CG2-CG2 3.47Å; V652-V716 HydrophobicContact CG2-CG1 4.33Å
653	K	78.2	Confident	70.8	Confident	111 Å²	111	65.4 Å²	65.4	48%	0.483	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.2	173.2	177.3	174.6	176.7	-175.8	0	109.6	I683 V685	K653-I683 HydrophobicContact CB-CD1 4.4Å; K653-I683 HydrophobicContact CB-CG1 4.01Å; K653-I683 HydrophobicContact CD-CD1 4.44Å; K653-I683 PolarHBondContact N-O 2.96Å; K653-I683 WeakPolarHBondContact O-CG1 2.98Å; K653-I683 PolarHBondContact O-N 3.5Å; K653-V685 HydrophobicContact CB-CG2 3.47Å; K653-V685 VanDerWaalsContact CB-CG2 3.47Å; K653-V685 HydrophobicContact CD-CG2 4.4Å
654	I	76.3	Confident	69.1	Low	41 Å²	41	67.6 Å²	67.6	21%	0.21	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133.2	171.1	-62.4	159.8	0	0	0	107.6	I644 A646 F680	I644-I654 HydrophobicContact CG2-CD1 3.85Å; A646-I654 HydrophobicContact CB-CD1 4.31Å; I654-F680 HydrophobicContact CG2-CD2 4.22Å
655	I	72.8	Confident	66.8	Low	53 Å²	53	72.3 Å²	72.3	27%	0.272	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	127.8	170.3	-51.1	-172.9	0	0	0	107.5	G657 Y681 I683	I655-G657 PolarHBondContact O-N 2.74Å; I655-G657 VanDerWaalsContact O-N 3.09Å; I655-Y681 PolarHBondContact N-O 3.43Å; I655-I683 HydrophobicContact CD1-CG2 3.93Å; I655-I683 HydrophobicContact CG1-CG2 4.2Å
656	P	63.4	Low	64.4	Low	125 Å²	125	69.4 Å²	69.4	81%	0.812	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	109.9	-179.1	26.8	-34	0	0	0	111.4
657	G	54.9	Low	62	Low	30 Å²	30	74.6 Å²	74.6	31%	0.309	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	169.6	128.5	175.1	0	0	0	0	0	112.5	I655 H659	I655-G657 PolarHBondContact O-N 2.74Å; I655-G657 VanDerWaalsContact O-N 3.09Å; G657-H659 PolarHBondContact O-CD2 2.84Å
658	F	67.6	Low	59.6	Low	84 Å²	84	78.4 Å²	78.4	37%	0.368	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	107.4	167.4	-67	-70	0	0	0	108.9	R638 I642 I644 L678	R638-F658 HydrophobicContact CG-CB 4.41Å; I642-F658 WeakPolarHBondContact O-CZ 3.36Å; I644-F658 HydrophobicContact CD1-CE1 3.69Å; I644-F658 HydrophobicContact CG1-CE1 3.98Å; I644-F658 HydrophobicContact CG1-CZ 4.36Å; F658-L678 HydrophobicContact CD1-CD1 3.94Å; F658-L678 HydrophobicContact CD1-CD2 3.83Å; F658-L678 HydrophobicContact CD1-CG 4.46Å; F658-L678 HydrophobicContact CE1-CD1 4.43Å; F658-L678 HydrophobicContact CE1-CD2 4.34Å
659	H	67	Low	57.2	Low	56 Å²	56	85.8 Å²	85.8	26%	0.259	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	157.6	-177.8	-59.9	-97.3	0	0	0	110.4	G657 L678 H679 Y681	G657-H659 PolarHBondContact O-CD2 2.84Å; H659-L678 WeakPolarHBondContact O-CA 2.97Å; H659-H679 WeakPolarHBondContact CB-CD2 3.41Å; H659-H679 VanDerWaalsContact CB-NE2 3.3Å; H659-H679 WeakPolarHBondContact CB-NE2 3.25Å; H659-H679 WeakPolarHBondContact CB-O 3.02Å; H659-H679 PolarHBondContact N-O 2.91Å; H659-H679 PolarHBondContact O-N 3.06Å; H659-Y681 AromaticContact CD2-CD2 3.69Å; H659-Y681 AromaticContact CD2-CE2 3.85Å; H659-Y681 AromaticContact NE2-CD2 3.57Å; H659-Y681 AromaticContact NE2-CE2 3.84Å
660	A	60.7	Low	54.8	Low	54 Å²	54	85.6 Å²	85.6	45%	0.446	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-76.1	149.9	-178.2	0	0	0	0	0	112	H679	A660-H679 PolarHBondContact O-CD2 3.44Å; A660-H679 PolarHBondContact O-NE2 2.91Å
661	P	61.7	Low	52.8	Low	30 Å²	30	88 Å²	88	20%	0.195	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-61.9	151.5	-176.2	26.8	-36.6	0	0	0	113.4	L663 E676	P661-L663 PolarHBondContact O-N 2.78Å; P661-L663 VanDerWaalsContact O-N 3.17Å; P661-E676 VanDerWaalsContact CA-OE1 3.32Å; P661-E676 WeakPolarHBondContact CA-OE1 3.29Å; P661-E676 HydrophobicContact CB-CB 4.48Å; P661-E676 HydrophobicContact CB-CG 3.83Å; P661-E676 VanDerWaalsContact CB-O 3.31Å; P661-E676 WeakPolarHBondContact CB-O 3.06Å; P661-E676 WeakPolarHBondContact CB-OE1 3.49Å
662	R	57.7	Low	50.9	Low	91 Å²	91	95.9 Å²	95.9	34%	0.343	53%	0.527	S	S	.	.			trans	-74.7	99.9	-176.6	-71.6	178.2	167.7	171.4	-1.7	111.7	E573 N664 E676	E573-R662 IonicContact OE1-CZ 3.63Å; E573-R662 IonicContact OE1-NH1 3.16Å; E573-R662 PolarHBondContact OE1-NH1 2.74Å; E573-R662 IonicContact OE2-CZ 3.76Å; E573-R662 IonicContact OE2-NH1 3.78Å; E573-R662 PolarHBondContact OE2-NH1 2.91Å; E573-R662 IonicContact OE2-NH2 3.41Å; R662-N664 VanDerWaalsContact C-N 3.34Å; R662-N664 PolarHBondContact O-N 3.16Å; R662-E676 PolarHBondContact N-OE1 2.88Å
663	L	49	Very low	49.3	Very low	110 Å²	110	101.7 Å²	101.7	58%	0.576	56%	0.557	S	S	*	*			trans	-70.7	88.7	164.8	-74.8	96.4	0	0	0	110.4	P661 S665	P661-L663 PolarHBondContact O-N 2.78Å; P661-L663 VanDerWaalsContact O-N 3.17Å; L663-S665 PolarHBondContact O-N 2.77Å
664	N	43.3	Very low	48.1	Very low	126 Å²	126	99.7 Å²	99.7	67%	0.674	56%	0.558	S	S	*	*			trans	-58	118.4	177.7	-80	-14.8	0	0	0	111.8	R662 S666	R662-N664 VanDerWaalsContact C-N 3.34Å; R662-N664 PolarHBondContact O-N 3.16Å; N664-S666 PolarHBondContact O-N 2.65Å
665	S	32.6	Very low	47.5	Very low	126 Å²	126	101.9 Å²	101.9	88%	0.881	57%	0.57	S	S	*	*			trans	-90.9	60.9	-174	62.5	0	0	0	0	112.8	L663	L663-S665 PolarHBondContact O-N 2.77Å
666	S	31.8	Very low	47.4	Very low	84 Å²	84	100.7 Å²	100.7	59%	0.587	56%	0.563	S	S	*	*			trans	-154.2	136	-179.7	57	0	0	0	0	112.4	N664	N664-S666 PolarHBondContact O-N 2.65Å
667	T	28.4	Very low	48.1	Very low	122 Å²	122	94.8 Å²	94.8	75%	0.748	53%	0.525	S	S	*	.			trans	55.5	114.8	173.5	51.9	0	0	0	0	115.6
668	E	28.8	Very low	49.3	Very low	158 Å²	158	93.4 Å²	93.4	74%	0.738	51%	0.51	S	S	*	.				68.7	114.8	65.1	-162.4	178.2	-159.3	0	0	112
669	Y	26.4	Very low	49.9	Very low	217 Å²	217	90.1 Å²	90.1	85%	0.851	50%	0.496	S	S	*	.	S	Bend	trans	64.3	154.1	-161.5	-58.2	-86	0	0	0	114.4
670	G	26.9	Very low	50.6	Low	75 Å²	75	87.6 Å²	87.6	77%	0.773	48%	0.484	S	S	*	.			trans	-106.1	117.3	-163.7	0	0	0	0	0	114.4
671	L	30.9	Very low	51.6	Low	147 Å²	147	88.3 Å²	88.3	77%	0.77	48%	0.476	S	S	*	.			trans	-162.5	108.6	160.1	-104.1	150.4	0	0	0	108.3	D673	L671-D673 PolarHBondContact O-N 2.98Å; L671-D673 VanDerWaalsContact O-N 3.14Å
672	F	32.5	Very low	52.5	Low	174 Å²	174	86.9 Å²	86.9	76%	0.763	47%	0.467	S	S	*	.			trans	-84.3	75.8	177.5	-77.3	-79.6	0	0	0	110.5
673	D	44.7	Very low	53.7	Low	121 Å²	121	84.8 Å²	84.8	65%	0.647	46%	0.462	S	S	*	.			trans	-86.2	-3	-175.5	-105	-18.1	0	0	0	114.9	L671 N675	L671-D673 PolarHBondContact O-N 2.98Å; L671-D673 VanDerWaalsContact O-N 3.14Å; D673-N675 VanDerWaalsContact C-N 3.3Å; D673-N675 PolarHBondContact O-N 2.99Å; D673-N675 PolarHBondContact O-ND2 2.72Å
674	S	52.4	Low	55	Low	70 Å²	70	79.7 Å²	79.7	49%	0.49	44%	0.436	S	S	.	.			trans	-74	80.5	173	59.8	0	0	0	0	110.7	E676	S674-E676 PolarHBondContact O-N 3.47Å; S674-E676 VanDerWaalsContact O-N 3.09Å
675	N	63.4	Low	56.4	Low	86 Å²	86	76.3 Å²	76.3	46%	0.46	42%	0.42	S	S	.	.			trans	-68.2	-2.9	-175.5	-77.6	-85.3	0	0	0	115	A625 S633 D673	A625-N675 WeakPolarHBondContact CB-O 3.26Å; S633-N675 PolarHBondContact OG-O 3.28Å; D673-N675 VanDerWaalsContact C-N 3.3Å; D673-N675 PolarHBondContact O-N 2.99Å; D673-N675 PolarHBondContact O-ND2 2.72Å
676	E	72.7	Confident	58.2	Low	28 Å²	28	70.8 Å²	70.8	13%	0.131	38%	0.38	C	S	.	.			trans	-71	146.5	179	55.7	164.5	-136.7	0	0	113.6	V571 L624 P661 R662 S674	V571-E676 HydrophobicContact CG2-CB 4.31Å; L624-E676 CarbonylContact O-C 3.26Å; L624-E676 WeakPolarHBondContact O-CA 3.27Å; P661-E676 VanDerWaalsContact CA-OE1 3.32Å; P661-E676 WeakPolarHBondContact CA-OE1 3.29Å; P661-E676 HydrophobicContact CB-CB 4.48Å; P661-E676 HydrophobicContact CB-CG 3.83Å; P661-E676 VanDerWaalsContact CB-O 3.31Å; P661-E676 WeakPolarHBondContact CB-O 3.06Å; P661-E676 WeakPolarHBondContact CB-OE1 3.49Å; R662-E676 PolarHBondContact N-OE1 2.88Å; S674-E676 PolarHBondContact O-N 3.47Å; S674-E676 VanDerWaalsContact O-N 3.09Å
677	C	76.4	Confident	60.2	Low	1 Å²	1	68.3 Å²	68.3	1%	0.007	36%	0.362	C	S	.	.	S	Bend	trans	-126.4	-3.5	178.1	66.7	0	0	0	0	114	L624 V626 M634 C637	L624-C677 PolarHBondContact O-N 3.1Å; V626-C677 PolarHBondContact N-SG 2.95Å; V626-C677 VanDerWaalsContact N-SG 3.4Å; M634-C677 WeakPolarHBondContact O-CB 3.4Å; C637-C677 HydrophobicContact CB-CB 3.89Å; C637-C677 WeakPolarHBondContact CB-SG 3.26Å; C637-C677 PolarHBondContact N-O 2.84Å; C637-C677 WeakPolarHBondContact SG-CB 3.11Å; C637-C677 CovalentContact SG-SG 2.03Å; C637-C677 PolarHBondContact SG-SG 3.24Å
678	L	81	Confident	62.4	Low	1 Å²	1	63.7 Å²	63.7	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	162.1	162.4	65.9	79.2	0	0	0	111.3	L624 C637 R638 I642 F658 H659	L624-L678 HydrophobicContact CB-CD1 3.7Å; L624-L678 HydrophobicContact CB-CG 4.16Å; L624-L678 HydrophobicContact CD2-CD1 4.03Å; L624-L678 HydrophobicContact CD2-CD2 4.43Å; L624-L678 HydrophobicContact CD2-CG 4.32Å; L624-L678 PolarHBondContact N-O 2.86Å; L624-L678 PolarHBondContact O-N 2.72Å; C637-L678 HydrophobicContact CB-CD2 4.04Å; R638-L678 HydrophobicContact CG-CB 4.38Å; I642-L678 HydrophobicContact CD1-CD2 4.03Å; F658-L678 HydrophobicContact CD1-CD1 3.94Å; F658-L678 HydrophobicContact CD1-CD2 3.83Å; F658-L678 HydrophobicContact CD1-CG 4.46Å; F658-L678 HydrophobicContact CE1-CD1 4.43Å; F658-L678 HydrophobicContact CE1-CD2 4.34Å; H659-L678 WeakPolarHBondContact O-CA 2.97Å
679	H	81	Confident	65	Low	16 Å²	16	60.2 Å²	60.2	7%	0.074	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	162.2	169.1	81.3	133.1	0	0	0	112.2	I622 H659 A660	I622-H679 CarbonylContact O-C 3.47Å; I622-H679 VanDerWaalsContact O-CA 3.25Å; I622-H679 WeakPolarHBondContact O-CA 3.28Å; I622-H679 VanDerWaalsContact O-CB 3.32Å; I622-H679 WeakPolarHBondContact O-CB 3.48Å; H659-H679 WeakPolarHBondContact CB-CD2 3.41Å; H659-H679 VanDerWaalsContact CB-NE2 3.3Å; H659-H679 WeakPolarHBondContact CB-NE2 3.25Å; H659-H679 WeakPolarHBondContact CB-O 3.02Å; H659-H679 PolarHBondContact N-O 2.91Å; H659-H679 PolarHBondContact O-N 3.06Å; A660-H679 PolarHBondContact O-CD2 3.44Å; A660-H679 PolarHBondContact O-NE2 2.91Å
680	F	80.5	Confident	67.6	Low	2 Å²	2	50.1 Å²	50.1	1%	0.009	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	162.7	-175.1	63.2	-83.2	0	0	0	113	F570 A621 I622 I644 I654 V682 I692	F570-F680 AromaticContact CE1-CE1 3.87Å; F570-F680 HydrophobicContact CE1-CE1 3.87Å; F570-F680 AromaticContact CE1-CZ 3.92Å; F570-F680 HydrophobicContact CE1-CZ 3.92Å; A621-F680 WeakPolarHBondContact CA-O 3.16Å; I622-F680 HydrophobicContact CB-CD1 4.48Å; I622-F680 HydrophobicContact CB-CE1 3.87Å; I622-F680 HydrophobicContact CB-CE2 4.06Å; I622-F680 HydrophobicContact CB-CZ 3.64Å; I622-F680 HydrophobicContact CD1-CE2 4.19Å; I622-F680 HydrophobicContact CD1-CZ 4.19Å; I622-F680 HydrophobicContact CG1-CZ 4.42Å; I622-F680 HydrophobicContact CG2-CE1 3.88Å; I622-F680 HydrophobicContact CG2-CZ 3.72Å; I622-F680 PolarHBondContact N-O 3.04Å; I622-F680 VanDerWaalsContact O-CD1 3.29Å; I622-F680 WeakPolarHBondContact O-CD1 3.45Å; I622-F680 PolarHBondContact O-N 3.15Å; I644-F680 HydrophobicContact CD1-CD1 3.53Å; I644-F680 HydrophobicContact CD1-CE1 3.57Å; I644-F680 HydrophobicContact CD1-CG 4.06Å; I644-F680 HydrophobicContact CD1-CZ 4.12Å; I644-F680 HydrophobicContact CG2-CE2 4.18Å; I644-F680 HydrophobicContact CG2-CZ 4.14Å; I654-F680 HydrophobicContact CG2-CD2 4.22Å; F680-V682 HydrophobicContact CD2-CG2 3.99Å; F680-V682 HydrophobicContact CE2-CG2 3.89Å; F680-I692 HydrophobicContact CE2-CG2 4.23Å; F680-I692 HydrophobicContact CZ-CG2 4.08Å
681	Y	81.3	Confident	70.3	Confident	69 Å²	69	49.3 Å²	49.3	27%	0.271	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	155.2	-174.6	-70.2	-82.6	0	0	0	114.4	L620 A621 I655 H659	L620-Y681 CarbonylContact O-C 3.56Å; L620-Y681 WeakPolarHBondContact O-CA 3.45Å; A621-Y681 HydrophobicContact CB-CD1 4.03Å; A621-Y681 HydrophobicContact CB-CE1 3.99Å; I655-Y681 PolarHBondContact N-O 3.43Å; H659-Y681 AromaticContact CD2-CD2 3.69Å; H659-Y681 AromaticContact CD2-CE2 3.85Å; H659-Y681 AromaticContact NE2-CD2 3.57Å; H659-Y681 AromaticContact NE2-CE2 3.84Å
682	V	81.6	Confident	72.9	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	132.9	-163.1	-178.3	0	0	0	0	110.3	L620 I622 V652 F680 I692	L620-V682 HydrophobicContact CB-CB 4.2Å; L620-V682 PolarHBondContact N-O 3.29Å; L620-V682 PolarHBondContact O-N 3.34Å; I622-V682 HydrophobicContact CD1-CG2 3.94Å; I622-V682 HydrophobicContact CG1-CG2 4.28Å; V652-V682 HydrophobicContact CG1-CG1 3.14Å; F680-V682 HydrophobicContact CD2-CG2 3.99Å; F680-V682 HydrophobicContact CE2-CG2 3.89Å; V682-I692 HydrophobicContact CG2-CD1 4.41Å
683	I	82.3	Confident	75.3	Confident	47 Å²	47	37.2 Å²	37.2	24%	0.241	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146	177	57.9	168.9	0	0	0	112.9	R619 V652 K653 I655	R619-I683 HydrophobicContact CG-CG2 4.27Å; V652-I683 WeakPolarHBondContact CA-O 3.04Å; K653-I683 HydrophobicContact CB-CD1 4.4Å; K653-I683 HydrophobicContact CB-CG1 4.01Å; K653-I683 HydrophobicContact CD-CD1 4.44Å; K653-I683 PolarHBondContact N-O 2.96Å; K653-I683 WeakPolarHBondContact O-CG1 2.98Å; K653-I683 PolarHBondContact O-N 3.5Å; I655-I683 HydrophobicContact CD1-CG2 3.93Å; I655-I683 HydrophobicContact CG1-CG2 4.2Å
684	G	75.8	Confident	77.1	Confident	3 Å²	3	31.4 Å²	31.4	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	124.6	171.8	0	0	0	0	0	111.6
685	V	72.9	Confident	78.5	Confident	55 Å²	55	30.5 Å²	30.5	33%	0.333	16%	0.156	S	C	.	.			trans	-102.9	-52.6	177.4	173.3	0	0	0	0	109.9	N650 V651 K653	N650-V685 WeakPolarHBondContact O-CB 3.26Å; N650-V685 WeakPolarHBondContact O-CG1 3.18Å; V651-V685 PolarHBondContact O-N 2.56Å; K653-V685 HydrophobicContact CB-CG2 3.47Å; K653-V685 VanDerWaalsContact CB-CG2 3.47Å; K653-V685 HydrophobicContact CD-CG2 4.4Å
686	N	71.7	Confident	79.3	Confident	10 Å²	10	27.5 Å²	27.5	5%	0.053	14%	0.139	C	C	.	.	S	Bend	trans	-114	168	172.3	-62.5	-22.1	0	0	0	110.3	I579 N650 V651 A718 Q808	I579-N686 WeakPolarHBondContact CD1-O 3.41Å; N650-N686 VanDerWaalsContact O-CB 3.27Å; N650-N686 WeakPolarHBondContact O-CB 3.38Å; N650-N686 PolarHBondContact O-N 3.13Å; N650-N686 PolarHBondContact O-ND2 2.84Å; V651-N686 PolarHBondContact O-N 2.69Å; N686-A718 WeakPolarHBondContact O-CB 3.27Å; N686-Q808 VanDerWaalsContact ND2-CD 3.34Å; N686-Q808 WeakPolarHBondContact ND2-CG 3.38Å; N686-Q808 PolarHBondContact ND2-NE2 3.38Å; N686-Q808 PolarHBondContact OD1-NE2 3.05Å; N686-Q808 PolarHBondContact OD1-OE1 2.94Å; N686-Q808 VanDerWaalsContact OD1-OE1 3.08Å
687	V	71.8	Confident	79.1	Confident	33 Å²	33	30.1 Å²	30.1	20%	0.2	15%	0.154	C	C	.	.	S	Bend	trans	-66.5	155	160.3	175.4	0	0	0	0	107.5	I579 A718 R720 E810	I579-V687 HydrophobicContact CD1-CB 4.38Å; I579-V687 HydrophobicContact CD1-CG2 3.58Å; V687-A718 WeakPolarHBondContact CA-O 3.48Å; V687-R720 HydrophobicContact CG2-CG 3.93Å; V687-E810 VanDerWaalsContact C-OE2 3.28Å; V687-E810 WeakPolarHBondContact CB-OE2 2.89Å; V687-E810 WeakPolarHBondContact CG1-OE2 3.46Å
688	G	76.6	Confident	78.3	Confident	24 Å²	24	32.1 Å²	32.1	25%	0.247	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	135.9	-161.9	177.6	0	0	0	0	0	114.5	A717 A718	G688-A717 VanDerWaalsContact O-CA 3.28Å; G688-A717 WeakPolarHBondContact O-CA 3.12Å; G688-A717 WeakPolarHBondContact O-CB 3.28Å; G688-A718 PolarHBondContact O-N 3.18Å; G688-A718 VanDerWaalsContact O-N 3.13Å
689	F	82	Confident	77.1	Confident	85 Å²	85	35.5 Å²	35.5	37%	0.373	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	143.3	-175	165.4	-90.9	0	0	0	110.4	H715 V716 A717 P752	F689-H715 HydrophobicContact CE2-CB 3.97Å; F689-H715 HydrophobicContact CZ-CB 4.1Å; F689-H715 AromaticContact CZ-CG 3.92Å; F689-H715 AromaticContact CZ-ND1 3.56Å; F689-V716 WeakPolarHBondContact CA-O 3.12Å; F689-A717 HydrophobicContact CB-CB 4.44Å; F689-A717 HydrophobicContact CD2-CB 4.4Å; F689-P752 HydrophobicContact CB-CG 4.49Å
690	T	81.9	Confident	75.6	Confident	6 Å²	6	39.4 Å²	39.4	4%	0.037	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	169.1	-173.5	-165.4	0	0	0	0	114.2	D648 V651 V652 H715 V716	D648-T690 WeakPolarHBondContact CB-OG1 3.23Å; D648-T690 PolarHBondContact N-OG1 2.96Å; D648-T690 PolarHBondContact O-OG1 2.85Å; D648-T690 VanDerWaalsContact O-OG1 3.05Å; V651-T690 HydrophobicContact CB-CG2 4.28Å; V652-T690 HydrophobicContact CB-CG2 3.77Å; V652-T690 HydrophobicContact CG2-CG2 3.47Å; V652-T690 VanDerWaalsContact CG2-CG2 3.47Å; T690-H715 WeakPolarHBondContact O-CA 3.38Å; T690-V716 PolarHBondContact N-O 3.45Å; T690-V716 PolarHBondContact O-N 2.8Å
691	E	83.6	Confident	73.9	Confident	57 Å²	57	45.1 Å²	45.1	27%	0.266	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	153	172.7	-89.8	-177.4	-155.3	0	0	111.3	V647 K693 V714 H715	V647-E691 HydrophobicContact CB-CB 3.81Å; V647-E691 HydrophobicContact CG2-CB 3.43Å; V647-E691 VanDerWaalsContact CG2-CB 3.43Å; V647-E691 PolarHBondContact N-O 2.91Å; E691-K693 IonicContact OE2-NZ 2.69Å; E691-V714 CarbonylContact C-O 3.56Å; E691-V714 VanDerWaalsContact CA-O 3.31Å; E691-V714 WeakPolarHBondContact CA-O 3.43Å; E691-H715 WeakPolarHBondContact CG-ND1 3.4Å; E691-H715 IonicContact OE1-CE1 2.72Å
692	I	84.1	Confident	71.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.2	171.6	-59.1	171.3	0	0	0	109.3	F570 I622 I644 F680 V682 R713 V714 V716	F570-I692 HydrophobicContact CZ-CG2 4.49Å; I622-I692 HydrophobicContact CD1-CD1 3.63Å; I644-I692 HydrophobicContact CG2-CG2 3.76Å; F680-I692 HydrophobicContact CE2-CG2 4.23Å; F680-I692 HydrophobicContact CZ-CG2 4.08Å; V682-I692 HydrophobicContact CG2-CD1 4.41Å; I692-R713 CarbonylContact O-C 3.6Å; I692-R713 VanDerWaalsContact O-CA 3.24Å; I692-R713 WeakPolarHBondContact O-CA 3.36Å; I692-V714 HydrophobicContact CB-CG1 3.96Å; I692-V714 PolarHBondContact N-O 2.66Å; I692-V714 PolarHBondContact O-N 3.4Å; I692-V716 HydrophobicContact CD1-CG2 3.9Å
693	K	84.5	Confident	69.7	Low	67 Å²	67	58.3 Å²	58.3	29%	0.291	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.9	-176.6	-67.5	173.7	177.4	157.6	0	111.4	I644 R645 V647 E691 S712 R713	I644-K693 CarbonylContact C-O 3.49Å; I644-K693 VanDerWaalsContact CA-O 3.3Å; I644-K693 WeakPolarHBondContact CA-O 3.37Å; R645-K693 PolarHBondContact N-O 2.89Å; R645-K693 PolarHBondContact O-N 2.74Å; V647-K693 HydrophobicContact CG2-CD 3.66Å; V647-K693 HydrophobicContact CG2-CG 3.98Å; V647-K693 VanDerWaalsContact CG2-NZ 3.33Å; E691-K693 IonicContact OE2-NZ 2.69Å; K693-S712 WeakPolarHBondContact CA-O 3.12Å; K693-R713 HydrophobicContact CG-CG 4.2Å
694	A	82.6	Confident	67.6	Low	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.2	172.8	0	0	0	0	0	111.1	F570 L624 E643 I644 V711 S712	F570-A694 HydrophobicContact CE2-CB 4.27Å; F570-A694 HydrophobicContact CZ-CB 4.12Å; L624-A694 HydrophobicContact CD1-CB 4.25Å; L624-A694 HydrophobicContact CD2-CB 4.43Å; E643-A694 CarbonylContact O-C 3.47Å; E643-A694 VanDerWaalsContact O-CA 3.3Å; E643-A694 WeakPolarHBondContact O-CA 3.39Å; I644-A694 HydrophobicContact CG1-CB 4.24Å; A694-V711 VanDerWaalsContact O-CA 3.26Å; A694-V711 WeakPolarHBondContact O-CA 3.27Å; A694-S712 PolarHBondContact N-O 3.22Å; A694-S712 VanDerWaalsContact N-O 3.1Å; A694-S712 PolarHBondContact O-N 2.68Å
695	I	81.9	Confident	65.9	Low	50 Å²	50	71.4 Å²	71.4	26%	0.256	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.1	-172.4	-51.7	175.1	0	0	0	110.8	I642 E643 L709 I710 V711	I642-I695 CarbonylContact C-O 3.29Å; I642-I695 WeakPolarHBondContact CA-O 3.48Å; E643-I695 HydrophobicContact CB-CB 4.4Å; E643-I695 PolarHBondContact N-O 3.1Å; E643-I695 PolarHBondContact O-N 3.47Å; I695-L709 HydrophobicContact CG2-CD2 4.08Å; I695-I710 CarbonylContact C-O 3.58Å; I695-I710 WeakPolarHBondContact CA-O 3.46Å; I695-V711 HydrophobicContact CG2-CG2 4.43Å
696	Y	78.6	Confident	64.7	Low	24 Å²	24	77.3 Å²	77.3	9%	0.094	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144.5	171.5	172.4	-102.1	0	0	0	112.3	P565 L640 I642 P698 I710	P565-Y696 HydrophobicContact CG-CE1 3.93Å; L640-Y696 HydrophobicContact CB-CD2 4.38Å; L640-Y696 HydrophobicContact CB-CE2 4.14Å; L640-Y696 HydrophobicContact CD2-CE2 3.92Å; I642-Y696 HydrophobicContact CG1-CD2 4.23Å; Y696-P698 HydrophobicContact CE1-CB 3.94Å; Y696-I710 HydrophobicContact CD1-CD1 3.95Å; Y696-I710 HydrophobicContact CD1-CG1 4.43Å; Y696-I710 PolarHBondContact N-O 3.29Å; Y696-I710 PolarHBondContact O-N 2.95Å
697	N	69	Low	63.6	Low	83 Å²	83	81.1 Å²	81.1	44%	0.444	43%	0.431	S	S	.	.			trans	-131.1	119.5	177.6	174.7	5.2	0	0	0	111.1	S699 L709	N697-S699 PolarHBondContact OD1-N 3.14Å; N697-S699 PolarHBondContact OD1-O 3.17Å; N697-L709 HydrophobicContact CB-CD2 4.4Å
698	P	60.6	Low	63	Low	42 Å²	42	83.6 Å²	83.6	27%	0.273	45%	0.446	S	S	.	.	S	Bend	trans	-83	-6.5	-177.2	32.6	-35.1	0	0	0	116.1	Y696 V708	Y696-P698 HydrophobicContact CE1-CB 3.94Å; P698-V708 WeakPolarHBondContact CD-O 3.48Å; P698-V708 HydrophobicContact CG-CB 4.27Å; P698-V708 HydrophobicContact CG-CG1 3.76Å
699	S	55.7	Low	62.5	Low	72 Å²	72	87.1 Å²	87.1	50%	0.503	46%	0.458	S	S	.	.			trans	-125.3	107.6	-175.6	-90.4	0	0	0	0	113.2	N697 V701	N697-S699 PolarHBondContact OD1-N 3.14Å; N697-S699 PolarHBondContact OD1-O 3.17Å; S699-V701 VanDerWaalsContact C-N 3.34Å
700	P	48.6	Very low	62.1	Low	99 Å²	99	84.6 Å²	84.6	64%	0.643	45%	0.448	S	S	*	.	S	Bend	trans	-79.9	-10.5	175.5	28.7	-30.8	0	0	0	114.3
701	V	44	Very low	61.9	Low	122 Å²	122	88 Å²	88	74%	0.739	47%	0.469	S	S	*	.	S	Bend	trans	-134	61	-171.6	-164.4	0	0	0	0	112.8	S699	S699-V701 VanDerWaalsContact C-N 3.34Å
702	N	38.1	Very low	61.9	Low	152 Å²	152	86.5 Å²	86.5	81%	0.813	47%	0.465	S	S	*	.			trans	-170.6	149.6	143.9	-102.2	-35.8	0	0	0	111
703	K	38.3	Very low	61.9	Low	194 Å²	194	93.7 Å²	93.7	84%	0.843	49%	0.492	S	S	*	.	S	Bend	trans	-101.9	16.8	-168.8	-142.1	176.6	-173.1	178.3	0	114.6
704	F	37.4	Very low	61.8	Low	193 Å²	193	91.3 Å²	91.3	85%	0.846	48%	0.483	S	S	*	.			trans	-147.6	46.4	-162	-78.2	-73.2	0	0	0	114.8
705	D	40.7	Very low	61.9	Low	131 Å²	131	96.1 Å²	96.1	70%	0.701	51%	0.505	S	S	*	.			trans	-152.4	112.2	156.5	-142.9	-39.1	0	0	0	110.8	S707	D705-S707 VanDerWaalsContact CG-OG 3.26Å; D705-S707 PolarHBondContact O-N 2.84Å; D705-S707 VanDerWaalsContact OD1-CB 3.26Å; D705-S707 WeakPolarHBondContact OD1-CB 3.37Å; D705-S707 PolarHBondContact OD1-N 3.1Å; D705-S707 PolarHBondContact OD1-OG 2.66Å
706	E	48	Very low	62	Low	179 Å²	179	93.8 Å²	93.8	84%	0.836	49%	0.493	S	S	*	.			trans	-81.6	-3	178.3	-68.5	-172.7	131.8	0	0	112.5	V708	E706-V708 VanDerWaalsContact C-N 3.34Å; E706-V708 PolarHBondContact O-N 3.49Å
707	S	48.3	Very low	62.2	Low	91 Å²	91	92.7 Å²	92.7	64%	0.636	49%	0.489	S	S	*	.	S	Bend	trans	-77.3	-5	-165.8	61.3	0	0	0	0	116.5	D705	D705-S707 VanDerWaalsContact CG-OG 3.26Å; D705-S707 PolarHBondContact O-N 2.84Å; D705-S707 VanDerWaalsContact OD1-CB 3.26Å; D705-S707 WeakPolarHBondContact OD1-CB 3.37Å; D705-S707 PolarHBondContact OD1-N 3.1Å; D705-S707 PolarHBondContact OD1-OG 2.66Å
708	V	58.2	Low	62.9	Low	85 Å²	85	88.8 Å²	88.8	52%	0.515	47%	0.468	S	S	.	.			trans	-131.3	54.6	-173.2	-156.8	0	0	0	0	112.8	P698 E706	P698-V708 WeakPolarHBondContact CD-O 3.48Å; P698-V708 HydrophobicContact CG-CB 4.27Å; P698-V708 HydrophobicContact CG-CG1 3.76Å; E706-V708 VanDerWaalsContact C-N 3.34Å; E706-V708 PolarHBondContact O-N 3.49Å
709	L	65.5	Low	63.9	Low	98 Å²	98	87.2 Å²	87.2	51%	0.513	46%	0.457	S	S	.	.			trans	-109.3	131.6	173.7	-82.4	161.1	0	0	0	111.2	I695 N697	I695-L709 HydrophobicContact CG2-CD2 4.08Å; N697-L709 HydrophobicContact CB-CD2 4.4Å
710	I	73.7	Confident	64.9	Low	31 Å²	31	86.1 Å²	86.1	16%	0.159	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.8	179.3	-44.4	176.1	0	0	0	109.6	S566 M568 I695 Y696	S566-I710 WeakPolarHBondContact O-CD1 3.31Å; M568-I710 HydrophobicContact CB-CG2 3.91Å; M568-I710 HydrophobicContact CE-CB 4.1Å; M568-I710 HydrophobicContact CE-CG2 4.08Å; M568-I710 VanDerWaalsContact CE-O 3.26Å; M568-I710 WeakPolarHBondContact CE-O 3.21Å; M568-I710 HydrophobicContact CG-CB 4.46Å; M568-I710 HydrophobicContact CG-CG2 3.73Å; I695-I710 CarbonylContact C-O 3.58Å; I695-I710 WeakPolarHBondContact CA-O 3.46Å; Y696-I710 HydrophobicContact CD1-CD1 3.95Å; Y696-I710 HydrophobicContact CD1-CG1 4.43Å; Y696-I710 PolarHBondContact N-O 3.29Å; Y696-I710 PolarHBondContact O-N 2.95Å
711	V	79.2	Confident	66.2	Low	77 Å²	77	85.7 Å²	85.7	47%	0.467	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	144.4	-165.5	-176.3	0	0	0	0	113.9	A694 I695	A694-V711 VanDerWaalsContact O-CA 3.26Å; A694-V711 WeakPolarHBondContact O-CA 3.27Å; I695-V711 HydrophobicContact CG2-CG2 4.43Å
712	S	82.6	Confident	67.7	Low	26 Å²	26	81.2 Å²	81.2	18%	0.182	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	168.4	176.3	-146.6	0	0	0	0	114.6	K693 A694	K693-S712 WeakPolarHBondContact CA-O 3.12Å; A694-S712 PolarHBondContact N-O 3.22Å; A694-S712 VanDerWaalsContact N-O 3.1Å; A694-S712 PolarHBondContact O-N 2.68Å
713	R	84.7	Confident	69.6	Low	152 Å²	152	78.1 Å²	78.1	57%	0.574	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.7	156.9	-175.1	-45.7	-169.9	-170.7	174.3	8.1	118	F570 I692 K693	F570-R713 WeakPolarHBondContact CD2-O 3.22Å; I692-R713 CarbonylContact O-C 3.6Å; I692-R713 VanDerWaalsContact O-CA 3.24Å; I692-R713 WeakPolarHBondContact O-CA 3.36Å; K693-R713 HydrophobicContact CG-CG 4.2Å
714	V	82.9	Confident	71.2	Confident	17 Å²	17	70.1 Å²	70.1	10%	0.103	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	172.8	173	68.9	0	0	0	0	114.3	F570 Y572 I622 E691 I692	F570-V714 HydrophobicContact CD1-CG1 4.27Å; F570-V714 HydrophobicContact CE1-CG1 4.09Å; F570-V714 HydrophobicContact CE2-CG1 4.43Å; F570-V714 HydrophobicContact CZ-CG1 4.18Å; Y572-V714 HydrophobicContact CD1-CG2 4.38Å; Y572-V714 HydrophobicContact CE1-CG2 4.03Å; I622-V714 HydrophobicContact CD1-CG1 4.33Å; I622-V714 HydrophobicContact CG2-CG1 4.37Å; E691-V714 CarbonylContact C-O 3.56Å; E691-V714 VanDerWaalsContact CA-O 3.31Å; E691-V714 WeakPolarHBondContact CA-O 3.43Å; I692-V714 HydrophobicContact CB-CG1 3.96Å; I692-V714 PolarHBondContact N-O 2.66Å; I692-V714 PolarHBondContact O-N 3.4Å
715	H	84.7	Confident	72.7	Confident	100 Å²	100	63.3 Å²	63.3	46%	0.463	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.4	-175.1	-62.3	-68.4	0	0	0	115.8	F689 T690 E691	F689-H715 HydrophobicContact CE2-CB 3.97Å; F689-H715 HydrophobicContact CZ-CB 4.1Å; F689-H715 AromaticContact CZ-CG 3.92Å; F689-H715 AromaticContact CZ-ND1 3.56Å; T690-H715 WeakPolarHBondContact O-CA 3.38Å; E691-H715 WeakPolarHBondContact CG-ND1 3.4Å; E691-H715 IonicContact OE1-CE1 2.72Å
716	V	82.8	Confident	73.7	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	155.8	-179	-176.9	0	0	0	0	113.7	L620 I622 V652 F689 T690 I692	L620-V716 HydrophobicContact CD2-CG1 3.73Å; L620-V716 HydrophobicContact CD2-CG2 4.16Å; I622-V716 HydrophobicContact CD1-CG2 4.13Å; V652-V716 HydrophobicContact CG2-CG1 4.33Å; F689-V716 WeakPolarHBondContact CA-O 3.12Å; T690-V716 PolarHBondContact N-O 3.45Å; T690-V716 PolarHBondContact O-N 2.8Å; I692-V716 HydrophobicContact CD1-CG2 3.9Å
717	A	82.9	Confident	74.4	Confident	1 Å²	1	51 Å²	51	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	163	174.8	0	0	0	0	0	116.3	N575 E576 V577 G688 F689 W751	N575-A717 PolarHBondContact O-N 3.05Å; N575-A717 VanDerWaalsContact O-N 3.07Å; E576-A717 WeakPolarHBondContact CA-O 3.48Å; V577-A717 PolarHBondContact N-O 3.33Å; V577-A717 VanDerWaalsContact N-O 3.1Å; G688-A717 VanDerWaalsContact O-CA 3.28Å; G688-A717 WeakPolarHBondContact O-CA 3.12Å; G688-A717 WeakPolarHBondContact O-CB 3.28Å; F689-A717 HydrophobicContact CB-CB 4.44Å; F689-A717 HydrophobicContact CD2-CB 4.4Å; A717-W751 HydrophobicContact CB-CZ3 3.97Å
718	A	83.3	Confident	75.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	150.3	-172.6	0	0	0	0	0	118.3	V577 I579 N686 V687 G688	V577-A718 HydrophobicContact CG1-CB 3.8Å; V577-A718 VanDerWaalsContact O-CA 3.26Å; V577-A718 WeakPolarHBondContact O-CA 3.38Å; I579-A718 HydrophobicContact CD1-CB 4.3Å; I579-A718 HydrophobicContact CG1-CB 4.15Å; N686-A718 WeakPolarHBondContact O-CB 3.27Å; V687-A718 WeakPolarHBondContact CA-O 3.48Å; G688-A718 PolarHBondContact O-N 3.18Å; G688-A718 VanDerWaalsContact O-N 3.13Å
719	Y	82.6	Confident	75.7	Confident	9 Å²	9	51.2 Å²	51.2	4%	0.035	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	173.8	-174.5	-49.6	-55.5	0	0	0	117	E576 V577 I579 Q749 M846	E576-Y719 HydrophobicContact CB-CE2 4.44Å; E576-Y719 HydrophobicContact CG-CE2 4.13Å; E576-Y719 VanDerWaalsContact OE1-CE2 3.23Å; E576-Y719 WeakPolarHBondContact OE1-CE2 3.44Å; E576-Y719 PolarHBondContact OE1-OH 2.9Å; V577-Y719 PolarHBondContact O-N 2.99Å; V577-Y719 VanDerWaalsContact O-N 3.09Å; I579-Y719 WeakPolarHBondContact CB-O 3.48Å; I579-Y719 WeakPolarHBondContact CD1-O 3.25Å; I579-Y719 VanDerWaalsContact CG1-O 3.27Å; I579-Y719 WeakPolarHBondContact CG1-O 3.34Å; I579-Y719 PolarHBondContact N-O 3.47Å; Y719-Q749 HydrophobicContact CD1-CB 4.08Å; Y719-Q749 HydrophobicContact CD1-CG 4.33Å; Y719-Q749 HydrophobicContact CE1-CB 3.9Å; Y719-M846 HydrophobicContact CD2-SD 4.1Å
720	R	77.1	Confident	75.9	Confident	49 Å²	49	52 Å²	52	19%	0.185	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.8	-178.9	-63.2	-171.5	-177	179.2	8.2	115.2	I579 V687 H746 G747 Q808	I579-R720 HydrophobicContact CB-CG 4.25Å; I579-R720 HydrophobicContact CD1-CG 3.81Å; V687-R720 HydrophobicContact CG2-CG 3.93Å; R720-H746 HydrophobicContact CB-CB 4.18Å; R720-G747 WeakPolarHBondContact O-CA 3.4Å; R720-G747 PolarHBondContact O-N 3.24Å; R720-Q808 PolarHBondContact NH2-O 3.49Å
721	K	74.6	Confident	76.1	Confident	91 Å²	91	53.5 Å²	53.5	40%	0.396	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	152	171.5	-71.9	-174.4	173.4	-177.9	0	113.6	L578 E614 H746	L578-K721 HydrophobicContact CD2-CG 4.12Å; E614-K721 IonicContact OE1-NZ 3.88Å; E614-K721 PolarHBondContact OE1-NZ 3.27Å; K721-H746 WeakPolarHBondContact O-CB 3.26Å
722	I	76.9	Confident	76.1	Confident	28 Å²	28	50 Å²	50	14%	0.144	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	144.4	-178.1	-57	174.8	0	0	0	111.8	V744 I834 L848	I722-V744 HydrophobicContact CG2-CG1 4Å; I722-I834 HydrophobicContact CD1-CD1 3.98Å; I722-I834 HydrophobicContact CD1-CG1 4.09Å; I722-I834 HydrophobicContact CG1-CD1 4.1Å; I722-L848 HydrophobicContact CD1-CB 3.88Å; I722-L848 HydrophobicContact CG1-CB 4.28Å; I722-L848 HydrophobicContact CG1-CD1 4.49Å
723	N	77.3	Confident	76.2	Confident	87 Å²	87	50.1 Å²	50.1	47%	0.465	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	136.8	-177.7	-176.9	72.2	0	0	0	114.4	T745	N723-T745 PolarHBondContact N-O 2.95Å; N723-T745 PolarHBondContact O-N 3.38Å; N723-T745 PolarHBondContact O-OG1 3.14Å
724	F	71.1	Confident	76.1	Confident	26 Å²	26	43 Å²	43	11%	0.114	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	148	172	-64.4	-86.1	0	0	0	112.2	E730 V744 K851 F852	F724-E730 HydrophobicContact CD2-CG 4.36Å; F724-E730 HydrophobicContact CE2-CG 4.3Å; F724-V744 HydrophobicContact CD1-CG2 3.74Å; F724-V744 HydrophobicContact CE1-CG2 3.87Å; F724-K851 WeakPolarHBondContact CE2-O 3.03Å; F724-K851 VanDerWaalsContact CZ-O 3.24Å; F724-K851 WeakPolarHBondContact CZ-O 3.22Å; F724-F852 HydrophobicContact CE1-CB 4.1Å; F724-F852 HydrophobicContact CE1-CD1 4.02Å; F724-F852 HydrophobicContact CE1-CG 4.28Å; F724-F852 HydrophobicContact CZ-CB 3.89Å; F724-F852 HydrophobicContact CZ-CD1 4.07Å; F724-F852 HydrophobicContact CZ-CG 4.37Å
725	I	69.8	Low	76	Confident	50 Å²	50	42.7 Å²	42.7	26%	0.256	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	-42.5	-174.7	-76.5	-163.1	0	0	0	114.2	L743 T745 L815 R967	I725-L743 HydrophobicContact CB-CB 4.2Å; I725-L743 HydrophobicContact CG2-CB 4.34Å; I725-L743 PolarHBondContact N-O 3.07Å; I725-T745 HydrophobicContact CD1-CG2 3.35Å; I725-T745 HydrophobicContact CG1-CG2 4.12Å; I725-L815 HydrophobicContact CD1-CD2 4.26Å; I725-R967 PolarHBondContact O-NH1 3.2Å; I725-R967 PolarHBondContact O-NH2 2.64Å
726	D	62	Low	75.9	Confident	45 Å²	45	39.3 Å²	39.3	24%	0.241	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	121.6	173.1	-174.2	40.1	0	0	0	107.3	R740 M742 L743	D726-R740 IonicContact OD1-CZ 3.83Å; D726-R740 IonicContact OD1-NH1 3.74Å; D726-R740 PolarHBondContact OD1-NH1 3.47Å; D726-R740 IonicContact OD1-NH2 3.62Å; D726-R740 PolarHBondContact OD1-NH2 3.19Å; D726-R740 IonicContact OD2-CZ 3.12Å; D726-R740 IonicContact OD2-NH1 2.97Å; D726-R740 PolarHBondContact OD2-NH1 3.21Å; D726-R740 IonicContact OD2-NH2 3.71Å; D726-M742 CarbonylContact O-C 3.36Å; D726-M742 WeakPolarHBondContact O-CA 3.37Å; D726-L743 PolarHBondContact O-N 3.28Å
727	P	62.5	Low	75.7	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.032	22%	0.222	C	C	.	.	S	Bend	cis	-57.8	160.2	-9.8	30.2	-36.7	0	0	0	112.6	T732 M742	P727-T732 HydrophobicContact CB-CG2 4.28Å; P727-T732 WeakPolarHBondContact CB-OG1 3.41Å; P727-T732 WeakPolarHBondContact CG-OG1 3.25Å; P727-M742 WeakPolarHBondContact CD-SD 3.15Å; P727-M742 HydrophobicContact CG-CE 4.48Å; P727-M742 HydrophobicContact CG-SD 3.8Å
728	V	65.8	Low	75.5	Confident	117 Å²	117	40.5 Å²	40.5	71%	0.709	22%	0.223	S	C	*	.	S	Bend	trans	-87.4	-15.2	178.2	-176	0	0	0	0	111.7
729	S	67.4	Low	75.4	Confident	65 Å²	65	43.6 Å²	43.6	46%	0.455	24%	0.242	S	C	.	.	S	Bend	trans	-103	145.9	177.2	175.7	0	0	0	0	110	V731	S729-V731 WeakPolarHBondContact CB-O 3.46Å; S729-V731 PolarHBondContact O-N 2.86Å; S729-V731 PolarHBondContact OG-N 2.7Å; S729-V731 VanDerWaalsContact OG-N 3.09Å; S729-V731 PolarHBondContact OG-O 3.48Å
730	E	70.6	Confident	75.3	Confident	114 Å²	114	45.2 Å²	45.2	53%	0.533	25%	0.248	S	C	.	.	S	Bend	trans	-71.3	-3.1	170.4	-67.6	171.5	-170.7	0	0	112.4	F724 T853	F724-E730 HydrophobicContact CD2-CG 4.36Å; F724-E730 HydrophobicContact CE2-CG 4.3Å; E730-T853 WeakPolarHBondContact O-CA 3.26Å; E730-T853 WeakPolarHBondContact O-CB 3.11Å; E730-T853 PolarHBondContact O-N 2.99Å
731	V	77.8	Confident	75.3	Confident	62 Å²	62	47 Å²	47	38%	0.376	26%	0.262	S	S	.	.	S	Bend	trans	-134.6	131.7	175.9	-172.6	0	0	0	0	109.6	S729 M855	S729-V731 WeakPolarHBondContact CB-O 3.46Å; S729-V731 PolarHBondContact O-N 2.86Å; S729-V731 PolarHBondContact OG-N 2.7Å; S729-V731 VanDerWaalsContact OG-N 3.09Å; S729-V731 PolarHBondContact OG-O 3.48Å; V731-M855 HydrophobicContact CG1-CG 3.94Å; V731-M855 HydrophobicContact CG1-SD 3.52Å; V731-M855 VanDerWaalsContact CG1-SD 3.52Å
732	T	79.8	Confident	75.5	Confident	3 Å²	3	43 Å²	43	2%	0.018	24%	0.244	C	C	.	.			trans	-137.6	126.3	-173.8	-56.7	0	0	0	0	113.5	P727 V734 R740 M855 E918	P727-T732 HydrophobicContact CB-CG2 4.28Å; P727-T732 WeakPolarHBondContact CB-OG1 3.41Å; P727-T732 WeakPolarHBondContact CG-OG1 3.25Å; T732-V734 HydrophobicContact CG2-CG2 4.28Å; T732-R740 HydrophobicContact CG2-CG 4.38Å; T732-M855 PolarHBondContact O-N 3.39Å; T732-E918 WeakPolarHBondContact CG2-OE2 3.35Å
733	P	83.1	Confident	75.5	Confident	29 Å²	29	44 Å²	44	19%	0.188	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	135.3	175.4	35.7	-32.2	0	0	0	113.4	Q915	P733-Q915 HydrophobicContact CB-CG 4.47Å
734	V	83	Confident	75.4	Confident	3 Å²	3	40 Å²	40	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.9	-175.7	-178.5	0	0	0	0	110.9	T732 R740 M855 C856 D857	T732-V734 HydrophobicContact CG2-CG2 4.28Å; V734-R740 HydrophobicContact CG2-CB 4.31Å; V734-M855 PolarHBondContact N-O 2.76Å; V734-C856 CarbonylContact O-C 3.58Å; V734-C856 VanDerWaalsContact O-CA 3.24Å; V734-C856 WeakPolarHBondContact O-CA 3.31Å; V734-D857 PolarHBondContact O-N 3.19Å
735	A	81.7	Confident	75.7	Confident	11 Å²	11	39 Å²	39	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	148	175.9	0	0	0	0	0	112.5	G737 S738 D857 S919	A735-G737 PolarHBondContact O-N 3.07Å; A735-G737 VanDerWaalsContact O-N 3.11Å; A735-S738 WeakPolarHBondContact O-CB 3.48Å; A735-S738 PolarHBondContact O-N 2.94Å; A735-D857 CarbonylContact C-O 3.37Å; A735-D857 VanDerWaalsContact CA-O 3.29Å; A735-D857 WeakPolarHBondContact CA-O 2.81Å; A735-S919 WeakPolarHBondContact CB-O 2.98Å
736	I	83	Confident	75.9	Confident	28 Å²	28	39.4 Å²	39.4	14%	0.144	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	118.1	176.8	-67	-179.3	0	0	0	110.9	I825 D857 V858 Y1002	I736-I825 HydrophobicContact CD1-CD1 3.84Å; I736-I825 HydrophobicContact CD1-CG1 3.67Å; I736-I825 HydrophobicContact CG1-CG1 4.41Å; I736-D857 PolarHBondContact N-O 2.75Å; I736-V858 HydrophobicContact CD1-CG2 3.49Å; I736-V858 VanDerWaalsContact CD1-CG2 3.49Å; I736-V858 HydrophobicContact CG1-CG2 4.1Å; I736-Y1002 HydrophobicContact CG2-CD1 3.59Å; I736-Y1002 HydrophobicContact CG2-CE1 3.94Å; I736-Y1002 HydrophobicContact CG2-CG 4.41Å
737	G	77.4	Confident	76.5	Confident	25 Å²	25	37.4 Å²	37.4	26%	0.258	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	105	-17.5	-179.2	0	0	0	0	0	114.9	A735	A735-G737 PolarHBondContact O-N 3.07Å; A735-G737 VanDerWaalsContact O-N 3.11Å
738	S	79	Confident	77.3	Confident	4 Å²	4	37.1 Å²	37.1	3%	0.028	21%	0.213	C	C	.	.			trans	-82.4	168.4	-179.6	-57.4	0	0	0	0	112.9	A735 D921	A735-S738 WeakPolarHBondContact O-CB 3.48Å; A735-S738 PolarHBondContact O-N 2.94Å; S738-D921 WeakPolarHBondContact CB-OD1 2.77Å; S738-D921 PolarHBondContact OG-OD1 3.02Å
739	T	80	Confident	77.7	Confident	65 Å²	65	33.8 Å²	33.8	40%	0.399	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.6	-171.9	-60.4	0	0	0	0	111	L820 R821	T739-L820 WeakPolarHBondContact CG2-O 3.47Å; T739-R821 HydrophobicContact CG2-CB 4.46Å
740	R	80.7	Confident	78.1	Confident	43 Å²	43	31.7 Å²	31.7	16%	0.162	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.6	-176.4	-158.5	75.7	171.9	82.5	-6.2	112	D726 T732 V734 L820 E918	D726-R740 IonicContact OD1-CZ 3.83Å; D726-R740 IonicContact OD1-NH1 3.74Å; D726-R740 PolarHBondContact OD1-NH1 3.47Å; D726-R740 IonicContact OD1-NH2 3.62Å; D726-R740 PolarHBondContact OD1-NH2 3.19Å; D726-R740 IonicContact OD2-CZ 3.12Å; D726-R740 IonicContact OD2-NH1 2.97Å; D726-R740 PolarHBondContact OD2-NH1 3.21Å; D726-R740 IonicContact OD2-NH2 3.71Å; T732-R740 HydrophobicContact CG2-CG 4.38Å; V734-R740 HydrophobicContact CG2-CB 4.31Å; R740-L820 PolarHBondContact N-O 3.07Å; R740-L820 PolarHBondContact O-N 2.96Å; R740-E918 IonicContact CZ-OE2 3.9Å; R740-E918 VanDerWaalsContact CZ-OE2 3.24Å; R740-E918 IonicContact NE-OE2 3.3Å; R740-E918 PolarHBondContact NE-OE2 2.59Å; R740-E918 IonicContact NH2-OE1 3.85Å; R740-E918 IonicContact NH2-OE2 3.87Å; R740-E918 PolarHBondContact NH2-OE2 3.45Å
741	N	77.9	Confident	78.3	Confident	87 Å²	87	27 Å²	27	47%	0.465	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	154.5	175.2	-64.8	-42.1	0	0	0	111.1	S819	N741-S819 WeakPolarHBondContact OD1-CB 3.34Å; N741-S819 PolarHBondContact OD1-OG 2.9Å
742	M	79	Confident	77.8	Confident	7 Å²	7	27.3 Å²	27.3	3%	0.034	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.9	-175.6	-62	-74.5	-172.3	0	0	111.3	D726 P727 F818 L820 F852 I854	D726-M742 CarbonylContact O-C 3.36Å; D726-M742 WeakPolarHBondContact O-CA 3.37Å; P727-M742 WeakPolarHBondContact CD-SD 3.15Å; P727-M742 HydrophobicContact CG-CE 4.48Å; P727-M742 HydrophobicContact CG-SD 3.8Å; M742-F818 HydrophobicContact CB-CD1 4.07Å; M742-F818 HydrophobicContact CB-CD2 3.65Å; M742-F818 HydrophobicContact CB-CE1 3.89Å; M742-F818 HydrophobicContact CB-CE2 3.45Å; M742-F818 VanDerWaalsContact CB-CE2 3.45Å; M742-F818 HydrophobicContact CB-CG 3.95Å; M742-F818 HydrophobicContact CB-CZ 3.57Å; M742-F818 WeakPolarHBondContact CB-O 3.17Å; M742-F818 HydrophobicContact CG-CD2 3.85Å; M742-F818 HydrophobicContact CG-CE2 3.5Å; M742-F818 HydrophobicContact CG-CZ 4.02Å; M742-F818 PolarHBondContact N-O 2.62Å; M742-F818 PolarHBondContact O-N 3.04Å; M742-F818 VanDerWaalsContact O-N 3.15Å; M742-L820 HydrophobicContact CE-CD1 3.9Å; M742-L820 HydrophobicContact CG-CD1 3.81Å; M742-F852 HydrophobicContact CE-CD2 4.41Å; M742-F852 HydrophobicContact CE-CE2 4.27Å; M742-I854 HydrophobicContact CE-CD1 3.94Å; M742-I854 HydrophobicContact CE-CG1 3.95Å
743	L	77.3	Confident	77.4	Confident	49 Å²	49	32.3 Å²	32.3	26%	0.257	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	129	-176.8	-91.2	150.5	0	0	0	112.8	I725 D726 L815	I725-L743 HydrophobicContact CB-CB 4.2Å; I725-L743 HydrophobicContact CG2-CB 4.34Å; I725-L743 PolarHBondContact N-O 3.07Å; D726-L743 PolarHBondContact O-N 3.28Å; L743-L815 HydrophobicContact CD2-CB 4.32Å; L743-L815 HydrophobicContact CD2-CD2 3.97Å
744	V	75.4	Confident	76.9	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.018	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.1	-176.8	-171.4	0	0	0	0	112	I722 F724 V816 F818 I832	I722-V744 HydrophobicContact CG2-CG1 4Å; F724-V744 HydrophobicContact CD1-CG2 3.74Å; F724-V744 HydrophobicContact CE1-CG2 3.87Å; V744-V816 HydrophobicContact CB-CB 4.46Å; V744-V816 PolarHBondContact N-O 2.85Å; V744-V816 PolarHBondContact O-N 2.96Å; V744-F818 HydrophobicContact CG2-CE1 4.09Å; V744-I832 HydrophobicContact CG1-CD1 4.23Å; V744-I832 HydrophobicContact CG2-CD1 4.46Å
745	T	76	Confident	76.1	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	168.2	-178.8	47.5	0	0	0	0	114.7	N723 I725 V813 L815	N723-T745 PolarHBondContact N-O 2.95Å; N723-T745 PolarHBondContact O-N 3.38Å; N723-T745 PolarHBondContact O-OG1 3.14Å; I725-T745 HydrophobicContact CD1-CG2 3.35Å; I725-T745 HydrophobicContact CG1-CG2 4.12Å; T745-V813 HydrophobicContact CG2-CG1 3.77Å; T745-L815 HydrophobicContact CG2-CD2 3.4Å; T745-L815 HydrophobicContact CG2-CG 4.33Å
746	H	75	Confident	75.8	Confident	58 Å²	58	43.9 Å²	43.9	27%	0.269	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	68.5	-172.4	174.7	-57.7	-33.3	0	0	0	114.3	R720 K721 I834	R720-H746 HydrophobicContact CB-CB 4.18Å; K721-H746 WeakPolarHBondContact O-CB 3.26Å; H746-I834 VanDerWaalsContact O-CD1 3.32Å; H746-I834 WeakPolarHBondContact O-CD1 3.28Å
747	G	74.1	Confident	75.6	Confident	2 Å²	2	45.2 Å²	45.2	2%	0.021	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.4	170.5	-162.2	0	0	0	0	0	112.9	R720 Q749	R720-G747 WeakPolarHBondContact O-CA 3.4Å; R720-G747 PolarHBondContact O-N 3.24Å; G747-Q749 PolarHBondContact O-NE2 3.37Å
748	P	79.1	Confident	75.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.			trans	-57.3	146.9	177.2	-19.9	32.4	0	0	0	111.7	H758 M846	P748-H758 PolarHBondContact O-NE2 2.87Å; P748-M846 HydrophobicContact CG-CE 4.32Å
749	Q	75.3	Confident	76.1	Confident	47 Å²	47	50 Å²	50	22%	0.22	26%	0.261	C	S	.	.			trans	-105.6	158.5	174.9	-62.2	-55.5	-56.6	0	0	110.9	Y719 G747 N836	Y719-Q749 HydrophobicContact CD1-CB 4.08Å; Y719-Q749 HydrophobicContact CD1-CG 4.33Å; Y719-Q749 HydrophobicContact CE1-CB 3.9Å; G747-Q749 PolarHBondContact O-NE2 3.37Å; Q749-N836 PolarHBondContact O-ND2 3Å
750	P	74.6	Confident	76.3	Confident	20 Å²	20	48.7 Å²	48.7	13%	0.13	25%	0.254	C	S	.	.			trans	-58.7	137.8	176.6	-22.6	33.3	0	0	0	112.3	L755 H758	P750-L755 HydrophobicContact CB-CD2 3.8Å; P750-H758 HydrophobicContact CG-CB 4.4Å
751	W	75	Confident	76.4	Confident	15 Å²	15	50.4 Å²	50.4	6%	0.057	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-61.9	127.3	-179.6	-177.7	-123.5	0	0	0	110.8	N575 E576 A717 L753 Q754 S841 N842	N575-W751 HydrophobicContact CB-CH2 4.19Å; E576-W751 HydrophobicContact CG-CE3 4.26Å; E576-W751 HydrophobicContact CG-CH2 4.42Å; E576-W751 HydrophobicContact CG-CZ3 3.64Å; E576-W751 WeakPolarHBondContact OE1-CZ3 3.12Å; A717-W751 HydrophobicContact CB-CZ3 3.97Å; W751-L753 HydrophobicContact CZ2-CD1 4.33Å; W751-L753 PolarHBondContact O-N 3.13Å; W751-Q754 CarbonylContact O-C 3.6Å; W751-Q754 PolarHBondContact O-N 3.36Å; W751-S841 PolarHBondContact NE1-OG 2.78Å; W751-N842 HydrophobicContact CD2-CB 4.18Å; W751-N842 HydrophobicContact CH2-CB 4.18Å; W751-N842 HydrophobicContact CZ2-CB 3.72Å
752	P	68.4	Low	76.6	Confident	69 Å²	69	48.3 Å²	48.3	45%	0.448	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-23.7	-174.1	-28.7	36.1	0	0	0	115.3	F689	F689-P752 HydrophobicContact CB-CG 4.49Å
753	L	70.7	Confident	76.8	Confident	108 Å²	108	52.9 Å²	52.9	57%	0.565	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-10.6	178.6	-53.3	174.4	0	0	0	113.6	W751	W751-L753 HydrophobicContact CZ2-CD1 4.33Å; W751-L753 PolarHBondContact O-N 3.13Å
754	Q	71.8	Confident	76.7	Confident	70 Å²	70	54.5 Å²	54.5	33%	0.327	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-153.1	98.7	175.3	-85.9	117.2	-17.9	0	0	111.3	W751 S756 T839 S841	W751-Q754 CarbonylContact O-C 3.6Å; W751-Q754 PolarHBondContact O-N 3.36Å; Q754-S756 PolarHBondContact O-N 2.86Å; Q754-T839 HydrophobicContact CB-CG2 4.12Å; Q754-T839 HydrophobicContact CG-CG2 4.19Å; Q754-T839 VanDerWaalsContact OE1-CB 3.3Å; Q754-T839 PolarHBondContact OE1-OG1 2.96Å; Q754-S841 PolarHBondContact OE1-OG 2.87Å
755	L	67.7	Low	76.6	Confident	126 Å²	126	58.3 Å²	58.3	66%	0.66	31%	0.307	S	S	*	.			trans	-83.6	-5.2	-171.1	-63.4	172.3	0	0	0	116	P750	P750-L755 HydrophobicContact CB-CD2 3.8Å
756	S	74.5	Confident	75.8	Confident	90 Å²	90	64 Å²	64	63%	0.629	34%	0.344	S	S	*	.			trans	-86.4	-8	-160.4	49.4	0	0	0	0	117	Q754	Q754-S756 PolarHBondContact O-N 2.86Å
757	E	78.2	Confident	75	Confident	57 Å²	57	67.1 Å²	67.1	27%	0.266	36%	0.363	S	S	.	.			trans	-110.9	31.7	-156.1	-55.4	-54.7	126.3	0	0	116.1	N836 R837	E757-N836 CarbonylContact O-C 3.54Å; E757-N836 WeakPolarHBondContact O-CA 3.11Å; E757-R837 HydrophobicContact CB-CB 3.78Å; E757-R837 HydrophobicContact CB-CG 3.97Å; E757-R837 HydrophobicContact CG-CB 4.14Å; E757-R837 VanDerWaalsContact OE2-CD 3.32Å; E757-R837 WeakPolarHBondContact OE2-CD 3.49Å; E757-R837 IonicContact OE2-CZ 2.67Å; E757-R837 IonicContact OE2-NE 3.74Å; E757-R837 IonicContact OE2-NH1 3.76Å; E757-R837 PolarHBondContact OE2-NH1 2.87Å
758	H	81.5	Confident	74	Confident	45 Å²	45	71.9 Å²	71.9	21%	0.208	40%	0.402	C	S	.	.			trans	-119.7	143.3	-164	175	-55.9	0	0	0	114.7	P748 P750 F784 R814 G835	P748-H758 PolarHBondContact O-NE2 2.87Å; P750-H758 HydrophobicContact CG-CB 4.4Å; H758-F784 AromaticContact CE1-CZ 3.94Å; H758-R814 PolarHBondContact NE2-NH1 3.4Å; H758-G835 WeakPolarHBondContact CA-O 3.4Å
759	Y	86.4	Confident	72.9	Confident	83 Å²	83	79.6 Å²	79.6	33%	0.325	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	165.7	-172.1	59.9	-85.6	0	0	0	116.1	E833 G835 V847	Y759-E833 HydrophobicContact CE2-CG 4.36Å; Y759-G835 WeakPolarHBondContact CD1-O 2.9Å; Y759-G835 VanDerWaalsContact CE1-C 3.41Å; Y759-G835 WeakPolarHBondContact CE1-O 3.47Å; Y759-G835 PolarHBondContact N-O 2.89Å; Y759-V847 WeakPolarHBondContact OH-CG1 3.26Å
760	V	82.9	Confident	71.8	Confident	39 Å²	39	82.2 Å²	82.2	24%	0.236	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	144	177.8	-175.7	0	0	0	0	112.5	F784 E833 I834	V760-F784 HydrophobicContact CG2-CE1 4.41Å; V760-F784 HydrophobicContact CG2-CE2 4.3Å; V760-F784 HydrophobicContact CG2-CZ 3.63Å; V760-E833 VanDerWaalsContact CA-O 3.31Å; V760-E833 WeakPolarHBondContact CA-O 3.3Å; V760-I834 HydrophobicContact CG1-CG1 4.49Å; V760-I834 HydrophobicContact CG2-CG1 4.3Å; V760-I834 HydrophobicContact CG2-CG2 4.34Å
761	N	83.9	Confident	70.9	Confident	79 Å²	79	86.4 Å²	86.4	42%	0.422	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.9	178.6	-66.1	-49.3	0	0	0	114.9	I832 E833	N761-I832 WeakPolarHBondContact O-CA 3.27Å; N761-I832 WeakPolarHBondContact O-CG1 3.32Å; N761-E833 HydrophobicContact CB-CB 4.45Å; N761-E833 PolarHBondContact N-O 2.78Å; N761-E833 PolarHBondContact ND2-OE2 2.71Å; N761-E833 PolarHBondContact O-N 2.87Å
762	V	81.9	Confident	70	Confident	42 Å²	42	92.7 Å²	92.7	26%	0.255	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	142.5	172.1	176.5	0	0	0	0	112.7	P782 V831 I832	V762-P782 HydrophobicContact CB-CG 4.19Å; V762-P782 HydrophobicContact CG2-CB 4.01Å; V762-P782 HydrophobicContact CG2-CG 3.94Å; V762-V831 VanDerWaalsContact CA-O 3.32Å; V762-V831 WeakPolarHBondContact CA-O 3.2Å; V762-I832 HydrophobicContact CG2-CB 4.22Å; V762-I832 HydrophobicContact CG2-CD1 3.96Å; V762-I832 HydrophobicContact CG2-CG1 3.94Å
763	F	83.9	Confident	69.5	Low	104 Å²	104	94.3 Å²	94.3	46%	0.456	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	159.7	177	49.9	-90.3	0	0	0	114.9	V831	F763-V831 HydrophobicContact CD2-CB 4.06Å; F763-V831 HydrophobicContact CD2-CG2 4.27Å; F763-V831 HydrophobicContact CE1-CG1 4.46Å; F763-V831 HydrophobicContact CE2-CB 3.67Å; F763-V831 HydrophobicContact CE2-CG1 3.91Å; F763-V831 HydrophobicContact CE2-CG2 3.89Å; F763-V831 HydrophobicContact CZ-CB 3.92Å; F763-V831 HydrophobicContact CZ-CG1 3.74Å; F763-V831 PolarHBondContact N-O 2.41Å; F763-V831 PolarHBondContact O-N 2.88Å
764	P	74.9	Confident	69	Low	82 Å²	82	91.4 Å²	91.4	53%	0.532	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	159.5	172.4	33.3	-35.9	0	0	0	113.3	F830	P764-F830 HydrophobicContact CB-CD1 3.78Å; P764-F830 HydrophobicContact CB-CE1 3.82Å
765	Q	73.6	Confident	68.6	Low	84 Å²	84	91.8 Å²	91.8	39%	0.393	52%	0.518	S	S	.	.			trans	-95	129.1	175.4	-162.3	172.3	-90.4	0	0	111.3	D767 E829	Q765-D767 PolarHBondContact O-N 3.31Å; Q765-E829 PolarHBondContact N-O 3.19Å; Q765-E829 PolarHBondContact NE2-OE2 3Å
766	P	58.4	Low	68.5	Low	123 Å²	123	86.5 Å²	86.5	80%	0.799	49%	0.492	S	S	*	.			trans	-89.1	102.4	-170.3	32.8	-34.6	0	0	0	114.1
767	D	58.3	Low	68.6	Low	125 Å²	125	85.7 Å²	85.7	67%	0.668	48%	0.483	S	S	*	.			trans	-86.8	145.7	160.5	-84.8	-37.2	0	0	0	111.6	Q765 D769	Q765-D767 PolarHBondContact O-N 3.31Å; D767-D769 PolarHBondContact O-N 3.48Å
768	A	52.7	Low	68.4	Low	102 Å²	102	87.4 Å²	87.4	84%	0.843	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.9	-159.8	0	0	0	0	0	117
769	D	55.6	Low	68.1	Low	162 Å²	162	90.1 Å²	90.1	87%	0.866	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	-0.9	-168	-76.7	-51.7	0	0	0	115.4	D767	D767-D769 PolarHBondContact O-N 3.48Å
770	N	52.6	Low	67.4	Low	102 Å²	102	87.8 Å²	87.8	55%	0.545	50%	0.504	S	S	.	.			trans	-85.3	125.3	-173.2	-79.3	-41.6	0	0	0	114	I772	N770-I772 PolarHBondContact O-N 2.89Å
771	D	55.5	Low	66.9	Low	107 Å²	107	93.4 Å²	93.4	57%	0.572	53%	0.528	S	S	*	.			trans	-69.1	124.8	172.9	-172.4	-32.4	0	0	0	110.6	S773 S774	D771-S773 VanDerWaalsContact CG-OG 3.26Å; D771-S773 PolarHBondContact O-N 2.76Å; D771-S773 WeakPolarHBondContact OD1-CB 3.22Å; D771-S773 PolarHBondContact OD1-N 3Å; D771-S773 PolarHBondContact OD1-OG 2.77Å; D771-S774 PolarHBondContact O-N 2.89Å; D771-S774 PolarHBondContact O-OG 2.99Å
772	I	56.9	Low	66.5	Low	148 Å²	148	92.1 Å²	92.1	76%	0.759	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-56.8	-24	-174.7	-59.7	173.3	0	0	0	111.9	N770 S774	N770-I772 PolarHBondContact O-N 2.89Å; I772-S774 VanDerWaalsContact C-N 3.27Å; I772-S774 PolarHBondContact O-N 2.97Å
773	S	57.4	Low	66	Low	103 Å²	103	94.6 Å²	94.6	72%	0.72	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-72.2	-10.9	177.3	62.6	0	0	0	0	115.6	D771	D771-S773 VanDerWaalsContact CG-OG 3.26Å; D771-S773 PolarHBondContact O-N 2.76Å; D771-S773 WeakPolarHBondContact OD1-CB 3.22Å; D771-S773 PolarHBondContact OD1-N 3Å; D771-S773 PolarHBondContact OD1-OG 2.77Å
774	S	61.1	Low	65.1	Low	46 Å²	46	93.9 Å²	93.9	32%	0.322	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-100.8	-5.8	-174.8	69	0	0	0	0	115.8	D771 I772	D771-S774 PolarHBondContact O-N 2.89Å; D771-S774 PolarHBondContact O-OG 2.99Å; I772-S774 VanDerWaalsContact C-N 3.27Å; I772-S774 PolarHBondContact O-N 2.97Å
775	L	63	Low	64.1	Low	78 Å²	78	92.7 Å²	92.7	41%	0.408	52%	0.523	S	S	.	.	S	Bend	trans	-77.3	147	-173.2	-69	164.9	0	0	0	113.8	T777 F828	L775-T777 PolarHBondContact O-N 2.96Å; L775-F828 HydrophobicContact CD2-CD1 4.01Å; L775-F828 HydrophobicContact CD2-CE1 4.44Å
776	P	65.6	Low	62.9	Low	15 Å²	15	97.9 Å²	97.9	10%	0.097	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-57.6	130.9	168.2	-23.5	33.7	0	0	0	111.4	L820 F828	P776-L820 HydrophobicContact CB-CD2 3.94Å; P776-F828 VanDerWaalsContact CD-CG 3.41Å; P776-F828 HydrophobicContact CG-CB 4.04Å; P776-F828 HydrophobicContact CG-CD1 4.18Å; P776-F828 HydrophobicContact CG-CD2 3.24Å; P776-F828 HydrophobicContact CG-CE1 4.48Å; P776-F828 HydrophobicContact CG-CE2 3.63Å; P776-F828 HydrophobicContact CG-CG 3.55Å; P776-F828 HydrophobicContact CG-CZ 4.23Å
777	T	76.5	Confident	62	Low	74 Å²	74	96.2 Å²	96.2	45%	0.454	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	126.9	-176.8	47.4	0	0	0	0	111.3	L775 I779	L775-T777 PolarHBondContact O-N 2.96Å; T777-I779 PolarHBondContact O-N 3.03Å
778	L	74.7	Confident	60.6	Low	93 Å²	93	96.6 Å²	96.6	49%	0.487	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	112.8	169	-173.9	72.8	0	0	0	108.7	S780 F818 L820	L778-S780 WeakPolarHBondContact CD1-O 3.48Å; L778-S780 WeakPolarHBondContact CG-O 3.49Å; L778-F818 HydrophobicContact CD1-CB 4.19Å; L778-F818 HydrophobicContact CD1-CD2 3.92Å; L778-F818 HydrophobicContact CD1-CG 4.46Å; L778-L820 HydrophobicContact CD1-CG 4.39Å
779	I	74.1	Confident	59.4	Low	101 Å²	101	101.2 Å²	101.2	52%	0.518	54%	0.536	S	S	.	.			trans	-88.3	-15.5	-174.8	-64.3	169.4	0	0	0	111.6	T777 S819 R821	T777-I779 PolarHBondContact O-N 3.03Å; I779-S819 PolarHBondContact N-O 2.76Å; I779-R821 HydrophobicContact CD1-CB 3.88Å
780	S	71.2	Confident	58.3	Low	34 Å²	34	102.8 Å²	102.8	24%	0.238	54%	0.538	C	S	.	.	S	Bend	trans	-154.4	140.5	-178.9	47.6	0	0	0	0	113.2	L778 F818 S819	L778-S780 WeakPolarHBondContact CD1-O 3.48Å; L778-S780 WeakPolarHBondContact CG-O 3.49Å; S780-F818 WeakPolarHBondContact O-CB 3.49Å; S780-F818 WeakPolarHBondContact OG-CA 3.46Å; S780-S819 PolarHBondContact OG-N 2.82Å
781	E	73.6	Confident	57.1	Low	158 Å²	158	107.2 Å²	107.2	74%	0.738	55%	0.552	S	S	*	*			trans	-73.7	152.2	176.3	-75.5	-178	-177.5	0	0	112.8	H783	E781-H783 PolarHBondContact O-N 2.83Å; E781-H783 PolarHBondContact O-ND1 3.41Å
782	P	74.3	Confident	56	Low	52 Å²	52	108.6 Å²	108.6	34%	0.338	57%	0.565	S	S	.	*			trans	-66.8	112.5	179.5	28.4	-35.9	0	0	0	111.8	V762 V816	V762-P782 HydrophobicContact CB-CG 4.19Å; V762-P782 HydrophobicContact CG2-CB 4.01Å; V762-P782 HydrophobicContact CG2-CG 3.94Å; P782-V816 HydrophobicContact CB-CG1 3.73Å
783	H	72.9	Confident	54.6	Low	93 Å²	93	107.5 Å²	107.5	43%	0.431	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.8	149.1	-177.1	60.2	-79.4	0	0	0	112	E781 S785 V816 S817	E781-H783 PolarHBondContact O-N 2.83Å; E781-H783 PolarHBondContact O-ND1 3.41Å; H783-S785 PolarHBondContact O-N 3.09Å; H783-V816 WeakPolarHBondContact O-CA 3.23Å; H783-S817 PolarHBondContact CE1-O 3.5Å; H783-S817 PolarHBondContact ND1-O 3.18Å; H783-S817 PolarHBondContact O-N 3.07Å
784	F	63.7	Low	53.3	Low	90 Å²	90	110.5 Å²	110.5	40%	0.395	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.3	119.5	171.1	-70.2	-59.2	0	0	0	110.8	H758 V760 R814 L815 V816	H758-F784 AromaticContact CE1-CZ 3.94Å; V760-F784 HydrophobicContact CG2-CE1 4.41Å; V760-F784 HydrophobicContact CG2-CE2 4.3Å; V760-F784 HydrophobicContact CG2-CZ 3.63Å; F784-R814 HydrophobicContact CD1-CB 3.78Å; F784-R814 HydrophobicContact CD1-CG 4.26Å; F784-R814 HydrophobicContact CE1-CB 3.87Å; F784-R814 HydrophobicContact CE1-CG 4.42Å; F784-L815 WeakPolarHBondContact CA-O 3.19Å; F784-V816 HydrophobicContact CD1-CG2 3.97Å; F784-V816 HydrophobicContact CE1-CG2 3.83Å
785	S	54	Low	51.6	Low	57 Å²	57	114.6 Å²	114.6	40%	0.399	58%	0.579	S	S	.	*			trans	-66.1	136	177.9	-171.8	0	0	0	0	111.9	H783 L815	H783-S785 PolarHBondContact O-N 3.09Å; S785-L815 PolarHBondContact N-O 2.85Å
786	K	49.3	Very low	50.1	Low	192 Å²	192	118 Å²	118	84%	0.835	60%	0.598	S	S	*	*			trans	-91.4	106	178.1	-68.5	179	-178.9	173.9	0	109.8
787	T	38	Very low	48.3	Very low	89 Å²	89	127 Å²	127	55%	0.546	64%	0.638	S	S	.	*			trans	-65.8	140.1	-179.4	49.9	0	0	0	0	112.9
788	V	30.1	Very low	46.2	Very low	132 Å²	132	126.7 Å²	126.7	80%	0.8	64%	0.644	S	S	*	*			trans	-118.1	124.9	176.1	178.9	0	0	0	0	109.7
789	Y	27.1	Very low	43.9	Very low	200 Å²	200	132 Å²	132	78%	0.784	66%	0.662	S	S	*	*			trans	-124.6	133.8	170.1	-82.3	-83.5	0	0	0	109.4
790	Q	32.3	Very low	41.7	Very low	194 Å²	194	131.5 Å²	131.5	91%	0.907	67%	0.666	S	S	*	*			trans	-133.3	146.8	164.6	-84.8	-172.3	-28.6	0	0	110.8
791	K	27.1	Very low	39.6	Very low	196 Å²	196	137.2 Å²	137.2	85%	0.852	70%	0.699	S	S	*	*			trans	-94.9	154.3	-173.6	-61.2	176	175.5	-179.4	0	111.6
792	T	33.3	Very low	37.4	Very low	135 Å²	135	136.7 Å²	136.7	83%	0.828	70%	0.697	S	S	*	*			trans	154.4	161.5	142.2	37	0	0	0	0	110.2
793	N	27.6	Very low	35.1	Very low	126 Å²	126	137.2 Å²	137.2	67%	0.674	70%	0.702	S	S	*	*			cis	-167	141.1	-46.7	-115.6	24.2	0	0	0	108.7
794	F	29	Very low	32.9	Very low	166 Å²	166	143 Å²	143	73%	0.728	72%	0.721	S	S	*	*			trans	69	127.1	155.6	-76.2	-120.2	0	0	0	120.3
795	D	27.4	Very low	31.1	Very low	131 Å²	131	144.5 Å²	144.5	70%	0.701	73%	0.732	S	S	*	*			trans	50.9	104.9	133.1	-48.6	-3.2	0	0	0	120.6
796	D	31	Very low	29.9	Very low	151 Å²	151	148 Å²	148	81%	0.807	74%	0.744	S	S	*	*				-168.1	168.6	91.1	-116.4	-28.1	0	0	0	112.1	A798	D796-A798 VanDerWaalsContact C-N 3.32Å; D796-A798 PolarHBondContact O-N 3.43Å
797	E	28.2	Very low	28.8	Very low	203 Å²	203	143.6 Å²	143.6	95%	0.949	73%	0.73	S	S	*	*	S	Bend	trans	-39.6	55.9	-164.1	-58.3	-160.5	123.9	0	0	121.4
798	A	32	Very low	28.5	Very low	68 Å²	68	142.5 Å²	142.5	56%	0.562	72%	0.718	S	S	*	*			trans	-131.6	97.9	164.5	0	0	0	0	0	109.9	D796 P800	D796-A798 VanDerWaalsContact C-N 3.32Å; D796-A798 PolarHBondContact O-N 3.43Å; A798-P800 VanDerWaalsContact O-CD 3.3Å; A798-P800 WeakPolarHBondContact O-CD 3.25Å
799	K	26.2	Very low	28.4	Very low	203 Å²	203	138.6 Å²	138.6	88%	0.883	69%	0.694	S	S	*	*			trans	-54.5	114	-179.9	-73.7	-176.3	178.6	177.6	0	110
800	P	27.3	Very low	28.7	Very low	92 Å²	92	133.3 Å²	133.3	60%	0.597	68%	0.677	S	S	*	*			trans	-68.6	138.3	-174.7	26.8	-33.3	0	0	0	110.1	A798 Q802	A798-P800 VanDerWaalsContact O-CD 3.3Å; A798-P800 WeakPolarHBondContact O-CD 3.25Å; P800-Q802 VanDerWaalsContact C-N 3.3Å; P800-Q802 HydrophobicContact CB-CG 4.25Å; P800-Q802 HydrophobicContact CG-CG 4.08Å; P800-Q802 PolarHBondContact O-N 2.81Å
801	V	28.1	Very low	28.7	Very low	154 Å²	154	126.5 Å²	126.5	93%	0.933	66%	0.659	S	S	*	*			trans	-76.3	83.3	-179	-176.6	0	0	0	0	108.9	S803	V801-S803 PolarHBondContact O-N 2.61Å
802	Q	27.3	Very low	29.4	Very low	146 Å²	146	124.7 Å²	124.7	68%	0.682	65%	0.653	S	S	*	*			trans	-81.3	116.8	-169.5	-76	176.3	-73.7	0	0	113.2	P800	P800-Q802 VanDerWaalsContact C-N 3.3Å; P800-Q802 HydrophobicContact CB-CG 4.25Å; P800-Q802 HydrophobicContact CG-CG 4.08Å; P800-Q802 PolarHBondContact O-N 2.81Å
803	S	25.3	Very low	29.9	Very low	64 Å²	64	120.5 Å²	120.5	45%	0.448	63%	0.627	S	S	.	*			trans	37.7	92.5	140.2	54.9	0	0	0	0	118.7	V801	V801-S803 PolarHBondContact O-N 2.61Å
804	Y	26.1	Very low	31.3	Very low	213 Å²	213	119.2 Å²	119.2	84%	0.835	61%	0.613	S	S	*	*	S	Bend	trans	-132.7	21.3	162	-93.4	-72.4	0	0	0	115.2
805	I	27.6	Very low	32.9	Very low	122 Å²	122	113.5 Å²	113.5	63%	0.626	59%	0.59	S	S	*	*	S	Bend	trans	-119.9	-13.1	169.4	-70.8	178.8	0	0	0	112.3	N965	I805-N965 WeakPolarHBondContact CD1-ND2 3.26Å; I805-N965 WeakPolarHBondContact CD1-OD1 3.42Å
806	M	27	Very low	34.9	Very low	132 Å²	132	107.8 Å²	107.8	65%	0.65	56%	0.559	S	S	*	*	S	Bend	trans	-128.9	54.6	172.9	-65.6	-160.8	80.2	0	0	111.4	T809	M806-T809 WeakPolarHBondContact CA-OG1 3.08Å; M806-T809 WeakPolarHBondContact CB-OG1 3.17Å; M806-T809 HydrophobicContact CE-CG2 4.04Å; M806-T809 PolarHBondContact O-OG1 2.99Å
807	D	27.9	Very low	37	Very low	99 Å²	99	102 Å²	102	53%	0.529	53%	0.531	S	S	.	.	S	Bend	trans	-147.6	121.8	162.2	-101.6	-40.2	0	0	0	106.9
808	Q	30.2	Very low	39.7	Very low	66 Å²	66	92.5 Å²	92.5	31%	0.308	49%	0.487	S	S	.	.	S	Bend	cis	-96.2	90.1	-2.8	-39.6	84.7	-12.6	0	0	110.2	N686 R720 E810	N686-Q808 VanDerWaalsContact ND2-CD 3.34Å; N686-Q808 WeakPolarHBondContact ND2-CG 3.38Å; N686-Q808 PolarHBondContact ND2-NE2 3.38Å; N686-Q808 PolarHBondContact OD1-NE2 3.05Å; N686-Q808 PolarHBondContact OD1-OE1 2.94Å; N686-Q808 VanDerWaalsContact OD1-OE1 3.08Å; R720-Q808 PolarHBondContact NH2-O 3.49Å; Q808-E810 VanDerWaalsContact C-N 3.33Å; Q808-E810 HydrophobicContact CB-CG 4.34Å
809	T	29.3	Very low	41.9	Very low	49 Å²	49	90.2 Å²	90.2	30%	0.301	47%	0.467	S	S	.	.			trans	-88.8	83.3	146.7	41.7	0	0	0	0	106.5	M806 V813	M806-T809 WeakPolarHBondContact CA-OG1 3.08Å; M806-T809 WeakPolarHBondContact CB-OG1 3.17Å; M806-T809 HydrophobicContact CE-CG2 4.04Å; M806-T809 PolarHBondContact O-OG1 2.99Å; T809-V813 HydrophobicContact CG2-CG2 4.28Å
810	E	31.8	Very low	44.7	Very low	90 Å²	90	80.9 Å²	80.9	42%	0.421	43%	0.426	S	S	.	.			trans	-50.6	149.9	179.7	-63.5	-170.3	113.5	0	0	111.5	V687 Q808 H812 V813	V687-E810 VanDerWaalsContact C-OE2 3.28Å; V687-E810 WeakPolarHBondContact CB-OE2 2.89Å; V687-E810 WeakPolarHBondContact CG1-OE2 3.46Å; Q808-E810 VanDerWaalsContact C-N 3.33Å; Q808-E810 HydrophobicContact CB-CG 4.34Å; E810-H812 PolarHBondContact O-N 2.81Å; E810-V813 PolarHBondContact O-N 2.97Å
811	G	32.4	Very low	47.4	Very low	51 Å²	51	80.7 Å²	80.7	53%	0.526	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	7.4	-161.8	0	0	0	0	0	118.4
812	H	41.5	Very low	50.1	Low	157 Å²	157	73.9 Å²	73.9	73%	0.727	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.1	44.7	178.2	-64.3	-22.1	0	0	0	112.8	E810 R814	E810-H812 PolarHBondContact O-N 2.81Å; H812-R814 VanDerWaalsContact C-N 3.31Å; H812-R814 PolarHBondContact O-N 2.79Å
813	V	44	Very low	52.5	Low	47 Å²	47	70.5 Å²	70.5	29%	0.285	36%	0.357	S	S	.	.			trans	-63.5	93.8	165.9	-176.5	0	0	0	0	109.5	T745 T809 E810 L815	T745-V813 HydrophobicContact CG2-CG1 3.77Å; T809-V813 HydrophobicContact CG2-CG2 4.28Å; E810-V813 PolarHBondContact O-N 2.97Å; V813-L815 HydrophobicContact CG1-CG 4.47Å; V813-L815 PolarHBondContact O-N 3.36Å
814	R	57.2	Low	54.9	Low	99 Å²	99	69.7 Å²	69.7	37%	0.374	35%	0.351	S	S	.	.			trans	-67.5	92.5	174.7	-74.8	-179.3	173.8	-173.6	-3.1	110.1	H758 F784 H812	H758-R814 PolarHBondContact NE2-NH1 3.4Å; F784-R814 HydrophobicContact CD1-CB 3.78Å; F784-R814 HydrophobicContact CD1-CG 4.26Å; F784-R814 HydrophobicContact CE1-CB 3.87Å; F784-R814 HydrophobicContact CE1-CG 4.42Å; H812-R814 VanDerWaalsContact C-N 3.31Å; H812-R814 PolarHBondContact O-N 2.79Å
815	L	62.7	Low	57.3	Low	47 Å²	47	64.6 Å²	64.6	25%	0.246	34%	0.337	C	S	.	.			trans	-73.6	134	172	-67	158.1	0	0	0	110	I725 L743 T745 F784 S785 V813	I725-L815 HydrophobicContact CD1-CD2 4.26Å; L743-L815 HydrophobicContact CD2-CB 4.32Å; L743-L815 HydrophobicContact CD2-CD2 3.97Å; T745-L815 HydrophobicContact CG2-CD2 3.4Å; T745-L815 HydrophobicContact CG2-CG 4.33Å; F784-L815 WeakPolarHBondContact CA-O 3.19Å; S785-L815 PolarHBondContact N-O 2.85Å; V813-L815 HydrophobicContact CG1-CG 4.47Å; V813-L815 PolarHBondContact O-N 3.36Å
816	V	70.4	Confident	59.8	Low	10 Å²	10	60.1 Å²	60.1	6%	0.061	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.4	168.2	-176.6	0	0	0	0	108.3	V744 P782 H783 F784	V744-V816 HydrophobicContact CB-CB 4.46Å; V744-V816 PolarHBondContact N-O 2.85Å; V744-V816 PolarHBondContact O-N 2.96Å; P782-V816 HydrophobicContact CB-CG1 3.73Å; H783-V816 WeakPolarHBondContact O-CA 3.23Å; F784-V816 HydrophobicContact CD1-CG2 3.97Å; F784-V816 HydrophobicContact CE1-CG2 3.83Å
817	S	75.4	Confident	62.4	Low	30 Å²	30	59.8 Å²	59.8	21%	0.21	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.5	-167.9	-174.4	0	0	0	0	112.5	H783	H783-S817 PolarHBondContact CE1-O 3.5Å; H783-S817 PolarHBondContact ND1-O 3.18Å; H783-S817 PolarHBondContact O-N 3.07Å
818	F	83.3	Confident	64.9	Low	4 Å²	4	56.5 Å²	56.5	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	169.6	173.6	57.2	-80.7	0	0	0	112.1	M742 V744 L778 S780 L820 F852	M742-F818 HydrophobicContact CB-CD1 4.07Å; M742-F818 HydrophobicContact CB-CD2 3.65Å; M742-F818 HydrophobicContact CB-CE1 3.89Å; M742-F818 HydrophobicContact CB-CE2 3.45Å; M742-F818 VanDerWaalsContact CB-CE2 3.45Å; M742-F818 HydrophobicContact CB-CG 3.95Å; M742-F818 HydrophobicContact CB-CZ 3.57Å; M742-F818 WeakPolarHBondContact CB-O 3.17Å; M742-F818 HydrophobicContact CG-CD2 3.85Å; M742-F818 HydrophobicContact CG-CE2 3.5Å; M742-F818 HydrophobicContact CG-CZ 4.02Å; M742-F818 PolarHBondContact N-O 2.62Å; M742-F818 PolarHBondContact O-N 3.04Å; M742-F818 VanDerWaalsContact O-N 3.15Å; V744-F818 HydrophobicContact CG2-CE1 4.09Å; L778-F818 HydrophobicContact CD1-CB 4.19Å; L778-F818 HydrophobicContact CD1-CD2 3.92Å; L778-F818 HydrophobicContact CD1-CG 4.46Å; S780-F818 WeakPolarHBondContact O-CB 3.49Å; S780-F818 WeakPolarHBondContact OG-CA 3.46Å; F818-L820 HydrophobicContact CD2-CD1 3.9Å; F818-L820 HydrophobicContact CE2-CD1 3.93Å; F818-F852 HydrophobicContact CE2-CE1 4.14Å; F818-F852 HydrophobicContact CE2-CE2 4.12Å; F818-F852 AromaticContact CE2-CZ 3.51Å; F818-F852 HydrophobicContact CE2-CZ 3.51Å; F818-F852 AromaticContact CZ-CE1 3.84Å; F818-F852 HydrophobicContact CZ-CE1 3.84Å; F818-F852 HydrophobicContact CZ-CE2 4.46Å; F818-F852 AromaticContact CZ-CZ 3.7Å; F818-F852 HydrophobicContact CZ-CZ 3.7Å
819	S	79.6	Confident	67.5	Low	20 Å²	20	56.4 Å²	56.4	14%	0.14	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	144.8	-171.6	-61.2	0	0	0	0	113.7	N741 I779 S780	N741-S819 WeakPolarHBondContact OD1-CB 3.34Å; N741-S819 PolarHBondContact OD1-OG 2.9Å; I779-S819 PolarHBondContact N-O 2.76Å; S780-S819 PolarHBondContact OG-N 2.82Å
820	L	84.1	Confident	70.2	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.031	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	160.4	-176.9	-72.2	124.6	0	0	0	113.4	T739 R740 M742 P776 L778 F818 F830 I854	T739-L820 WeakPolarHBondContact CG2-O 3.47Å; R740-L820 PolarHBondContact N-O 3.07Å; R740-L820 PolarHBondContact O-N 2.96Å; M742-L820 HydrophobicContact CE-CD1 3.9Å; M742-L820 HydrophobicContact CG-CD1 3.81Å; P776-L820 HydrophobicContact CB-CD2 3.94Å; L778-L820 HydrophobicContact CD1-CG 4.39Å; F818-L820 HydrophobicContact CD2-CD1 3.9Å; F818-L820 HydrophobicContact CE2-CD1 3.93Å; L820-F830 HydrophobicContact CD2-CZ 4.43Å; L820-I854 HydrophobicContact CB-CD1 4.2Å; L820-I854 HydrophobicContact CD1-CD1 3.93Å; L820-I854 HydrophobicContact CD2-CD1 3.88Å; L820-I854 HydrophobicContact CG-CD1 4.21Å
821	R	84.7	Confident	72.7	Confident	89 Å²	89	52.4 Å²	52.4	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	140.2	-175.2	171	176.3	159	132.2	-3.1	113.1	T739 I779 E823	T739-R821 HydrophobicContact CG2-CB 4.46Å; I779-R821 HydrophobicContact CD1-CB 3.88Å; R821-E823 IonicContact CZ-OE1 2.69Å; R821-E823 IonicContact NE-OE1 3.35Å; R821-E823 PolarHBondContact NE-OE1 3.4Å; R821-E823 IonicContact NH2-OE1 3.23Å; R821-E823 PolarHBondContact NH2-OE1 2.83Å
822	C	84.1	Confident	75.2	Confident	10 Å²	10	50.1 Å²	50.1	7%	0.068	26%	0.255	C	S	.	.			trans	-81.9	115.6	173.8	-76.5	0	0	0	0	111.8	C856	C822-C856 HydrophobicContact CB-CB 3.82Å; C822-C856 WeakPolarHBondContact CB-SG 3.24Å; C822-C856 WeakPolarHBondContact SG-CB 3.27Å; C822-C856 CovalentContact SG-SG 2.04Å; C822-C856 PolarHBondContact SG-SG 3.19Å
823	E	78.6	Confident	77.4	Confident	75 Å²	75	45.9 Å²	45.9	35%	0.35	24%	0.235	S	C	.	.			trans	-103.9	-15.3	169.1	-77.4	-69.8	130.6	0	0	113.5	R821 R1001	R821-E823 IonicContact CZ-OE1 2.69Å; R821-E823 IonicContact NE-OE1 3.35Å; R821-E823 PolarHBondContact NE-OE1 3.4Å; R821-E823 IonicContact NH2-OE1 3.23Å; R821-E823 PolarHBondContact NH2-OE1 2.83Å; E823-R1001 IonicContact OE2-CZ 3.63Å; E823-R1001 IonicContact OE2-NH1 2.85Å; E823-R1001 PolarHBondContact OE2-NH1 2.81Å; E823-R1001 IonicContact OE2-NH2 3.27Å; E823-R1001 PolarHBondContact OE2-NH2 3.43Å
824	S	74.4	Confident	79.4	Confident	48 Å²	48	44.2 Å²	44.2	34%	0.336	23%	0.225	S	C	.	.	S	Bend	trans	-146.9	169.3	-175	60.4	0	0	0	0	111.5	C856	S824-C856 VanDerWaalsContact O-CB 3.3Å; S824-C856 WeakPolarHBondContact O-CB 3.41Å; S824-C856 PolarHBondContact O-SG 2.72Å
825	I	77.9	Confident	80.7	Confident	106 Å²	106	39.5 Å²	39.5	54%	0.544	21%	0.207	S	C	.	.	S	Bend	trans	-86.2	124.8	171	-59.9	170.9	0	0	0	107.7	I736	I736-I825 HydrophobicContact CD1-CD1 3.84Å; I736-I825 HydrophobicContact CD1-CG1 3.67Å; I736-I825 HydrophobicContact CG1-CG1 4.41Å
826	G	78.5	Confident	81.6	Confident	27 Å²	27	38 Å²	38	28%	0.278	20%	0.199	S	C	.	.			trans	170.1	-174.1	-177.1	0	0	0	0	0	114.6
827	M	82.5	Confident	82.1	Confident	126 Å²	126	45.1 Å²	45.1	62%	0.621	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	146.8	175.3	-58.7	-151.9	-57.8	0	0	112.6	I854 M855	M827-I854 VanDerWaalsContact CA-O 3.3Å; M827-I854 WeakPolarHBondContact CA-O 3.5Å; M827-M855 HydrophobicContact CG-CG 3.94Å; M827-M855 HydrophobicContact SD-CE 3.82Å; M827-M855 HydrophobicContact SD-CG 3.72Å; M827-M855 HydrophobicContact SD-SD 4Å
828	F	81	Confident	82.2	Confident	29 Å²	29	48.2 Å²	48.2	13%	0.127	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	145.5	-168.5	-45.7	-87.1	0	0	0	114	L775 P776 F830 T853 I854	L775-F828 HydrophobicContact CD2-CD1 4.01Å; L775-F828 HydrophobicContact CD2-CE1 4.44Å; P776-F828 VanDerWaalsContact CD-CG 3.41Å; P776-F828 HydrophobicContact CG-CB 4.04Å; P776-F828 HydrophobicContact CG-CD1 4.18Å; P776-F828 HydrophobicContact CG-CD2 3.24Å; P776-F828 HydrophobicContact CG-CE1 4.48Å; P776-F828 HydrophobicContact CG-CE2 3.63Å; P776-F828 HydrophobicContact CG-CG 3.55Å; P776-F828 HydrophobicContact CG-CZ 4.23Å; F828-F830 HydrophobicContact CB-CE2 4.35Å; F828-T853 CarbonylContact O-C 3.58Å; F828-T853 VanDerWaalsContact O-CA 3.23Å; F828-T853 WeakPolarHBondContact O-CA 3.46Å; F828-T853 WeakPolarHBondContact O-CG2 3.34Å; F828-I854 PolarHBondContact N-O 2.8Å; F828-I854 PolarHBondContact O-N 2.92Å; F828-I854 VanDerWaalsContact O-N 3.12Å
829	E	84.2	Confident	81.7	Confident	65 Å²	65	48.9 Å²	48.9	30%	0.304	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147.9	-168.6	-160.4	-160.6	168.4	0	0	116.7	Q765 K851 F852	Q765-E829 PolarHBondContact N-O 3.19Å; Q765-E829 PolarHBondContact NE2-OE2 3Å; E829-K851 WeakPolarHBondContact OE1-CE 3.2Å; E829-K851 IonicContact OE1-NZ 2.63Å; E829-K851 PolarHBondContact OE1-NZ 2.94Å; E829-F852 CarbonylContact C-O 3.49Å; E829-F852 WeakPolarHBondContact CA-O 3.18Å
830	F	85	Confident	81.2	Confident	28 Å²	28	53.6 Å²	53.6	12%	0.123	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	169.8	-173.1	-59.5	-94.9	0	0	0	116.5	P764 L820 F828 K851 F852 I854	P764-F830 HydrophobicContact CB-CD1 3.78Å; P764-F830 HydrophobicContact CB-CE1 3.82Å; L820-F830 HydrophobicContact CD2-CZ 4.43Å; F828-F830 HydrophobicContact CB-CE2 4.35Å; F830-K851 CarbonylContact O-C 3.51Å; F830-K851 VanDerWaalsContact O-CA 3.31Å; F830-K851 WeakPolarHBondContact O-CA 3.4Å; F830-F852 HydrophobicContact CB-CD1 3.93Å; F830-F852 HydrophobicContact CB-CD2 4.25Å; F830-F852 HydrophobicContact CB-CE1 3.42Å; F830-F852 VanDerWaalsContact CB-CE1 3.42Å; F830-F852 HydrophobicContact CB-CE2 3.78Å; F830-F852 HydrophobicContact CB-CG 4.32Å; F830-F852 HydrophobicContact CB-CZ 3.33Å; F830-F852 HydrophobicContact CD1-CZ 4.45Å; F830-F852 HydrophobicContact CD2-CD2 4.22Å; F830-F852 AromaticContact CD2-CE2 3.6Å; F830-F852 HydrophobicContact CD2-CE2 3.6Å; F830-F852 AromaticContact CD2-CZ 3.93Å; F830-F852 HydrophobicContact CD2-CZ 3.93Å; F830-F852 HydrophobicContact CE2-CE2 4.43Å; F830-F852 HydrophobicContact CG-CE1 4.29Å; F830-F852 AromaticContact CG-CE2 3.88Å; F830-F852 HydrophobicContact CG-CE2 3.88Å; F830-F852 AromaticContact CG-CZ 3.69Å; F830-F852 HydrophobicContact CG-CZ 3.69Å; F830-F852 PolarHBondContact N-O 2.74Å; F830-F852 PolarHBondContact O-N 2.83Å; F830-I854 HydrophobicContact CE2-CD1 4.24Å
831	V	86.1	Confident	80.4	Confident	26 Å²	26	55.2 Å²	55.2	16%	0.158	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	155.7	-168.8	-168.7	0	0	0	0	115.5	V762 F763 S850 K851	V762-V831 VanDerWaalsContact CA-O 3.32Å; V762-V831 WeakPolarHBondContact CA-O 3.2Å; F763-V831 HydrophobicContact CD2-CB 4.06Å; F763-V831 HydrophobicContact CD2-CG2 4.27Å; F763-V831 HydrophobicContact CE1-CG1 4.46Å; F763-V831 HydrophobicContact CE2-CB 3.67Å; F763-V831 HydrophobicContact CE2-CG1 3.91Å; F763-V831 HydrophobicContact CE2-CG2 3.89Å; F763-V831 HydrophobicContact CZ-CB 3.92Å; F763-V831 HydrophobicContact CZ-CG1 3.74Å; F763-V831 PolarHBondContact N-O 2.41Å; F763-V831 PolarHBondContact O-N 2.88Å; V831-S850 WeakPolarHBondContact CG1-O 3.27Å; V831-K851 HydrophobicContact CG2-CG 4.35Å
832	I	84.8	Confident	79.7	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	154.9	-179.1	-172.2	164.5	0	0	0	116.8	V744 N761 V762 S849 S850	V744-I832 HydrophobicContact CG1-CD1 4.23Å; V744-I832 HydrophobicContact CG2-CD1 4.46Å; N761-I832 WeakPolarHBondContact O-CA 3.27Å; N761-I832 WeakPolarHBondContact O-CG1 3.32Å; V762-I832 HydrophobicContact CG2-CB 4.22Å; V762-I832 HydrophobicContact CG2-CD1 3.96Å; V762-I832 HydrophobicContact CG2-CG1 3.94Å; I832-S849 CarbonylContact O-C 3.55Å; I832-S849 VanDerWaalsContact O-CA 3.28Å; I832-S849 WeakPolarHBondContact O-CA 3.42Å; I832-S849 VanDerWaalsContact O-CB 3.27Å; I832-S849 WeakPolarHBondContact O-CB 3.07Å; I832-S850 PolarHBondContact N-O 3.31Å; I832-S850 PolarHBondContact O-N 3.29Å
833	E	87	Confident	79.2	Confident	68 Å²	68	56.5 Å²	56.5	32%	0.318	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	149.3	-171.1	-177.5	-171	-150.7	0	0	116.3	Y759 V760 N761	Y759-E833 HydrophobicContact CE2-CG 4.36Å; V760-E833 VanDerWaalsContact CA-O 3.31Å; V760-E833 WeakPolarHBondContact CA-O 3.3Å; N761-E833 HydrophobicContact CB-CB 4.45Å; N761-E833 PolarHBondContact N-O 2.78Å; N761-E833 PolarHBondContact ND2-OE2 2.71Å; N761-E833 PolarHBondContact O-N 2.87Å
834	I	87	Confident	79.1	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.062	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	140.4	179.1	-44.4	178.7	0	0	0	115.6	I722 H746 V760 L848	I722-I834 HydrophobicContact CD1-CD1 3.98Å; I722-I834 HydrophobicContact CD1-CG1 4.09Å; I722-I834 HydrophobicContact CG1-CD1 4.1Å; H746-I834 VanDerWaalsContact O-CD1 3.32Å; H746-I834 WeakPolarHBondContact O-CD1 3.28Å; V760-I834 HydrophobicContact CG1-CG1 4.49Å; V760-I834 HydrophobicContact CG2-CG1 4.3Å; V760-I834 HydrophobicContact CG2-CG2 4.34Å; I834-L848 PolarHBondContact N-O 2.8Å; I834-L848 PolarHBondContact O-N 3.07Å
835	G	83.2	Confident	79.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.8	-175.7	174.6	0	0	0	0	0	120.7	H758 Y759	H758-G835 WeakPolarHBondContact CA-O 3.4Å; Y759-G835 WeakPolarHBondContact CD1-O 2.9Å; Y759-G835 VanDerWaalsContact CE1-C 3.41Å; Y759-G835 WeakPolarHBondContact CE1-O 3.47Å; Y759-G835 PolarHBondContact N-O 2.89Å
836	N	82.2	Confident	79.2	Confident	16 Å²	16	53.6 Å²	53.6	9%	0.086	29%	0.286	C	S	.	.			trans	-127.4	178.7	-177.6	-88.7	-26.4	0	0	0	114.5	Q749 E757 P845 M846	Q749-N836 PolarHBondContact O-ND2 3Å; E757-N836 CarbonylContact O-C 3.54Å; E757-N836 WeakPolarHBondContact O-CA 3.11Å; N836-P845 HydrophobicContact CB-CB 4.45Å; N836-M846 PolarHBondContact N-O 2.89Å
837	R	81.5	Confident	79.4	Confident	159 Å²	159	55.9 Å²	55.9	60%	0.6	29%	0.294	S	S	*	.			trans	-130.7	162.3	172.6	-54.1	-169.6	-167.7	136.9	-8.2	115.5	E757	E757-R837 HydrophobicContact CB-CB 3.78Å; E757-R837 HydrophobicContact CB-CG 3.97Å; E757-R837 HydrophobicContact CG-CB 4.14Å; E757-R837 VanDerWaalsContact OE2-CD 3.32Å; E757-R837 WeakPolarHBondContact OE2-CD 3.49Å; E757-R837 IonicContact OE2-CZ 2.67Å; E757-R837 IonicContact OE2-NE 3.74Å; E757-R837 IonicContact OE2-NH1 3.76Å; E757-R837 PolarHBondContact OE2-NH1 2.87Å
838	P	77.6	Confident	79.4	Confident	94 Å²	94	51.9 Å²	51.9	61%	0.61	28%	0.275	S	S	*	.			trans	-83	154.9	-167.1	-12	29.3	0	0	0	117.1	P845	P838-P845 HydrophobicContact CB-CG 4.07Å; P838-P845 HydrophobicContact CG-CG 3.84Å
839	T	70.8	Confident	79.5	Confident	18 Å²	18	54.9 Å²	54.9	11%	0.11	30%	0.299	C	S	.	.			trans	-147.5	171.8	-175.7	92.4	0	0	0	0	114.4	Q754 S841 N842 L843	Q754-T839 HydrophobicContact CB-CG2 4.12Å; Q754-T839 HydrophobicContact CG-CG2 4.19Å; Q754-T839 VanDerWaalsContact OE1-CB 3.3Å; Q754-T839 PolarHBondContact OE1-OG1 2.96Å; T839-S841 VanDerWaalsContact C-N 3.29Å; T839-S841 PolarHBondContact O-N 2.52Å; T839-S841 PolarHBondContact OG1-N 3.16Å; T839-S841 PolarHBondContact OG1-OG 2.71Å; T839-N842 PolarHBondContact N-O 2.57Å; T839-N842 CarbonylContact O-C 3.57Å; T839-N842 PolarHBondContact O-N 3.33Å; T839-N842 PolarHBondContact OG1-N 3.19Å; T839-L843 PolarHBondContact O-N 3.25Å
840	P	69.5	Low	79.4	Confident	119 Å²	119	53.4 Å²	53.4	77%	0.773	30%	0.296	S	S	*	.	S	Bend	trans	-70.3	-16.8	175.6	-19.9	33.5	0	0	0	115.5
841	S	67.8	Low	79.4	Confident	40 Å²	40	56.3 Å²	56.3	28%	0.28	31%	0.309	S	S	.	.	S	Bend	trans	-98.8	-18.6	176.1	62.9	0	0	0	0	112.7	N575 W751 Q754 T839	N575-S841 PolarHBondContact ND2-O 2.4Å; W751-S841 PolarHBondContact NE1-OG 2.78Å; Q754-S841 PolarHBondContact OE1-OG 2.87Å; T839-S841 VanDerWaalsContact C-N 3.29Å; T839-S841 PolarHBondContact O-N 2.52Å; T839-S841 PolarHBondContact OG1-N 3.16Å; T839-S841 PolarHBondContact OG1-OG 2.71Å
842	N	69.8	Low	79.3	Confident	7 Å²	7	55.7 Å²	55.7	4%	0.037	30%	0.304	C	S	.	.			trans	-138.6	96.9	167.4	179.6	9.6	0	0	0	109.9	E576 W751 T839 H844	E576-N842 PolarHBondContact OE1-ND2 2.72Å; E576-N842 PolarHBondContact OE2-ND2 3.25Å; W751-N842 HydrophobicContact CD2-CB 4.18Å; W751-N842 HydrophobicContact CH2-CB 4.18Å; W751-N842 HydrophobicContact CZ2-CB 3.72Å; T839-N842 PolarHBondContact N-O 2.57Å; T839-N842 CarbonylContact O-C 3.57Å; T839-N842 PolarHBondContact O-N 3.33Å; T839-N842 PolarHBondContact OG1-N 3.19Å; N842-H844 PolarHBondContact O-N 2.69Å; N842-H844 PolarHBondContact OD1-N 2.72Å; N842-H844 VanDerWaalsContact OD1-N 3.08Å; N842-H844 PolarHBondContact OD1-O 3.37Å
843	L	74.4	Confident	79.4	Confident	120 Å²	120	57.2 Å²	57.2	63%	0.628	31%	0.313	S	S	*	.	S	Bend	trans	-67.7	-15.4	-179.6	-72.2	160	0	0	0	113.4	T839	T839-L843 PolarHBondContact O-N 3.25Å
844	H	75.7	Confident	79.1	Confident	103 Å²	103	54.5 Å²	54.5	48%	0.477	30%	0.301	S	S	.	.	S	Bend	trans	-146	81	-164.8	-56.5	117.5	0	0	0	114.4	N842	N842-H844 PolarHBondContact O-N 2.69Å; N842-H844 PolarHBondContact OD1-N 2.72Å; N842-H844 VanDerWaalsContact OD1-N 3.08Å; N842-H844 PolarHBondContact OD1-O 3.37Å
845	P	76.5	Confident	79	Confident	41 Å²	41	56.3 Å²	56.3	27%	0.266	31%	0.31	S	S	.	.			trans	-90.6	-176.7	-174.1	38.6	-41	0	0	0	117	N836 P838	N836-P845 HydrophobicContact CB-CB 4.45Å; P838-P845 HydrophobicContact CB-CG 4.07Å; P838-P845 HydrophobicContact CG-CG 3.84Å
846	M	78.9	Confident	79.2	Confident	24 Å²	24	56.8 Å²	56.8	12%	0.118	31%	0.313	C	S	.	.			trans	-130.8	154.2	-163.6	180	-178.5	146.1	0	0	116.8	L578 Y719 P748 N836 L848	L578-M846 HydrophobicContact CD1-CE 3.7Å; L578-M846 HydrophobicContact CD1-SD 4.09Å; L578-M846 HydrophobicContact CD2-CE 3.89Å; L578-M846 HydrophobicContact CG-CE 3.64Å; L578-M846 HydrophobicContact CG-SD 4.08Å; Y719-M846 HydrophobicContact CD2-SD 4.1Å; P748-M846 HydrophobicContact CG-CE 4.32Å; N836-M846 PolarHBondContact N-O 2.89Å; M846-L848 HydrophobicContact CE-CD1 3.94Å; M846-L848 HydrophobicContact CE-CG 4.26Å
847	V	81.8	Confident	79.2	Confident	74 Å²	74	57.1 Å²	57.1	45%	0.448	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	151.7	-172.5	-176.8	0	0	0	0	113.3	Y759	Y759-V847 WeakPolarHBondContact OH-CG1 3.26Å
848	L	83.6	Confident	79.2	Confident	43 Å²	43	51.1 Å²	51.1	23%	0.225	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	165.4	-176.5	-63.4	178.3	0	0	0	117.4	I722 I834 M846	I722-L848 HydrophobicContact CD1-CB 3.88Å; I722-L848 HydrophobicContact CG1-CB 4.28Å; I722-L848 HydrophobicContact CG1-CD1 4.49Å; I834-L848 PolarHBondContact N-O 2.8Å; I834-L848 PolarHBondContact O-N 3.07Å; M846-L848 HydrophobicContact CE-CD1 3.94Å; M846-L848 HydrophobicContact CE-CG 4.26Å
849	S	82.7	Confident	79.1	Confident	91 Å²	91	47.9 Å²	47.9	64%	0.636	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.5	171	179.6	58.3	0	0	0	0	118	I832	I832-S849 CarbonylContact O-C 3.55Å; I832-S849 VanDerWaalsContact O-CA 3.28Å; I832-S849 WeakPolarHBondContact O-CA 3.42Å; I832-S849 VanDerWaalsContact O-CB 3.27Å; I832-S849 WeakPolarHBondContact O-CB 3.07Å
850	S	81.8	Confident	79.6	Confident	35 Å²	35	51.4 Å²	51.4	25%	0.245	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	-175.9	-177.9	-165	0	0	0	0	118	V831 I832	V831-S850 WeakPolarHBondContact CG1-O 3.27Å; I832-S850 PolarHBondContact N-O 3.31Å; I832-S850 PolarHBondContact O-N 3.29Å
851	K	84.2	Confident	80	Confident	89 Å²	89	48 Å²	48	39%	0.387	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	162.9	-171.7	-79	-167.7	157.9	-149.9	0	116.8	F724 E829 F830 V831	F724-K851 WeakPolarHBondContact CE2-O 3.03Å; F724-K851 VanDerWaalsContact CZ-O 3.24Å; F724-K851 WeakPolarHBondContact CZ-O 3.22Å; E829-K851 WeakPolarHBondContact OE1-CE 3.2Å; E829-K851 IonicContact OE1-NZ 2.63Å; E829-K851 PolarHBondContact OE1-NZ 2.94Å; F830-K851 CarbonylContact O-C 3.51Å; F830-K851 VanDerWaalsContact O-CA 3.31Å; F830-K851 WeakPolarHBondContact O-CA 3.4Å; V831-K851 HydrophobicContact CG2-CG 4.35Å
852	F	85	Confident	80.6	Confident	12 Å²	12	47.5 Å²	47.5	5%	0.053	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	170.6	172.2	70.4	-87.4	0	0	0	118.3	F724 M742 F818 E829 F830	F724-F852 HydrophobicContact CE1-CB 4.1Å; F724-F852 HydrophobicContact CE1-CD1 4.02Å; F724-F852 HydrophobicContact CE1-CG 4.28Å; F724-F852 HydrophobicContact CZ-CB 3.89Å; F724-F852 HydrophobicContact CZ-CD1 4.07Å; F724-F852 HydrophobicContact CZ-CG 4.37Å; M742-F852 HydrophobicContact CE-CD2 4.41Å; M742-F852 HydrophobicContact CE-CE2 4.27Å; F818-F852 HydrophobicContact CE2-CE1 4.14Å; F818-F852 HydrophobicContact CE2-CE2 4.12Å; F818-F852 AromaticContact CE2-CZ 3.51Å; F818-F852 HydrophobicContact CE2-CZ 3.51Å; F818-F852 AromaticContact CZ-CE1 3.84Å; F818-F852 HydrophobicContact CZ-CE1 3.84Å; F818-F852 HydrophobicContact CZ-CE2 4.46Å; F818-F852 AromaticContact CZ-CZ 3.7Å; F818-F852 HydrophobicContact CZ-CZ 3.7Å; E829-F852 CarbonylContact C-O 3.49Å; E829-F852 WeakPolarHBondContact CA-O 3.18Å; F830-F852 HydrophobicContact CB-CD1 3.93Å; F830-F852 HydrophobicContact CB-CD2 4.25Å; F830-F852 HydrophobicContact CB-CE1 3.42Å; F830-F852 VanDerWaalsContact CB-CE1 3.42Å; F830-F852 HydrophobicContact CB-CE2 3.78Å; F830-F852 HydrophobicContact CB-CG 4.32Å; F830-F852 HydrophobicContact CB-CZ 3.33Å; F830-F852 HydrophobicContact CD1-CZ 4.45Å; F830-F852 HydrophobicContact CD2-CD2 4.22Å; F830-F852 AromaticContact CD2-CE2 3.6Å; F830-F852 HydrophobicContact CD2-CE2 3.6Å; F830-F852 AromaticContact CD2-CZ 3.93Å; F830-F852 HydrophobicContact CD2-CZ 3.93Å; F830-F852 HydrophobicContact CE2-CE2 4.43Å; F830-F852 HydrophobicContact CG-CE1 4.29Å; F830-F852 AromaticContact CG-CE2 3.88Å; F830-F852 HydrophobicContact CG-CE2 3.88Å; F830-F852 AromaticContact CG-CZ 3.69Å; F830-F852 HydrophobicContact CG-CZ 3.69Å; F830-F852 PolarHBondContact N-O 2.74Å; F830-F852 PolarHBondContact O-N 2.83Å
853	T	85.7	Confident	81.1	Confident	36 Å²	36	50.2 Å²	50.2	22%	0.221	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	158.6	-171.9	-53.7	0	0	0	0	116.3	E730 F828	E730-T853 WeakPolarHBondContact O-CA 3.26Å; E730-T853 WeakPolarHBondContact O-CB 3.11Å; E730-T853 PolarHBondContact O-N 2.99Å; F828-T853 CarbonylContact O-C 3.58Å; F828-T853 VanDerWaalsContact O-CA 3.23Å; F828-T853 WeakPolarHBondContact O-CA 3.46Å; F828-T853 WeakPolarHBondContact O-CG2 3.34Å
854	I	82.5	Confident	81.4	Confident	11 Å²	11	45.6 Å²	45.6	6%	0.056	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.5	-177.4	-51.6	173.3	0	0	0	113.9	M742 L820 M827 F828 F830	M742-I854 HydrophobicContact CE-CD1 3.94Å; M742-I854 HydrophobicContact CE-CG1 3.95Å; L820-I854 HydrophobicContact CB-CD1 4.2Å; L820-I854 HydrophobicContact CD1-CD1 3.93Å; L820-I854 HydrophobicContact CD2-CD1 3.88Å; L820-I854 HydrophobicContact CG-CD1 4.21Å; M827-I854 VanDerWaalsContact CA-O 3.3Å; M827-I854 WeakPolarHBondContact CA-O 3.5Å; F828-I854 PolarHBondContact N-O 2.8Å; F828-I854 PolarHBondContact O-N 2.92Å; F828-I854 VanDerWaalsContact O-N 3.12Å; F830-I854 HydrophobicContact CE2-CD1 4.24Å
855	M	84.2	Confident	81.2	Confident	50 Å²	50	43.2 Å²	43.2	25%	0.246	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155.5	177.1	-52.7	175.2	68.6	0	0	114.9	V731 T732 V734 M827	V731-M855 HydrophobicContact CG1-CG 3.94Å; V731-M855 HydrophobicContact CG1-SD 3.52Å; V731-M855 VanDerWaalsContact CG1-SD 3.52Å; T732-M855 PolarHBondContact O-N 3.39Å; V734-M855 PolarHBondContact N-O 2.76Å; M827-M855 HydrophobicContact CG-CG 3.94Å; M827-M855 HydrophobicContact SD-CE 3.82Å; M827-M855 HydrophobicContact SD-CG 3.72Å; M827-M855 HydrophobicContact SD-SD 4Å
856	C	86.4	Confident	80.8	Confident	11 Å²	11	42 Å²	42	7%	0.074	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	132.7	-177.7	-44.7	0	0	0	0	115.4	V734 C822 S824	V734-C856 CarbonylContact O-C 3.58Å; V734-C856 VanDerWaalsContact O-CA 3.24Å; V734-C856 WeakPolarHBondContact O-CA 3.31Å; C822-C856 HydrophobicContact CB-CB 3.82Å; C822-C856 WeakPolarHBondContact CB-SG 3.24Å; C822-C856 WeakPolarHBondContact SG-CB 3.27Å; C822-C856 CovalentContact SG-SG 2.04Å; C822-C856 PolarHBondContact SG-SG 3.19Å; S824-C856 VanDerWaalsContact O-CB 3.3Å; S824-C856 WeakPolarHBondContact O-CB 3.41Å; S824-C856 PolarHBondContact O-SG 2.72Å
857	D	82.4	Confident	80.1	Confident	22 Å²	22	43.2 Å²	43.2	12%	0.118	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	-171.1	-175.4	-164.7	20.2	0	0	0	117.4	V734 A735 I736 S912 Q915 L917	V734-D857 PolarHBondContact O-N 3.19Å; A735-D857 CarbonylContact C-O 3.37Å; A735-D857 VanDerWaalsContact CA-O 3.29Å; A735-D857 WeakPolarHBondContact CA-O 2.81Å; I736-D857 PolarHBondContact N-O 2.75Å; D857-S912 VanDerWaalsContact CG-OG 3.24Å; D857-S912 PolarHBondContact OD1-OG 2.94Å; D857-S912 VanDerWaalsContact OD1-OG 3.1Å; D857-S912 WeakPolarHBondContact OD2-CB 3.09Å; D857-S912 PolarHBondContact OD2-N 3.19Å; D857-S912 PolarHBondContact OD2-OG 2.69Å; D857-Q915 PolarHBondContact OD2-NE2 3.28Å; D857-L917 HydrophobicContact CB-CD2 4.46Å
858	V	81.3	Confident	79.3	Confident	34 Å²	34	41.6 Å²	41.6	21%	0.206	24%	0.238	C	C	.	.			trans	-127.1	151.7	-172.2	-175.1	0	0	0	0	113.6	I736 G911 S912	I736-V858 HydrophobicContact CD1-CG2 3.49Å; I736-V858 VanDerWaalsContact CD1-CG2 3.49Å; I736-V858 HydrophobicContact CG1-CG2 4.1Å; V858-G911 CarbonylContact O-C 3.4Å; V858-G911 WeakPolarHBondContact O-CA 2.25Å; V858-S912 PolarHBondContact O-N 2.77Å
859	A	76.4	Confident	78.1	Confident	26 Å²	26	44.4 Å²	44.4	22%	0.215	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	150.1	-169.8	0	0	0	0	0	117.5	F910 L917	A859-F910 CarbonylContact C-O 3.56Å; A859-F910 WeakPolarHBondContact CA-O 2.25Å; A859-L917 HydrophobicContact CB-CD1 3.65Å
860	V	80.4	Confident	77.1	Confident	91 Å²	91	43.6 Å²	43.6	55%	0.552	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	-39.2	-166.8	-172.6	0	0	0	0	117.5	F910	V860-F910 PolarHBondContact N-O 3.4Å
861	S	78.4	Confident	76.2	Confident	49 Å²	49	42.2 Å²	42.2	34%	0.343	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	175.5	-168.6	74	0	0	0	0	116.6	F909 F910	S861-F909 WeakPolarHBondContact O-CA 2.27Å; S861-F910 VanDerWaalsContact OG-CD2 3.32Å; S861-F910 WeakPolarHBondContact OG-CD2 3.19Å
862	L	81.3	Confident	75	Confident	28 Å²	28	41.3 Å²	41.3	15%	0.147	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	144.3	-171.2	-178.8	67.7	0	0	0	113.6	L907 I908 V994 L1012	L862-L907 HydrophobicContact CD1-CD2 3.93Å; L862-I908 WeakPolarHBondContact CA-O 3.19Å; L862-I908 WeakPolarHBondContact CD1-O 3.29Å; L862-V994 HydrophobicContact CD1-CG2 4.05Å; L862-V994 HydrophobicContact CD2-CB 4.34Å; L862-V994 HydrophobicContact CD2-CG2 3.6Å; L862-V994 HydrophobicContact CG-CG2 4.46Å; L862-L1012 HydrophobicContact CB-CB 3.69Å; L862-L1012 HydrophobicContact CB-CD1 3.94Å; L862-L1012 HydrophobicContact CB-CG 4.32Å; L862-L1012 HydrophobicContact CD2-CB 3.7Å; L862-L1012 HydrophobicContact CG-CB 4.33Å
863	Q	79.8	Confident	73.7	Confident	64 Å²	64	42.5 Å²	42.5	30%	0.299	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.8	175.6	-166.6	172.1	21.6	0	0	113.3	N888 L907 I908	Q863-N888 PolarHBondContact NE2-OD1 3.43Å; Q863-L907 WeakPolarHBondContact O-CA 2.93Å; Q863-I908 PolarHBondContact N-O 3.22Å; Q863-I908 PolarHBondContact O-N 2.95Å
864	L	79.5	Confident	72.6	Confident	23 Å²	23	43.4 Å²	43.4	12%	0.12	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150.1	172.6	-70.6	179.8	0	0	0	112.5	H906 L907 V992	L864-H906 WeakPolarHBondContact CA-O 2.26Å; L864-L907 HydrophobicContact CD2-CD2 4.16Å; L864-L907 HydrophobicContact CD2-CG 4.13Å; L864-V992 HydrophobicContact CD1-CB 4.11Å; L864-V992 HydrophobicContact CD1-CG2 3.9Å; L864-V992 HydrophobicContact CD2-CB 4.16Å; L864-V992 HydrophobicContact CD2-CG1 4.07Å; L864-V992 HydrophobicContact CD2-CG2 3.84Å; L864-V992 HydrophobicContact CG-CG2 4.47Å
865	L	71.5	Confident	71.4	Confident	53 Å²	53	48.5 Å²	48.5	28%	0.277	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	116.2	-176.7	-177.4	70.9	0	0	0	113.5	I885 I905 H906	L865-I885 HydrophobicContact CD1-CB 4.41Å; L865-I885 HydrophobicContact CD1-CG2 3.67Å; L865-I905 CarbonylContact O-C 3.58Å; L865-I905 WeakPolarHBondContact O-CA 3.04Å; L865-H906 HydrophobicContact CB-CB 4.31Å; L865-H906 PolarHBondContact N-O 3.45Å; L865-H906 VanDerWaalsContact N-O 3.14Å; L865-H906 PolarHBondContact O-N 2.74Å
866	P	68.6	Low	69.9	Low	15 Å²	15	50 Å²	50	10%	0.097	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	151.7	175.8	30.4	-34.3	0	0	0	113.8	F868 L895 I905 L1016	P866-F868 HydrophobicContact CB-CE2 4.31Å; P866-F868 HydrophobicContact CB-CZ 4.27Å; P866-F868 HydrophobicContact CG-CE2 4.17Å; P866-F868 HydrophobicContact CG-CZ 4.15Å; P866-L895 HydrophobicContact CB-CD2 4.32Å; P866-L895 HydrophobicContact CG-CD2 4.13Å; P866-I905 HydrophobicContact CB-CG1 4.3Å; P866-L1016 HydrophobicContact CB-CD2 4.37Å; P866-L1016 HydrophobicContact CG-CD2 4.4Å
867	V	65.4	Low	68.8	Low	50 Å²	50	50.7 Å²	50.7	30%	0.303	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	111.4	-174.4	-179.3	0	0	0	0	109.6	T903 V904 H906	V867-T903 WeakPolarHBondContact O-CG2 3.43Å; V867-V904 HydrophobicContact CB-CB 3.93Å; V867-V904 HydrophobicContact CB-CG1 4.05Å; V867-V904 HydrophobicContact CG1-CB 4.4Å; V867-V904 HydrophobicContact CG2-CG1 4.32Å; V867-V904 PolarHBondContact N-O 3.33Å; V867-V904 PolarHBondContact O-N 3.46Å; V867-H906 WeakPolarHBondContact CG2-CD2 2.83Å
868	F	63.5	Low	67.8	Low	41 Å²	41	52.4 Å²	52.4	18%	0.18	30%	0.298	C	S	.	.			trans	-90.5	131.2	-177.2	-52.7	-94.5	0	0	0	110.8	P866 F870 L882 I885 L895 L897	P866-F868 HydrophobicContact CB-CE2 4.31Å; P866-F868 HydrophobicContact CB-CZ 4.27Å; P866-F868 HydrophobicContact CG-CE2 4.17Å; P866-F868 HydrophobicContact CG-CZ 4.15Å; F868-F870 HydrophobicContact CB-CE1 4.01Å; F868-F870 HydrophobicContact CB-CE2 3.9Å; F868-F870 HydrophobicContact CB-CZ 3.62Å; F868-F870 HydrophobicContact CD2-CZ 4.46Å; F868-F870 HydrophobicContact CG-CZ 4.2Å; F868-F870 PolarHBondContact O-N 2.73Å; F868-L882 HydrophobicContact CD2-CD2 4.1Å; F868-I885 HydrophobicContact CE2-CD1 3.98Å; F868-L895 HydrophobicContact CE1-CD1 4.05Å; F868-L895 HydrophobicContact CE1-CD2 3.96Å; F868-L895 HydrophobicContact CE1-CG 4.16Å; F868-L895 HydrophobicContact CZ-CD1 3.64Å; F868-L895 HydrophobicContact CZ-CD2 3.75Å; F868-L895 HydrophobicContact CZ-CG 4.08Å; F868-L897 HydrophobicContact CD1-CD2 3.99Å; F868-L897 HydrophobicContact CE1-CD2 3.78Å
869	Q	59.6	Low	66.8	Low	102 Å²	102	56.1 Å²	56.1	48%	0.477	32%	0.322	S	S	.	.			trans	-86.1	101.3	164.7	-71.4	-174.1	-4.5	0	0	108.7	I901	Q869-I901 HydrophobicContact CB-CD1 4Å; Q869-I901 WeakPolarHBondContact O-CD1 3.35Å
870	F	61.8	Low	65.9	Low	73 Å²	73	55.4 Å²	55.4	32%	0.32	32%	0.316	S	S	.	.			trans	-71.7	153.7	169.2	-59.2	-68.4	0	0	0	110	F868 C880 L882	F868-F870 HydrophobicContact CB-CE1 4.01Å; F868-F870 HydrophobicContact CB-CE2 3.9Å; F868-F870 HydrophobicContact CB-CZ 3.62Å; F868-F870 HydrophobicContact CD2-CZ 4.46Å; F868-F870 HydrophobicContact CG-CZ 4.2Å; F868-F870 PolarHBondContact O-N 2.73Å; F870-C880 HydrophobicContact CD1-CB 3.48Å; F870-C880 VanDerWaalsContact CD1-CB 3.48Å; F870-C880 WeakPolarHBondContact CD1-SG 3.18Å; F870-C880 HydrophobicContact CD2-CB 4.44Å; F870-C880 HydrophobicContact CE1-CB 3.36Å; F870-C880 HydrophobicContact CE2-CB 4.35Å; F870-C880 HydrophobicContact CG-CB 4.03Å; F870-C880 HydrophobicContact CZ-CB 3.83Å; F870-L882 HydrophobicContact CE2-CD2 3.96Å; F870-L882 HydrophobicContact CE2-CG 4.3Å; F870-L882 HydrophobicContact CZ-CD2 3.72Å; F870-L882 HydrophobicContact CZ-CG 4.22Å
871	P	62	Low	64.8	Low	6 Å²	6	53.5 Å²	53.5	4%	0.039	31%	0.305	C	S	.	.			trans	-53.6	156.5	172.4	21.4	-31.5	0	0	0	111.1	L873 L1111 P1114 L1126 P1128	P871-L873 HydrophobicContact CG-CD2 4.23Å; P871-L873 PolarHBondContact O-N 3.24Å; P871-L1111 WeakPolarHBondContact CD-O 3.33Å; P871-L1111 WeakPolarHBondContact CG-O 3.15Å; P871-P1114 HydrophobicContact CB-CB 4.07Å; P871-P1114 HydrophobicContact CG-CB 4.29Å; P871-L1126 CarbonylContact C-O 3.41Å; P871-L1126 WeakPolarHBondContact CA-O 3.24Å; P871-L1126 HydrophobicContact CB-CB 4.16Å; P871-L1126 WeakPolarHBondContact CB-O 3.24Å; P871-P1128 HydrophobicContact CG-CB 4.35Å
872	S	59.7	Low	63.5	Low	70 Å²	70	56 Å²	56	49%	0.49	31%	0.314	S	S	.	.			trans	-73.9	72.4	179.6	58.8	0	0	0	0	110.2	P874 L1126	S872-P874 WeakPolarHBondContact O-CD 3.16Å; S872-L1126 PolarHBondContact N-O 3.17Å; S872-L1126 PolarHBondContact OG-O 2.9Å
873	L	56.5	Low	61.9	Low	37 Å²	37	60.4 Å²	60.4	19%	0.194	34%	0.342	C	S	.	.			trans	-58.3	122.9	177.2	-66.9	-179.2	0	0	0	109.6	P871 F877 P878 L1111 P1128	P871-L873 HydrophobicContact CG-CD2 4.23Å; P871-L873 PolarHBondContact O-N 3.24Å; L873-F877 HydrophobicContact CB-CB 4.16Å; L873-F877 HydrophobicContact CD1-CB 4.29Å; L873-F877 HydrophobicContact CD2-CB 4.09Å; L873-F877 HydrophobicContact CD2-CG 4.28Å; L873-F877 HydrophobicContact CG-CB 4.4Å; L873-P878 WeakPolarHBondContact CD1-O 3.04Å; L873-L1111 HydrophobicContact CD1-CB 4.48Å; L873-L1111 HydrophobicContact CD1-CD2 4.05Å; L873-L1111 HydrophobicContact CD2-CD2 3.65Å; L873-P1128 HydrophobicContact CD2-CB 4.33Å; L873-P1128 HydrophobicContact CD2-CG 4.09Å
874	P	62.7	Low	60	Low	55 Å²	55	63.1 Å²	63.1	36%	0.357	36%	0.359	S	S	.	.			trans	-52.1	150.5	164.9	-26.7	35.1	0	0	0	110.7	S872 H876 F877	S872-P874 WeakPolarHBondContact O-CD 3.16Å; P874-H876 PolarHBondContact O-N 2.91Å; P874-F877 HydrophobicContact CB-CD2 3.91Å; P874-F877 HydrophobicContact CB-CE2 3.93Å; P874-F877 HydrophobicContact CG-CD2 4Å; P874-F877 HydrophobicContact CG-CE2 3.71Å; P874-F877 PolarHBondContact O-N 2.98Å
875	P	57.1	Low	58.2	Low	119 Å²	119	63.7 Å²	63.7	77%	0.773	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	48	-172.8	31.9	-36.3	0	0	0	113
876	H	54.1	Low	56.5	Low	82 Å²	82	65 Å²	65	38%	0.38	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.7	-36.4	-172.1	-41.6	-26.4	0	0	0	109	P874 R1064	P874-H876 PolarHBondContact O-N 2.91Å; H876-R1064 PolarHBondContact ND1-NH2 3.33Å
877	F	62.1	Low	54.8	Low	25 Å²	25	67.8 Å²	67.8	11%	0.11	40%	0.395	C	S	.	.	S	Bend	trans	-77.9	143	173	-61	-99.9	0	0	0	110.4	L873 P874 Y1054 E1056 I1109 L1111	L873-F877 HydrophobicContact CB-CB 4.16Å; L873-F877 HydrophobicContact CD1-CB 4.29Å; L873-F877 HydrophobicContact CD2-CB 4.09Å; L873-F877 HydrophobicContact CD2-CG 4.28Å; L873-F877 HydrophobicContact CG-CB 4.4Å; P874-F877 HydrophobicContact CB-CD2 3.91Å; P874-F877 HydrophobicContact CB-CE2 3.93Å; P874-F877 HydrophobicContact CG-CD2 4Å; P874-F877 HydrophobicContact CG-CE2 3.71Å; P874-F877 PolarHBondContact O-N 2.98Å; F877-Y1054 AromaticContact CD1-CD1 3.29Å; F877-Y1054 HydrophobicContact CD1-CD1 3.29Å; F877-Y1054 AromaticContact CD1-CE1 3.39Å; F877-Y1054 HydrophobicContact CD1-CE1 3.39Å; F877-Y1054 HydrophobicContact CD1-CG 4.15Å; F877-Y1054 AromaticContact CE1-CD1 3.6Å; F877-Y1054 HydrophobicContact CE1-CD1 3.6Å; F877-Y1054 AromaticContact CE1-CE1 3.67Å; F877-Y1054 HydrophobicContact CE1-CE1 3.67Å; F877-Y1054 HydrophobicContact CG-CD1 4.37Å; F877-Y1054 HydrophobicContact CG-CE1 4.16Å; F877-E1056 HydrophobicContact CE1-CB 4.49Å; F877-E1056 VanDerWaalsContact CZ-CD 3.44Å; F877-E1056 VanDerWaalsContact CZ-OE1 3.3Å; F877-E1056 WeakPolarHBondContact CZ-OE1 3.31Å; F877-E1056 WeakPolarHBondContact CZ-OE2 3.41Å; F877-I1109 HydrophobicContact CD1-CG2 4.47Å; F877-I1109 HydrophobicContact CE1-CD1 3.79Å; F877-I1109 HydrophobicContact CE1-CG2 4.03Å; F877-I1109 HydrophobicContact CZ-CD1 4.27Å; F877-L1111 HydrophobicContact CB-CD2 3.89Å; F877-L1111 HydrophobicContact CD1-CD2 3.78Å; F877-L1111 HydrophobicContact CG-CD2 4.25Å
878	P	62.4	Low	53.5	Low	58 Å²	58	72.2 Å²	72.2	38%	0.377	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-70.6	148.6	175.1	28.6	-31.3	0	0	0	110.5	L873 Y1054 L1111	L873-P878 WeakPolarHBondContact CD1-O 3.04Å; P878-Y1054 HydrophobicContact CG-CD2 3.7Å; P878-Y1054 HydrophobicContact CG-CE2 3.88Å; P878-L1111 HydrophobicContact CG-CD1 3.84Å; P878-L1111 WeakPolarHBondContact O-CD1 3.07Å
879	P	60.5	Low	52.2	Low	111 Å²	111	76 Å²	76	72%	0.721	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-65.3	154.1	174.5	30.1	-35.8	0	0	0	110.6
880	C	58	Low	51.5	Low	12 Å²	12	75.1 Å²	75.1	8%	0.081	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-58.6	141.6	176	-83.2	0	0	0	0	112.9	F870 L882 L1111 C1112	F870-C880 HydrophobicContact CD1-CB 3.48Å; F870-C880 VanDerWaalsContact CD1-CB 3.48Å; F870-C880 WeakPolarHBondContact CD1-SG 3.18Å; F870-C880 HydrophobicContact CD2-CB 4.44Å; F870-C880 HydrophobicContact CE1-CB 3.36Å; F870-C880 HydrophobicContact CE2-CB 4.35Å; F870-C880 HydrophobicContact CG-CB 4.03Å; F870-C880 HydrophobicContact CZ-CB 3.83Å; C880-L882 PolarHBondContact O-N 2.99Å; C880-L1111 PolarHBondContact SG-O 3.05Å; C880-C1112 VanDerWaalsContact CA-SG 3.59Å; C880-C1112 HydrophobicContact CB-CB 4.16Å; C880-C1112 WeakPolarHBondContact CB-SG 2.93Å; C880-C1112 WeakPolarHBondContact SG-CA 3.19Å; C880-C1112 WeakPolarHBondContact SG-CB 3.35Å; C880-C1112 PolarHBondContact SG-N 3.26Å; C880-C1112 VanDerWaalsContact SG-N 3.43Å; C880-C1112 CovalentContact SG-SG 2.04Å; C880-C1112 PolarHBondContact SG-SG 2.8Å
881	P	57.4	Low	50.6	Low	51 Å²	51	74.7 Å²	74.7	33%	0.331	44%	0.437	S	S	.	.			trans	-65.5	100.1	168.7	32.2	-39	0	0	0	109.1	V883 Y1052	P881-V883 VanDerWaalsContact C-N 3.25Å; P881-V883 PolarHBondContact O-N 3.05Å; P881-Y1052 HydrophobicContact CB-CE1 4.3Å; P881-Y1052 HydrophobicContact CB-CE2 4.26Å; P881-Y1052 VanDerWaalsContact CD-CD1 3.48Å; P881-Y1052 HydrophobicContact CG-CD1 3.56Å; P881-Y1052 HydrophobicContact CG-CD2 3.6Å; P881-Y1052 HydrophobicContact CG-CE1 3.57Å; P881-Y1052 HydrophobicContact CG-CE2 3.62Å; P881-Y1052 HydrophobicContact CG-CG 3.55Å
882	L	50.4	Low	49.7	Very low	100 Å²	100	82.4 Å²	82.4	52%	0.524	47%	0.473	S	S	.	.			trans	-65.7	94.9	159.3	-72.7	161.8	0	0	0	106.8	F868 F870 C880 N884 I885	F868-L882 HydrophobicContact CD2-CD2 4.1Å; F870-L882 HydrophobicContact CE2-CD2 3.96Å; F870-L882 HydrophobicContact CE2-CG 4.3Å; F870-L882 HydrophobicContact CZ-CD2 3.72Å; F870-L882 HydrophobicContact CZ-CG 4.22Å; C880-L882 PolarHBondContact O-N 2.99Å; L882-N884 PolarHBondContact O-N 3.04Å; L882-N884 VanDerWaalsContact O-N 3.17Å; L882-I885 HydrophobicContact CD2-CD1 4.44Å
883	V	47.8	Very low	49.4	Very low	121 Å²	121	84.8 Å²	84.8	73%	0.733	48%	0.48	S	S	*	.			trans	-47	123.3	168.6	176.8	0	0	0	0	106.7	P881 I885	P881-V883 VanDerWaalsContact C-N 3.25Å; P881-V883 PolarHBondContact O-N 3.05Å; V883-I885 WeakPolarHBondContact O-CG1 3.4Å; V883-I885 PolarHBondContact O-N 3.16Å
884	N	38.6	Very low	49.5	Very low	121 Å²	121	88.1 Å²	88.1	65%	0.647	49%	0.493	S	S	*	.			trans	-61.5	102.2	-157.3	-173.7	18.6	0	0	0	112.1	L882 S886	L882-N884 PolarHBondContact O-N 3.04Å; L882-N884 VanDerWaalsContact O-N 3.17Å; N884-S886 PolarHBondContact ND2-OG 2.66Å; N884-S886 PolarHBondContact O-N 2.79Å; N884-S886 PolarHBondContact OD1-OG 2.78Å; N884-S886 VanDerWaalsContact OD1-OG 3.04Å
885	I	43.3	Very low	49.8	Very low	35 Å²	35	86.4 Å²	86.4	18%	0.179	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.6	-166.1	-55.5	-175.2	0	0	0	112.5	L865 F868 L882 V883 S887 W890	L865-I885 HydrophobicContact CD1-CB 4.41Å; L865-I885 HydrophobicContact CD1-CG2 3.67Å; F868-I885 HydrophobicContact CE2-CD1 3.98Å; L882-I885 HydrophobicContact CD2-CD1 4.44Å; V883-I885 WeakPolarHBondContact O-CG1 3.4Å; V883-I885 PolarHBondContact O-N 3.16Å; I885-S887 VanDerWaalsContact C-N 3.32Å; I885-S887 PolarHBondContact O-N 2.84Å; I885-W890 HydrophobicContact CB-CZ2 4.17Å; I885-W890 HydrophobicContact CG1-CZ2 4.27Å; I885-W890 HydrophobicContact CG2-CZ2 3.71Å; I885-W890 PolarHBondContact O-NE1 3.19Å
886	S	36	Very low	50.4	Low	81 Å²	81	85.3 Å²	85.3	57%	0.566	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	1.4	-174.5	63	0	0	0	0	116.6	N884 N888	N884-S886 PolarHBondContact ND2-OG 2.66Å; N884-S886 PolarHBondContact O-N 2.79Å; N884-S886 PolarHBondContact OD1-OG 2.78Å; N884-S886 VanDerWaalsContact OD1-OG 3.04Å; S886-N888 PolarHBondContact O-N 3.03Å
887	S	32.1	Very low	51.2	Low	74 Å²	74	81.9 Å²	81.9	52%	0.517	45%	0.452	S	S	.	.			trans	-70.5	115.1	165.6	55.5	0	0	0	0	110.1	I885 D889 W890	I885-S887 VanDerWaalsContact C-N 3.32Å; I885-S887 PolarHBondContact O-N 2.84Å; S887-D889 PolarHBondContact O-N 2.74Å; S887-W890 PolarHBondContact O-NE1 2.68Å
888	N	37.9	Very low	51.7	Low	143 Å²	143	81.4 Å²	81.4	77%	0.765	45%	0.451	S	S	*	.	S	Bend	trans	-66.6	8.7	-173.1	-84.5	-16.5	0	0	0	116.4	Q863 S886	Q863-N888 PolarHBondContact NE2-OD1 3.43Å; S886-N888 PolarHBondContact O-N 3.03Å
889	D	37	Very low	52.4	Low	120 Å²	120	78.8 Å²	78.8	64%	0.642	43%	0.434	S	S	*	.			trans	-122.1	54.7	-167.6	-145	-22.5	0	0	0	113.3	S887 S891	S887-D889 PolarHBondContact O-N 2.74Å; D889-S891 PolarHBondContact O-N 3.16Å; D889-S891 WeakPolarHBondContact OD1-CB 3.29Å; D889-S891 PolarHBondContact OD1-OG 2.9Å
890	W	45.1	Very low	52.7	Low	83 Å²	83	74.1 Å²	74.1	31%	0.314	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	25.3	177.4	-78.1	83.1	0	0	0	114.1	I885 S887 L895 L1016	I885-W890 HydrophobicContact CB-CZ2 4.17Å; I885-W890 HydrophobicContact CG1-CZ2 4.27Å; I885-W890 HydrophobicContact CG2-CZ2 3.71Å; I885-W890 PolarHBondContact O-NE1 3.19Å; S887-W890 PolarHBondContact O-NE1 2.68Å; W890-L895 HydrophobicContact CH2-CD1 3.99Å; W890-L895 HydrophobicContact CZ3-CB 4.44Å; W890-L895 HydrophobicContact CZ3-CD1 3.86Å; W890-L1016 HydrophobicContact CE3-CD1 4.5Å
891	S	42.2	Very low	53.5	Low	64 Å²	64	73.9 Å²	73.9	45%	0.448	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-20	-169.4	57.4	0	0	0	0	114.2	D889	D889-S891 PolarHBondContact O-N 3.16Å; D889-S891 WeakPolarHBondContact OD1-CB 3.29Å; D889-S891 PolarHBondContact OD1-OG 2.9Å
892	H	42.8	Very low	54.3	Low	168 Å²	168	74 Å²	74	78%	0.778	40%	0.402	S	S	*	.	S	Bend	trans	-125.7	-18.2	-169.9	-70.8	80.3	0	0	0	116.2
893	D	54	Low	55.3	Low	121 Å²	121	69.8 Å²	69.8	65%	0.647	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-97.5	140	-175.2	-74.4	-43.8	0	0	0	113.8
894	K	58.4	Low	56.6	Low	106 Å²	106	65.2 Å²	65.2	46%	0.461	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-88.9	121	174.2	-76.1	-173.4	176.4	-178.6	0	111	I896 S987	K894-I896 PolarHBondContact O-N 3.27Å; K894-S987 PolarHBondContact NZ-OG 2.81Å
895	L	68.7	Low	58.6	Low	20 Å²	20	59.6 Å²	59.6	11%	0.105	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	118.2	179.6	-177.4	71.5	0	0	0	112.7	P866 F868 W890 N1017 I1018 Y1019	P866-L895 HydrophobicContact CB-CD2 4.32Å; P866-L895 HydrophobicContact CG-CD2 4.13Å; F868-L895 HydrophobicContact CE1-CD1 4.05Å; F868-L895 HydrophobicContact CE1-CD2 3.96Å; F868-L895 HydrophobicContact CE1-CG 4.16Å; F868-L895 HydrophobicContact CZ-CD1 3.64Å; F868-L895 HydrophobicContact CZ-CD2 3.75Å; F868-L895 HydrophobicContact CZ-CG 4.08Å; W890-L895 HydrophobicContact CH2-CD1 3.99Å; W890-L895 HydrophobicContact CZ3-CB 4.44Å; W890-L895 HydrophobicContact CZ3-CD1 3.86Å; L895-N1017 VanDerWaalsContact CB-O 3.22Å; L895-N1017 WeakPolarHBondContact CB-O 3.46Å; L895-N1017 PolarHBondContact N-O 3.31Å; L895-I1018 HydrophobicContact CB-CG1 4.46Å; L895-I1018 CarbonylContact O-C 2.66Å; L895-I1018 VanDerWaalsContact O-CA 3.31Å; L895-I1018 WeakPolarHBondContact O-CA 3.15Å; L895-Y1019 PolarHBondContact O-N 2.96Å
896	I	68.8	Low	60.3	Low	96 Å²	96	59.4 Å²	59.4	49%	0.492	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	127	178.1	-57.6	168.8	0	0	0	110.8	K894 Y1019	K894-I896 PolarHBondContact O-N 3.27Å; I896-Y1019 HydrophobicContact CG1-CD1 4.36Å
897	L	72.8	Confident	62.6	Low	9 Å²	9	55.7 Å²	55.7	5%	0.047	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	151	167.7	-66.8	-178.1	0	0	0	111.5	F868 T903 I1018 Y1019 L1020	F868-L897 HydrophobicContact CD1-CD2 3.99Å; F868-L897 HydrophobicContact CE1-CD2 3.78Å; L897-T903 HydrophobicContact CD2-CG2 4.01Å; L897-I1018 HydrophobicContact CD1-CD1 4.37Å; L897-I1018 HydrophobicContact CD1-CG2 3.57Å; L897-I1018 HydrophobicContact CG-CG2 3.82Å; L897-Y1019 PolarHBondContact N-O 2.73Å; L897-L1020 HydrophobicContact CB-CD2 3.96Å; L897-L1020 WeakPolarHBondContact O-CA 3.08Å
898	P	71.5	Confident	64.9	Low	16 Å²	16	52.8 Å²	52.8	10%	0.104	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	137.4	169.9	32.2	-35.2	0	0	0	110.7	T900 I901 F1113 P1114	P898-T900 PolarHBondContact O-N 3Å; P898-I901 HydrophobicContact CG-CD1 4.02Å; P898-I901 HydrophobicContact CG-CG1 3.66Å; P898-F1113 HydrophobicContact CB-CD2 4.08Å; P898-F1113 HydrophobicContact CB-CE2 3.87Å; P898-F1113 HydrophobicContact CB-CZ 4.15Å; P898-P1114 HydrophobicContact CB-CG 3.88Å; P898-P1114 HydrophobicContact CG-CG 3.77Å
899	N	76.5	Confident	67.1	Low	3 Å²	3	47 Å²	47	2%	0.016	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	18.7	-178.9	75.6	-0.5	0	0	0	114.3	L981 G982 H983 S984 L1020 S1021	N899-L981 CarbonylContact O-C 3.56Å; N899-L981 VanDerWaalsContact O-CA 3.32Å; N899-L981 WeakPolarHBondContact O-CA 3.45Å; N899-G982 PolarHBondContact ND2-O 2.85Å; N899-G982 VanDerWaalsContact ND2-O 3.08Å; N899-G982 PolarHBondContact O-N 2.02Å; N899-G982 WeakPolarHBondContact OD1-CA 3.32Å; N899-G982 PolarHBondContact OD1-N 3.23Å; N899-H983 PolarHBondContact ND2-N 2.85Å; N899-S984 WeakPolarHBondContact CB-O 3.45Å; N899-S984 PolarHBondContact ND2-O 2.98Å; N899-L1020 HydrophobicContact CB-CD2 4.29Å; N899-S1021 VanDerWaalsContact CG-O 3.28Å; N899-S1021 PolarHBondContact ND2-O 2.91Å
900	T	68	Low	69.2	Low	12 Å²	12	43.7 Å²	43.7	7%	0.074	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-8.8	-170.2	49.6	0	0	0	0	114.6	P898 F1113 P1114	P898-T900 PolarHBondContact O-N 3Å; T900-F1113 HydrophobicContact CG2-CE1 4.04Å; T900-P1114 WeakPolarHBondContact CB-O 3.41Å; T900-P1114 WeakPolarHBondContact CG2-O 2.79Å; T900-P1114 PolarHBondContact OG1-O 3.25Å
901	I	73.6	Confident	70.7	Confident	8 Å²	8	40 Å²	40	4%	0.041	21%	0.209	C	C	.	.	S	Bend	trans	-151	166	-174.7	57.7	157	0	0	0	115.8	Q869 P898 P978 P1114 L1126	Q869-I901 HydrophobicContact CB-CD1 4Å; Q869-I901 WeakPolarHBondContact O-CD1 3.35Å; P898-I901 HydrophobicContact CG-CD1 4.02Å; P898-I901 HydrophobicContact CG-CG1 3.66Å; I901-P978 WeakPolarHBondContact O-CD 3.36Å; I901-P978 WeakPolarHBondContact O-CG 3.45Å; I901-P1114 HydrophobicContact CD1-CG 3.69Å; I901-P1114 HydrophobicContact CG1-CG 3.81Å; I901-P1114 HydrophobicContact CG2-CB 4.3Å; I901-P1114 HydrophobicContact CG2-CG 4.22Å; I901-L1126 HydrophobicContact CG2-CD1 3.79Å; I901-L1126 HydrophobicContact CG2-CD2 3.42Å; I901-L1126 VanDerWaalsContact CG2-CD2 3.42Å; I901-L1126 HydrophobicContact CG2-CG 4.26Å
902	P	74.6	Confident	72.3	Confident	54 Å²	54	40.4 Å²	40.4	35%	0.351	21%	0.212	S	C	.	.			trans	-73.1	175.4	167.5	-17.5	33.9	0	0	0	115.9	I976 T977	P902-I976 CarbonylContact C-O 3.51Å; P902-I976 WeakPolarHBondContact CA-O 3.48Å; P902-I976 WeakPolarHBondContact CB-O 3.37Å; P902-T977 HydrophobicContact CB-CG2 3.76Å; P902-T977 HydrophobicContact CG-CG2 3.91Å
903	T	70.7	Confident	73.8	Confident	10 Å²	10	39.6 Å²	39.6	6%	0.061	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	158	-177.8	-49.2	0	0	0	0	113.7	V867 L897 L975 I976	V867-T903 WeakPolarHBondContact O-CG2 3.43Å; L897-T903 HydrophobicContact CD2-CG2 4.01Å; T903-L975 CarbonylContact O-C 2.75Å; T903-L975 WeakPolarHBondContact O-CA 3.25Å; T903-I976 PolarHBondContact N-O 2.89Å; T903-I976 PolarHBondContact O-N 2.85Å
904	V	77	Confident	74.5	Confident	26 Å²	26	38.4 Å²	38.4	16%	0.158	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	160.5	-171.1	170.5	0	0	0	0	112.8	V867 Y973 F974 L975	V867-V904 HydrophobicContact CB-CB 3.93Å; V867-V904 HydrophobicContact CB-CG1 4.05Å; V867-V904 HydrophobicContact CG1-CB 4.4Å; V867-V904 HydrophobicContact CG2-CG1 4.32Å; V867-V904 PolarHBondContact N-O 3.33Å; V867-V904 PolarHBondContact O-N 3.46Å; V904-Y973 HydrophobicContact CG1-CD2 4.4Å; V904-F974 CarbonylContact C-O 3.58Å; V904-F974 VanDerWaalsContact CA-O 3.27Å; V904-F974 WeakPolarHBondContact CA-O 3.47Å; V904-F974 WeakPolarHBondContact CG1-O 3.12Å; V904-L975 HydrophobicContact CG2-CD2 3.48Å; V904-L975 VanDerWaalsContact CG2-CD2 3.48Å; V904-L975 HydrophobicContact CG2-CG 3.93Å
905	I	79.9	Confident	75.3	Confident	3 Å²	3	35.5 Å²	35.5	2%	0.015	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	142.1	-179.6	-54.2	-172.2	0	0	0	113.8	L865 P866 Y973 F974 I976 L1016	L865-I905 CarbonylContact O-C 3.58Å; L865-I905 WeakPolarHBondContact O-CA 3.04Å; P866-I905 HydrophobicContact CB-CG1 4.3Å; I905-Y973 CarbonylContact O-C 3.6Å; I905-Y973 WeakPolarHBondContact O-CA 3.45Å; I905-Y973 WeakPolarHBondContact O-CB 3.45Å; I905-F974 HydrophobicContact CB-CD1 4.06Å; I905-F974 HydrophobicContact CB-CD2 4.36Å; I905-F974 HydrophobicContact CB-CE1 3.67Å; I905-F974 HydrophobicContact CB-CE2 3.99Å; I905-F974 HydrophobicContact CB-CG 4.4Å; I905-F974 HydrophobicContact CB-CZ 3.64Å; I905-F974 HydrophobicContact CD1-CE2 3.69Å; I905-F974 HydrophobicContact CD1-CZ 3.62Å; I905-F974 HydrophobicContact CG1-CE2 4.09Å; I905-F974 HydrophobicContact CG1-CZ 4.05Å; I905-F974 HydrophobicContact CG2-CD1 4.33Å; I905-F974 HydrophobicContact CG2-CE1 3.57Å; I905-F974 HydrophobicContact CG2-CE2 4.49Å; I905-F974 HydrophobicContact CG2-CZ 3.66Å; I905-F974 PolarHBondContact N-O 2.92Å; I905-F974 PolarHBondContact O-N 3.33Å; I905-I976 HydrophobicContact CD1-CD1 3.98Å; I905-L1016 HydrophobicContact CD1-CD2 3.8Å
906	H	78.9	Confident	75.7	Confident	31 Å²	31	38 Å²	38	14%	0.144	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	171.9	-176	-83.2	-66	0	0	0	116.9	L864 L865 V867 P972	L864-H906 WeakPolarHBondContact CA-O 2.26Å; L865-H906 HydrophobicContact CB-CB 4.31Å; L865-H906 PolarHBondContact N-O 3.45Å; L865-H906 VanDerWaalsContact N-O 3.14Å; L865-H906 PolarHBondContact O-N 2.74Å; V867-H906 WeakPolarHBondContact CG2-CD2 2.83Å; H906-P972 CarbonylContact C-O 3.35Å; H906-P972 VanDerWaalsContact CA-O 3.3Å; H906-P972 WeakPolarHBondContact CA-O 3Å; H906-P972 PolarHBondContact ND1-O 2.9Å
907	L	83.3	Confident	76.2	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.7	174.6	-64.9	119.5	0	0	0	115	L862 Q863 L864 V952 P972 V992	L862-L907 HydrophobicContact CD1-CD2 3.93Å; Q863-L907 WeakPolarHBondContact O-CA 2.93Å; L864-L907 HydrophobicContact CD2-CD2 4.16Å; L864-L907 HydrophobicContact CD2-CG 4.13Å; L907-V952 HydrophobicContact CD1-CG1 4.04Å; L907-P972 HydrophobicContact CB-CG 4.02Å; L907-P972 HydrophobicContact CD1-CB 3.88Å; L907-P972 HydrophobicContact CD1-CG 3.88Å; L907-P972 PolarHBondContact N-O 2.85Å; L907-V992 HydrophobicContact CD2-CG1 3.74Å
908	I	82	Confident	76.2	Confident	14 Å²	14	36 Å²	36	7%	0.072	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	153.1	-176.5	-53.2	177	0	0	0	113	L862 Q863 F910	L862-I908 WeakPolarHBondContact CA-O 3.19Å; L862-I908 WeakPolarHBondContact CD1-O 3.29Å; Q863-I908 PolarHBondContact N-O 3.22Å; Q863-I908 PolarHBondContact O-N 2.95Å; I908-F910 HydrophobicContact CG2-CE2 3.99Å; I908-F910 HydrophobicContact CG2-CZ 4.14Å
909	F	82.5	Confident	76.4	Confident	21 Å²	21	36.5 Å²	36.5	9%	0.092	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.3	176.8	-63.6	-87	0	0	0	114.2	S861 V920 L923 V994	S861-F909 WeakPolarHBondContact O-CA 2.27Å; F909-V920 HydrophobicContact CD2-CG2 4.26Å; F909-L923 HydrophobicContact CD1-CD1 3.69Å; F909-L923 HydrophobicContact CD2-CD1 4.46Å; F909-L923 HydrophobicContact CE1-CB 4.05Å; F909-L923 HydrophobicContact CE1-CD1 3.53Å; F909-L923 HydrophobicContact CE1-CG 4.36Å; F909-L923 HydrophobicContact CE2-CB 4.41Å; F909-L923 HydrophobicContact CE2-CD1 4.34Å; F909-L923 HydrophobicContact CG-CD1 4.16Å; F909-L923 HydrophobicContact CZ-CB 3.73Å; F909-L923 HydrophobicContact CZ-CD1 3.89Å; F909-L923 HydrophobicContact CZ-CG 4.45Å; F909-V994 HydrophobicContact CE1-CG1 3.94Å; F909-V994 HydrophobicContact CZ-CG1 4.33Å
910	F	82.9	Confident	76.3	Confident	51 Å²	51	37.7 Å²	37.7	22%	0.224	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	158.5	178.4	-61.8	-92.6	0	0	0	113.9	A859 V860 S861 I908 Q915	A859-F910 CarbonylContact C-O 3.56Å; A859-F910 WeakPolarHBondContact CA-O 2.25Å; V860-F910 PolarHBondContact N-O 3.4Å; S861-F910 VanDerWaalsContact OG-CD2 3.32Å; S861-F910 WeakPolarHBondContact OG-CD2 3.19Å; I908-F910 HydrophobicContact CG2-CE2 3.99Å; I908-F910 HydrophobicContact CG2-CZ 4.14Å; F910-Q915 CarbonylContact C-O 3.55Å; F910-Q915 WeakPolarHBondContact CA-O 3.42Å
911	G	75.3	Confident	76.5	Confident	4 Å²	4	41.7 Å²	41.7	4%	0.041	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-167	179.6	0	0	0	0	0	116.1	V858 S914 Q915	V858-G911 CarbonylContact O-C 3.4Å; V858-G911 WeakPolarHBondContact O-CA 2.25Å; G911-S914 PolarHBondContact O-N 3.27Å; G911-Q915 VanDerWaalsContact CA-OE1 3.28Å; G911-Q915 PolarHBondContact N-O 3.49Å
912	S	76.6	Confident	76.6	Confident	73 Å²	73	42.4 Å²	42.4	51%	0.51	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-31.9	-172	75.5	0	0	0	0	114.2	D857 V858 S914	D857-S912 VanDerWaalsContact CG-OG 3.24Å; D857-S912 PolarHBondContact OD1-OG 2.94Å; D857-S912 VanDerWaalsContact OD1-OG 3.1Å; D857-S912 WeakPolarHBondContact OD2-CB 3.09Å; D857-S912 PolarHBondContact OD2-N 3.19Å; D857-S912 PolarHBondContact OD2-OG 2.69Å; V858-S912 PolarHBondContact O-N 2.77Å; S912-S914 PolarHBondContact O-N 3.04Å
913	E	74.1	Confident	76.7	Confident	152 Å²	152	40.7 Å²	40.7	71%	0.71	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	18.9	171.1	-60.3	-164.9	143.8	0	0	112	Q915	E913-Q915 PolarHBondContact O-N 2.77Å
914	S	68.7	Low	76.9	Confident	96 Å²	96	45.1 Å²	45.1	67%	0.671	25%	0.249	S	C	*	.	S	Bend	trans	63.6	19.4	-175.8	-49.9	0	0	0	0	115.4	G911 S912	G911-S914 PolarHBondContact O-N 3.27Å; S912-S914 PolarHBondContact O-N 3.04Å
915	Q	74.4	Confident	76.8	Confident	44 Å²	44	44.8 Å²	44.8	21%	0.206	25%	0.248	C	C	.	.			trans	-79.5	146	175.3	75.7	-73.8	45.8	0	0	112.2	P733 D857 F910 G911 E913	P733-Q915 HydrophobicContact CB-CG 4.47Å; D857-Q915 PolarHBondContact OD2-NE2 3.28Å; F910-Q915 CarbonylContact C-O 3.55Å; F910-Q915 WeakPolarHBondContact CA-O 3.42Å; G911-Q915 VanDerWaalsContact CA-OE1 3.28Å; G911-Q915 PolarHBondContact N-O 3.49Å; E913-Q915 PolarHBondContact O-N 2.77Å
916	E	77.5	Confident	76.9	Confident	74 Å²	74	49.8 Å²	49.8	35%	0.346	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-73	132.4	170.5	-174.5	169.9	177.2	0	0	109.6	R971	E916-R971 IonicContact OE1-CZ 3.45Å; E916-R971 IonicContact OE1-NE 2.66Å; E916-R971 PolarHBondContact OE1-NE 2.79Å; E916-R971 IonicContact OE1-NH2 3.91Å; E916-R971 PolarHBondContact OE1-NH2 2.78Å; E916-R971 IonicContact OE2-NH2 2.8Å; E916-R971 PolarHBondContact OE2-NH2 2.86Å
917	L	78.6	Confident	76.8	Confident	8 Å²	8	49.2 Å²	49.2	4%	0.042	27%	0.274	C	S	.	.			trans	-91.2	116	-178.5	-65.8	170	0	0	0	109.7	D857 A859 S919 V920	D857-L917 HydrophobicContact CB-CD2 4.46Å; A859-L917 HydrophobicContact CB-CD1 3.65Å; L917-S919 VanDerWaalsContact C-N 3.26Å; L917-S919 PolarHBondContact O-N 3.32Å; L917-V920 HydrophobicContact CB-CG1 3.66Å; L917-V920 HydrophobicContact CD1-CG1 4.39Å
918	E	73.6	Confident	76.8	Confident	54 Å²	54	52.4 Å²	52.4	25%	0.252	29%	0.293	S	S	.	.	S	Bend	trans	-65.9	-24.8	-174	-72	-157.3	151.3	0	0	114.4	T732 R740 H969	T732-E918 WeakPolarHBondContact CG2-OE2 3.35Å; R740-E918 IonicContact CZ-OE2 3.9Å; R740-E918 VanDerWaalsContact CZ-OE2 3.24Å; R740-E918 IonicContact NE-OE2 3.3Å; R740-E918 PolarHBondContact NE-OE2 2.59Å; R740-E918 IonicContact NH2-OE1 3.85Å; R740-E918 IonicContact NH2-OE2 3.87Å; R740-E918 PolarHBondContact NH2-OE2 3.45Å; E918-H969 IonicContact OE1-CE1 3.18Å; E918-H969 PolarHBondContact OE1-CE1 3.18Å
919	S	75.7	Confident	76.6	Confident	27 Å²	27	52.5 Å²	52.5	19%	0.189	29%	0.294	C	S	.	.			trans	-128.3	121.5	177.5	-156.7	0	0	0	0	109	A735 L917 D921	A735-S919 WeakPolarHBondContact CB-O 2.98Å; L917-S919 VanDerWaalsContact C-N 3.26Å; L917-S919 PolarHBondContact O-N 3.32Å; S919-D921 PolarHBondContact OG-OD1 3.07Å
920	V	74.7	Confident	76.4	Confident	27 Å²	27	54.4 Å²	54.4	16%	0.164	31%	0.31	C	S	.	.			trans	-135.7	42.6	-176.4	-68.4	0	0	0	0	111.5	F909 L917 S922 L923	F909-V920 HydrophobicContact CD2-CG2 4.26Å; L917-V920 HydrophobicContact CB-CG1 3.66Å; L917-V920 HydrophobicContact CD1-CG1 4.39Å; V920-S922 PolarHBondContact O-N 3Å; V920-L923 HydrophobicContact CB-CD1 4.35Å
921	D	72.8	Confident	75.5	Confident	97 Å²	97	55.5 Å²	55.5	52%	0.519	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	40.4	-174.2	42	-50.9	0	0	0	114.7	S738 S919	S738-D921 WeakPolarHBondContact CB-OD1 2.77Å; S738-D921 PolarHBondContact OG-OD1 3.02Å; S919-D921 PolarHBondContact OG-OD1 3.07Å
922	S	74.1	Confident	74.7	Confident	23 Å²	23	58.5 Å²	58.5	16%	0.161	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-154.1	21.6	-174.6	55.4	0	0	0	0	117.8	V920 S996 S997	V920-S922 PolarHBondContact O-N 3Å; S922-S996 WeakPolarHBondContact O-CA 3.47Å; S922-S997 WeakPolarHBondContact CA-OG 3.18Å; S922-S997 PolarHBondContact O-N 2.77Å; S922-S997 PolarHBondContact O-OG 2.8Å
923	L	76.7	Confident	73.7	Confident	18 Å²	18	60.1 Å²	60.1	9%	0.094	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	162.4	-170.5	-52.2	171.1	0	0	0	115.8	F909 V920 M954 H995	F909-L923 HydrophobicContact CD1-CD1 3.69Å; F909-L923 HydrophobicContact CD2-CD1 4.46Å; F909-L923 HydrophobicContact CE1-CB 4.05Å; F909-L923 HydrophobicContact CE1-CD1 3.53Å; F909-L923 HydrophobicContact CE1-CG 4.36Å; F909-L923 HydrophobicContact CE2-CB 4.41Å; F909-L923 HydrophobicContact CE2-CD1 4.34Å; F909-L923 HydrophobicContact CG-CD1 4.16Å; F909-L923 HydrophobicContact CZ-CB 3.73Å; F909-L923 HydrophobicContact CZ-CD1 3.89Å; F909-L923 HydrophobicContact CZ-CG 4.45Å; V920-L923 HydrophobicContact CB-CD1 4.35Å; L923-M954 WeakPolarHBondContact O-CE 2.24Å; L923-H995 VanDerWaalsContact CA-O 3.3Å; L923-H995 WeakPolarHBondContact CA-O 3.13Å
924	V	75.2	Confident	72.2	Confident	102 Å²	102	58.3 Å²	58.3	62%	0.618	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151	160.2	-171.3	-164.2	0	0	0	0	116.7	V994 H995	V924-V994 CarbonylContact O-C 2.88Å; V924-V994 WeakPolarHBondContact O-CA 3.43Å; V924-V994 WeakPolarHBondContact O-CB 3.22Å; V924-V994 WeakPolarHBondContact O-CG1 3.46Å; V924-V994 WeakPolarHBondContact O-CG2 3.08Å; V924-H995 PolarHBondContact N-O 3.01Å; V924-H995 VanDerWaalsContact N-O 3.14Å; V924-H995 PolarHBondContact O-N 3.48Å; V924-H995 VanDerWaalsContact O-N 3.14Å
925	S	75.5	Confident	70.9	Confident	19 Å²	19	61.8 Å²	61.8	13%	0.133	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	176.1	-175.7	66.6	0	0	0	0	121.8	T993	S925-T993 CarbonylContact C-O 3.46Å; S925-T993 WeakPolarHBondContact CA-O 3.46Å; S925-T993 WeakPolarHBondContact CB-O 3.42Å
926	N	81	Confident	69.2	Low	109 Å²	109	70.2 Å²	70.2	58%	0.583	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-158.1	170.5	-176.2	-106.8	-119.3	0	0	0	118.4	V992 T993	N926-V992 WeakPolarHBondContact O-CA 3.49Å; N926-V992 WeakPolarHBondContact O-CB 3.43Å; N926-V992 VanDerWaalsContact O-CG1 3.29Å; N926-V992 WeakPolarHBondContact O-CG1 2.26Å; N926-V992 WeakPolarHBondContact O-CG2 3.44Å; N926-T993 PolarHBondContact N-O 2.78Å; N926-T993 VanDerWaalsContact N-O 3.11Å; N926-T993 PolarHBondContact O-N 3.35Å
927	V	78	Confident	67	Low	19 Å²	19	70 Å²	70	12%	0.115	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	160	-166.4	-155.5	0	0	0	0	121.1	P950 V952 F974 V990 H991 V992	V927-P950 HydrophobicContact CB-CG 4.23Å; V927-P950 HydrophobicContact CG1-CG 3.93Å; V927-V952 HydrophobicContact CG2-CG2 3.39Å; V927-F974 HydrophobicContact CB-CD1 4.49Å; V927-F974 HydrophobicContact CG1-CD1 3.93Å; V927-F974 HydrophobicContact CG1-CD2 3.79Å; V927-F974 HydrophobicContact CG1-CE1 3.64Å; V927-F974 HydrophobicContact CG1-CE2 3.49Å; V927-F974 VanDerWaalsContact CG1-CE2 3.49Å; V927-F974 HydrophobicContact CG1-CG 4Å; V927-F974 HydrophobicContact CG1-CZ 3.4Å; V927-F974 VanDerWaalsContact CG1-CZ 3.4Å; V927-F974 HydrophobicContact CG2-CB 4.31Å; V927-F974 HydrophobicContact CG2-CD1 3.66Å; V927-F974 HydrophobicContact CG2-CE1 4Å; V927-F974 HydrophobicContact CG2-CG 3.94Å; V927-V990 HydrophobicContact CG1-CG1 4.26Å; V927-H991 CarbonylContact C-O 3.52Å; V927-H991 VanDerWaalsContact CA-O 3.25Å; V927-H991 WeakPolarHBondContact CA-O 3.42Å; V927-V992 HydrophobicContact CB-CG2 4.27Å; V927-V992 HydrophobicContact CG1-CG2 3.92Å; V927-V992 HydrophobicContact CG2-CG2 4.16Å
928	V	83.4	Confident	65	Low	69 Å²	69	75.5 Å²	75.5	42%	0.418	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	157.4	168.9	-179.2	0	0	0	0	116.9	V990 H991	V928-V990 CarbonylContact O-C 3.45Å; V928-V990 VanDerWaalsContact O-CA 3.3Å; V928-V990 WeakPolarHBondContact O-CA 2.79Å; V928-V990 VanDerWaalsContact O-CG1 3.29Å; V928-V990 WeakPolarHBondContact O-CG1 2.24Å; V928-H991 PolarHBondContact N-O 3.39Å; V928-H991 PolarHBondContact O-N 2.98Å
929	I	77	Confident	63.1	Low	15 Å²	15	79.9 Å²	79.9	8%	0.077	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	156.6	-179.3	-51.7	171.1	0	0	0	117.6	V948 P950 I976 A989 V990	I929-V948 VanDerWaalsContact CB-O 3.23Å; I929-V948 WeakPolarHBondContact CB-O 3.17Å; I929-V948 WeakPolarHBondContact CG1-O 3.14Å; I929-V948 PolarHBondContact N-O 2.7Å; I929-P950 HydrophobicContact CD1-CG 4.11Å; I929-P950 HydrophobicContact CG1-CG 4.48Å; I929-I976 HydrophobicContact CD1-CG1 4.09Å; I929-A989 CarbonylContact C-O 3.53Å; I929-A989 WeakPolarHBondContact CA-O 2.26Å; I929-A989 WeakPolarHBondContact CG2-O 3.44Å; I929-V990 HydrophobicContact CG1-CG1 4.19Å; I929-V990 HydrophobicContact CG1-CG2 4.33Å
930	S	78.7	Confident	61.5	Low	62 Å²	62	86 Å²	86	43%	0.434	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	-175.8	169.7	71.4	0	0	0	0	117.8	L988 A989	S930-L988 CarbonylContact O-C 3.57Å; S930-L988 WeakPolarHBondContact O-CA 3.07Å; S930-L988 WeakPolarHBondContact O-CB 3.42Å; S930-A989 PolarHBondContact N-O 2.86Å; S930-A989 PolarHBondContact O-N 2.68Å
931	S	63.1	Low	60.1	Low	74 Å²	74	95 Å²	95	52%	0.517	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	150.4	-171.5	-169.1	0	0	0	0	114.5	S987	S931-S987 PolarHBondContact OG-O 3.27Å
932	I	60.1	Low	59.1	Low	66 Å²	66	96.7 Å²	96.7	34%	0.338	53%	0.531	S	S	.	.			trans	-136.9	88.1	-168.1	-40.1	167.3	0	0	0	114.1	S987 L988 A989	I932-S987 PolarHBondContact N-O 2.77Å; I932-S987 WeakPolarHBondContact O-CB 3.39Å; I932-L988 WeakPolarHBondContact CD1-O 3.28Å; I932-A989 HydrophobicContact CD1-CB 4.18Å
933	D	55.4	Low	58.6	Low	108 Å²	108	102.5 Å²	102.5	58%	0.578	56%	0.556	S	S	*	*			trans	-152.7	170	172.6	-86.7	-57.2	0	0	0	113.1	S987	D933-S987 PolarHBondContact OD2-N 3Å
934	D	41.5	Very low	58.2	Low	113 Å²	113	102.1 Å²	102.1	60%	0.604	55%	0.554	S	S	*	*			trans	66.4	87.1	174.8	-73.6	-14.8	0	0	0	120.9
935	D	42	Very low	58.1	Low	169 Å²	169	98.5 Å²	98.5	90%	0.904	53%	0.531	S	S	*	.	S	Bend	trans	-83.4	5.3	156.1	-164.8	43.4	0	0	0	112.7
936	R	38	Very low	58.2	Low	221 Å²	221	102.7 Å²	102.7	83%	0.834	55%	0.549	S	S	*	.	S	Bend	trans	-144	83.7	177.2	-68.2	-168.6	-179.6	-162.5	0	111.6	T938	R936-T938 PolarHBondContact O-N 3.08Å
937	G	32.1	Very low	58	Low	71 Å²	71	105.1 Å²	105.1	73%	0.732	55%	0.551	S	S	*	*			trans	-62.9	115	-173.5	0	0	0	0	0	115.1
938	T	37	Very low	58	Low	122 Å²	122	108.2 Å²	108.2	75%	0.748	57%	0.57	S	S	*	*			trans	-130	131.6	151.9	37.4	0	0	0	0	108.8	R936 E940	R936-T938 PolarHBondContact O-N 3.08Å; T938-E940 PolarHBondContact O-N 3.47Å; T938-E940 VanDerWaalsContact O-N 3.14Å
939	T	33.5	Very low	57.9	Low	147 Å²	147	110.5 Å²	110.5	90%	0.902	58%	0.58	S	S	*	*	S	Bend	trans	-84	94.6	-156.8	52.1	0	0	0	0	115.1
940	E	41.6	Very low	58	Low	156 Å²	156	110.9 Å²	110.9	73%	0.729	58%	0.583	S	S	*	*			trans	-131	120.3	139.6	-73.1	-162.6	150.7	0	0	108.9	T938 L942	T938-E940 PolarHBondContact O-N 3.47Å; T938-E940 VanDerWaalsContact O-N 3.14Å; E940-L942 PolarHBondContact O-N 3.15Å
941	K	45.6	Very low	57.9	Low	215 Å²	215	112.6 Å²	112.6	94%	0.935	59%	0.593	S	S	*	*			trans	-73	86	170.2	-88	-168.5	171.8	-172.5	0	108.5	Q943	K941-Q943 VanDerWaalsContact C-N 3.3Å; K941-Q943 PolarHBondContact O-N 2.98Å
942	L	51.4	Low	58.4	Low	133 Å²	133	111.1 Å²	111.1	70%	0.696	58%	0.581	S	S	*	*			trans	-60.3	94.1	168.8	-79.5	161	0	0	0	108.7	E940 L944	E940-L942 PolarHBondContact O-N 3.15Å; L942-L944 PolarHBondContact O-N 2.9Å; L942-L944 VanDerWaalsContact O-N 3.14Å
943	Q	63.2	Low	58.8	Low	145 Å²	145	112.7 Å²	112.7	68%	0.678	59%	0.586	S	S	*	*			trans	-66.4	111.4	176.5	-174.9	170.7	-3	0	0	107.7	K941 A979	K941-Q943 VanDerWaalsContact C-N 3.3Å; K941-Q943 PolarHBondContact O-N 2.98Å; Q943-A979 WeakPolarHBondContact O-CB 3.1Å
944	L	70.1	Confident	59	Low	10 Å²	10	112.5 Å²	112.5	5%	0.052	58%	0.584	C	S	.	*			trans	-89.4	-27.4	-175	-67.5	177.1	0	0	0	113.5	L942 P978 A979 L988 L1020	L942-L944 PolarHBondContact O-N 2.9Å; L942-L944 VanDerWaalsContact O-N 3.14Å; L944-P978 CarbonylContact O-C 3.39Å; L944-P978 WeakPolarHBondContact O-CA 3.46Å; L944-A979 PolarHBondContact O-N 2.89Å; L944-L988 HydrophobicContact CB-CD2 3.98Å; L944-L988 HydrophobicContact CD1-CD2 4.16Å; L944-L1020 HydrophobicContact CD2-CD1 4.4Å
945	V	72	Confident	59.5	Low	25 Å²	25	112.8 Å²	112.8	15%	0.152	59%	0.585	C	S	.	*	B	Isolated β-bridge	trans	-135.9	161.9	-175.2	-68	0	0	0	0	113.5	I976 T977 L988	V945-I976 HydrophobicContact CG1-CG2 4.46Å; V945-T977 WeakPolarHBondContact CA-O 3.39Å; V945-T977 VanDerWaalsContact CB-O 3.26Å; V945-T977 WeakPolarHBondContact CB-O 3.4Å; V945-T977 WeakPolarHBondContact CG1-O 3.28Å; V945-L988 HydrophobicContact CG1-CD1 3.42Å; V945-L988 VanDerWaalsContact CG1-CD1 3.42Å; V945-L988 HydrophobicContact CG1-CD2 3.88Å; V945-L988 HydrophobicContact CG1-CG 4.31Å; V945-L988 HydrophobicContact CG2-CD2 4.12Å
946	Q	77.4	Confident	59.7	Low	108 Å²	108	113.8 Å²	113.8	51%	0.505	58%	0.577	S	S	.	*	S	Bend	trans	-89.4	-34.7	-173.8	-161.1	-174.4	11.3	0	0	114.8	T977	Q946-T977 VanDerWaalsContact CB-OG1 3.24Å; Q946-T977 WeakPolarHBondContact CB-OG1 3.32Å; Q946-T977 PolarHBondContact N-O 2.79Å; Q946-T977 VanDerWaalsContact N-O 3.12Å; Q946-T977 PolarHBondContact OE1-OG1 2.81Å; Q946-T977 VanDerWaalsContact OE1-OG1 3.1Å
947	Y	77.8	Confident	59.3	Low	159 Å²	159	108.8 Å²	108.8	62%	0.624	58%	0.576	S	S	*	*			trans	-135.3	162	-173.4	-63.2	-71.2	0	0	0	112
948	V	78.4	Confident	59.4	Low	85 Å²	85	112 Å²	112	52%	0.515	58%	0.577	S	S	.	*	S	Bend	trans	-120.6	-33.6	-172.7	-174.6	0	0	0	0	113.6	I929	I929-V948 VanDerWaalsContact CB-O 3.23Å; I929-V948 WeakPolarHBondContact CB-O 3.17Å; I929-V948 WeakPolarHBondContact CG1-O 3.14Å; I929-V948 PolarHBondContact N-O 2.7Å
949	D	79.9	Confident	58.9	Low	117 Å²	117	115.8 Å²	115.8	63%	0.626	58%	0.579	S	S	*	*			trans	-128.6	106.8	-173.5	-58.4	-60.2	0	0	0	112.1
950	P	79.6	Confident	58.8	Low	22 Å²	22	113.9 Å²	113.9	14%	0.143	56%	0.563	C	S	.	*			trans	-105.2	150	-176.4	38	-34	0	0	0	115.1	V927 I929 F974	V927-P950 HydrophobicContact CB-CG 4.23Å; V927-P950 HydrophobicContact CG1-CG 3.93Å; I929-P950 HydrophobicContact CD1-CG 4.11Å; I929-P950 HydrophobicContact CG1-CG 4.48Å; P950-F974 HydrophobicContact CB-CB 4.4Å; P950-F974 HydrophobicContact CB-CD2 4.26Å; P950-F974 HydrophobicContact CG-CB 4.46Å; P950-F974 HydrophobicContact CG-CD2 3.62Å; P950-F974 HydrophobicContact CG-CE2 4.22Å; P950-F974 HydrophobicContact CG-CG 4.33Å
951	P	77.2	Confident	58.4	Low	99 Å²	99	114.2 Å²	114.2	64%	0.643	56%	0.562	S	S	*	*			trans	-88.9	165.1	179.7	36	-36.5	0	0	0	114.6	F974	P951-F974 VanDerWaalsContact O-CB 3.29Å; P951-F974 WeakPolarHBondContact O-CB 3.23Å
952	V	73.3	Confident	57.6	Low	42 Å²	42	114.1 Å²	114.1	26%	0.255	56%	0.556	S	S	.	*			trans	-108.3	146.3	180	-170.2	0	0	0	0	112.6	L907 V927 P972 Y973	L907-V952 HydrophobicContact CD1-CG1 4.04Å; V927-V952 HydrophobicContact CG2-CG2 3.39Å; V952-P972 HydrophobicContact CG1-CB 3.88Å; V952-Y973 WeakPolarHBondContact CA-O 3.46Å
953	Q	68.9	Low	56.7	Low	99 Å²	99	113.2 Å²	113.2	46%	0.463	56%	0.56	S	S	.	*	B	Isolated β-bridge	trans	-128.4	152.5	-178.9	-58.8	179.9	-0.1	0	0	112.4	P972 Y973	Q953-P972 WeakPolarHBondContact O-CA 3.31Å; Q953-P972 WeakPolarHBondContact O-CB 3.47Å; Q953-Y973 HydrophobicContact CB-CE1 4.12Å; Q953-Y973 HydrophobicContact CB-CE2 4.43Å; Q953-Y973 PolarHBondContact N-O 2.83Å; Q953-Y973 PolarHBondContact O-N 3.15Å; Q953-Y973 PolarHBondContact OE1-OH 3.36Å; Q953-Y973 VanDerWaalsContact OE1-OH 3.11Å
954	M	58.2	Low	55.1	Low	105 Å²	105	115.6 Å²	115.6	52%	0.517	57%	0.569	S	S	.	*			trans	-126.7	143.9	175.7	-105.2	-168.1	177.2	0	0	110.2	L923 Y956 P972	L923-M954 WeakPolarHBondContact O-CE 2.24Å; M954-Y956 PolarHBondContact O-N 3.28Å; M954-P972 HydrophobicContact CG-CB 4.11Å; M954-P972 HydrophobicContact CG-CG 4.41Å
955	D	52.3	Low	53.3	Low	118 Å²	118	121.2 Å²	121.2	63%	0.631	60%	0.599	S	S	*	*			trans	-99	88.6	-170.4	-157.8	16.9	0	0	0	111.9
956	Y	46.8	Very low	51.6	Low	191 Å²	191	129.7 Å²	129.7	75%	0.749	63%	0.628	S	S	*	*			trans	-95.9	135	166.8	-92.7	-91.9	0	0	0	109.2	M954 D958	M954-Y956 PolarHBondContact O-N 3.28Å; Y956-D958 PolarHBondContact O-N 3.19Å; Y956-D958 VanDerWaalsContact O-N 3.1Å
957	S	30	Very low	49.7	Very low	116 Å²	116	132.7 Å²	132.7	81%	0.811	64%	0.635	S	S	*	*	S	Bend	trans	-56.5	106.5	-166.6	58	0	0	0	0	115.6
958	D	33.5	Very low	47.8	Very low	138 Å²	138	130.6 Å²	130.6	74%	0.738	63%	0.633	S	S	*	*			trans	-154.8	142.3	157.6	-127.3	1.2	0	0	0	111.4	Y956	Y956-D958 PolarHBondContact O-N 3.19Å; Y956-D958 VanDerWaalsContact O-N 3.1Å
959	Y	26.1	Very low	46.2	Very low	202 Å²	202	130.7 Å²	130.7	79%	0.792	63%	0.627	S	S	*	*			trans	-5.4	134.6	170.9	-65.1	-107.7	0	0	0	118.5
960	D	31.2	Very low	44.9	Very low	107 Å²	107	128.9 Å²	128.9	57%	0.572	62%	0.624	S	S	*	*				-168.8	135.2	55.8	-135.4	3.7	0	0	0	117.9	R962	D960-R962 PolarHBondContact O-N 3.27Å
961	K	32.8	Very low	44.3	Very low	162 Å²	162	131.5 Å²	131.5	70%	0.704	63%	0.631	S	S	*	*	S	Bend	trans	57.7	-19.6	144.5	-75.2	173.3	-163.6	80.7	0	126.4
962	R	30.7	Very low	44.2	Very low	213 Å²	213	127.1 Å²	127.1	80%	0.804	60%	0.602	S	S	*	*	S	Bend	trans	-126.8	-1.5	-167.4	-82.7	-168.3	-179.9	-170.3	0.8	122.3	D960	D960-R962 PolarHBondContact O-N 3.27Å
963	S	31.2	Very low	44.4	Very low	114 Å²	114	128.7 Å²	128.7	80%	0.797	60%	0.604	S	S	*	*			trans	-141.7	66.2	-174.4	60	0	0	0	0	117.5	N965	S963-N965 PolarHBondContact O-N 2.93Å
964	F	29.9	Very low	45.2	Very low	195 Å²	195	124.1 Å²	124.1	86%	0.855	58%	0.583	S	S	*	*			trans	-84.2	97.3	169.3	-73.8	-95.8	0	0	0	111.9
965	N	32.4	Very low	46.2	Very low	129 Å²	129	123.5 Å²	123.5	69%	0.69	58%	0.581	S	S	*	*	S	Bend	trans	-170.4	-4.2	154.7	-112.9	-30.5	0	0	0	118.4	I805 S963	I805-N965 WeakPolarHBondContact CD1-ND2 3.26Å; I805-N965 WeakPolarHBondContact CD1-OD1 3.42Å; S963-N965 PolarHBondContact O-N 2.93Å
966	R	36.8	Very low	47.5	Very low	202 Å²	202	118.6 Å²	118.6	76%	0.762	56%	0.555	S	S	*	*			trans	-118.4	116.5	167.3	-69.9	-176.9	177.9	-178	-0.5	108.3	M968	R966-M968 HydrophobicContact CB-CG 4.02Å; R966-M968 PolarHBondContact O-N 2.93Å
967	R	36.5	Very low	49.1	Very low	171 Å²	171	110.9 Å²	110.9	65%	0.645	53%	0.528	S	S	*	.			trans	-70.8	86	159.8	-69.2	-170.7	-173	176.5	5	106.6	I725	I725-R967 PolarHBondContact O-NH1 3.2Å; I725-R967 PolarHBondContact O-NH2 2.64Å
968	M	38	Very low	51.3	Low	116 Å²	116	106.4 Å²	106.4	57%	0.571	50%	0.496	S	S	*	.			trans	-77.2	125.9	172.2	-74	-168.2	164.4	0	0	108.6	R966	R966-M968 HydrophobicContact CB-CG 4.02Å; R966-M968 PolarHBondContact O-N 2.93Å
969	H	45.4	Very low	53.5	Low	86 Å²	86	102.1 Å²	102.1	40%	0.398	48%	0.479	S	S	.	.			trans	-60.8	146.3	161.1	-52.9	-102.5	0	0	0	107.9	E918 R971	E918-H969 IonicContact OE1-CE1 3.18Å; E918-H969 PolarHBondContact OE1-CE1 3.18Å; H969-R971 WeakPolarHBondContact O-CG 3.27Å; H969-R971 PolarHBondContact O-N 2.88Å
970	S	53.2	Low	55.8	Low	80 Å²	80	97.6 Å²	97.6	56%	0.559	47%	0.469	S	S	*	.			trans	-70.4	94.8	-163.7	35.8	0	0	0	0	113.7
971	R	66.3	Low	57.6	Low	76 Å²	76	97.2 Å²	97.2	29%	0.287	47%	0.466	S	S	.	.			trans	-116.4	131.2	-174.2	-69.5	175.9	-179.1	-174.8	3.4	113.3	E916 H969	E916-R971 IonicContact OE1-CZ 3.45Å; E916-R971 IonicContact OE1-NE 2.66Å; E916-R971 PolarHBondContact OE1-NE 2.79Å; E916-R971 IonicContact OE1-NH2 3.91Å; E916-R971 PolarHBondContact OE1-NH2 2.78Å; E916-R971 IonicContact OE2-NH2 2.8Å; E916-R971 PolarHBondContact OE2-NH2 2.86Å; H969-R971 WeakPolarHBondContact O-CG 3.27Å; H969-R971 PolarHBondContact O-N 2.88Å
972	P	74.1	Confident	58.9	Low	7 Å²	7	90.8 Å²	90.8	5%	0.045	45%	0.446	C	S	.	.			trans	-78.7	165.7	-178.3	19	-17.7	0	0	0	116.4	H906 L907 V952 Q953 M954	H906-P972 CarbonylContact C-O 3.35Å; H906-P972 VanDerWaalsContact CA-O 3.3Å; H906-P972 WeakPolarHBondContact CA-O 3Å; H906-P972 PolarHBondContact ND1-O 2.9Å; L907-P972 HydrophobicContact CB-CG 4.02Å; L907-P972 HydrophobicContact CD1-CB 3.88Å; L907-P972 HydrophobicContact CD1-CG 3.88Å; L907-P972 PolarHBondContact N-O 2.85Å; V952-P972 HydrophobicContact CG1-CB 3.88Å; Q953-P972 WeakPolarHBondContact O-CA 3.31Å; Q953-P972 WeakPolarHBondContact O-CB 3.47Å; M954-P972 HydrophobicContact CG-CB 4.11Å; M954-P972 HydrophobicContact CG-CG 4.41Å
973	Y	78.6	Confident	60.7	Low	75 Å²	75	88.2 Å²	88.2	29%	0.294	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	170	-170.4	66.6	-89.2	0	0	0	120	V904 I905 V952 Q953	V904-Y973 HydrophobicContact CG1-CD2 4.4Å; I905-Y973 CarbonylContact O-C 3.6Å; I905-Y973 WeakPolarHBondContact O-CA 3.45Å; I905-Y973 WeakPolarHBondContact O-CB 3.45Å; V952-Y973 WeakPolarHBondContact CA-O 3.46Å; Q953-Y973 HydrophobicContact CB-CE1 4.12Å; Q953-Y973 HydrophobicContact CB-CE2 4.43Å; Q953-Y973 PolarHBondContact N-O 2.83Å; Q953-Y973 PolarHBondContact O-N 3.15Å; Q953-Y973 PolarHBondContact OE1-OH 3.36Å; Q953-Y973 VanDerWaalsContact OE1-OH 3.11Å
974	F	85.3	Confident	62.4	Low	4 Å²	4	83.4 Å²	83.4	2%	0.018	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	-172.4	176.3	71.8	-89.5	0	0	0	116.7	V904 I905 V927 P950 P951 V990 V992	V904-F974 CarbonylContact C-O 3.58Å; V904-F974 VanDerWaalsContact CA-O 3.27Å; V904-F974 WeakPolarHBondContact CA-O 3.47Å; V904-F974 WeakPolarHBondContact CG1-O 3.12Å; I905-F974 HydrophobicContact CB-CD1 4.06Å; I905-F974 HydrophobicContact CB-CD2 4.36Å; I905-F974 HydrophobicContact CB-CE1 3.67Å; I905-F974 HydrophobicContact CB-CE2 3.99Å; I905-F974 HydrophobicContact CB-CG 4.4Å; I905-F974 HydrophobicContact CB-CZ 3.64Å; I905-F974 HydrophobicContact CD1-CE2 3.69Å; I905-F974 HydrophobicContact CD1-CZ 3.62Å; I905-F974 HydrophobicContact CG1-CE2 4.09Å; I905-F974 HydrophobicContact CG1-CZ 4.05Å; I905-F974 HydrophobicContact CG2-CD1 4.33Å; I905-F974 HydrophobicContact CG2-CE1 3.57Å; I905-F974 HydrophobicContact CG2-CE2 4.49Å; I905-F974 HydrophobicContact CG2-CZ 3.66Å; I905-F974 PolarHBondContact N-O 2.92Å; I905-F974 PolarHBondContact O-N 3.33Å; V927-F974 HydrophobicContact CB-CD1 4.49Å; V927-F974 HydrophobicContact CG1-CD1 3.93Å; V927-F974 HydrophobicContact CG1-CD2 3.79Å; V927-F974 HydrophobicContact CG1-CE1 3.64Å; V927-F974 HydrophobicContact CG1-CE2 3.49Å; V927-F974 VanDerWaalsContact CG1-CE2 3.49Å; V927-F974 HydrophobicContact CG1-CG 4Å; V927-F974 HydrophobicContact CG1-CZ 3.4Å; V927-F974 VanDerWaalsContact CG1-CZ 3.4Å; V927-F974 HydrophobicContact CG2-CB 4.31Å; V927-F974 HydrophobicContact CG2-CD1 3.66Å; V927-F974 HydrophobicContact CG2-CE1 4Å; V927-F974 HydrophobicContact CG2-CG 3.94Å; P950-F974 HydrophobicContact CB-CB 4.4Å; P950-F974 HydrophobicContact CB-CD2 4.26Å; P950-F974 HydrophobicContact CG-CB 4.46Å; P950-F974 HydrophobicContact CG-CD2 3.62Å; P950-F974 HydrophobicContact CG-CE2 4.22Å; P950-F974 HydrophobicContact CG-CG 4.33Å; P951-F974 VanDerWaalsContact O-CB 3.29Å; P951-F974 WeakPolarHBondContact O-CB 3.23Å; F974-V990 HydrophobicContact CE2-CG1 3.84Å; F974-V990 HydrophobicContact CZ-CG1 3.76Å; F974-V992 HydrophobicContact CE1-CG2 4.13Å
975	L	78.7	Confident	64.3	Low	91 Å²	91	77.5 Å²	77.5	48%	0.476	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	161.7	-165.3	-84.1	144.1	0	0	0	119	T903 V904	T903-L975 CarbonylContact O-C 2.75Å; T903-L975 WeakPolarHBondContact O-CA 3.25Å; V904-L975 HydrophobicContact CG2-CD2 3.48Å; V904-L975 VanDerWaalsContact CG2-CD2 3.48Å; V904-L975 HydrophobicContact CG2-CG 3.93Å
976	I	79.6	Confident	66.3	Low	15 Å²	15	71.6 Å²	71.6	8%	0.077	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	149.7	175.9	-51.5	-178.3	0	0	0	113.2	P902 T903 I905 I929 V945 V990 I1018	P902-I976 CarbonylContact C-O 3.51Å; P902-I976 WeakPolarHBondContact CA-O 3.48Å; P902-I976 WeakPolarHBondContact CB-O 3.37Å; T903-I976 PolarHBondContact N-O 2.89Å; T903-I976 PolarHBondContact O-N 2.85Å; I905-I976 HydrophobicContact CD1-CD1 3.98Å; I929-I976 HydrophobicContact CD1-CG1 4.09Å; V945-I976 HydrophobicContact CG1-CG2 4.46Å; I976-V990 HydrophobicContact CD1-CG2 4.07Å; I976-I1018 HydrophobicContact CD1-CD1 3.81Å
977	T	80.9	Confident	68	Low	30 Å²	30	62.1 Å²	62.1	18%	0.184	33%	0.326	C	S	.	.			trans	-142.2	135.5	-179.5	41.3	0	0	0	0	116.7	P902 V945 Q946	P902-T977 HydrophobicContact CB-CG2 3.76Å; P902-T977 HydrophobicContact CG-CG2 3.91Å; V945-T977 WeakPolarHBondContact CA-O 3.39Å; V945-T977 VanDerWaalsContact CB-O 3.26Å; V945-T977 WeakPolarHBondContact CB-O 3.4Å; V945-T977 WeakPolarHBondContact CG1-O 3.28Å; Q946-T977 VanDerWaalsContact CB-OG1 3.24Å; Q946-T977 WeakPolarHBondContact CB-OG1 3.32Å; Q946-T977 PolarHBondContact N-O 2.79Å; Q946-T977 VanDerWaalsContact N-O 3.12Å; Q946-T977 PolarHBondContact OE1-OG1 2.81Å; Q946-T977 VanDerWaalsContact OE1-OG1 3.1Å
978	P	76	Confident	69.9	Low	22 Å²	22	54.2 Å²	54.2	14%	0.143	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-75.9	166.5	174.5	-14.6	29.8	0	0	0	115.5	I901 L944	I901-P978 WeakPolarHBondContact O-CD 3.36Å; I901-P978 WeakPolarHBondContact O-CG 3.45Å; L944-P978 CarbonylContact O-C 3.39Å; L944-P978 WeakPolarHBondContact O-CA 3.46Å
979	A	79.4	Confident	71.9	Confident	47 Å²	47	49 Å²	49	39%	0.388	27%	0.273	S	S	.	.	S	Bend	trans	-94.5	-42.6	-176.5	0	0	0	0	0	117	Q943 L944	Q943-A979 WeakPolarHBondContact O-CB 3.1Å; L944-A979 PolarHBondContact O-N 2.89Å
980	N	75.3	Confident	73.5	Confident	108 Å²	108	45 Å²	45	58%	0.578	25%	0.254	S	S	*	.	S	Bend	trans	-135.4	100	-175.3	-142.1	-0	0	0	0	111.1	G982 H983 S984	N980-G982 PolarHBondContact O-N 2.71Å; N980-H983 PolarHBondContact O-N 3Å; N980-S984 WeakPolarHBondContact CB-OG 3.27Å; N980-S984 PolarHBondContact N-OG 2.95Å; N980-S984 VanDerWaalsContact N-OG 3.16Å; N980-S984 PolarHBondContact O-N 2.82Å; N980-S984 PolarHBondContact O-OG 2.82Å
981	L	68.7	Low	75	Confident	99 Å²	99	45 Å²	45	52%	0.518	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	133.5	-165.2	-56.8	178.3	0	0	0	112.2	N899 H983	N899-L981 CarbonylContact O-C 3.56Å; N899-L981 VanDerWaalsContact O-CA 3.32Å; N899-L981 WeakPolarHBondContact O-CA 3.45Å; L981-H983 PolarHBondContact O-CD2 2.89Å; L981-H983 PolarHBondContact O-N 2.78Å
982	G	60.4	Low	75.7	Confident	26 Å²	26	41.9 Å²	41.9	27%	0.268	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	-16.8	-178.1	0	0	0	0	0	115	N899 N980	N899-G982 PolarHBondContact ND2-O 2.85Å; N899-G982 VanDerWaalsContact ND2-O 3.08Å; N899-G982 PolarHBondContact O-N 2.02Å; N899-G982 WeakPolarHBondContact OD1-CA 3.32Å; N899-G982 PolarHBondContact OD1-N 3.23Å; N980-G982 PolarHBondContact O-N 2.71Å
983	H	67.9	Low	76.1	Confident	159 Å²	159	44.5 Å²	44.5	74%	0.736	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-25.2	-170.8	-67.4	-74.1	0	0	0	115.6	N899 N980 L981	N899-H983 PolarHBondContact ND2-N 2.85Å; N980-H983 PolarHBondContact O-N 3Å; L981-H983 PolarHBondContact O-CD2 2.89Å; L981-H983 PolarHBondContact O-N 2.78Å
984	S	67.1	Low	75.9	Confident	14 Å²	14	41.3 Å²	41.3	10%	0.098	24%	0.238	C	C	.	.			trans	-69	139.8	179.4	-66.9	0	0	0	0	113.4	N899 N980	N899-S984 WeakPolarHBondContact CB-O 3.45Å; N899-S984 PolarHBondContact ND2-O 2.98Å; N980-S984 WeakPolarHBondContact CB-OG 3.27Å; N980-S984 PolarHBondContact N-OG 2.95Å; N980-S984 VanDerWaalsContact N-OG 3.16Å; N980-S984 PolarHBondContact O-N 2.82Å; N980-S984 PolarHBondContact O-OG 2.82Å
985	S	70.8	Confident	75.4	Confident	71 Å²	71	47.6 Å²	47.6	50%	0.497	27%	0.267	S	S	.	.			trans	-146.1	139.6	166.9	47.9	0	0	0	0	110.1	L1020	S985-L1020 WeakPolarHBondContact CB-O 3.38Å
986	G	72.7	Confident	74.6	Confident	5 Å²	5	45.9 Å²	45.9	5%	0.052	26%	0.263	C	S	.	.			trans	156.8	-174.5	-168.7	0	0	0	0	0	113.8	Y1019 L1020	G986-Y1019 CarbonylContact O-C 3.54Å; G986-Y1019 VanDerWaalsContact O-CA 3.28Å; G986-Y1019 WeakPolarHBondContact O-CA 3.49Å; G986-Y1019 VanDerWaalsContact O-CD2 3.28Å; G986-Y1019 WeakPolarHBondContact O-CD2 2.97Å; G986-L1020 PolarHBondContact O-N 2.94Å; G986-L1020 VanDerWaalsContact O-N 3.15Å
987	S	73.3	Confident	73.9	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	152.3	-168.3	-38.1	0	0	0	0	117.9	K894 S931 I932 D933 I1018	K894-S987 PolarHBondContact NZ-OG 2.81Å; S931-S987 PolarHBondContact OG-O 3.27Å; I932-S987 PolarHBondContact N-O 2.77Å; I932-S987 WeakPolarHBondContact O-CB 3.39Å; D933-S987 PolarHBondContact OD2-N 3Å; S987-I1018 CarbonylContact C-O 3.55Å; S987-I1018 VanDerWaalsContact CA-O 3.28Å; S987-I1018 WeakPolarHBondContact CA-O 3.46Å; S987-I1018 WeakPolarHBondContact CB-O 3.49Å
988	L	76.7	Confident	72.9	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	169.7	-169.1	-49.2	157.9	0	0	0	116.3	S930 I932 L944 V945 N1017 I1018	S930-L988 CarbonylContact O-C 3.57Å; S930-L988 WeakPolarHBondContact O-CA 3.07Å; S930-L988 WeakPolarHBondContact O-CB 3.42Å; I932-L988 WeakPolarHBondContact CD1-O 3.28Å; L944-L988 HydrophobicContact CB-CD2 3.98Å; L944-L988 HydrophobicContact CD1-CD2 4.16Å; V945-L988 HydrophobicContact CG1-CD1 3.42Å; V945-L988 VanDerWaalsContact CG1-CD1 3.42Å; V945-L988 HydrophobicContact CG1-CD2 3.88Å; V945-L988 HydrophobicContact CG1-CG 4.31Å; V945-L988 HydrophobicContact CG2-CD2 4.12Å; L988-N1017 CarbonylContact O-C 3.58Å; L988-N1017 WeakPolarHBondContact O-CA 3.26Å; L988-I1018 HydrophobicContact CB-CB 4.1Å; L988-I1018 HydrophobicContact CB-CG2 4.48Å; L988-I1018 HydrophobicContact CD1-CG2 4.23Å; L988-I1018 PolarHBondContact N-O 2.94Å; L988-I1018 PolarHBondContact O-N 2.97Å
989	A	79	Confident	72.1	Confident	8 Å²	8	53.4 Å²	53.4	7%	0.066	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	164.1	179.2	0	0	0	0	0	117.9	I929 S930 I932 L1016 N1017	I929-A989 CarbonylContact C-O 3.53Å; I929-A989 WeakPolarHBondContact CA-O 2.26Å; I929-A989 WeakPolarHBondContact CG2-O 3.44Å; S930-A989 PolarHBondContact N-O 2.86Å; S930-A989 PolarHBondContact O-N 2.68Å; I932-A989 HydrophobicContact CD1-CB 4.18Å; A989-L1016 CarbonylContact C-O 3.54Å; A989-L1016 WeakPolarHBondContact CA-O 3.39Å; A989-N1017 WeakPolarHBondContact CB-OD1 3.48Å
990	V	79.7	Confident	71	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	155.6	-167.2	-165.3	0	0	0	0	116.7	V927 V928 I929 F974 I976 I1015 L1016 I1018	V927-V990 HydrophobicContact CG1-CG1 4.26Å; V928-V990 CarbonylContact O-C 3.45Å; V928-V990 VanDerWaalsContact O-CA 3.3Å; V928-V990 WeakPolarHBondContact O-CA 2.79Å; V928-V990 VanDerWaalsContact O-CG1 3.29Å; V928-V990 WeakPolarHBondContact O-CG1 2.24Å; I929-V990 HydrophobicContact CG1-CG1 4.19Å; I929-V990 HydrophobicContact CG1-CG2 4.33Å; F974-V990 HydrophobicContact CE2-CG1 3.84Å; F974-V990 HydrophobicContact CZ-CG1 3.76Å; I976-V990 HydrophobicContact CD1-CG2 4.07Å; V990-I1015 CarbonylContact O-C 3.45Å; V990-I1015 VanDerWaalsContact O-CA 3.23Å; V990-I1015 WeakPolarHBondContact O-CA 3.34Å; V990-I1015 VanDerWaalsContact O-CG2 3.29Å; V990-I1015 WeakPolarHBondContact O-CG2 3.08Å; V990-L1016 HydrophobicContact CB-CB 4.33Å; V990-L1016 PolarHBondContact N-O 2.78Å; V990-L1016 PolarHBondContact O-N 2.88Å; V990-I1018 HydrophobicContact CG2-CD1 4.41Å
991	H	83.8	Confident	70.3	Confident	82 Å²	82	61 Å²	61	38%	0.38	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156.1	-176.9	-57.7	-98.1	0	0	0	118.7	V927 V928 S1014	V927-H991 CarbonylContact C-O 3.52Å; V927-H991 VanDerWaalsContact CA-O 3.25Å; V927-H991 WeakPolarHBondContact CA-O 3.42Å; V928-H991 PolarHBondContact N-O 3.39Å; V928-H991 PolarHBondContact O-N 2.98Å; H991-S1014 CarbonylContact C-O 3.49Å; H991-S1014 WeakPolarHBondContact CA-O 3.26Å
992	V	82.1	Confident	69.9	Low	9 Å²	9	57.7 Å²	57.7	6%	0.055	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	159.6	-173.8	166	0	0	0	0	120	L864 L907 N926 V927 F974 K1013 S1014	L864-V992 HydrophobicContact CD1-CB 4.11Å; L864-V992 HydrophobicContact CD1-CG2 3.9Å; L864-V992 HydrophobicContact CD2-CB 4.16Å; L864-V992 HydrophobicContact CD2-CG1 4.07Å; L864-V992 HydrophobicContact CD2-CG2 3.84Å; L864-V992 HydrophobicContact CG-CG2 4.47Å; L907-V992 HydrophobicContact CD2-CG1 3.74Å; N926-V992 WeakPolarHBondContact O-CA 3.49Å; N926-V992 WeakPolarHBondContact O-CB 3.43Å; N926-V992 VanDerWaalsContact O-CG1 3.29Å; N926-V992 WeakPolarHBondContact O-CG1 2.26Å; N926-V992 WeakPolarHBondContact O-CG2 3.44Å; V927-V992 HydrophobicContact CB-CG2 4.27Å; V927-V992 HydrophobicContact CG1-CG2 3.92Å; V927-V992 HydrophobicContact CG2-CG2 4.16Å; F974-V992 HydrophobicContact CE1-CG2 4.13Å; V992-K1013 VanDerWaalsContact O-CA 3.27Å; V992-K1013 WeakPolarHBondContact O-CA 3.1Å; V992-S1014 PolarHBondContact N-O 2.98Å; V992-S1014 PolarHBondContact O-N 3.04Å; V992-S1014 VanDerWaalsContact O-N 3.14Å
993	T	82.6	Confident	69.8	Low	63 Å²	63	60.5 Å²	60.5	39%	0.387	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	166.1	177.7	65.9	0	0	0	0	120.1	S925 N926 L1012 K1013	S925-T993 CarbonylContact C-O 3.46Å; S925-T993 WeakPolarHBondContact CA-O 3.46Å; S925-T993 WeakPolarHBondContact CB-O 3.42Å; N926-T993 PolarHBondContact N-O 2.78Å; N926-T993 VanDerWaalsContact N-O 3.11Å; N926-T993 PolarHBondContact O-N 3.35Å; T993-L1012 CarbonylContact C-O 3.41Å; T993-L1012 VanDerWaalsContact CA-O 3.27Å; T993-L1012 WeakPolarHBondContact CA-O 3.37Å; T993-K1013 HydrophobicContact CG2-CD 4.49Å; T993-K1013 HydrophobicContact CG2-CG 4.13Å
994	V	74.3	Confident	69.2	Low	7 Å²	7	57.7 Å²	57.7	4%	0.042	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	155.8	-170	164.5	0	0	0	0	122.3	L862 F909 V924 L1012	L862-V994 HydrophobicContact CD1-CG2 4.05Å; L862-V994 HydrophobicContact CD2-CB 4.34Å; L862-V994 HydrophobicContact CD2-CG2 3.6Å; L862-V994 HydrophobicContact CG-CG2 4.46Å; F909-V994 HydrophobicContact CE1-CG1 3.94Å; F909-V994 HydrophobicContact CZ-CG1 4.33Å; V924-V994 CarbonylContact O-C 2.88Å; V924-V994 WeakPolarHBondContact O-CA 3.43Å; V924-V994 WeakPolarHBondContact O-CB 3.22Å; V924-V994 WeakPolarHBondContact O-CG1 3.46Å; V924-V994 WeakPolarHBondContact O-CG2 3.08Å; V994-L1012 HydrophobicContact CB-CB 4.15Å; V994-L1012 HydrophobicContact CG1-CB 4.48Å; V994-L1012 HydrophobicContact CG1-CD1 4.15Å; V994-L1012 PolarHBondContact N-O 3.3Å; V994-L1012 VanDerWaalsContact N-O 3.13Å
995	H	74.4	Confident	68.7	Low	136 Å²	136	62.3 Å²	62.3	63%	0.63	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.3	-175.9	175.6	-57	-60	0	0	0	119.7	L923 V924	L923-H995 VanDerWaalsContact CA-O 3.3Å; L923-H995 WeakPolarHBondContact CA-O 3.13Å; V924-H995 PolarHBondContact N-O 3.01Å; V924-H995 VanDerWaalsContact N-O 3.14Å; V924-H995 PolarHBondContact O-N 3.48Å; V924-H995 VanDerWaalsContact O-N 3.14Å
996	S	62.6	Low	67.9	Low	56 Å²	56	61.2 Å²	61.2	39%	0.392	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	168.4	-168.1	-177	0	0	0	0	119.3	S922	S922-S996 WeakPolarHBondContact O-CA 3.47Å
997	S	64.9	Low	66.8	Low	85 Å²	85	67 Å²	67	59%	0.594	37%	0.366	S	S	*	.			trans	-144.1	15	-165.1	75.8	0	0	0	0	123.9	S922	S922-S997 WeakPolarHBondContact CA-OG 3.18Å; S922-S997 PolarHBondContact O-N 2.77Å; S922-S997 PolarHBondContact O-OG 2.8Å
998	L	59.3	Low	65.8	Low	57 Å²	57	70.1 Å²	70.1	30%	0.298	40%	0.398	S	S	.	.			trans	-77.3	159	-168.4	-84.7	162.4	0	0	0	118.8	Y1002 L1006	L998-Y1002 HydrophobicContact CD2-CD2 4.4Å; L998-L1006 HydrophobicContact CB-CD1 4.16Å; L998-L1006 HydrophobicContact CD1-CD1 4.19Å; L998-L1006 HydrophobicContact CD1-CD2 4.03Å
999	P	58.8	Low	64.7	Low	82 Å²	82	73 Å²	73	53%	0.532	41%	0.413	S	S	.	.			trans	-80.3	157.1	176.3	-13.3	29.5	0	0	0	117	R1001 Y1002	P999-R1001 VanDerWaalsContact C-N 3.29Å; P999-R1001 PolarHBondContact O-N 2.69Å; P999-Y1002 PolarHBondContact O-N 2.88Å; P999-Y1002 VanDerWaalsContact O-N 3.14Å
1000	N	57.6	Low	63.5	Low	146 Å²	146	82.1 Å²	82.1	78%	0.781	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-53.3	-23.7	-172.8	-88.3	5.4	0	0	0	118.1	Y1002 V1003	N1000-Y1002 PolarHBondContact O-N 2.71Å; N1000-V1003 PolarHBondContact O-N 2.81Å
1001	R	59.8	Low	62.6	Low	169 Å²	169	83.7 Å²	83.7	64%	0.638	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-61.8	-27.9	177.8	-175.8	179.1	175.7	-145.6	-2.7	112.1	E823 P999	E823-R1001 IonicContact OE2-CZ 3.63Å; E823-R1001 IonicContact OE2-NH1 2.85Å; E823-R1001 PolarHBondContact OE2-NH1 2.81Å; E823-R1001 IonicContact OE2-NH2 3.27Å; E823-R1001 PolarHBondContact OE2-NH2 3.43Å; P999-R1001 VanDerWaalsContact C-N 3.29Å; P999-R1001 PolarHBondContact O-N 2.69Å
1002	Y	60.4	Low	62.1	Low	30 Å²	30	82 Å²	82	12%	0.118	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-95.9	-3.5	-174.2	-56.3	-76.8	0	0	0	114.1	I736 L998 P999 N1000 P1004 F1005	I736-Y1002 HydrophobicContact CG2-CD1 3.59Å; I736-Y1002 HydrophobicContact CG2-CE1 3.94Å; I736-Y1002 HydrophobicContact CG2-CG 4.41Å; L998-Y1002 HydrophobicContact CD2-CD2 4.4Å; P999-Y1002 PolarHBondContact O-N 2.88Å; P999-Y1002 VanDerWaalsContact O-N 3.14Å; N1000-Y1002 PolarHBondContact O-N 2.71Å; Y1002-P1004 VanDerWaalsContact C-N 3.34Å; Y1002-F1005 PolarHBondContact O-N 3.26Å
1003	V	57.9	Low	61.8	Low	84 Å²	84	89.2 Å²	89.2	51%	0.509	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-54.3	-34.8	-178	169.9	0	0	0	0	115.2	N1000 F1005 L1006	N1000-V1003 PolarHBondContact O-N 2.81Å; V1003-F1005 PolarHBondContact O-N 3.14Å; V1003-L1006 PolarHBondContact O-N 3.14Å
1004	P	55.4	Low	61.8	Low	100 Å²	100	88 Å²	88	65%	0.649	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-59.1	-18.1	174.9	-26.2	36.4	0	0	0	115	Y1002	Y1002-P1004 VanDerWaalsContact C-N 3.34Å
1005	F	56.2	Low	62	Low	111 Å²	111	92.8 Å²	92.8	49%	0.487	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-109.1	8.8	-173.7	-47.8	-79.3	0	0	0	113.5	Y1002 V1003	Y1002-F1005 PolarHBondContact O-N 3.26Å; V1003-F1005 PolarHBondContact O-N 3.14Å
1006	L	54.5	Low	62.1	Low	49 Å²	49	87.1 Å²	87.1	26%	0.257	49%	0.487	S	S	.	.			trans	-113	26.6	-169	-71.4	170.9	0	0	0	118.7	L998 V1003 G1008 I1009	L998-L1006 HydrophobicContact CB-CD1 4.16Å; L998-L1006 HydrophobicContact CD1-CD1 4.19Å; L998-L1006 HydrophobicContact CD1-CD2 4.03Å; V1003-L1006 PolarHBondContact O-N 3.14Å; L1006-G1008 PolarHBondContact O-N 3.05Å; L1006-I1009 HydrophobicContact CD2-CD1 4.12Å
1007	P	50	Low	62.8	Low	127 Å²	127	87 Å²	87	83%	0.825	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	80.6	-177.9	35.2	-36.7	0	0	0	113.6
1008	G	52.6	Low	63.3	Low	67 Å²	67	83.2 Å²	83.2	69%	0.691	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-175.3	-21.3	171.3	0	0	0	0	0	119.5	L1006 Q1010	L1006-G1008 PolarHBondContact O-N 3.05Å; G1008-Q1010 PolarHBondContact O-N 2.87Å
1009	I	52.1	Low	64.2	Low	66 Å²	66	84.7 Å²	84.7	34%	0.338	46%	0.457	S	S	.	.			trans	-84.9	70.1	-161	-42.7	178.2	0	0	0	113.5	L1006	L1006-I1009 HydrophobicContact CD2-CD1 4.12Å
1010	Q	54.1	Low	65.1	Low	198 Å²	198	81 Å²	81	93%	0.925	43%	0.432	S	S	*	.	S	Bend	trans	-115	57.5	178	-68.2	-163.5	-2.8	0	0	115.2	G1008	G1008-Q1010 PolarHBondContact O-N 2.87Å
1011	G	60.8	Low	65.7	Low	33 Å²	33	74.7 Å²	74.7	34%	0.34	40%	0.4	S	S	.	.			trans	89.1	101.8	154.9	0	0	0	0	0	117.9
1012	L	73.1	Confident	66.3	Low	46 Å²	46	69.7 Å²	69.7	24%	0.241	39%	0.389	C	S	.	.			trans	-92.9	154.9	-176.9	-50.2	166.2	0	0	0	112.2	L862 T993 V994	L862-L1012 HydrophobicContact CB-CB 3.69Å; L862-L1012 HydrophobicContact CB-CD1 3.94Å; L862-L1012 HydrophobicContact CB-CG 4.32Å; L862-L1012 HydrophobicContact CD2-CB 3.7Å; L862-L1012 HydrophobicContact CG-CB 4.33Å; T993-L1012 CarbonylContact C-O 3.41Å; T993-L1012 VanDerWaalsContact CA-O 3.27Å; T993-L1012 WeakPolarHBondContact CA-O 3.37Å; V994-L1012 HydrophobicContact CB-CB 4.15Å; V994-L1012 HydrophobicContact CG1-CB 4.48Å; V994-L1012 HydrophobicContact CG1-CD1 4.15Å; V994-L1012 PolarHBondContact N-O 3.3Å; V994-L1012 VanDerWaalsContact N-O 3.13Å
1013	K	77.2	Confident	66.9	Low	162 Å²	162	71.8 Å²	71.8	70%	0.704	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.3	159.5	-172	-50.2	-172.7	-178.4	177.1	0	115.1	V992 T993	V992-K1013 VanDerWaalsContact O-CA 3.27Å; V992-K1013 WeakPolarHBondContact O-CA 3.1Å; T993-K1013 HydrophobicContact CG2-CD 4.49Å; T993-K1013 HydrophobicContact CG2-CG 4.13Å
1014	S	81.4	Confident	67.7	Low	36 Å²	36	68.3 Å²	68.3	25%	0.252	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	171.4	177.1	-163.3	0	0	0	0	117.1	H991 V992	H991-S1014 CarbonylContact C-O 3.49Å; H991-S1014 WeakPolarHBondContact CA-O 3.26Å; V992-S1014 PolarHBondContact N-O 2.98Å; V992-S1014 PolarHBondContact O-N 3.04Å; V992-S1014 VanDerWaalsContact O-N 3.14Å
1015	I	78.2	Confident	68.7	Low	108 Å²	108	69 Å²	69	55%	0.554	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.4	156.9	-168.5	-49.4	-175.9	0	0	0	114.1	V990	V990-I1015 CarbonylContact O-C 3.45Å; V990-I1015 VanDerWaalsContact O-CA 3.23Å; V990-I1015 WeakPolarHBondContact O-CA 3.34Å; V990-I1015 VanDerWaalsContact O-CG2 3.29Å; V990-I1015 WeakPolarHBondContact O-CG2 3.08Å
1016	L	77	Confident	69.4	Low	18 Å²	18	65 Å²	65	9%	0.094	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	157.3	178.1	-174.9	64.8	0	0	0	116.8	P866 W890 I905 A989 V990	P866-L1016 HydrophobicContact CB-CD2 4.37Å; P866-L1016 HydrophobicContact CG-CD2 4.4Å; W890-L1016 HydrophobicContact CE3-CD1 4.5Å; I905-L1016 HydrophobicContact CD1-CD2 3.8Å; A989-L1016 CarbonylContact C-O 3.54Å; A989-L1016 WeakPolarHBondContact CA-O 3.39Å; V990-L1016 HydrophobicContact CB-CB 4.33Å; V990-L1016 PolarHBondContact N-O 2.78Å; V990-L1016 PolarHBondContact O-N 2.88Å
1017	N	77.2	Confident	70.3	Confident	54 Å²	54	66.7 Å²	66.7	29%	0.289	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	150.8	-176.9	-67.7	-41.2	0	0	0	116.7	L895 L988 A989	L895-N1017 VanDerWaalsContact CB-O 3.22Å; L895-N1017 WeakPolarHBondContact CB-O 3.46Å; L895-N1017 PolarHBondContact N-O 3.31Å; L988-N1017 CarbonylContact O-C 3.58Å; L988-N1017 WeakPolarHBondContact O-CA 3.26Å; A989-N1017 WeakPolarHBondContact CB-OD1 3.48Å
1018	I	75.2	Confident	70.8	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	158.6	-161.7	-57.3	177	0	0	0	116.9	L895 L897 I976 S987 L988 V990	L895-I1018 HydrophobicContact CB-CG1 4.46Å; L895-I1018 CarbonylContact O-C 2.66Å; L895-I1018 VanDerWaalsContact O-CA 3.31Å; L895-I1018 WeakPolarHBondContact O-CA 3.15Å; L897-I1018 HydrophobicContact CD1-CD1 4.37Å; L897-I1018 HydrophobicContact CD1-CG2 3.57Å; L897-I1018 HydrophobicContact CG-CG2 3.82Å; I976-I1018 HydrophobicContact CD1-CD1 3.81Å; S987-I1018 CarbonylContact C-O 3.55Å; S987-I1018 VanDerWaalsContact CA-O 3.28Å; S987-I1018 WeakPolarHBondContact CA-O 3.46Å; S987-I1018 WeakPolarHBondContact CB-O 3.49Å; L988-I1018 HydrophobicContact CB-CB 4.1Å; L988-I1018 HydrophobicContact CB-CG2 4.48Å; L988-I1018 HydrophobicContact CD1-CG2 4.23Å; L988-I1018 PolarHBondContact N-O 2.94Å; L988-I1018 PolarHBondContact O-N 2.97Å; V990-I1018 HydrophobicContact CG2-CD1 4.41Å
1019	Y	78	Confident	71.4	Confident	89 Å²	89	64.9 Å²	64.9	35%	0.349	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	171.3	173	-178.6	-104.2	0	0	0	115.2	L895 I896 L897 G986	L895-Y1019 PolarHBondContact O-N 2.96Å; I896-Y1019 HydrophobicContact CG1-CD1 4.36Å; L897-Y1019 PolarHBondContact N-O 2.73Å; G986-Y1019 CarbonylContact O-C 3.54Å; G986-Y1019 VanDerWaalsContact O-CA 3.28Å; G986-Y1019 WeakPolarHBondContact O-CA 3.49Å; G986-Y1019 VanDerWaalsContact O-CD2 3.28Å; G986-Y1019 WeakPolarHBondContact O-CD2 2.97Å
1020	L	77.6	Confident	72.1	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.016	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.8	-175.4	-69.1	165	0	0	0	115.6	L897 N899 L944 S985 G986	L897-L1020 HydrophobicContact CB-CD2 3.96Å; L897-L1020 WeakPolarHBondContact O-CA 3.08Å; N899-L1020 HydrophobicContact CB-CD2 4.29Å; L944-L1020 HydrophobicContact CD2-CD1 4.4Å; S985-L1020 WeakPolarHBondContact CB-O 3.38Å; G986-L1020 PolarHBondContact O-N 2.94Å; G986-L1020 VanDerWaalsContact O-N 3.15Å
1021	S	70.4	Confident	72.7	Confident	14 Å²	14	64.6 Å²	64.6	10%	0.098	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	167.3	-164.8	-162.4	0	0	0	0	117.6	N899 G1049 F1113	N899-S1021 VanDerWaalsContact CG-O 3.28Å; N899-S1021 PolarHBondContact ND2-O 2.91Å; S1021-G1049 PolarHBondContact OG-O 3.04Å; S1021-G1049 VanDerWaalsContact OG-O 3.1Å; S1021-F1113 VanDerWaalsContact O-CE2 3.3Å; S1021-F1113 WeakPolarHBondContact O-CE2 3.45Å; S1021-F1113 WeakPolarHBondContact O-CZ 3.45Å
1022	P	72.7	Confident	73.1	Confident	65 Å²	65	64 Å²	64	42%	0.422	35%	0.349	S	S	.	.			trans	-111	-159.7	178.9	42.1	-34.2	0	0	0	117	G1049	P1022-G1049 CarbonylContact O-C 3.44Å; P1022-G1049 WeakPolarHBondContact O-CA 3.39Å; P1022-G1049 PolarHBondContact O-N 3Å; P1022-G1049 VanDerWaalsContact O-N 3.08Å
1023	V	73.1	Confident	73.1	Confident	74 Å²	74	68.7 Å²	68.7	45%	0.448	37%	0.367	S	S	.	.			trans	-106.8	172.5	-157.4	-158.5	0	0	0	0	116.7	G1048 G1049 S1129	V1023-G1048 WeakPolarHBondContact O-CA 2.98Å; V1023-G1049 PolarHBondContact O-N 3.32Å; V1023-S1129 WeakPolarHBondContact CG1-OG 3.45Å
1024	I	75.1	Confident	72.8	Confident	10 Å²	10	61.8 Å²	61.8	5%	0.051	34%	0.338	C	S	.	.			trans	-98.6	154.8	-162.9	-165.1	177.6	0	0	0	118.5	I1046 H1047 Y1053 A1108 D1110	I1024-I1046 HydrophobicContact CD1-CG2 4.08Å; I1024-I1046 HydrophobicContact CG1-CG2 3.98Å; I1024-H1047 CarbonylContact C-O 3.09Å; I1024-H1047 VanDerWaalsContact CA-O 3.26Å; I1024-H1047 WeakPolarHBondContact CA-O 3.39Å; I1024-Y1053 HydrophobicContact CD1-CD1 3.4Å; I1024-Y1053 VanDerWaalsContact CD1-CD1 3.4Å; I1024-Y1053 HydrophobicContact CD1-CE1 3.9Å; I1024-Y1053 HydrophobicContact CD1-CG 3.9Å; I1024-Y1053 HydrophobicContact CG1-CD1 4.12Å; I1024-Y1053 HydrophobicContact CG1-CE1 4.1Å; I1024-A1108 HydrophobicContact CD1-CB 4.31Å; I1024-D1110 HydrophobicContact CD1-CB 4.35Å
1025	N	76.8	Confident	72.4	Confident	115 Å²	115	60.2 Å²	60.2	62%	0.615	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.7	164.7	172.2	-84.8	-65.8	0	0	0	115.3	I1046 H1047	N1025-I1046 CarbonylContact O-C 3.48Å; N1025-I1046 WeakPolarHBondContact O-CA 3.36Å; N1025-I1046 WeakPolarHBondContact O-CG2 3.31Å; N1025-H1047 PolarHBondContact N-O 2.72Å; N1025-H1047 PolarHBondContact O-N 2.65Å
1026	A	70.3	Confident	72.2	Confident	28 Å²	28	55.6 Å²	55.6	23%	0.231	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	159.1	-177.6	0	0	0	0	0	117.4	Y1045 I1046	A1026-Y1045 CarbonylContact C-O 3.49Å; A1026-Y1045 VanDerWaalsContact CA-O 3.28Å; A1026-Y1045 WeakPolarHBondContact CA-O 3.25Å; A1026-I1046 HydrophobicContact CB-CG1 4.1Å
1027	V	72.5	Confident	71.8	Confident	83 Å²	83	55.4 Å²	55.4	50%	0.503	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	141.9	-176.5	-179.3	0	0	0	0	112.6	V1044 Y1045	V1027-V1044 CarbonylContact O-C 3.57Å; V1027-V1044 WeakPolarHBondContact O-CG1 3.46Å; V1027-Y1045 PolarHBondContact N-O 2.63Å; V1027-Y1045 PolarHBondContact O-N 2.8Å
1028	P	61.8	Low	71.3	Confident	60 Å²	60	56.8 Å²	56.8	39%	0.39	31%	0.314	S	S	.	.			cis	-83.1	166.5	-5.9	35	-37.4	0	0	0	113.4
1029	S	64.1	Low	70.9	Confident	97 Å²	97	62.3 Å²	62.3	68%	0.678	34%	0.34	S	S	*	.			trans	-111.1	21.4	-165.6	52.8	0	0	0	0	115.5
1030	Q	67.2	Low	70.3	Confident	156 Å²	156	58.7 Å²	58.7	73%	0.729	33%	0.328	S	S	*	.	S	Bend	trans	-125.1	168.1	-175.1	-66.7	-173	-6.3	0	0	112.7	I1032	Q1030-I1032 PolarHBondContact O-N 2.83Å
1031	L	67.2	Low	69.9	Low	101 Å²	101	61.4 Å²	61.4	53%	0.529	35%	0.348	S	S	.	.			trans	-62.4	124.5	-172	-176.1	72.5	0	0	0	113.2	N1134 D1136	L1031-N1134 HydrophobicContact CD1-CB 4.1Å; L1031-D1136 HydrophobicContact CD1-CB 4.31Å
1032	I	69.7	Low	70	Confident	22 Å²	22	62.6 Å²	62.6	11%	0.113	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	121.2	176.2	-55	176.7	0	0	0	109.8	Q1030 L1034 V1044 I1096 N1134 V1135 D1136	Q1030-I1032 PolarHBondContact O-N 2.83Å; I1032-L1034 HydrophobicContact CG2-CG 4.29Å; I1032-V1044 HydrophobicContact CD1-CG2 4.18Å; I1032-I1096 HydrophobicContact CD1-CD1 4.03Å; I1032-N1134 PolarHBondContact N-O 2.81Å; I1032-V1135 HydrophobicContact CB-CG1 4.21Å; I1032-V1135 HydrophobicContact CB-CG2 4.3Å; I1032-V1135 HydrophobicContact CD1-CG2 4.39Å; I1032-V1135 HydrophobicContact CG2-CG1 4.41Å; I1032-V1135 CarbonylContact O-C 3.43Å; I1032-V1135 WeakPolarHBondContact O-CA 3.46Å; I1032-D1136 PolarHBondContact O-N 2.58Å
1033	K	71.2	Confident	70.2	Confident	144 Å²	144	62.3 Å²	62.3	63%	0.626	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.3	168.9	-77.5	-171.3	175.2	-170.7	0	111.3	D1136	K1033-D1136 CarbonylContact C-O 3.6Å; K1033-D1136 WeakPolarHBondContact CA-O 3.37Å; K1033-D1136 HydrophobicContact CG-CB 4.49Å
1034	L	71.8	Confident	70.3	Confident	16 Å²	16	58.8 Å²	58.8	8%	0.084	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	158.5	173.4	-70.3	169	0	0	0	111	I1032 I1069 I1096 V1135 D1136 V1137 I1138	I1032-L1034 HydrophobicContact CG2-CG 4.29Å; L1034-I1069 HydrophobicContact CD1-CG2 4.08Å; L1034-I1096 HydrophobicContact CD1-CG2 3.81Å; L1034-V1135 HydrophobicContact CD1-CG1 4.08Å; L1034-D1136 PolarHBondContact N-O 3.48Å; L1034-V1137 HydrophobicContact CB-CG1 4.42Å; L1034-V1137 HydrophobicContact CB-CG2 4.21Å; L1034-V1137 WeakPolarHBondContact O-CA 3.31Å; L1034-I1138 PolarHBondContact O-N 3.36Å
1035	F	72.9	Confident	70.4	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.018	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	139	172.2	179.5	-108.7	0	0	0	110.3	H1037 P1098 I1138 L1140 L1171 C1175 L1178 L1179	F1035-H1037 VanDerWaalsContact C-N 3.31Å; F1035-H1037 HydrophobicContact CD1-CB 4Å; F1035-H1037 HydrophobicContact CE1-CB 4.21Å; F1035-H1037 PolarHBondContact O-N 3.07Å; F1035-P1098 WeakPolarHBondContact O-CG 3.28Å; F1035-I1138 CarbonylContact C-O 3.57Å; F1035-I1138 WeakPolarHBondContact CA-O 2.89Å; F1035-I1138 WeakPolarHBondContact CD2-O 2.98Å; F1035-L1140 HydrophobicContact CZ-CB 4.45Å; F1035-L1171 HydrophobicContact CD2-CD1 4.19Å; F1035-L1171 HydrophobicContact CD2-CD2 3.87Å; F1035-L1171 HydrophobicContact CE2-CD1 3.36Å; F1035-L1171 HydrophobicContact CE2-CD2 3.69Å; F1035-L1171 HydrophobicContact CE2-CG 4.2Å; F1035-L1171 HydrophobicContact CZ-CD1 3.65Å; F1035-C1175 HydrophobicContact CB-CB 3.87Å; F1035-C1175 HydrophobicContact CD1-CB 4.41Å; F1035-C1175 HydrophobicContact CD2-CB 4.05Å; F1035-C1175 HydrophobicContact CG-CB 3.83Å; F1035-L1178 HydrophobicContact CB-CD1 4.28Å; F1035-L1178 HydrophobicContact CD1-CB 4.05Å; F1035-L1178 HydrophobicContact CD1-CD1 3.9Å; F1035-L1178 HydrophobicContact CE1-CB 4.31Å; F1035-L1179 HydrophobicContact CE1-CD2 3.82Å; F1035-L1179 HydrophobicContact CE1-CG 3.97Å; F1035-L1179 HydrophobicContact CZ-CD1 4.18Å; F1035-L1179 HydrophobicContact CZ-CD2 3.77Å; F1035-L1179 HydrophobicContact CZ-CG 4Å
1036	Y	73.9	Confident	70.2	Confident	10 Å²	10	57 Å²	57	4%	0.039	32%	0.317	C	S	.	.	S	Bend	trans	-72.8	76.9	-172.6	-174.6	-149.9	0	0	0	113.6	P1098 Q1099 V1101 I1138 P1254 G1255 L1256	Y1036-P1098 HydrophobicContact CD2-CB 4.11Å; Y1036-Q1099 WeakPolarHBondContact CE2-O 3.15Å; Y1036-Q1099 PolarHBondContact OH-O 3.24Å; Y1036-V1101 HydrophobicContact CD1-CG2 3.71Å; Y1036-V1101 HydrophobicContact CE1-CG2 4.39Å; Y1036-V1101 HydrophobicContact CG-CG2 4.34Å; Y1036-I1138 PolarHBondContact N-O 3.43Å; Y1036-P1254 HydrophobicContact CD2-CG 4.46Å; Y1036-P1254 HydrophobicContact CE1-CB 4.44Å; Y1036-P1254 WeakPolarHBondContact CE1-O 3.18Å; Y1036-P1254 HydrophobicContact CE2-CB 3.78Å; Y1036-P1254 HydrophobicContact CE2-CG 4.09Å; Y1036-P1254 PolarHBondContact OH-O 3.08Å; Y1036-G1255 PolarHBondContact OH-O 2.61Å; Y1036-G1255 VanDerWaalsContact OH-O 3.07Å; Y1036-L1256 HydrophobicContact CE1-CD2 4.38Å; Y1036-L1256 HydrophobicContact CE1-CG 4.37Å
1037	H	68.6	Low	70.4	Confident	15 Å²	15	59.3 Å²	59.3	7%	0.069	32%	0.322	C	S	.	.	S	Bend	trans	-144.7	146.7	175.1	-174.2	-115	0	0	0	110.7	F1035 E1039 A1040 P1098 L1178	F1035-H1037 VanDerWaalsContact C-N 3.31Å; F1035-H1037 HydrophobicContact CD1-CB 4Å; F1035-H1037 HydrophobicContact CE1-CB 4.21Å; F1035-H1037 PolarHBondContact O-N 3.07Å; H1037-E1039 VanDerWaalsContact CE1-CD 3.49Å; H1037-E1039 IonicContact CE1-OE1 3.15Å; H1037-E1039 IonicContact CE1-OE2 3Å; H1037-E1039 PolarHBondContact CE1-OE2 2.9Å; H1037-E1039 PolarHBondContact ND1-N 3Å; H1037-E1039 IonicContact ND1-OE2 3.58Å; H1037-E1039 PolarHBondContact O-N 3.13Å; H1037-E1039 VanDerWaalsContact O-N 3.16Å; H1037-A1040 PolarHBondContact O-N 2.94Å; H1037-A1040 VanDerWaalsContact O-N 3.16Å; H1037-P1098 WeakPolarHBondContact O-CG 3.33Å; H1037-L1178 HydrophobicContact CB-CB 4.01Å; H1037-L1178 HydrophobicContact CB-CD1 4.36Å; H1037-L1178 PolarHBondContact CD2-O 2.73Å; H1037-L1178 PolarHBondContact CE1-O 2.93Å; H1037-L1178 PolarHBondContact NE2-O 3.01Å
1038	S	66.4	Low	70.4	Confident	82 Å²	82	55.8 Å²	55.8	57%	0.573	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-18.8	-173.3	47.2	0	0	0	0	115.1
1039	E	67.9	Low	70.9	Confident	121 Å²	121	53 Å²	53	57%	0.565	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.6	179.2	-61.9	168.3	-171.1	0	0	113.2	H1037 L1178 K1180	H1037-E1039 VanDerWaalsContact CE1-CD 3.49Å; H1037-E1039 IonicContact CE1-OE1 3.15Å; H1037-E1039 IonicContact CE1-OE2 3Å; H1037-E1039 PolarHBondContact CE1-OE2 2.9Å; H1037-E1039 PolarHBondContact ND1-N 3Å; H1037-E1039 IonicContact ND1-OE2 3.58Å; H1037-E1039 PolarHBondContact O-N 3.13Å; H1037-E1039 VanDerWaalsContact O-N 3.16Å; E1039-L1178 HydrophobicContact CB-CD2 4.32Å; E1039-K1180 IonicContact OE1-NZ 2.75Å; E1039-K1180 PolarHBondContact OE1-NZ 3.32Å; E1039-K1180 VanDerWaalsContact OE1-NZ 3.09Å
1040	A	65.1	Low	71.1	Confident	12 Å²	12	50 Å²	50	10%	0.099	27%	0.265	C	S	.	.			trans	-86.7	128.5	176.9	0	0	0	0	0	111.7	H1037 P1098 L1178	H1037-A1040 PolarHBondContact O-N 2.94Å; H1037-A1040 VanDerWaalsContact O-N 3.16Å; A1040-P1098 HydrophobicContact CB-CG 4.23Å; A1040-P1098 WeakPolarHBondContact O-CD 3.35Å; A1040-L1178 HydrophobicContact CB-CD1 4.1Å
1041	S	69.7	Low	71.2	Confident	60 Å²	60	43.1 Å²	43.1	42%	0.42	24%	0.235	S	C	.	.			trans	-146.8	166.2	171.8	79.9	0	0	0	0	115.9	E1095 I1096	S1041-E1095 VanDerWaalsContact CB-OE1 3.22Å; S1041-E1095 WeakPolarHBondContact CB-OE1 2.93Å; S1041-E1095 PolarHBondContact OG-OE1 3.41Å; S1041-I1096 CarbonylContact C-O 3.55Å; S1041-I1096 WeakPolarHBondContact CA-O 3.32Å; S1041-I1096 WeakPolarHBondContact CB-O 3.03Å
1042	S	72	Confident	71.4	Confident	39 Å²	39	43.3 Å²	43.3	27%	0.273	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	172.2	178.4	-172.7	0	0	0	0	110.7	E1095 I1096	S1042-E1095 CarbonylContact O-C 3.48Å; S1042-E1095 VanDerWaalsContact O-CA 3.29Å; S1042-E1095 WeakPolarHBondContact O-CA 2.7Å; S1042-I1096 PolarHBondContact N-O 2.73Å; S1042-I1096 PolarHBondContact O-N 2.66Å
1043	T	77.3	Confident	71.5	Confident	59 Å²	59	43 Å²	43	36%	0.362	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	145	-171.4	56.9	0	0	0	0	115.7	Y1094 E1095	T1043-Y1094 CarbonylContact C-O 3.54Å; T1043-Y1094 VanDerWaalsContact CA-O 3.3Å; T1043-Y1094 WeakPolarHBondContact CA-O 2.9Å; T1043-E1095 HydrophobicContact CG2-CB 4.5Å
1044	V	74.8	Confident	71.7	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	154.9	-174.8	177.4	0	0	0	0	111	V1027 I1032 Y1094 I1096 F1133	V1027-V1044 CarbonylContact O-C 3.57Å; V1027-V1044 WeakPolarHBondContact O-CG1 3.46Å; I1032-V1044 HydrophobicContact CD1-CG2 4.18Å; V1044-Y1094 PolarHBondContact N-O 2.72Å; V1044-Y1094 PolarHBondContact O-N 3.1Å; V1044-I1096 HydrophobicContact CG2-CD1 3.61Å; V1044-I1096 HydrophobicContact CG2-CG1 4.39Å; V1044-F1133 HydrophobicContact CB-CE2 4.48Å; V1044-F1133 HydrophobicContact CG1-CE1 4.15Å; V1044-F1133 HydrophobicContact CG1-CE2 4.07Å; V1044-F1133 HydrophobicContact CG1-CZ 3.83Å; V1044-F1133 HydrophobicContact CG2-CD2 4.43Å; V1044-F1133 HydrophobicContact CG2-CE2 3.93Å; V1044-F1133 HydrophobicContact CG2-CZ 4.43Å
1045	Y	78	Confident	71.6	Confident	88 Å²	88	39.6 Å²	39.6	35%	0.345	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	147.2	-177.5	-49.8	-83.7	0	0	0	112.8	A1026 V1027 T1093	A1026-Y1045 CarbonylContact C-O 3.49Å; A1026-Y1045 VanDerWaalsContact CA-O 3.28Å; A1026-Y1045 WeakPolarHBondContact CA-O 3.25Å; V1027-Y1045 PolarHBondContact N-O 2.63Å; V1027-Y1045 PolarHBondContact O-N 2.8Å; Y1045-T1093 HydrophobicContact CD1-CG2 3.8Å; Y1045-T1093 HydrophobicContact CE1-CG2 3.7Å
1046	I	71.2	Confident	71.4	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.1	-179.8	-54.3	-172	0	0	0	111.3	I1024 N1025 A1026 Y1053 L1055 R1091 R1092 Y1094 A1108	I1024-I1046 HydrophobicContact CD1-CG2 4.08Å; I1024-I1046 HydrophobicContact CG1-CG2 3.98Å; N1025-I1046 CarbonylContact O-C 3.48Å; N1025-I1046 WeakPolarHBondContact O-CA 3.36Å; N1025-I1046 WeakPolarHBondContact O-CG2 3.31Å; A1026-I1046 HydrophobicContact CB-CG1 4.1Å; I1046-Y1053 HydrophobicContact CB-CD2 4.17Å; I1046-Y1053 HydrophobicContact CB-CE2 4.11Å; I1046-Y1053 HydrophobicContact CG2-CD2 3.58Å; I1046-Y1053 HydrophobicContact CG2-CE2 3.57Å; I1046-Y1053 HydrophobicContact CG2-CG 4.08Å; I1046-L1055 HydrophobicContact CD1-CD2 3.88Å; I1046-R1091 CarbonylContact O-C 3.57Å; I1046-R1091 VanDerWaalsContact O-CA 3.29Å; I1046-R1091 WeakPolarHBondContact O-CA 3.38Å; I1046-R1092 PolarHBondContact N-O 3.33Å; I1046-R1092 PolarHBondContact O-N 3.24Å; I1046-Y1094 HydrophobicContact CB-CE2 4.13Å; I1046-Y1094 HydrophobicContact CD1-CD2 3.83Å; I1046-Y1094 HydrophobicContact CD1-CE2 3.5Å; I1046-Y1094 VanDerWaalsContact CD1-CE2 3.5Å; I1046-Y1094 HydrophobicContact CG1-CD2 3.93Å; I1046-Y1094 HydrophobicContact CG1-CE2 3.78Å; I1046-A1108 HydrophobicContact CD1-CB 3.75Å
1047	H	75.6	Confident	70.7	Confident	75 Å²	75	41.2 Å²	41.2	35%	0.347	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	146.9	-177	-67.9	-106.7	0	0	0	113.2	I1024 N1025 P1090 R1091	I1024-H1047 CarbonylContact C-O 3.09Å; I1024-H1047 VanDerWaalsContact CA-O 3.26Å; I1024-H1047 WeakPolarHBondContact CA-O 3.39Å; N1025-H1047 PolarHBondContact N-O 2.72Å; N1025-H1047 PolarHBondContact O-N 2.65Å; H1047-P1090 WeakPolarHBondContact CA-O 3.48Å; H1047-R1091 VanDerWaalsContact CE1-CD 3.42Å; H1047-R1091 WeakPolarHBondContact CE1-CD 3.41Å; H1047-R1091 PolarHBondContact CE1-NE 2.84Å; H1047-R1091 PolarHBondContact NE2-NE 3.17Å
1048	G	71.7	Confident	70	Confident	10 Å²	10	43.9 Å²	43.9	10%	0.103	24%	0.24	C	C	.	.			trans	103.8	-168.8	165	0	0	0	0	0	116.2	V1023 Y1053 P1090	V1023-G1048 WeakPolarHBondContact O-CA 2.98Å; G1048-Y1053 PolarHBondContact N-OH 3.21Å; G1048-Y1053 WeakPolarHBondContact O-CE1 3.33Å; G1048-Y1053 VanDerWaalsContact O-CZ 3.27Å; G1048-Y1053 PolarHBondContact O-OH 3.22Å; G1048-P1090 PolarHBondContact N-O 2.87Å; G1048-P1090 VanDerWaalsContact O-CG 3.31Å; G1048-P1090 WeakPolarHBondContact O-CG 3.36Å
1049	G	72.8	Confident	69	Low	1 Å²	1	41.7 Å²	41.7	1%	0.01	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	-152.4	167.7	0	0	0	0	0	117.7	S1021 P1022 V1023 D1110	S1021-G1049 PolarHBondContact OG-O 3.04Å; S1021-G1049 VanDerWaalsContact OG-O 3.1Å; P1022-G1049 CarbonylContact O-C 3.44Å; P1022-G1049 WeakPolarHBondContact O-CA 3.39Å; P1022-G1049 PolarHBondContact O-N 3Å; P1022-G1049 VanDerWaalsContact O-N 3.08Å; V1023-G1049 PolarHBondContact O-N 3.32Å; G1049-D1110 WeakPolarHBondContact CA-OD2 2.93Å
1050	S	68.2	Low	67.9	Low	35 Å²	35	43 Å²	43	25%	0.245	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.7	168.2	70.1	0	0	0	0	112.9	Y1052 D1110	S1050-Y1052 VanDerWaalsContact C-N 3.31Å; S1050-Y1052 PolarHBondContact OG-N 2.79Å; S1050-D1110 WeakPolarHBondContact CB-OD1 3.27Å; S1050-D1110 PolarHBondContact N-OD2 3.26Å; S1050-D1110 VanDerWaalsContact OG-CG 3.23Å; S1050-D1110 PolarHBondContact OG-OD1 2.56Å; S1050-D1110 PolarHBondContact OG-OD2 3.17Å; S1050-D1110 VanDerWaalsContact OG-OD2 3.12Å
1051	G	68.7	Low	67	Low	10 Å²	10	46.9 Å²	46.9	10%	0.103	26%	0.261	C	S	.	.	S	Bend	trans	80.1	6.9	-168.3	0	0	0	0	0	114.3	R1092	G1051-R1092 VanDerWaalsContact O-CZ 3.28Å; G1051-R1092 PolarHBondContact O-NE 2.72Å; G1051-R1092 PolarHBondContact O-NH2 3.26Å
1052	Y	71	Confident	65.8	Low	105 Å²	105	50.1 Å²	50.1	41%	0.412	28%	0.278	S	S	.	.			trans	-124.1	90.1	178	-137.5	-90.3	0	0	0	113.1	P881 S1050 L1111	P881-Y1052 HydrophobicContact CB-CE1 4.3Å; P881-Y1052 HydrophobicContact CB-CE2 4.26Å; P881-Y1052 VanDerWaalsContact CD-CD1 3.48Å; P881-Y1052 HydrophobicContact CG-CD1 3.56Å; P881-Y1052 HydrophobicContact CG-CD2 3.6Å; P881-Y1052 HydrophobicContact CG-CE1 3.57Å; P881-Y1052 HydrophobicContact CG-CE2 3.62Å; P881-Y1052 HydrophobicContact CG-CG 3.55Å; S1050-Y1052 VanDerWaalsContact C-N 3.31Å; S1050-Y1052 PolarHBondContact OG-N 2.79Å; Y1052-L1111 PolarHBondContact O-N 3.1Å
1053	Y	72.9	Confident	64.6	Low	16 Å²	16	52.8 Å²	52.8	6%	0.063	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.9	-176.7	-31.6	-56.1	0	0	0	111.3	I1024 I1046 G1048 P1090 R1092 I1109 D1110	I1024-Y1053 HydrophobicContact CD1-CD1 3.4Å; I1024-Y1053 VanDerWaalsContact CD1-CD1 3.4Å; I1024-Y1053 HydrophobicContact CD1-CE1 3.9Å; I1024-Y1053 HydrophobicContact CD1-CG 3.9Å; I1024-Y1053 HydrophobicContact CG1-CD1 4.12Å; I1024-Y1053 HydrophobicContact CG1-CE1 4.1Å; I1046-Y1053 HydrophobicContact CB-CD2 4.17Å; I1046-Y1053 HydrophobicContact CB-CE2 4.11Å; I1046-Y1053 HydrophobicContact CG2-CD2 3.58Å; I1046-Y1053 HydrophobicContact CG2-CE2 3.57Å; I1046-Y1053 HydrophobicContact CG2-CG 4.08Å; G1048-Y1053 PolarHBondContact N-OH 3.21Å; G1048-Y1053 WeakPolarHBondContact O-CE1 3.33Å; G1048-Y1053 VanDerWaalsContact O-CZ 3.27Å; G1048-Y1053 PolarHBondContact O-OH 3.22Å; Y1053-P1090 PolarHBondContact OH-O 2.85Å; Y1053-R1092 HydrophobicContact CD2-CB 4.44Å; Y1053-R1092 HydrophobicContact CD2-CG 4.37Å; Y1053-R1092 HydrophobicContact CE2-CB 4.12Å; Y1053-R1092 HydrophobicContact CE2-CG 3.92Å; Y1053-I1109 CarbonylContact C-O 3.59Å; Y1053-D1110 HydrophobicContact CD1-CB 4.38Å
1054	Y	74.3	Confident	63.1	Low	54 Å²	54	57.3 Å²	57.3	21%	0.212	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	162	155.7	-173.2	-121.1	0	0	0	110.6	F877 P878 E1056 A1108 I1109 L1111	F877-Y1054 AromaticContact CD1-CD1 3.29Å; F877-Y1054 HydrophobicContact CD1-CD1 3.29Å; F877-Y1054 AromaticContact CD1-CE1 3.39Å; F877-Y1054 HydrophobicContact CD1-CE1 3.39Å; F877-Y1054 HydrophobicContact CD1-CG 4.15Å; F877-Y1054 AromaticContact CE1-CD1 3.6Å; F877-Y1054 HydrophobicContact CE1-CD1 3.6Å; F877-Y1054 AromaticContact CE1-CE1 3.67Å; F877-Y1054 HydrophobicContact CE1-CE1 3.67Å; F877-Y1054 HydrophobicContact CG-CD1 4.37Å; F877-Y1054 HydrophobicContact CG-CE1 4.16Å; P878-Y1054 HydrophobicContact CG-CD2 3.7Å; P878-Y1054 HydrophobicContact CG-CE2 3.88Å; Y1054-E1056 HydrophobicContact CD1-CB 3.94Å; Y1054-E1056 HydrophobicContact CE1-CB 3.66Å; Y1054-E1056 HydrophobicContact CE1-CG 4.23Å; Y1054-A1108 CarbonylContact O-C 3.46Å; Y1054-A1108 WeakPolarHBondContact O-CA 3.4Å; Y1054-I1109 WeakPolarHBondContact CB-O 3.4Å; Y1054-I1109 PolarHBondContact N-O 2.74Å; Y1054-I1109 PolarHBondContact O-N 3.05Å; Y1054-L1111 HydrophobicContact CG-CD2 4.23Å
1055	L	71.2	Confident	61.7	Low	34 Å²	34	62.2 Å²	62.2	18%	0.178	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	99.4	173.3	-70.4	157.6	0	0	0	106.7	I1046 I1071 Y1094 I1106 Q1107 A1108 F1133	I1046-L1055 HydrophobicContact CD1-CD2 3.88Å; L1055-I1071 HydrophobicContact CB-CD1 3.94Å; L1055-I1071 HydrophobicContact CD1-CB 4.35Å; L1055-I1071 HydrophobicContact CD1-CD1 3.87Å; L1055-I1071 HydrophobicContact CD1-CG2 3.97Å; L1055-I1071 HydrophobicContact CG-CD1 4.33Å; L1055-Y1094 HydrophobicContact CD1-CD1 3.99Å; L1055-Y1094 HydrophobicContact CD1-CE1 3.8Å; L1055-Y1094 HydrophobicContact CD1-CG 4.44Å; L1055-I1106 HydrophobicContact CB-CG2 4.09Å; L1055-I1106 HydrophobicContact CD2-CG2 3.57Å; L1055-I1106 HydrophobicContact CG-CG2 4.43Å; L1055-Q1107 CarbonylContact C-O 3.58Å; L1055-Q1107 WeakPolarHBondContact CA-O 3.26Å; L1055-A1108 HydrophobicContact CD2-CB 3.74Å; L1055-F1133 HydrophobicContact CD2-CE1 4.48Å
1056	E	68	Low	60.4	Low	33 Å²	33	61 Å²	61	15%	0.154	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	159	174	-172.3	164.4	-137.1	0	0	109.9	F877 Y1054 I1106 Q1107 I1109	F877-E1056 HydrophobicContact CE1-CB 4.49Å; F877-E1056 VanDerWaalsContact CZ-CD 3.44Å; F877-E1056 VanDerWaalsContact CZ-OE1 3.3Å; F877-E1056 WeakPolarHBondContact CZ-OE1 3.31Å; F877-E1056 WeakPolarHBondContact CZ-OE2 3.41Å; Y1054-E1056 HydrophobicContact CD1-CB 3.94Å; Y1054-E1056 HydrophobicContact CE1-CB 3.66Å; Y1054-E1056 HydrophobicContact CE1-CG 4.23Å; E1056-I1106 CarbonylContact O-C 3.49Å; E1056-I1106 WeakPolarHBondContact O-CA 3.38Å; E1056-Q1107 HydrophobicContact CB-CB 4.36Å; E1056-Q1107 PolarHBondContact N-O 2.83Å; E1056-Q1107 PolarHBondContact O-N 3.14Å; E1056-I1109 HydrophobicContact CB-CD1 3.85Å; E1056-I1109 VanDerWaalsContact OE2-CD1 3.25Å; E1056-I1109 WeakPolarHBondContact OE2-CD1 3.06Å
1057	N	58.4	Low	59.8	Low	16 Å²	16	65.2 Å²	65.2	9%	0.086	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.5	173.1	-79.3	-29.3	0	0	0	109.5	G1059 Y1067 V1104 T1105 I1106	N1057-G1059 PolarHBondContact O-N 2.97Å; N1057-Y1067 HydrophobicContact CB-CD1 3.81Å; N1057-Y1067 HydrophobicContact CB-CE1 3.55Å; N1057-Y1067 WeakPolarHBondContact ND2-CD1 3.29Å; N1057-V1104 HydrophobicContact CB-CG1 4.36Å; N1057-V1104 HydrophobicContact CB-CG2 3.98Å; N1057-V1104 WeakPolarHBondContact OD1-CG1 3.17Å; N1057-T1105 CarbonylContact C-O 3.49Å; N1057-T1105 VanDerWaalsContact CA-O 3.27Å; N1057-T1105 WeakPolarHBondContact CA-O 3.33Å; N1057-I1106 VanDerWaalsContact OD1-CG1 3.26Å; N1057-I1106 WeakPolarHBondContact OD1-CG1 3.41Å
1058	S	54.2	Low	58.9	Low	70 Å²	70	61.9 Å²	61.9	49%	0.49	32%	0.321	S	S	.	.			trans	-76.1	33.7	-177.2	88	0	0	0	0	114.3	T1105	S1058-T1105 PolarHBondContact N-O 3Å; S1058-T1105 VanDerWaalsContact OG-CB 3.31Å; S1058-T1105 WeakPolarHBondContact OG-CB 3.34Å; S1058-T1105 PolarHBondContact OG-OG1 3.06Å
1059	G	46.9	Very low	58.6	Low	37 Å²	37	61.9 Å²	61.9	38%	0.381	32%	0.318	S	S	.	.	S	Bend	trans	-85.1	150.2	173.7	0	0	0	0	0	111.6	N1057 L1061	N1057-G1059 PolarHBondContact O-N 2.97Å; G1059-L1061 PolarHBondContact O-N 2.72Å
1060	N	44.3	Very low	58.6	Low	149 Å²	149	68.1 Å²	68.1	80%	0.797	34%	0.342	S	S	*	.			trans	-64.7	128	-176	-145.7	-1.1	0	0	0	110.8	T1062	N1060-T1062 PolarHBondContact O-N 2.87Å
1061	L	44.9	Very low	58.6	Low	93 Å²	93	68.6 Å²	68.6	49%	0.487	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	9.7	-158.7	-104	125	0	0	0	117	G1059	G1059-L1061 PolarHBondContact O-N 2.72Å
1062	T	45.9	Very low	58.7	Low	127 Å²	127	70 Å²	70	78%	0.779	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-16.7	-178.3	48.1	0	0	0	0	114.4	N1060	N1060-T1062 PolarHBondContact O-N 2.87Å
1063	D	47	Very low	58.4	Low	95 Å²	95	68.8 Å²	68.8	51%	0.508	35%	0.346	S	S	.	.			trans	-124.1	65.6	-162.4	-141.1	-27.7	0	0	0	113.9	H1065 H1066	D1063-H1065 PolarHBondContact O-N 2.51Å; D1063-H1066 PolarHBondContact O-N 3.21Å; D1063-H1066 IonicContact OD1-CE1 2.75Å; D1063-H1066 PolarHBondContact OD1-CE1 2.74Å; D1063-H1066 IonicContact OD1-CG 2.81Å; D1063-H1066 IonicContact OD1-ND1 3.85Å; D1063-H1066 PolarHBondContact OD1-ND1 2.94Å; D1063-H1066 IonicContact OD2-ND1 2.82Å
1064	R	44.2	Very low	57.8	Low	155 Å²	155	72.8 Å²	72.8	59%	0.585	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	0.4	-164.1	-85.7	-173.8	168.1	-158.9	-5.4	117.8	H876	H876-R1064 PolarHBondContact ND1-NH2 3.33Å
1065	H	45.9	Very low	56.8	Low	103 Å²	103	77.4 Å²	77.4	48%	0.477	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-17.1	177.9	-73.6	-43.5	0	0	0	114.6	D1063 Y1067 H1100	D1063-H1065 PolarHBondContact O-N 2.51Å; H1065-Y1067 PolarHBondContact O-N 2.86Å; H1065-H1100 PolarHBondContact O-CE1 2.94Å; H1065-H1100 PolarHBondContact O-ND1 3.48Å
1066	H	50.4	Low	55.6	Low	63 Å²	63	82 Å²	82	29%	0.292	42%	0.416	S	S	.	.			trans	-98.6	41.2	-166.9	-60.2	113.7	0	0	0	114.8	D1063 P1068 L1256 L1257	D1063-H1066 PolarHBondContact O-N 3.21Å; D1063-H1066 IonicContact OD1-CE1 2.75Å; D1063-H1066 PolarHBondContact OD1-CE1 2.74Å; D1063-H1066 IonicContact OD1-CG 2.81Å; D1063-H1066 IonicContact OD1-ND1 3.85Å; D1063-H1066 PolarHBondContact OD1-ND1 2.94Å; D1063-H1066 IonicContact OD2-ND1 2.82Å; H1066-P1068 WeakPolarHBondContact O-CD 3.11Å; H1066-L1256 PolarHBondContact CD2-O 3.29Å; H1066-L1256 VanDerWaalsContact CD2-O 3.27Å; H1066-L1256 PolarHBondContact NE2-O 3.12Å; H1066-L1257 WeakPolarHBondContact NE2-CG 2.98Å
1067	Y	59.7	Low	54	Low	88 Å²	88	88.3 Å²	88.3	35%	0.345	45%	0.445	S	S	.	.			trans	-71.5	125.3	171.6	-69.2	-50.3	0	0	0	110.6	N1057 H1065 I1069 Q1099 H1100	N1057-Y1067 HydrophobicContact CB-CD1 3.81Å; N1057-Y1067 HydrophobicContact CB-CE1 3.55Å; N1057-Y1067 WeakPolarHBondContact ND2-CD1 3.29Å; H1065-Y1067 PolarHBondContact O-N 2.86Å; Y1067-I1069 PolarHBondContact O-N 2.94Å; Y1067-I1069 VanDerWaalsContact O-N 3.15Å; Y1067-Q1099 WeakPolarHBondContact O-CB 3.33Å; Y1067-H1100 PolarHBondContact O-ND1 3.4Å
1068	P	57	Low	52.9	Low	5 Å²	5	94 Å²	94	3%	0.032	48%	0.483	C	S	.	.	S	Bend	trans	-69.5	-9.7	-175.9	27.6	-37.2	0	0	0	115	H1066 P1098 Q1099 H1100 G1102 V1104 V1137	H1066-P1068 WeakPolarHBondContact O-CD 3.11Å; P1068-P1098 CarbonylContact O-C 3.47Å; P1068-P1098 WeakPolarHBondContact O-CA 3.19Å; P1068-Q1099 PolarHBondContact O-N 2.8Å; P1068-H1100 VanDerWaalsContact CA-O 3.28Å; P1068-H1100 WeakPolarHBondContact CA-O 2.9Å; P1068-H1100 WeakPolarHBondContact CB-O 3.35Å; P1068-H1100 PolarHBondContact O-N 3.08Å; P1068-H1100 VanDerWaalsContact O-O 3.05Å; P1068-G1102 VanDerWaalsContact CB-O 3.3Å; P1068-G1102 WeakPolarHBondContact CB-O 3.06Å; P1068-G1102 WeakPolarHBondContact CG-O 3.22Å; P1068-V1104 HydrophobicContact CG-CB 3.73Å; P1068-V1104 HydrophobicContact CG-CG2 3.6Å; P1068-V1137 HydrophobicContact CB-CB 3.93Å; P1068-V1137 HydrophobicContact CB-CG2 3.8Å
1069	I	65.7	Low	51.8	Low	10 Å²	10	96.7 Å²	96.7	5%	0.051	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.9	-177.5	54.9	-169	0	0	0	114.2	L1034 Y1067 I1096 Q1097 V1104 I1106 V1135 V1137	L1034-I1069 HydrophobicContact CD1-CG2 4.08Å; Y1067-I1069 PolarHBondContact O-N 2.94Å; Y1067-I1069 VanDerWaalsContact O-N 3.15Å; I1069-I1096 HydrophobicContact CB-CG2 3.86Å; I1069-I1096 HydrophobicContact CD1-CG2 4.06Å; I1069-I1096 HydrophobicContact CG1-CG2 4.45Å; I1069-I1096 HydrophobicContact CG2-CG2 3.81Å; I1069-Q1097 CarbonylContact C-O 3.52Å; I1069-Q1097 VanDerWaalsContact CA-O 3.24Å; I1069-Q1097 WeakPolarHBondContact CA-O 3.38Å; I1069-Q1097 WeakPolarHBondContact CB-O 3.35Å; I1069-V1104 HydrophobicContact CD1-CB 4.49Å; I1069-V1104 HydrophobicContact CD1-CG1 3.6Å; I1069-V1104 HydrophobicContact CG1-CG1 4.17Å; I1069-I1106 HydrophobicContact CD1-CD1 3.49Å; I1069-I1106 VanDerWaalsContact CD1-CD1 3.49Å; I1069-I1106 HydrophobicContact CD1-CG1 3.96Å; I1069-V1135 HydrophobicContact CD1-CB 3.81Å; I1069-V1135 HydrophobicContact CD1-CG1 3.99Å; I1069-V1135 HydrophobicContact CD1-CG2 3.75Å; I1069-V1135 HydrophobicContact CG2-CG1 3.92Å; I1069-V1137 HydrophobicContact CG2-CG2 3.47Å; I1069-V1137 VanDerWaalsContact CG2-CG2 3.47Å
1070	R	71.6	Confident	51	Low	133 Å²	133	103.3 Å²	103.3	50%	0.502	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	146.5	159	-151	-177.4	-166.9	171.4	6.4	108	T1072 I1096 Q1097 Q1099	R1070-T1072 HydrophobicContact CG-CG2 4.16Å; R1070-I1096 WeakPolarHBondContact O-CA 3.24Å; R1070-Q1097 HydrophobicContact CB-CB 4.12Å; R1070-Q1097 PolarHBondContact N-O 3.28Å; R1070-Q1097 PolarHBondContact O-N 2.94Å; R1070-Q1097 VanDerWaalsContact O-O 3.05Å; R1070-Q1099 HydrophobicContact CB-CG 3.64Å; R1070-Q1099 HydrophobicContact CG-CG 4.29Å
1071	I	68.7	Low	50.2	Low	45 Å²	45	100.7 Å²	100.7	23%	0.231	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.2	164.2	-45	172	0	0	0	106.6	L1055 Y1094 I1096 I1106	L1055-I1071 HydrophobicContact CB-CD1 3.94Å; L1055-I1071 HydrophobicContact CD1-CB 4.35Å; L1055-I1071 HydrophobicContact CD1-CD1 3.87Å; L1055-I1071 HydrophobicContact CD1-CG2 3.97Å; L1055-I1071 HydrophobicContact CG-CD1 4.33Å; I1071-Y1094 HydrophobicContact CG2-CD1 3.77Å; I1071-Y1094 HydrophobicContact CG2-CG 4.03Å; I1071-I1096 HydrophobicContact CG2-CG1 4.49Å; I1071-I1106 HydrophobicContact CD1-CD1 3.52Å; I1071-I1106 HydrophobicContact CD1-CG1 4.03Å; I1071-I1106 HydrophobicContact CD1-CG2 4.09Å; I1071-I1106 HydrophobicContact CG1-CD1 4.28Å
1072	T	70.3	Confident	49.5	Very low	39 Å²	39	103 Å²	103	24%	0.239	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144	178.2	55.8	0	0	0	0	109.1	R1070 Y1094 E1095	R1070-T1072 HydrophobicContact CG-CG2 4.16Å; T1072-Y1094 CarbonylContact O-C 3.55Å; T1072-Y1094 VanDerWaalsContact O-CA 3.27Å; T1072-Y1094 WeakPolarHBondContact O-CA 2.89Å; T1072-E1095 PolarHBondContact N-O 2.77Å; T1072-E1095 PolarHBondContact O-N 2.99Å; T1072-E1095 PolarHBondContact OG1-O 2.67Å; T1072-E1095 VanDerWaalsContact OG1-O 3.09Å
1073	E	66	Low	48.8	Very low	80 Å²	80	105.9 Å²	105.9	37%	0.374	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.2	175.6	-172.2	169.5	-176.2	0	0	109.8	L1075 R1092 Y1094	E1073-L1075 PolarHBondContact O-N 3.36Å; E1073-L1075 VanDerWaalsContact O-N 3.16Å; E1073-R1092 WeakPolarHBondContact OE1-CD 2.67Å; E1073-R1092 WeakPolarHBondContact OE1-CG 2.7Å; E1073-R1092 IonicContact OE1-CZ 2.82Å; E1073-R1092 IonicContact OE1-NE 2.7Å; E1073-R1092 IonicContact OE1-NH1 3.24Å; E1073-R1092 PolarHBondContact OE1-NH1 2.93Å; E1073-R1092 IonicContact OE2-CZ 3.46Å; E1073-R1092 IonicContact OE2-NH1 2.91Å; E1073-R1092 PolarHBondContact OE2-NH1 3.44Å; E1073-Y1094 HydrophobicContact CB-CD1 4.25Å; E1073-Y1094 HydrophobicContact CB-CE1 4.14Å; E1073-Y1094 HydrophobicContact CG-CE1 4.32Å
1074	K	58.8	Low	48.1	Very low	100 Å²	100	108 Å²	108	44%	0.435	56%	0.561	S	S	.	*			trans	-83.9	94.1	-177	-151.3	-175.9	-169.4	89.5	0	109.1	N1076 T1093 E1095	K1074-N1076 PolarHBondContact O-N 2.97Å; K1074-T1093 HydrophobicContact CB-CG2 4.31Å; K1074-T1093 PolarHBondContact N-O 3.1Å; K1074-E1095 IonicContact NZ-OE2 2.82Å; K1074-E1095 PolarHBondContact NZ-OE2 2.67Å
1075	L	54.4	Low	47.4	Very low	150 Å²	150	107.4 Å²	107.4	79%	0.785	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-59.4	117.3	174.2	-112.7	73.6	0	0	0	109.8	E1073 E1077	E1073-L1075 PolarHBondContact O-N 3.36Å; E1073-L1075 VanDerWaalsContact O-N 3.16Å; L1075-E1077 PolarHBondContact O-N 2.92Å
1076	N	44.6	Very low	46.8	Very low	132 Å²	132	107.3 Å²	107.3	71%	0.706	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-78.7	117.2	167.2	-72	-24.2	0	0	0	108.4	K1074	K1074-N1076 PolarHBondContact O-N 2.97Å
1077	E	35.5	Very low	46.2	Very low	165 Å²	165	115.1 Å²	115.1	77%	0.771	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-63.4	131.2	172	-68.1	-171.7	133.2	0	0	110.6	L1075 T1079	L1075-E1077 PolarHBondContact O-N 2.92Å; E1077-T1079 VanDerWaalsContact C-N 3.32Å; E1077-T1079 PolarHBondContact O-N 3.35Å
1078	P	35.1	Very low	45.6	Very low	134 Å²	134	118 Å²	118	87%	0.87	62%	0.624	S	S	*	*			trans	-75	82.9	179.9	30.6	-34.5	0	0	0	110.8
1079	T	30.9	Very low	45.3	Very low	127 Å²	127	124.5 Å²	124.5	78%	0.779	66%	0.656	S	S	*	*			trans	-74.8	133.3	177.3	34.3	0	0	0	0	111.9	E1077	E1077-T1079 VanDerWaalsContact C-N 3.32Å; E1077-T1079 PolarHBondContact O-N 3.35Å
1080	L	30.4	Very low	44.8	Very low	176 Å²	176	126.3 Å²	126.3	92%	0.921	67%	0.668	S	S	*	*			trans	-12.8	132.8	-172.9	-122.1	68.2	0	0	0	120.3
1081	A	26.3	Very low	44.3	Very low	94 Å²	94	127 Å²	127	78%	0.777	67%	0.671	S	S	*	*			trans	-62.9	145.9	-171.7	0	0	0	0	0	117.5
1082	T	31	Very low	44.3	Very low	143 Å²	143	127.7 Å²	127.7	88%	0.877	67%	0.671	S	S	*	*			trans	-138	155.3	140.6	43.1	0	0	0	0	109.6
1083	H	30.6	Very low	44.3	Very low	186 Å²	186	127 Å²	127	86%	0.861	67%	0.666	S	S	*	*			trans	-80.1	127.4	-169.4	-60	-48.7	0	0	0	114.6
1084	T	33	Very low	44.7	Very low	141 Å²	141	124 Å²	124	87%	0.865	65%	0.652	S	S	*	*			trans	-177	149.4	130.6	17.5	0	0	0	0	110.9
1085	I	30.5	Very low	45.6	Very low	142 Å²	142	120.7 Å²	120.7	73%	0.728	64%	0.638	S	S	*	*			trans	-105.1	132	178.8	-59.8	165.1	0	0	0	109.1	Y1087	I1085-Y1087 HydrophobicContact CG2-CD2 4.31Å; I1085-Y1087 HydrophobicContact CG2-CE2 4.34Å
1086	P	31.4	Very low	46.5	Very low	101 Å²	101	113.5 Å²	113.5	66%	0.656	60%	0.6	S	S	*	*				-125.5	151	121.5	36	-31.3	0	0	0	111.3	I1088	P1086-I1088 WeakPolarHBondContact O-CG1 3.37Å; P1086-I1088 PolarHBondContact O-N 3.09Å
1087	Y	39.7	Very low	47.9	Very low	226 Å²	226	109.3 Å²	109.3	89%	0.886	58%	0.577	S	S	*	*			trans	-64.2	102.9	176.7	-68.7	-94.5	0	0	0	110.4	I1085	I1085-Y1087 HydrophobicContact CG2-CD2 4.31Å; I1085-Y1087 HydrophobicContact CG2-CE2 4.34Å
1088	I	45.2	Very low	49.5	Very low	149 Å²	149	102 Å²	102	76%	0.764	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-78.7	126	-177.6	-48.4	-174.5	0	0	0	109.1	P1086	P1086-I1088 WeakPolarHBondContact O-CG1 3.37Å; P1086-I1088 PolarHBondContact O-N 3.09Å
1089	M	51.3	Low	51	Low	141 Å²	141	99.5 Å²	99.5	70%	0.695	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-52.6	145.2	171.5	-68.1	176.6	173.1	0	0	110.9	R1091	M1089-R1091 PolarHBondContact O-N 2.8Å
1090	P	56.1	Low	52.6	Low	48 Å²	48	94.3 Å²	94.3	31%	0.312	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-54.6	125.6	178.2	23.1	-34.7	0	0	0	111.1	H1047 G1048 Y1053	H1047-P1090 WeakPolarHBondContact CA-O 3.48Å; G1048-P1090 PolarHBondContact N-O 2.87Å; G1048-P1090 VanDerWaalsContact O-CG 3.31Å; G1048-P1090 WeakPolarHBondContact O-CG 3.36Å; Y1053-P1090 PolarHBondContact OH-O 2.85Å
1091	R	60.6	Low	54.4	Low	147 Å²	147	87.7 Å²	87.7	56%	0.555	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.3	125.1	-179	-179.5	-174.5	-173.3	-159.6	-4.6	108.4	I1046 H1047 M1089	I1046-R1091 CarbonylContact O-C 3.57Å; I1046-R1091 VanDerWaalsContact O-CA 3.29Å; I1046-R1091 WeakPolarHBondContact O-CA 3.38Å; H1047-R1091 VanDerWaalsContact CE1-CD 3.42Å; H1047-R1091 WeakPolarHBondContact CE1-CD 3.41Å; H1047-R1091 PolarHBondContact CE1-NE 2.84Å; H1047-R1091 PolarHBondContact NE2-NE 3.17Å; M1089-R1091 PolarHBondContact O-N 2.8Å
1092	R	68.6	Low	56.4	Low	60 Å²	60	84.4 Å²	84.4	23%	0.226	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	152	177.7	-66.3	-175.4	-177.2	-110.4	10.5	111.2	I1046 G1051 Y1053 E1073 Y1094	I1046-R1092 PolarHBondContact N-O 3.33Å; I1046-R1092 PolarHBondContact O-N 3.24Å; G1051-R1092 VanDerWaalsContact O-CZ 3.28Å; G1051-R1092 PolarHBondContact O-NE 2.72Å; G1051-R1092 PolarHBondContact O-NH2 3.26Å; Y1053-R1092 HydrophobicContact CD2-CB 4.44Å; Y1053-R1092 HydrophobicContact CD2-CG 4.37Å; Y1053-R1092 HydrophobicContact CE2-CB 4.12Å; Y1053-R1092 HydrophobicContact CE2-CG 3.92Å; E1073-R1092 WeakPolarHBondContact OE1-CD 2.67Å; E1073-R1092 WeakPolarHBondContact OE1-CG 2.7Å; E1073-R1092 IonicContact OE1-CZ 2.82Å; E1073-R1092 IonicContact OE1-NE 2.7Å; E1073-R1092 IonicContact OE1-NH1 3.24Å; E1073-R1092 PolarHBondContact OE1-NH1 2.93Å; E1073-R1092 IonicContact OE2-CZ 3.46Å; E1073-R1092 IonicContact OE2-NH1 2.91Å; E1073-R1092 PolarHBondContact OE2-NH1 3.44Å; R1092-Y1094 HydrophobicContact CB-CD2 4.41Å; R1092-Y1094 HydrophobicContact CB-CE2 3.55Å; R1092-Y1094 VanDerWaalsContact CD-OH 3.22Å; R1092-Y1094 WeakPolarHBondContact CD-OH 3.34Å
1093	T	71	Confident	58.2	Low	24 Å²	24	85.9 Å²	85.9	15%	0.147	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130	-178.4	-54.5	0	0	0	0	109	Y1045 K1074	Y1045-T1093 HydrophobicContact CD1-CG2 3.8Å; Y1045-T1093 HydrophobicContact CE1-CG2 3.7Å; K1074-T1093 HydrophobicContact CB-CG2 4.31Å; K1074-T1093 PolarHBondContact N-O 3.1Å
1094	Y	73.3	Confident	60.1	Low	17 Å²	17	77.5 Å²	77.5	7%	0.067	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.3	-171.6	-66.3	-82	0	0	0	111.5	T1043 V1044 I1046 L1055 I1071 T1072 E1073 R1092	T1043-Y1094 CarbonylContact C-O 3.54Å; T1043-Y1094 VanDerWaalsContact CA-O 3.3Å; T1043-Y1094 WeakPolarHBondContact CA-O 2.9Å; V1044-Y1094 PolarHBondContact N-O 2.72Å; V1044-Y1094 PolarHBondContact O-N 3.1Å; I1046-Y1094 HydrophobicContact CB-CE2 4.13Å; I1046-Y1094 HydrophobicContact CD1-CD2 3.83Å; I1046-Y1094 HydrophobicContact CD1-CE2 3.5Å; I1046-Y1094 VanDerWaalsContact CD1-CE2 3.5Å; I1046-Y1094 HydrophobicContact CG1-CD2 3.93Å; I1046-Y1094 HydrophobicContact CG1-CE2 3.78Å; L1055-Y1094 HydrophobicContact CD1-CD1 3.99Å; L1055-Y1094 HydrophobicContact CD1-CE1 3.8Å; L1055-Y1094 HydrophobicContact CD1-CG 4.44Å; I1071-Y1094 HydrophobicContact CG2-CD1 3.77Å; I1071-Y1094 HydrophobicContact CG2-CG 4.03Å; T1072-Y1094 CarbonylContact O-C 3.55Å; T1072-Y1094 VanDerWaalsContact O-CA 3.27Å; T1072-Y1094 WeakPolarHBondContact O-CA 2.89Å; E1073-Y1094 HydrophobicContact CB-CD1 4.25Å; E1073-Y1094 HydrophobicContact CB-CE1 4.14Å; E1073-Y1094 HydrophobicContact CG-CE1 4.32Å; R1092-Y1094 HydrophobicContact CB-CD2 4.41Å; R1092-Y1094 HydrophobicContact CB-CE2 3.55Å; R1092-Y1094 VanDerWaalsContact CD-OH 3.22Å; R1092-Y1094 WeakPolarHBondContact CD-OH 3.34Å
1095	E	77.5	Confident	61.9	Low	31 Å²	31	72.2 Å²	72.2	15%	0.145	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.7	173.3	176	166.5	177.2	0	0	109.3	S1041 S1042 T1043 T1072 K1074	S1041-E1095 VanDerWaalsContact CB-OE1 3.22Å; S1041-E1095 WeakPolarHBondContact CB-OE1 2.93Å; S1041-E1095 PolarHBondContact OG-OE1 3.41Å; S1042-E1095 CarbonylContact O-C 3.48Å; S1042-E1095 VanDerWaalsContact O-CA 3.29Å; S1042-E1095 WeakPolarHBondContact O-CA 2.7Å; T1043-E1095 HydrophobicContact CG2-CB 4.5Å; T1072-E1095 PolarHBondContact N-O 2.77Å; T1072-E1095 PolarHBondContact O-N 2.99Å; T1072-E1095 PolarHBondContact OG1-O 2.67Å; T1072-E1095 VanDerWaalsContact OG1-O 3.09Å; K1074-E1095 IonicContact NZ-OE2 2.82Å; K1074-E1095 PolarHBondContact NZ-OE2 2.67Å
1096	I	74.5	Confident	63.8	Low	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124	-177.6	-53.9	176.3	0	0	0	107.9	I1032 L1034 S1041 S1042 V1044 I1069 R1070 I1071 I1106 F1133 V1135	I1032-I1096 HydrophobicContact CD1-CD1 4.03Å; L1034-I1096 HydrophobicContact CD1-CG2 3.81Å; S1041-I1096 CarbonylContact C-O 3.55Å; S1041-I1096 WeakPolarHBondContact CA-O 3.32Å; S1041-I1096 WeakPolarHBondContact CB-O 3.03Å; S1042-I1096 PolarHBondContact N-O 2.73Å; S1042-I1096 PolarHBondContact O-N 2.66Å; V1044-I1096 HydrophobicContact CG2-CD1 3.61Å; V1044-I1096 HydrophobicContact CG2-CG1 4.39Å; I1069-I1096 HydrophobicContact CB-CG2 3.86Å; I1069-I1096 HydrophobicContact CD1-CG2 4.06Å; I1069-I1096 HydrophobicContact CG1-CG2 4.45Å; I1069-I1096 HydrophobicContact CG2-CG2 3.81Å; R1070-I1096 WeakPolarHBondContact O-CA 3.24Å; I1071-I1096 HydrophobicContact CG2-CG1 4.49Å; I1096-I1106 HydrophobicContact CD1-CD1 4.37Å; I1096-F1133 HydrophobicContact CD1-CE2 3.89Å; I1096-V1135 HydrophobicContact CD1-CG2 4.29Å
1097	Q	72.3	Confident	65.9	Low	44 Å²	44	62.3 Å²	62.3	21%	0.206	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	157.1	172.5	-60.4	170.8	-20	0	0	108.2	I1069 R1070	I1069-Q1097 CarbonylContact C-O 3.52Å; I1069-Q1097 VanDerWaalsContact CA-O 3.24Å; I1069-Q1097 WeakPolarHBondContact CA-O 3.38Å; I1069-Q1097 WeakPolarHBondContact CB-O 3.35Å; R1070-Q1097 HydrophobicContact CB-CB 4.12Å; R1070-Q1097 PolarHBondContact N-O 3.28Å; R1070-Q1097 PolarHBondContact O-N 2.94Å; R1070-Q1097 VanDerWaalsContact O-O 3.05Å
1098	P	71.2	Confident	67.5	Low	10 Å²	10	51.5 Å²	51.5	7%	0.065	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	150.5	175.7	35.5	-38	0	0	0	112.4	F1035 Y1036 H1037 A1040 P1068 V1137	F1035-P1098 WeakPolarHBondContact O-CG 3.28Å; Y1036-P1098 HydrophobicContact CD2-CB 4.11Å; H1037-P1098 WeakPolarHBondContact O-CG 3.33Å; A1040-P1098 HydrophobicContact CB-CG 4.23Å; A1040-P1098 WeakPolarHBondContact O-CD 3.35Å; P1068-P1098 CarbonylContact O-C 3.47Å; P1068-P1098 WeakPolarHBondContact O-CA 3.19Å; P1098-V1137 HydrophobicContact CB-CG1 3.67Å
1099	Q	65.1	Low	69	Low	83 Å²	83	44.7 Å²	44.7	39%	0.388	21%	0.212	S	C	.	.			trans	-127.6	-34.3	-179.2	-86.4	-88.9	-60.1	0	0	113.2	Y1036 Y1067 P1068 R1070	Y1036-Q1099 WeakPolarHBondContact CE2-O 3.15Å; Y1036-Q1099 PolarHBondContact OH-O 3.24Å; Y1067-Q1099 WeakPolarHBondContact O-CB 3.33Å; P1068-Q1099 PolarHBondContact O-N 2.8Å; R1070-Q1099 HydrophobicContact CB-CG 3.64Å; R1070-Q1099 HydrophobicContact CG-CG 4.29Å
1100	H	65.6	Low	70.1	Confident	18 Å²	18	38 Å²	38	8%	0.083	18%	0.179	C	C	.	.	S	Bend	trans	-150.4	-176.9	175.9	-60.3	92.3	0	0	0	108.9	H1065 Y1067 P1068 V1137 L1256	H1065-H1100 PolarHBondContact O-CE1 2.94Å; H1065-H1100 PolarHBondContact O-ND1 3.48Å; Y1067-H1100 PolarHBondContact O-ND1 3.4Å; P1068-H1100 VanDerWaalsContact CA-O 3.28Å; P1068-H1100 WeakPolarHBondContact CA-O 2.9Å; P1068-H1100 WeakPolarHBondContact CB-O 3.35Å; P1068-H1100 PolarHBondContact O-N 3.08Å; P1068-H1100 VanDerWaalsContact O-O 3.05Å; H1100-V1137 VanDerWaalsContact O-CG1 3.29Å; H1100-V1137 WeakPolarHBondContact O-CG1 3.42Å; H1100-L1256 HydrophobicContact CB-CD2 4.42Å; H1100-L1256 PolarHBondContact CD2-O 2.75Å; H1100-L1256 VanDerWaalsContact CD2-O 3.26Å
1101	V	68.3	Low	70.8	Confident	36 Å²	36	35.8 Å²	35.8	22%	0.218	17%	0.165	C	C	.	.	S	Bend	trans	-89.9	141.3	171.5	-179.9	0	0	0	0	110.2	Y1036 V1137 G1139 T1166 L1256	Y1036-V1101 HydrophobicContact CD1-CG2 3.71Å; Y1036-V1101 HydrophobicContact CE1-CG2 4.39Å; Y1036-V1101 HydrophobicContact CG-CG2 4.34Å; V1101-V1137 WeakPolarHBondContact CG1-O 3.28Å; V1101-G1139 VanDerWaalsContact CG2-CA 3.47Å; V1101-T1166 HydrophobicContact CG1-CG2 3.89Å; V1101-T1166 WeakPolarHBondContact CG1-OG1 3.4Å; V1101-T1166 HydrophobicContact CG2-CG2 4.32Å; V1101-L1256 HydrophobicContact CB-CD2 3.87Å; V1101-L1256 HydrophobicContact CG2-CD2 3.72Å; V1101-L1256 HydrophobicContact CG2-CG 4.4Å
1102	G	68.2	Low	71.3	Confident	25 Å²	25	30 Å²	30	26%	0.258	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	142	173.9	171.4	0	0	0	0	0	114	P1068 V1137	P1068-G1102 VanDerWaalsContact CB-O 3.3Å; P1068-G1102 WeakPolarHBondContact CB-O 3.06Å; P1068-G1102 WeakPolarHBondContact CG-O 3.22Å; G1102-V1137 PolarHBondContact N-O 3.04Å; G1102-V1137 PolarHBondContact O-N 3.08Å
1103	R	68.5	Low	71.5	Confident	174 Å²	174	27.3 Å²	27.3	66%	0.657	14%	0.136	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	142.7	175.2	-171.9	176	-68.5	161.6	0.7	110.9	V1135 D1136	R1103-V1135 WeakPolarHBondContact CG-O 3.18Å; R1103-D1136 HydrophobicContact CG-CB 4.48Å; R1103-D1136 IonicContact CZ-OD2 2.83Å; R1103-D1136 IonicContact NE-OD1 3.2Å; R1103-D1136 IonicContact NE-OD2 3.36Å; R1103-D1136 PolarHBondContact NE-OD2 3.28Å; R1103-D1136 IonicContact NH2-OD2 3.98Å; R1103-D1136 PolarHBondContact NH2-OD2 3.01Å
1104	V	70.2	Confident	71.5	Confident	10 Å²	10	26.2 Å²	26.2	6%	0.061	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	141.3	178	131.4	0	0	0	0	111.4	N1057 P1068 I1069 I1106 V1135	N1057-V1104 HydrophobicContact CB-CG1 4.36Å; N1057-V1104 HydrophobicContact CB-CG2 3.98Å; N1057-V1104 WeakPolarHBondContact OD1-CG1 3.17Å; P1068-V1104 HydrophobicContact CG-CB 3.73Å; P1068-V1104 HydrophobicContact CG-CG2 3.6Å; I1069-V1104 HydrophobicContact CD1-CB 4.49Å; I1069-V1104 HydrophobicContact CD1-CG1 3.6Å; I1069-V1104 HydrophobicContact CG1-CG1 4.17Å; V1104-I1106 HydrophobicContact CG1-CG1 3.83Å; V1104-V1135 PolarHBondContact N-O 2.89Å; V1104-V1135 PolarHBondContact O-N 3.3Å
1105	T	70.1	Confident	71.2	Confident	31 Å²	31	27 Å²	27	19%	0.19	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127	160.5	-46.9	0	0	0	0	107.4	N1057 S1058 F1133 N1134	N1057-T1105 CarbonylContact C-O 3.49Å; N1057-T1105 VanDerWaalsContact CA-O 3.27Å; N1057-T1105 WeakPolarHBondContact CA-O 3.33Å; S1058-T1105 PolarHBondContact N-O 3Å; S1058-T1105 VanDerWaalsContact OG-CB 3.31Å; S1058-T1105 WeakPolarHBondContact OG-CB 3.34Å; S1058-T1105 PolarHBondContact OG-OG1 3.06Å; T1105-F1133 CarbonylContact C-O 3.53Å; T1105-F1133 WeakPolarHBondContact CA-O 3.31Å; T1105-F1133 VanDerWaalsContact CG2-O 3.31Å; T1105-F1133 WeakPolarHBondContact CG2-O 2.84Å; T1105-N1134 WeakPolarHBondContact CB-OD1 3.32Å; T1105-N1134 WeakPolarHBondContact CG2-OD1 3.14Å; T1105-N1134 PolarHBondContact OG1-OD1 3.3Å
1106	I	71.7	Confident	70.5	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.7	174.7	-63.2	159.9	0	0	0	108.9	L1055 E1056 N1057 I1069 I1071 I1096 V1104 E1132 F1133 V1135	L1055-I1106 HydrophobicContact CB-CG2 4.09Å; L1055-I1106 HydrophobicContact CD2-CG2 3.57Å; L1055-I1106 HydrophobicContact CG-CG2 4.43Å; E1056-I1106 CarbonylContact O-C 3.49Å; E1056-I1106 WeakPolarHBondContact O-CA 3.38Å; N1057-I1106 VanDerWaalsContact OD1-CG1 3.26Å; N1057-I1106 WeakPolarHBondContact OD1-CG1 3.41Å; I1069-I1106 HydrophobicContact CD1-CD1 3.49Å; I1069-I1106 VanDerWaalsContact CD1-CD1 3.49Å; I1069-I1106 HydrophobicContact CD1-CG1 3.96Å; I1071-I1106 HydrophobicContact CD1-CD1 3.52Å; I1071-I1106 HydrophobicContact CD1-CG1 4.03Å; I1071-I1106 HydrophobicContact CD1-CG2 4.09Å; I1071-I1106 HydrophobicContact CG1-CD1 4.28Å; I1096-I1106 HydrophobicContact CD1-CD1 4.37Å; V1104-I1106 HydrophobicContact CG1-CG1 3.83Å; I1106-E1132 CarbonylContact O-C 3.48Å; I1106-E1132 VanDerWaalsContact O-CA 3.3Å; I1106-E1132 WeakPolarHBondContact O-CA 3.17Å; I1106-F1133 HydrophobicContact CB-CD1 4.23Å; I1106-F1133 HydrophobicContact CB-CD2 4.33Å; I1106-F1133 HydrophobicContact CB-CE1 3.84Å; I1106-F1133 HydrophobicContact CB-CE2 3.97Å; I1106-F1133 HydrophobicContact CB-CG 4.46Å; I1106-F1133 HydrophobicContact CB-CZ 3.71Å; I1106-F1133 HydrophobicContact CD1-CD2 4.07Å; I1106-F1133 HydrophobicContact CD1-CE1 4.45Å; I1106-F1133 HydrophobicContact CD1-CE2 3.23Å; I1106-F1133 HydrophobicContact CD1-CZ 3.47Å; I1106-F1133 VanDerWaalsContact CD1-CZ 3.47Å; I1106-F1133 HydrophobicContact CG1-CE2 4.16Å; I1106-F1133 HydrophobicContact CG1-CZ 4.2Å; I1106-F1133 HydrophobicContact CG2-CD1 4.41Å; I1106-F1133 HydrophobicContact CG2-CE1 3.64Å; I1106-F1133 HydrophobicContact CG2-CE2 4.38Å; I1106-F1133 HydrophobicContact CG2-CZ 3.62Å; I1106-F1133 PolarHBondContact N-O 2.94Å; I1106-F1133 PolarHBondContact O-N 3.27Å; I1106-V1135 HydrophobicContact CD1-CG2 4.02Å
1107	Q	75.3	Confident	69.6	Low	34 Å²	34	36.7 Å²	36.7	16%	0.159	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.1	169	-63.2	-177	-27.9	0	0	109.7	L1055 E1056 I1109 A1131 E1132	L1055-Q1107 CarbonylContact C-O 3.58Å; L1055-Q1107 WeakPolarHBondContact CA-O 3.26Å; E1056-Q1107 HydrophobicContact CB-CB 4.36Å; E1056-Q1107 PolarHBondContact N-O 2.83Å; E1056-Q1107 PolarHBondContact O-N 3.14Å; Q1107-I1109 HydrophobicContact CB-CD1 4.05Å; Q1107-I1109 HydrophobicContact CB-CG1 4.22Å; Q1107-A1131 CarbonylContact C-O 3.46Å; Q1107-A1131 VanDerWaalsContact CA-O 3.24Å; Q1107-A1131 WeakPolarHBondContact CA-O 2.82Å; Q1107-E1132 HydrophobicContact CG-CG 4.09Å; Q1107-E1132 PolarHBondContact NE2-OE1 3.17Å
1108	A	73.7	Confident	68.3	Low	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	119.5	171.6	0	0	0	0	0	110.1	I1024 I1046 Y1054 L1055 Q1130 A1131	I1024-A1108 HydrophobicContact CD1-CB 4.31Å; I1046-A1108 HydrophobicContact CD1-CB 3.75Å; Y1054-A1108 CarbonylContact O-C 3.46Å; Y1054-A1108 WeakPolarHBondContact O-CA 3.4Å; L1055-A1108 HydrophobicContact CD2-CB 3.74Å; A1108-Q1130 CarbonylContact O-C 3.58Å; A1108-Q1130 VanDerWaalsContact O-CA 3.27Å; A1108-Q1130 WeakPolarHBondContact O-CA 2.96Å; A1108-A1131 PolarHBondContact N-O 3.36Å; A1108-A1131 PolarHBondContact O-N 3.39Å
1109	I	75.5	Confident	66.7	Low	5 Å²	5	46.3 Å²	46.3	3%	0.026	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	119.6	-168	-67.6	176.6	0	0	0	110.9	F877 Y1053 Y1054 E1056 Q1107 L1111 P1128 S1129 Q1130	F877-I1109 HydrophobicContact CD1-CG2 4.47Å; F877-I1109 HydrophobicContact CE1-CD1 3.79Å; F877-I1109 HydrophobicContact CE1-CG2 4.03Å; F877-I1109 HydrophobicContact CZ-CD1 4.27Å; Y1053-I1109 CarbonylContact C-O 3.59Å; Y1054-I1109 WeakPolarHBondContact CB-O 3.4Å; Y1054-I1109 PolarHBondContact N-O 2.74Å; Y1054-I1109 PolarHBondContact O-N 3.05Å; E1056-I1109 HydrophobicContact CB-CD1 3.85Å; E1056-I1109 VanDerWaalsContact OE2-CD1 3.25Å; E1056-I1109 WeakPolarHBondContact OE2-CD1 3.06Å; Q1107-I1109 HydrophobicContact CB-CD1 4.05Å; Q1107-I1109 HydrophobicContact CB-CG1 4.22Å; I1109-L1111 PolarHBondContact O-N 3.16Å; I1109-P1128 HydrophobicContact CG2-CB 3.53Å; I1109-P1128 HydrophobicContact CG2-CG 3.5Å; I1109-S1129 CarbonylContact C-O 3.53Å; I1109-S1129 WeakPolarHBondContact CA-O 2.92Å; I1109-Q1130 HydrophobicContact CG1-CB 3.89Å
1110	D	74.2	Confident	65.5	Low	0 Å²	0	49 Å²	49	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	107.4	177.8	-162.3	-48.3	0	0	0	111.3	I1024 G1049 S1050 Y1053 C1112 F1113 P1128 S1129	I1024-D1110 HydrophobicContact CD1-CB 4.35Å; G1049-D1110 WeakPolarHBondContact CA-OD2 2.93Å; S1050-D1110 WeakPolarHBondContact CB-OD1 3.27Å; S1050-D1110 PolarHBondContact N-OD2 3.26Å; S1050-D1110 VanDerWaalsContact OG-CG 3.23Å; S1050-D1110 PolarHBondContact OG-OD1 2.56Å; S1050-D1110 PolarHBondContact OG-OD2 3.17Å; S1050-D1110 VanDerWaalsContact OG-OD2 3.12Å; Y1053-D1110 HydrophobicContact CD1-CB 4.38Å; D1110-C1112 PolarHBondContact OD1-N 2.84Å; D1110-C1112 VanDerWaalsContact OD1-N 3.09Å; D1110-F1113 HydrophobicContact CB-CB 4.05Å; D1110-F1113 VanDerWaalsContact CG-CB 3.43Å; D1110-F1113 VanDerWaalsContact OD1-CB 3.25Å; D1110-F1113 WeakPolarHBondContact OD1-CB 3.02Å; D1110-F1113 PolarHBondContact OD1-N 2.65Å; D1110-P1128 WeakPolarHBondContact O-CB 3.18Å; D1110-S1129 PolarHBondContact N-O 3.31Å
1111	L	71.2	Confident	64.3	Low	2 Å²	2	52.3 Å²	52.3	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-31.6	-175	-62.7	173	0	0	0	113.3	P871 L873 F877 P878 C880 Y1052 Y1054 I1109	P871-L1111 WeakPolarHBondContact CD-O 3.33Å; P871-L1111 WeakPolarHBondContact CG-O 3.15Å; L873-L1111 HydrophobicContact CD1-CB 4.48Å; L873-L1111 HydrophobicContact CD1-CD2 4.05Å; L873-L1111 HydrophobicContact CD2-CD2 3.65Å; F877-L1111 HydrophobicContact CB-CD2 3.89Å; F877-L1111 HydrophobicContact CD1-CD2 3.78Å; F877-L1111 HydrophobicContact CG-CD2 4.25Å; P878-L1111 HydrophobicContact CG-CD1 3.84Å; P878-L1111 WeakPolarHBondContact O-CD1 3.07Å; C880-L1111 PolarHBondContact SG-O 3.05Å; Y1052-L1111 PolarHBondContact O-N 3.1Å; Y1054-L1111 HydrophobicContact CG-CD2 4.23Å; I1109-L1111 PolarHBondContact O-N 3.16Å
1112	C	70.7	Confident	62.9	Low	25 Å²	25	58.1 Å²	58.1	17%	0.169	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	1	-167.7	-46.8	0	0	0	0	111.9	C880 D1110 P1114	C880-C1112 VanDerWaalsContact CA-SG 3.59Å; C880-C1112 HydrophobicContact CB-CB 4.16Å; C880-C1112 WeakPolarHBondContact CB-SG 2.93Å; C880-C1112 WeakPolarHBondContact SG-CA 3.19Å; C880-C1112 WeakPolarHBondContact SG-CB 3.35Å; C880-C1112 PolarHBondContact SG-N 3.26Å; C880-C1112 VanDerWaalsContact SG-N 3.43Å; C880-C1112 CovalentContact SG-SG 2.04Å; C880-C1112 PolarHBondContact SG-SG 2.8Å; D1110-C1112 PolarHBondContact OD1-N 2.84Å; D1110-C1112 VanDerWaalsContact OD1-N 3.09Å; C1112-P1114 WeakPolarHBondContact O-CD 3.24Å
1113	F	73.7	Confident	61.8	Low	4 Å²	4	63.5 Å²	63.5	2%	0.018	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	88.7	170.5	-151.5	-83.5	0	0	0	110.9	P898 T900 S1021 D1110	P898-F1113 HydrophobicContact CB-CD2 4.08Å; P898-F1113 HydrophobicContact CB-CE2 3.87Å; P898-F1113 HydrophobicContact CB-CZ 4.15Å; T900-F1113 HydrophobicContact CG2-CE1 4.04Å; S1021-F1113 VanDerWaalsContact O-CE2 3.3Å; S1021-F1113 WeakPolarHBondContact O-CE2 3.45Å; S1021-F1113 WeakPolarHBondContact O-CZ 3.45Å; D1110-F1113 HydrophobicContact CB-CB 4.05Å; D1110-F1113 VanDerWaalsContact CG-CB 3.43Å; D1110-F1113 VanDerWaalsContact OD1-CB 3.25Å; D1110-F1113 WeakPolarHBondContact OD1-CB 3.02Å; D1110-F1113 PolarHBondContact OD1-N 2.65Å
1114	P	70.7	Confident	60.8	Low	1 Å²	1	66 Å²	66	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	146.8	174.4	19.3	-28.7	0	0	0	112.3	P871 P898 T900 I901 C1112 L1126	P871-P1114 HydrophobicContact CB-CB 4.07Å; P871-P1114 HydrophobicContact CG-CB 4.29Å; P898-P1114 HydrophobicContact CB-CG 3.88Å; P898-P1114 HydrophobicContact CG-CG 3.77Å; T900-P1114 WeakPolarHBondContact CB-O 3.41Å; T900-P1114 WeakPolarHBondContact CG2-O 2.79Å; T900-P1114 PolarHBondContact OG1-O 3.25Å; I901-P1114 HydrophobicContact CD1-CG 3.69Å; I901-P1114 HydrophobicContact CG1-CG 3.81Å; I901-P1114 HydrophobicContact CG2-CB 4.3Å; I901-P1114 HydrophobicContact CG2-CG 4.22Å; C1112-P1114 WeakPolarHBondContact O-CD 3.24Å; P1114-L1126 HydrophobicContact CB-CB 4.42Å; P1114-L1126 HydrophobicContact CB-CD2 4.37Å
1115	S	67.5	Low	59.8	Low	34 Å²	34	70.1 Å²	70.1	24%	0.238	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	143.5	-172.5	-176.4	0	0	0	0	110.7	S1127	S1115-S1127 CarbonylContact C-O 3.47Å; S1115-S1127 WeakPolarHBondContact CA-O 3.19Å; S1115-S1127 WeakPolarHBondContact CB-O 3.21Å; S1115-S1127 PolarHBondContact N-O 3.1Å; S1115-S1127 PolarHBondContact O-N 3.35Å; S1115-S1127 PolarHBondContact O-OG 2.75Å
1116	T	63	Low	59.3	Low	93 Å²	93	70 Å²	70	57%	0.571	38%	0.378	S	S	*	.			trans	-96.6	107.6	-176.9	45.4	0	0	0	0	111.3	S1118	T1116-S1118 PolarHBondContact O-N 3.12Å
1117	K	54.4	Low	58.9	Low	142 Å²	142	70.7 Å²	70.7	62%	0.617	38%	0.383	S	S	*	.			trans	-64.4	134.2	170.3	-88.6	174.7	-179.5	-179.9	0	110.6	N1119 S1127	K1117-N1119 PolarHBondContact O-N 2.82Å; K1117-S1127 WeakPolarHBondContact CG-OG 3.22Å
1118	S	45.9	Very low	58.6	Low	120 Å²	120	69.9 Å²	69.9	84%	0.839	38%	0.381	S	S	*	.	S	Bend	trans	-78.2	77.7	-172.1	59.8	0	0	0	0	113	T1116	T1116-S1118 PolarHBondContact O-N 3.12Å
1119	N	37.9	Very low	58.6	Low	136 Å²	136	70.6 Å²	70.6	73%	0.727	39%	0.386	S	S	*	.			trans	-143.2	107.2	163.5	-106.9	-15.3	0	0	0	109.2	K1117 S1121	K1117-N1119 PolarHBondContact O-N 2.82Å; N1119-S1121 PolarHBondContact O-N 2.72Å
1120	P	40.3	Very low	58.3	Low	138 Å²	138	74.4 Å²	74.4	90%	0.896	40%	0.403	S	S	*	.			trans	-84	45.9	-166.7	35.2	-37.9	0	0	0	113.7
1121	S	39.5	Very low	58.3	Low	88 Å²	88	75.3 Å²	75.3	62%	0.615	41%	0.411	S	S	*	.	S	Bend	trans	-152.2	119.8	-179.9	59.6	0	0	0	0	112.8	N1119	N1119-S1121 PolarHBondContact O-N 2.72Å
1122	N	39.7	Very low	58.4	Low	158 Å²	158	80.4 Å²	80.4	85%	0.845	43%	0.434	S	S	*	.	S	Bend	trans	70.2	126.2	177.1	-59.4	-11.1	0	0	0	117
1123	E	44.9	Very low	58.5	Low	139 Å²	139	79.7 Å²	79.7	65%	0.65	43%	0.428	S	S	*	.			trans	56.2	133.8	176.1	-67.2	-169.8	144	0	0	118.2	N1125	E1123-N1125 VanDerWaalsContact CB-ND2 3.25Å; E1123-N1125 WeakPolarHBondContact CB-ND2 3.19Å; E1123-N1125 PolarHBondContact O-N 3.05Å; E1123-N1125 PolarHBondContact OE2-ND2 3.45Å
1124	Y	46.4	Very low	58.6	Low	226 Å²	226	82.6 Å²	82.6	89%	0.886	44%	0.444	S	S	*	.			trans	-76.3	60.9	169.8	-73.7	-83.7	0	0	0	110.9	L1126	Y1124-L1126 PolarHBondContact O-N 3.19Å
1125	N	50.8	Low	58.6	Low	96 Å²	96	82.5 Å²	82.5	51%	0.513	44%	0.444	S	S	.	.			trans	-75.9	90.6	179.5	-78.4	-41.3	0	0	0	110.3	E1123 S1127	E1123-N1125 VanDerWaalsContact CB-ND2 3.25Å; E1123-N1125 WeakPolarHBondContact CB-ND2 3.19Å; E1123-N1125 PolarHBondContact O-N 3.05Å; E1123-N1125 PolarHBondContact OE2-ND2 3.45Å; N1125-S1127 PolarHBondContact O-N 3.46Å; N1125-S1127 VanDerWaalsContact O-N 3.13Å
1126	L	57.8	Low	58.9	Low	28 Å²	28	82 Å²	82	15%	0.147	44%	0.439	C	S	.	.			trans	-68.2	102.9	-177.9	-67	170.7	0	0	0	111	P871 S872 I901 P1114 Y1124	P871-L1126 CarbonylContact C-O 3.41Å; P871-L1126 WeakPolarHBondContact CA-O 3.24Å; P871-L1126 HydrophobicContact CB-CB 4.16Å; P871-L1126 WeakPolarHBondContact CB-O 3.24Å; S872-L1126 PolarHBondContact N-O 3.17Å; S872-L1126 PolarHBondContact OG-O 2.9Å; I901-L1126 HydrophobicContact CG2-CD1 3.79Å; I901-L1126 HydrophobicContact CG2-CD2 3.42Å; I901-L1126 VanDerWaalsContact CG2-CD2 3.42Å; I901-L1126 HydrophobicContact CG2-CG 4.26Å; P1114-L1126 HydrophobicContact CB-CB 4.42Å; P1114-L1126 HydrophobicContact CB-CD2 4.37Å; Y1124-L1126 PolarHBondContact O-N 3.19Å
1127	S	63.5	Low	59.2	Low	15 Å²	15	77.7 Å²	77.7	11%	0.105	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	149.9	173.6	46.7	0	0	0	0	112.2	S1115 K1117 N1125	S1115-S1127 CarbonylContact C-O 3.47Å; S1115-S1127 WeakPolarHBondContact CA-O 3.19Å; S1115-S1127 WeakPolarHBondContact CB-O 3.21Å; S1115-S1127 PolarHBondContact N-O 3.1Å; S1115-S1127 PolarHBondContact O-N 3.35Å; S1115-S1127 PolarHBondContact O-OG 2.75Å; K1117-S1127 WeakPolarHBondContact CG-OG 3.22Å; N1125-S1127 PolarHBondContact O-N 3.46Å; N1125-S1127 VanDerWaalsContact O-N 3.13Å
1128	P	69.3	Low	59.9	Low	18 Å²	18	72 Å²	72	12%	0.117	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	163.9	164.1	32.2	-35.7	0	0	0	111.5	P871 L873 I1109 D1110	P871-P1128 HydrophobicContact CG-CB 4.35Å; L873-P1128 HydrophobicContact CD2-CB 4.33Å; L873-P1128 HydrophobicContact CD2-CG 4.09Å; I1109-P1128 HydrophobicContact CG2-CB 3.53Å; I1109-P1128 HydrophobicContact CG2-CG 3.5Å; D1110-P1128 WeakPolarHBondContact O-CB 3.18Å
1129	S	73.2	Confident	61	Low	15 Å²	15	66.2 Å²	66.2	11%	0.105	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	150.5	179.5	-164.6	0	0	0	0	112.8	V1023 I1109 D1110	V1023-S1129 WeakPolarHBondContact CG1-OG 3.45Å; I1109-S1129 CarbonylContact C-O 3.53Å; I1109-S1129 WeakPolarHBondContact CA-O 2.92Å; D1110-S1129 PolarHBondContact N-O 3.31Å
1130	Q	70.2	Confident	62.8	Low	84 Å²	84	60.5 Å²	60.5	39%	0.393	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.8	-163.9	62.1	178.9	95.2	0	0	117.2	A1108 I1109	A1108-Q1130 CarbonylContact O-C 3.58Å; A1108-Q1130 VanDerWaalsContact O-CA 3.27Å; A1108-Q1130 WeakPolarHBondContact O-CA 2.96Å; I1109-Q1130 HydrophobicContact CG1-CB 3.89Å
1131	A	73	Confident	64.3	Low	19 Å²	19	57 Å²	57	16%	0.157	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	160.7	172.1	0	0	0	0	0	112.5	Q1107 A1108	Q1107-A1131 CarbonylContact C-O 3.46Å; Q1107-A1131 VanDerWaalsContact CA-O 3.24Å; Q1107-A1131 WeakPolarHBondContact CA-O 2.82Å; A1108-A1131 PolarHBondContact N-O 3.36Å; A1108-A1131 PolarHBondContact O-N 3.39Å
1132	E	73.3	Confident	66	Low	109 Å²	109	54.5 Å²	54.5	51%	0.509	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.8	-163.5	-40.4	-168.7	136.8	0	0	117.6	I1106 Q1107	I1106-E1132 CarbonylContact O-C 3.48Å; I1106-E1132 VanDerWaalsContact O-CA 3.3Å; I1106-E1132 WeakPolarHBondContact O-CA 3.17Å; Q1107-E1132 HydrophobicContact CG-CG 4.09Å; Q1107-E1132 PolarHBondContact NE2-OE1 3.17Å
1133	F	74.3	Confident	67.9	Low	10 Å²	10	47.2 Å²	47.2	4%	0.044	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	167.4	169.4	60	-80.3	0	0	0	114.4	V1044 L1055 I1096 T1105 I1106	V1044-F1133 HydrophobicContact CB-CE2 4.48Å; V1044-F1133 HydrophobicContact CG1-CE1 4.15Å; V1044-F1133 HydrophobicContact CG1-CE2 4.07Å; V1044-F1133 HydrophobicContact CG1-CZ 3.83Å; V1044-F1133 HydrophobicContact CG2-CD2 4.43Å; V1044-F1133 HydrophobicContact CG2-CE2 3.93Å; V1044-F1133 HydrophobicContact CG2-CZ 4.43Å; L1055-F1133 HydrophobicContact CD2-CE1 4.48Å; I1096-F1133 HydrophobicContact CD1-CE2 3.89Å; T1105-F1133 CarbonylContact C-O 3.53Å; T1105-F1133 WeakPolarHBondContact CA-O 3.31Å; T1105-F1133 VanDerWaalsContact CG2-O 3.31Å; T1105-F1133 WeakPolarHBondContact CG2-O 2.84Å; I1106-F1133 HydrophobicContact CB-CD1 4.23Å; I1106-F1133 HydrophobicContact CB-CD2 4.33Å; I1106-F1133 HydrophobicContact CB-CE1 3.84Å; I1106-F1133 HydrophobicContact CB-CE2 3.97Å; I1106-F1133 HydrophobicContact CB-CG 4.46Å; I1106-F1133 HydrophobicContact CB-CZ 3.71Å; I1106-F1133 HydrophobicContact CD1-CD2 4.07Å; I1106-F1133 HydrophobicContact CD1-CE1 4.45Å; I1106-F1133 HydrophobicContact CD1-CE2 3.23Å; I1106-F1133 HydrophobicContact CD1-CZ 3.47Å; I1106-F1133 VanDerWaalsContact CD1-CZ 3.47Å; I1106-F1133 HydrophobicContact CG1-CE2 4.16Å; I1106-F1133 HydrophobicContact CG1-CZ 4.2Å; I1106-F1133 HydrophobicContact CG2-CD1 4.41Å; I1106-F1133 HydrophobicContact CG2-CE1 3.64Å; I1106-F1133 HydrophobicContact CG2-CE2 4.38Å; I1106-F1133 HydrophobicContact CG2-CZ 3.62Å; I1106-F1133 PolarHBondContact N-O 2.94Å; I1106-F1133 PolarHBondContact O-N 3.27Å
1134	N	75	Confident	69.6	Low	65 Å²	65	42.9 Å²	42.9	35%	0.348	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.4	-167.6	-77.5	-58.8	0	0	0	116.1	L1031 I1032 T1105	L1031-N1134 HydrophobicContact CD1-CB 4.1Å; I1032-N1134 PolarHBondContact N-O 2.81Å; T1105-N1134 WeakPolarHBondContact CB-OD1 3.32Å; T1105-N1134 WeakPolarHBondContact CG2-OD1 3.14Å; T1105-N1134 PolarHBondContact OG1-OD1 3.3Å
1135	V	71.1	Confident	71.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	145.9	179.9	-168.4	0	0	0	0	112	I1032 L1034 I1069 I1096 R1103 V1104 I1106 V1137	I1032-V1135 HydrophobicContact CB-CG1 4.21Å; I1032-V1135 HydrophobicContact CB-CG2 4.3Å; I1032-V1135 HydrophobicContact CD1-CG2 4.39Å; I1032-V1135 HydrophobicContact CG2-CG1 4.41Å; I1032-V1135 CarbonylContact O-C 3.43Å; I1032-V1135 WeakPolarHBondContact O-CA 3.46Å; L1034-V1135 HydrophobicContact CD1-CG1 4.08Å; I1069-V1135 HydrophobicContact CD1-CB 3.81Å; I1069-V1135 HydrophobicContact CD1-CG1 3.99Å; I1069-V1135 HydrophobicContact CD1-CG2 3.75Å; I1069-V1135 HydrophobicContact CG2-CG1 3.92Å; I1096-V1135 HydrophobicContact CD1-CG2 4.29Å; R1103-V1135 WeakPolarHBondContact CG-O 3.18Å; V1104-V1135 PolarHBondContact N-O 2.89Å; V1104-V1135 PolarHBondContact O-N 3.3Å; I1106-V1135 HydrophobicContact CD1-CG2 4.02Å; V1135-V1137 HydrophobicContact CG1-CG2 4.3Å
1136	D	72.6	Confident	72.6	Confident	24 Å²	24	33.8 Å²	33.8	13%	0.128	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	122.6	-178.6	-149.6	-10.1	0	0	0	110.5	L1031 I1032 K1033 L1034 R1103	L1031-D1136 HydrophobicContact CD1-CB 4.31Å; I1032-D1136 PolarHBondContact O-N 2.58Å; K1033-D1136 CarbonylContact C-O 3.6Å; K1033-D1136 WeakPolarHBondContact CA-O 3.37Å; K1033-D1136 HydrophobicContact CG-CB 4.49Å; L1034-D1136 PolarHBondContact N-O 3.48Å; R1103-D1136 HydrophobicContact CG-CB 4.48Å; R1103-D1136 IonicContact CZ-OD2 2.83Å; R1103-D1136 IonicContact NE-OD1 3.2Å; R1103-D1136 IonicContact NE-OD2 3.36Å; R1103-D1136 PolarHBondContact NE-OD2 3.28Å; R1103-D1136 IonicContact NH2-OD2 3.98Å; R1103-D1136 PolarHBondContact NH2-OD2 3.01Å
1137	V	69.5	Low	73.5	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	116.8	-172.9	-169.5	0	0	0	0	111.5	L1034 P1068 I1069 P1098 H1100 V1101 G1102 V1135	L1034-V1137 HydrophobicContact CB-CG1 4.42Å; L1034-V1137 HydrophobicContact CB-CG2 4.21Å; L1034-V1137 WeakPolarHBondContact O-CA 3.31Å; P1068-V1137 HydrophobicContact CB-CB 3.93Å; P1068-V1137 HydrophobicContact CB-CG2 3.8Å; I1069-V1137 HydrophobicContact CG2-CG2 3.47Å; I1069-V1137 VanDerWaalsContact CG2-CG2 3.47Å; P1098-V1137 HydrophobicContact CB-CG1 3.67Å; H1100-V1137 VanDerWaalsContact O-CG1 3.29Å; H1100-V1137 WeakPolarHBondContact O-CG1 3.42Å; V1101-V1137 WeakPolarHBondContact CG1-O 3.28Å; G1102-V1137 PolarHBondContact N-O 3.04Å; G1102-V1137 PolarHBondContact O-N 3.08Å; V1135-V1137 HydrophobicContact CG1-CG2 4.3Å
1138	I	70.8	Confident	74.1	Confident	21 Å²	21	39.2 Å²	39.2	11%	0.108	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.7	-177.5	-53.5	168.9	0	0	0	108.7	L1034 F1035 Y1036 L1171	L1034-I1138 PolarHBondContact O-N 3.36Å; F1035-I1138 CarbonylContact C-O 3.57Å; F1035-I1138 WeakPolarHBondContact CA-O 2.89Å; F1035-I1138 WeakPolarHBondContact CD2-O 2.98Å; Y1036-I1138 PolarHBondContact N-O 3.43Å; I1138-L1171 HydrophobicContact CG2-CD2 3.95Å
1139	G	68.6	Low	74.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.			trans	-104.6	177.2	172.6	0	0	0	0	0	113.2	V1101 G1165 T1166	V1101-G1139 VanDerWaalsContact CG2-CA 3.47Å; G1139-G1165 CarbonylContact O-C 3.4Å; G1139-G1165 VanDerWaalsContact O-CA 3.28Å; G1139-G1165 WeakPolarHBondContact O-CA 3.25Å; G1139-T1166 PolarHBondContact N-OG1 2.89Å; G1139-T1166 PolarHBondContact O-N 2.75Å
1140	L	74.5	Confident	74.3	Confident	16 Å²	16	42.3 Å²	42.3	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	114.4	168.4	-178.5	64.3	0	0	0	108.9	F1035 A1142 L1143 A1163 L1171 L1179 V1253 V1264	F1035-L1140 HydrophobicContact CZ-CB 4.45Å; L1140-A1142 WeakPolarHBondContact CD1-O 3.47Å; L1140-L1143 HydrophobicContact CD1-CD2 3.91Å; L1140-L1143 HydrophobicContact CD1-CG 4.37Å; L1140-L1143 HydrophobicContact CD2-CD1 4.39Å; L1140-L1143 HydrophobicContact CD2-CD2 4.03Å; L1140-L1143 HydrophobicContact CD2-CG 4.03Å; L1140-A1163 HydrophobicContact CD1-CB 3.77Å; L1140-L1171 HydrophobicContact CD1-CD1 4.32Å; L1140-L1179 HydrophobicContact CD1-CD1 4.08Å; L1140-L1179 HydrophobicContact CD2-CD1 4.3Å; L1140-L1179 HydrophobicContact CD2-CD2 3.97Å; L1140-V1253 HydrophobicContact CB-CG1 4.25Å; L1140-V1253 HydrophobicContact CD2-CG1 4.18Å; L1140-V1264 HydrophobicContact CD2-CB 3.81Å; L1140-V1264 HydrophobicContact CD2-CG1 3.91Å; L1140-V1264 HydrophobicContact CD2-CG2 4.03Å; L1140-V1264 HydrophobicContact CG-CB 4.38Å; L1140-V1264 HydrophobicContact CG-CG1 4.1Å; L1140-V1264 HydrophobicContact CG-CG2 4.29Å
1141	S	73	Confident	74.5	Confident	63 Å²	63	38.4 Å²	38.4	44%	0.441	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-36.6	177.4	65.6	0	0	0	0	112.6	I1164 G1165	S1141-I1164 PolarHBondContact N-O 3.5Å; S1141-I1164 PolarHBondContact OG-O 2.76Å; S1141-G1165 WeakPolarHBondContact CB-O 3.24Å; S1141-G1165 PolarHBondContact OG-O 2.69Å
1142	A	75.3	Confident	74.8	Confident	36 Å²	36	40 Å²	40	30%	0.298	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	151.6	177.8	0	0	0	0	0	112.1	L1140 I1164	L1140-A1142 WeakPolarHBondContact CD1-O 3.47Å; A1142-I1164 HydrophobicContact CB-CB 4.45Å; A1142-I1164 HydrophobicContact CB-CD1 4.43Å; A1142-I1164 PolarHBondContact O-N 3.13Å
1143	L	79	Confident	74.9	Confident	6 Å²	6	37.2 Å²	37.2	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.9	159.3	-66.8	172.4	0	0	0	108.1	L1140 V1161 E1162 A1163 L1181 I1249 V1264 S1266	L1140-L1143 HydrophobicContact CD1-CD2 3.91Å; L1140-L1143 HydrophobicContact CD1-CG 4.37Å; L1140-L1143 HydrophobicContact CD2-CD1 4.39Å; L1140-L1143 HydrophobicContact CD2-CD2 4.03Å; L1140-L1143 HydrophobicContact CD2-CG 4.03Å; L1143-V1161 HydrophobicContact CD2-CG1 4.06Å; L1143-E1162 WeakPolarHBondContact CA-O 3.48Å; L1143-A1163 HydrophobicContact CD2-CB 4.03Å; L1143-L1181 HydrophobicContact CD2-CD2 4.37Å; L1143-I1249 HydrophobicContact CD1-CG2 4.11Å; L1143-V1264 HydrophobicContact CD1-CG1 4.28Å; L1143-V1264 WeakPolarHBondContact CD1-O 2.97Å; L1143-V1264 HydrophobicContact CG-CG1 4.01Å; L1143-S1266 VanDerWaalsContact O-CA 3.31Å; L1143-S1266 WeakPolarHBondContact O-CA 3.37Å
1144	N	80.4	Confident	74.9	Confident	47 Å²	47	38.1 Å²	38.1	25%	0.251	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.1	176	-157.5	0.8	0	0	0	109.4	R1146 V1161 E1162	N1144-R1146 PolarHBondContact ND2-NH2 2.75Å; N1144-V1161 WeakPolarHBondContact O-CA 2.88Å; N1144-E1162 HydrophobicContact CB-CB 3.96Å; N1144-E1162 HydrophobicContact CB-CG 4.46Å; N1144-E1162 WeakPolarHBondContact CB-OE2 3.38Å; N1144-E1162 PolarHBondContact N-O 2.84Å; N1144-E1162 PolarHBondContact ND2-OE2 3.13Å; N1144-E1162 PolarHBondContact O-N 3.41Å; N1144-E1162 VanDerWaalsContact O-N 3.14Å
1145	L	82.1	Confident	74.8	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	116.5	177.8	172.4	57.1	0	0	0	110.3	V1147 A1159 F1235 L1247 I1249 N1267 V1269	L1145-V1147 HydrophobicContact CD1-CG2 3.63Å; L1145-V1147 HydrophobicContact CG-CG2 4.29Å; L1145-A1159 HydrophobicContact CD1-CB 4.17Å; L1145-F1235 HydrophobicContact CD1-CZ 4.43Å; L1145-L1247 HydrophobicContact CD1-CD2 4.45Å; L1145-L1247 HydrophobicContact CD2-CD2 4.09Å; L1145-L1247 HydrophobicContact CD2-CG 4.04Å; L1145-I1249 HydrophobicContact CD1-CD1 3.82Å; L1145-I1249 HydrophobicContact CD1-CG1 4.43Å; L1145-I1249 HydrophobicContact CD2-CG1 4.32Å; L1145-N1267 PolarHBondContact N-OD1 2.79Å; L1145-N1267 PolarHBondContact O-ND2 3.48Å; L1145-N1267 PolarHBondContact O-OD1 3.17Å; L1145-V1269 HydrophobicContact CD2-CG2 4.01Å; L1145-V1269 HydrophobicContact CG-CG2 3.99Å
1146	R	79.1	Confident	75	Confident	129 Å²	129	42.4 Å²	42.4	49%	0.487	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.8	174.7	-59.2	-172.7	-171.4	138.6	8.2	111	N1144 F1160 E1162	N1144-R1146 PolarHBondContact ND2-NH2 2.75Å; R1146-F1160 PolarHBondContact N-O 2.88Å; R1146-F1160 PolarHBondContact O-N 3.34Å; R1146-F1160 VanDerWaalsContact O-N 3.14Å; R1146-E1162 VanDerWaalsContact CZ-CD 3.49Å; R1146-E1162 IonicContact CZ-OE1 3.3Å; R1146-E1162 IonicContact CZ-OE2 3.33Å; R1146-E1162 IonicContact NH1-OE1 2.66Å; R1146-E1162 PolarHBondContact NH1-OE1 3.22Å; R1146-E1162 IonicContact NH1-OE2 3.2Å; R1146-E1162 IonicContact NH2-OE1 3.51Å; R1146-E1162 PolarHBondContact NH2-OE1 3.23Å; R1146-E1162 IonicContact NH2-OE2 3.48Å; R1146-E1162 PolarHBondContact NH2-OE2 2.97Å
1147	V	76.2	Confident	75.2	Confident	24 Å²	24	42.6 Å²	42.6	15%	0.145	23%	0.227	C	C	.	.			trans	-146.1	150.6	178.9	178.9	0	0	0	0	109	L1145 I1151 V1157 A1159 L1247 V1269 I1271	L1145-V1147 HydrophobicContact CD1-CG2 3.63Å; L1145-V1147 HydrophobicContact CG-CG2 4.29Å; V1147-I1151 HydrophobicContact CG1-CD1 4.18Å; V1147-V1157 HydrophobicContact CG1-CG1 4.32Å; V1147-A1159 HydrophobicContact CG2-CB 3.34Å; V1147-L1247 HydrophobicContact CG2-CD2 3.95Å; V1147-V1269 HydrophobicContact CB-CG1 4.39Å; V1147-I1271 HydrophobicContact CB-CD1 4.44Å; V1147-I1271 HydrophobicContact CG1-CD1 3.61Å; V1147-I1271 HydrophobicContact CG1-CG1 4.41Å
1148	H	74.9	Confident	75.6	Confident	134 Å²	134	45.1 Å²	45.1	62%	0.62	24%	0.242	S	C	*	.			trans	-71	129.7	171.4	-67.8	84.8	0	0	0	110.6	Q1150 V1157	H1148-Q1150 PolarHBondContact O-N 3.02Å; H1148-Q1150 VanDerWaalsContact O-N 3.16Å; H1148-V1157 HydrophobicContact CB-CG1 4.44Å
1149	N	71.8	Confident	76.1	Confident	76 Å²	76	44.1 Å²	44.1	41%	0.406	24%	0.237	S	C	.	.	S	Bend	trans	-70.7	-5.9	-175.2	64.8	-29.1	0	0	0	114.9	I1271 Q1272	N1149-I1271 WeakPolarHBondContact O-CA 2.88Å; N1149-Q1272 PolarHBondContact O-N 2.98Å
1150	Q	75.1	Confident	76.8	Confident	21 Å²	21	48.8 Å²	48.8	10%	0.098	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126.6	176.4	-54.6	-173.4	11	0	0	108	H1148 Q1272 F1274 Y1365	H1148-Q1150 PolarHBondContact O-N 3.02Å; H1148-Q1150 VanDerWaalsContact O-N 3.16Å; Q1150-Q1272 HydrophobicContact CG-CB 4.49Å; Q1150-F1274 HydrophobicContact CB-CD1 4.18Å; Q1150-F1274 HydrophobicContact CB-CE1 3.78Å; Q1150-Y1365 HydrophobicContact CB-CD1 4.16Å; Q1150-Y1365 VanDerWaalsContact CD-CD1 3.48Å; Q1150-Y1365 HydrophobicContact CG-CD1 4.09Å; Q1150-Y1365 HydrophobicContact CG-CE1 4.21Å; Q1150-Y1365 VanDerWaalsContact OE1-CB 3.24Å; Q1150-Y1365 VanDerWaalsContact OE1-CD1 3.24Å
1151	I	75.4	Confident	77	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	136.9	-176.4	-62.7	-174.3	0	0	0	109.2	V1147 V1157 V1237 I1271 Q1272 V1273 F1274	V1147-I1151 HydrophobicContact CG1-CD1 4.18Å; I1151-V1157 HydrophobicContact CD1-CB 3.89Å; I1151-V1157 HydrophobicContact CD1-CG2 3.85Å; I1151-V1157 HydrophobicContact CG1-CB 4.45Å; I1151-V1157 HydrophobicContact CG1-CG2 3.88Å; I1151-V1157 HydrophobicContact CG2-CG2 4.27Å; I1151-V1237 HydrophobicContact CD1-CG1 4Å; I1151-I1271 HydrophobicContact CB-CG2 4.04Å; I1151-I1271 HydrophobicContact CD1-CD1 4.26Å; I1151-I1271 HydrophobicContact CD1-CG2 3.69Å; I1151-I1271 HydrophobicContact CG1-CG2 3.71Å; I1151-Q1272 PolarHBondContact N-O 2.83Å; I1151-Q1272 VanDerWaalsContact O-O 3.07Å; I1151-V1273 VanDerWaalsContact O-CA 3.26Å; I1151-V1273 WeakPolarHBondContact O-CA 3.45Å; I1151-F1274 VanDerWaalsContact C-CE1 3.43Å; I1151-F1274 WeakPolarHBondContact O-CD1 3.33Å; I1151-F1274 WeakPolarHBondContact O-CE1 3.43Å; I1151-F1274 PolarHBondContact O-N 3.17Å
1152	Q	78.9	Confident	77.4	Confident	51 Å²	51	47.7 Å²	47.7	24%	0.238	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	139	178.5	173.8	168.1	-88.4	0	0	111.4	G1154 D1155 F1274 P1276 S1366	Q1152-G1154 PolarHBondContact O-N 2.81Å; Q1152-G1154 VanDerWaalsContact O-N 3.16Å; Q1152-D1155 HydrophobicContact CB-CB 4.24Å; Q1152-D1155 WeakPolarHBondContact CB-OD2 3.02Å; Q1152-D1155 PolarHBondContact NE2-OD1 3.41Å; Q1152-D1155 PolarHBondContact NE2-OD2 2.93Å; Q1152-D1155 WeakPolarHBondContact O-CB 3.22Å; Q1152-D1155 PolarHBondContact O-N 2.85Å; Q1152-F1274 CarbonylContact C-O 3.48Å; Q1152-F1274 HydrophobicContact CB-CE2 4.01Å; Q1152-F1274 HydrophobicContact CB-CZ 3.9Å; Q1152-F1274 HydrophobicContact CG-CE2 4.43Å; Q1152-P1276 HydrophobicContact CG-CB 3.77Å; Q1152-P1276 HydrophobicContact CG-CG 3.52Å; Q1152-P1276 VanDerWaalsContact OE1-CA 3.26Å; Q1152-S1366 PolarHBondContact OE1-OG 3.05Å
1153	L	76	Confident	77.4	Confident	52 Å²	52	46.2 Å²	46.2	27%	0.272	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	118.7	-178.9	-178.7	77	0	0	0	111.3	I1240 L1242 V1273 F1274	L1153-I1240 VanDerWaalsContact CD1-C 3.44Å; L1153-L1242 HydrophobicContact CB-CD2 3.94Å; L1153-L1242 HydrophobicContact CD1-CD2 4.26Å; L1153-L1242 HydrophobicContact CD2-CD2 3.86Å; L1153-L1242 HydrophobicContact CD2-CG 4.19Å; L1153-L1242 HydrophobicContact CG-CD2 4.23Å; L1153-V1273 HydrophobicContact CB-CG1 4.27Å; L1153-V1273 HydrophobicContact CD1-CG1 3.97Å; L1153-F1274 PolarHBondContact N-O 2.79Å
1154	G	73.2	Confident	77.4	Confident	29 Å²	29	48 Å²	48	30%	0.299	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.2	-21.1	-178.9	0	0	0	0	0	113.8	Q1152 R1238 G1239	Q1152-G1154 PolarHBondContact O-N 2.81Å; Q1152-G1154 VanDerWaalsContact O-N 3.16Å; G1154-R1238 PolarHBondContact O-NE 2.66Å; G1154-R1238 PolarHBondContact O-NH2 2.97Å; G1154-G1239 WeakPolarHBondContact CA-O 3.31Å; G1154-G1239 PolarHBondContact N-O 3.39Å
1155	D	73.9	Confident	77	Confident	72 Å²	72	45.7 Å²	45.7	39%	0.385	23%	0.23	S	C	.	.			trans	-80	154.9	-178	-62.9	19.6	0	0	0	110.9	Q1152 R1238 G1239	Q1152-D1155 HydrophobicContact CB-CB 4.24Å; Q1152-D1155 WeakPolarHBondContact CB-OD2 3.02Å; Q1152-D1155 PolarHBondContact NE2-OD1 3.41Å; Q1152-D1155 PolarHBondContact NE2-OD2 2.93Å; Q1152-D1155 WeakPolarHBondContact O-CB 3.22Å; Q1152-D1155 PolarHBondContact O-N 2.85Å; D1155-R1238 WeakPolarHBondContact O-CA 3.22Å; D1155-G1239 PolarHBondContact O-N 3.23Å
1156	E	75.6	Confident	76.6	Confident	82 Å²	82	48.6 Å²	48.6	38%	0.383	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122	178.7	-52.2	-156.9	144.9	0	0	109.9	R1208 V1237 R1238	E1156-R1208 IonicContact OE1-CZ 3.47Å; E1156-R1208 IonicContact OE1-NH2 3.92Å; E1156-R1208 PolarHBondContact OE1-NH2 3.03Å; E1156-V1237 WeakPolarHBondContact CA-O 3.41Å; E1156-R1238 HydrophobicContact CG-CB 3.84Å; E1156-R1238 HydrophobicContact CG-CG 3.83Å; E1156-R1238 WeakPolarHBondContact OE1-CD 2.83Å; E1156-R1238 IonicContact OE1-CZ 3.57Å; E1156-R1238 IonicContact OE1-NE 3.59Å; E1156-R1238 IonicContact OE1-NH1 3.56Å; E1156-R1238 PolarHBondContact OE1-NH1 3.03Å
1157	V	75.2	Confident	76.1	Confident	29 Å²	29	46 Å²	46	18%	0.176	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.9	176.5	178.3	0	0	0	0	109.1	V1147 H1148 I1151 A1159 V1237	V1147-V1157 HydrophobicContact CG1-CG1 4.32Å; H1148-V1157 HydrophobicContact CB-CG1 4.44Å; I1151-V1157 HydrophobicContact CD1-CB 3.89Å; I1151-V1157 HydrophobicContact CD1-CG2 3.85Å; I1151-V1157 HydrophobicContact CG1-CB 4.45Å; I1151-V1157 HydrophobicContact CG1-CG2 3.88Å; I1151-V1157 HydrophobicContact CG2-CG2 4.27Å; V1157-A1159 PolarHBondContact O-N 3.07Å; V1157-V1237 PolarHBondContact N-O 2.91Å; V1157-V1237 PolarHBondContact O-N 2.83Å
1158	T	78.1	Confident	75.7	Confident	55 Å²	55	47.7 Å²	47.7	34%	0.337	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	120.2	174.5	-45.4	0	0	0	0	109.8	F1160 Q1234	T1158-F1160 HydrophobicContact CG2-CD1 4.46Å; T1158-F1160 HydrophobicContact CG2-CD2 4.48Å; T1158-F1160 HydrophobicContact CG2-CE1 3.91Å; T1158-F1160 HydrophobicContact CG2-CE2 3.95Å; T1158-F1160 HydrophobicContact CG2-CZ 3.64Å; T1158-Q1234 HydrophobicContact CG2-CB 4.13Å
1159	A	81.9	Confident	75.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.2	169.2	0	0	0	0	0	109.6	L1145 V1147 V1157 Q1234 F1235 V1237	L1145-A1159 HydrophobicContact CD1-CB 4.17Å; V1147-A1159 HydrophobicContact CG2-CB 3.34Å; V1157-A1159 PolarHBondContact O-N 3.07Å; A1159-Q1234 WeakPolarHBondContact O-CA 3.47Å; A1159-F1235 HydrophobicContact CB-CD1 3.93Å; A1159-F1235 HydrophobicContact CB-CD2 4.04Å; A1159-F1235 HydrophobicContact CB-CE1 3.47Å; A1159-F1235 VanDerWaalsContact CB-CE1 3.47Å; A1159-F1235 HydrophobicContact CB-CE2 3.64Å; A1159-F1235 HydrophobicContact CB-CG 4.19Å; A1159-F1235 HydrophobicContact CB-CZ 3.32Å; A1159-F1235 PolarHBondContact N-O 3.22Å; A1159-F1235 PolarHBondContact O-N 2.85Å; A1159-V1237 HydrophobicContact CB-CG2 3.82Å
1160	F	82.7	Confident	75.4	Confident	98 Å²	98	45.4 Å²	45.4	43%	0.43	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.4	177.4	-63.7	-81.6	0	0	0	110.9	R1146 T1158	R1146-F1160 PolarHBondContact N-O 2.88Å; R1146-F1160 PolarHBondContact O-N 3.34Å; R1146-F1160 VanDerWaalsContact O-N 3.14Å; T1158-F1160 HydrophobicContact CG2-CD1 4.46Å; T1158-F1160 HydrophobicContact CG2-CD2 4.48Å; T1158-F1160 HydrophobicContact CG2-CE1 3.91Å; T1158-F1160 HydrophobicContact CG2-CE2 3.95Å; T1158-F1160 HydrophobicContact CG2-CZ 3.64Å
1161	V	79.3	Confident	75.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	113.6	179.5	-161.2	0	0	0	0	109.1	L1143 N1144 L1181 G1233 F1235 I1249	L1143-V1161 HydrophobicContact CD2-CG1 4.06Å; N1144-V1161 WeakPolarHBondContact O-CA 2.88Å; V1161-L1181 HydrophobicContact CG1-CD2 4.45Å; V1161-G1233 PolarHBondContact N-O 3.42Å; V1161-G1233 PolarHBondContact O-N 2.92Å; V1161-F1235 HydrophobicContact CG2-CD1 4.13Å; V1161-F1235 HydrophobicContact CG2-CE1 3.67Å; V1161-I1249 HydrophobicContact CB-CD1 4.31Å; V1161-I1249 HydrophobicContact CG1-CD1 4.02Å; V1161-I1249 HydrophobicContact CG2-CD1 3.34Å
1162	E	80.5	Confident	75.1	Confident	55 Å²	55	46.5 Å²	46.5	26%	0.257	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	118.9	168.1	-55.3	168.5	156.6	0	0	108.2	L1143 N1144 R1146 I1164	L1143-E1162 WeakPolarHBondContact CA-O 3.48Å; N1144-E1162 HydrophobicContact CB-CB 3.96Å; N1144-E1162 HydrophobicContact CB-CG 4.46Å; N1144-E1162 WeakPolarHBondContact CB-OE2 3.38Å; N1144-E1162 PolarHBondContact N-O 2.84Å; N1144-E1162 PolarHBondContact ND2-OE2 3.13Å; N1144-E1162 PolarHBondContact O-N 3.41Å; N1144-E1162 VanDerWaalsContact O-N 3.14Å; R1146-E1162 VanDerWaalsContact CZ-CD 3.49Å; R1146-E1162 IonicContact CZ-OE1 3.3Å; R1146-E1162 IonicContact CZ-OE2 3.33Å; R1146-E1162 IonicContact NH1-OE1 2.66Å; R1146-E1162 PolarHBondContact NH1-OE1 3.22Å; R1146-E1162 IonicContact NH1-OE2 3.2Å; R1146-E1162 IonicContact NH2-OE1 3.51Å; R1146-E1162 PolarHBondContact NH2-OE1 3.23Å; R1146-E1162 IonicContact NH2-OE2 3.48Å; R1146-E1162 PolarHBondContact NH2-OE2 2.97Å; E1162-I1164 HydrophobicContact CB-CG1 4.46Å
1163	A	76.1	Confident	74.5	Confident	4 Å²	4	44.7 Å²	44.7	3%	0.033	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	107.6	170	0	0	0	0	0	109.4	L1140 L1143 L1171 L1179 W1220	L1140-A1163 HydrophobicContact CD1-CB 3.77Å; L1143-A1163 HydrophobicContact CD2-CB 4.03Å; A1163-L1171 HydrophobicContact CB-CD1 3.99Å; A1163-L1171 PolarHBondContact O-N 2.99Å; A1163-L1171 VanDerWaalsContact O-N 3.08Å; A1163-L1179 HydrophobicContact CB-CD1 3.82Å; A1163-W1220 HydrophobicContact CB-CH2 3.74Å; A1163-W1220 HydrophobicContact CB-CZ3 4.28Å
1164	I	79.4	Confident	74	Confident	43 Å²	43	50.8 Å²	50.8	22%	0.221	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.2	-175.3	-51.4	-179	0	0	0	108.3	S1141 A1142 E1162	S1141-I1164 PolarHBondContact N-O 3.5Å; S1141-I1164 PolarHBondContact OG-O 2.76Å; A1142-I1164 HydrophobicContact CB-CB 4.45Å; A1142-I1164 HydrophobicContact CB-CD1 4.43Å; A1142-I1164 PolarHBondContact O-N 3.13Å; E1162-I1164 HydrophobicContact CB-CG1 4.46Å
1165	G	71.2	Confident	73.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	163.2	174.3	0	0	0	0	0	112.3	G1139 S1141 D1167 G1168 I1169	G1139-G1165 CarbonylContact O-C 3.4Å; G1139-G1165 VanDerWaalsContact O-CA 3.28Å; G1139-G1165 WeakPolarHBondContact O-CA 3.25Å; S1141-G1165 WeakPolarHBondContact CB-O 3.24Å; S1141-G1165 PolarHBondContact OG-O 2.69Å; G1165-D1167 WeakPolarHBondContact CA-OD1 3.46Å; G1165-D1167 PolarHBondContact O-N 2.91Å; G1165-G1168 PolarHBondContact O-N 2.76Å; G1165-I1169 WeakPolarHBondContact CA-O 3.36Å; G1165-I1169 PolarHBondContact N-O 3.21Å
1166	T	74	Confident	73.8	Confident	62 Å²	62	47.2 Å²	47.2	38%	0.38	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-6.5	172	49	0	0	0	0	113.9	V1101 G1139 G1168	V1101-T1166 HydrophobicContact CG1-CG2 3.89Å; V1101-T1166 WeakPolarHBondContact CG1-OG1 3.4Å; V1101-T1166 HydrophobicContact CG2-CG2 4.32Å; G1139-T1166 PolarHBondContact N-OG1 2.89Å; G1139-T1166 PolarHBondContact O-N 2.75Å; T1166-G1168 VanDerWaalsContact C-N 3.34Å
1167	D	68.7	Low	73.5	Confident	76 Å²	76	49.4 Å²	49.4	41%	0.406	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-2.4	164.3	57.3	-1.5	0	0	0	112.9	G1165 I1169	G1165-D1167 WeakPolarHBondContact CA-OD1 3.46Å; G1165-D1167 PolarHBondContact O-N 2.91Å; D1167-I1169 VanDerWaalsContact C-N 3.3Å; D1167-I1169 HydrophobicContact CB-CG1 4.46Å; D1167-I1169 PolarHBondContact OD1-N 3.2Å; D1167-I1169 VanDerWaalsContact OD1-N 3.12Å
1168	G	68.2	Low	73.2	Confident	58 Å²	58	49.7 Å²	49.7	60%	0.598	27%	0.266	S	S	*	.	S	Bend	trans	80.9	4.3	-176.7	0	0	0	0	0	114.4	G1165 T1166	G1165-G1168 PolarHBondContact O-N 2.76Å; T1166-G1168 VanDerWaalsContact C-N 3.34Å
1169	I	70	Confident	73.1	Confident	105 Å²	105	47.1 Å²	47.1	54%	0.538	25%	0.25	S	S	.	.	S	Bend	trans	-99	145.1	-177.2	-52.9	179	0	0	0	109.1	G1165 D1167	G1165-I1169 WeakPolarHBondContact CA-O 3.36Å; G1165-I1169 PolarHBondContact N-O 3.21Å; D1167-I1169 VanDerWaalsContact C-N 3.3Å; D1167-I1169 HydrophobicContact CB-CG1 4.46Å; D1167-I1169 PolarHBondContact OD1-N 3.2Å; D1167-I1169 VanDerWaalsContact OD1-N 3.12Å
1170	T	70.7	Confident	72.6	Confident	58 Å²	58	52.2 Å²	52.2	36%	0.356	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-64.9	133.4	172.1	33.6	0	0	0	0	110.9	P1230	T1170-P1230 VanDerWaalsContact OG1-CB 3.25Å; T1170-P1230 WeakPolarHBondContact OG1-CB 2.97Å
1171	L	71.8	Confident	72.2	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-65.2	132.5	-171.2	-67.4	173.7	0	0	0	112.3	F1035 I1138 L1140 A1163 C1175 L1179	F1035-L1171 HydrophobicContact CD2-CD1 4.19Å; F1035-L1171 HydrophobicContact CD2-CD2 3.87Å; F1035-L1171 HydrophobicContact CE2-CD1 3.36Å; F1035-L1171 HydrophobicContact CE2-CD2 3.69Å; F1035-L1171 HydrophobicContact CE2-CG 4.2Å; F1035-L1171 HydrophobicContact CZ-CD1 3.65Å; I1138-L1171 HydrophobicContact CG2-CD2 3.95Å; L1140-L1171 HydrophobicContact CD1-CD1 4.32Å; A1163-L1171 HydrophobicContact CB-CD1 3.99Å; A1163-L1171 PolarHBondContact O-N 2.99Å; A1163-L1171 VanDerWaalsContact O-N 3.08Å; L1171-C1175 HydrophobicContact CB-CB 4.35Å; L1171-L1179 HydrophobicContact CD1-CD1 3.78Å
1172	P	71	Confident	71.9	Confident	42 Å²	42	50.7 Å²	50.7	27%	0.273	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-72.6	160.1	179.3	30.5	-35.8	0	0	0	111.8	K1174 C1175 A1176	P1172-K1174 VanDerWaalsContact C-N 3.3Å; P1172-K1174 PolarHBondContact O-N 3.01Å; P1172-C1175 HydrophobicContact CG-CB 4.35Å; P1172-C1175 WeakPolarHBondContact O-CA 3.49Å; P1172-C1175 WeakPolarHBondContact O-CB 3.48Å; P1172-C1175 PolarHBondContact O-N 2.82Å; P1172-A1176 PolarHBondContact O-N 3.14Å
1173	S	66.5	Low	71.6	Confident	14 Å²	14	49.7 Å²	49.7	10%	0.098	27%	0.269	C	S	.	.	H	α-helix	trans	-44.7	-42.9	-171.5	69.3	0	0	0	0	117.1	C1175 R1177 A1227 E1229 C1231	S1173-C1175 VanDerWaalsContact C-N 3.28Å; S1173-C1175 PolarHBondContact O-N 2.76Å; S1173-R1177 WeakPolarHBondContact O-CG 3.45Å; S1173-R1177 PolarHBondContact O-N 3.38Å; S1173-A1227 PolarHBondContact OG-O 2.93Å; S1173-E1229 PolarHBondContact N-O 2.87Å; S1173-C1231 WeakPolarHBondContact CA-SG 3.23Å; S1173-C1231 WeakPolarHBondContact CB-SG 3.48Å
1174	K	66.8	Low	71.3	Confident	179 Å²	179	52.2 Å²	52.2	78%	0.778	28%	0.281	S	S	*	.	H	α-helix	trans	-70.8	-22.4	-179.1	-162.7	177.9	-178.5	-175.2	0	113.3	P1172	P1172-K1174 VanDerWaalsContact C-N 3.3Å; P1172-K1174 PolarHBondContact O-N 3.01Å
1175	C	71.1	Confident	70.4	Confident	26 Å²	26	51.6 Å²	51.6	18%	0.176	28%	0.28	C	S	.	.	H	α-helix	trans	-93.5	-43	177.7	-57.7	0	0	0	0	111.2	F1035 L1171 P1172 S1173 R1177 L1178	F1035-C1175 HydrophobicContact CB-CB 3.87Å; F1035-C1175 HydrophobicContact CD1-CB 4.41Å; F1035-C1175 HydrophobicContact CD2-CB 4.05Å; F1035-C1175 HydrophobicContact CG-CB 3.83Å; L1171-C1175 HydrophobicContact CB-CB 4.35Å; P1172-C1175 HydrophobicContact CG-CB 4.35Å; P1172-C1175 WeakPolarHBondContact O-CA 3.49Å; P1172-C1175 WeakPolarHBondContact O-CB 3.48Å; P1172-C1175 PolarHBondContact O-N 2.82Å; S1173-C1175 VanDerWaalsContact C-N 3.28Å; S1173-C1175 PolarHBondContact O-N 2.76Å; C1175-R1177 VanDerWaalsContact C-N 3.32Å; C1175-R1177 PolarHBondContact O-N 2.76Å; C1175-L1178 WeakPolarHBondContact O-CB 3.26Å; C1175-L1178 PolarHBondContact O-N 2.92Å; C1175-L1178 VanDerWaalsContact O-N 3.1Å
1176	A	70.2	Confident	69.8	Low	1 Å²	1	54.4 Å²	54.4	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-57.6	-42.1	-178.8	0	0	0	0	0	112.6	P1172 L1178 L1179 W1220 C1231	P1172-A1176 PolarHBondContact O-N 3.14Å; A1176-L1178 PolarHBondContact O-N 2.99Å; A1176-L1178 VanDerWaalsContact O-N 3.09Å; A1176-L1179 WeakPolarHBondContact O-CB 3.3Å; A1176-L1179 PolarHBondContact O-N 3.02Å; A1176-W1220 HydrophobicContact CB-CD2 4.02Å; A1176-W1220 HydrophobicContact CB-CE3 3.87Å; A1176-W1220 HydrophobicContact CB-CZ3 4.16Å; A1176-W1220 VanDerWaalsContact O-CE2 3.28Å; A1176-W1220 PolarHBondContact O-NE1 3.48Å; A1176-W1220 VanDerWaalsContact O-NE1 3.16Å; A1176-C1231 HydrophobicContact CB-CB 4.21Å
1177	R	69.6	Low	68.4	Low	128 Å²	128	56.3 Å²	56.3	48%	0.483	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.8	178.3	-70.5	179.1	-177.4	169.3	3.8	115	S1173 C1175 L1179	S1173-R1177 WeakPolarHBondContact O-CG 3.45Å; S1173-R1177 PolarHBondContact O-N 3.38Å; C1175-R1177 VanDerWaalsContact C-N 3.32Å; C1175-R1177 PolarHBondContact O-N 2.76Å; R1177-L1179 VanDerWaalsContact C-N 3.26Å; R1177-L1179 PolarHBondContact O-N 3.08Å
1178	L	70.1	Confident	66.6	Low	35 Å²	35	56 Å²	56	18%	0.183	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.3	175	-63.4	168.3	0	0	0	112.6	F1035 H1037 E1039 A1040 C1175 A1176	F1035-L1178 HydrophobicContact CB-CD1 4.28Å; F1035-L1178 HydrophobicContact CD1-CB 4.05Å; F1035-L1178 HydrophobicContact CD1-CD1 3.9Å; F1035-L1178 HydrophobicContact CE1-CB 4.31Å; H1037-L1178 HydrophobicContact CB-CB 4.01Å; H1037-L1178 HydrophobicContact CB-CD1 4.36Å; H1037-L1178 PolarHBondContact CD2-O 2.73Å; H1037-L1178 PolarHBondContact CE1-O 2.93Å; H1037-L1178 PolarHBondContact NE2-O 3.01Å; E1039-L1178 HydrophobicContact CB-CD2 4.32Å; A1040-L1178 HydrophobicContact CB-CD1 4.1Å; C1175-L1178 WeakPolarHBondContact O-CB 3.26Å; C1175-L1178 PolarHBondContact O-N 2.92Å; C1175-L1178 VanDerWaalsContact O-N 3.1Å; A1176-L1178 PolarHBondContact O-N 2.99Å; A1176-L1178 VanDerWaalsContact O-N 3.09Å
1179	L	74.6	Confident	64.8	Low	1 Å²	1	56.2 Å²	56.2	1%	0.005	29%	0.29	C	S	.	.			trans	-90.7	109.5	-179.3	-68.5	174.2	0	0	0	112	F1035 L1140 A1163 L1171 A1176 R1177 L1181 W1220 S1251 V1253	F1035-L1179 HydrophobicContact CE1-CD2 3.82Å; F1035-L1179 HydrophobicContact CE1-CG 3.97Å; F1035-L1179 HydrophobicContact CZ-CD1 4.18Å; F1035-L1179 HydrophobicContact CZ-CD2 3.77Å; F1035-L1179 HydrophobicContact CZ-CG 4Å; L1140-L1179 HydrophobicContact CD1-CD1 4.08Å; L1140-L1179 HydrophobicContact CD2-CD1 4.3Å; L1140-L1179 HydrophobicContact CD2-CD2 3.97Å; A1163-L1179 HydrophobicContact CB-CD1 3.82Å; L1171-L1179 HydrophobicContact CD1-CD1 3.78Å; A1176-L1179 WeakPolarHBondContact O-CB 3.3Å; A1176-L1179 PolarHBondContact O-N 3.02Å; R1177-L1179 VanDerWaalsContact C-N 3.26Å; R1177-L1179 PolarHBondContact O-N 3.08Å; L1179-L1181 PolarHBondContact O-N 3.45Å; L1179-L1181 VanDerWaalsContact O-N 3.11Å; L1179-W1220 HydrophobicContact CB-CZ2 3.8Å; L1179-W1220 HydrophobicContact CD1-CH2 4.34Å; L1179-W1220 HydrophobicContact CD1-CZ2 4.13Å; L1179-W1220 PolarHBondContact O-NE1 2.87Å; L1179-S1251 WeakPolarHBondContact CD2-OG 3.23Å; L1179-V1253 HydrophobicContact CD2-CG1 3.74Å
1180	K	72.5	Confident	62.9	Low	106 Å²	106	58.2 Å²	58.2	46%	0.461	30%	0.297	S	S	.	.			trans	-75.9	91.8	168.8	-80.7	164.7	-179.8	144.9	0	110.3	E1039 S1182	E1039-K1180 IonicContact OE1-NZ 2.75Å; E1039-K1180 PolarHBondContact OE1-NZ 3.32Å; E1039-K1180 VanDerWaalsContact OE1-NZ 3.09Å; K1180-S1182 PolarHBondContact O-N 3.13Å
1181	L	74.6	Confident	61	Low	17 Å²	17	58.2 Å²	58.2	9%	0.089	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	118.7	172.1	-60.7	-179.4	0	0	0	110.6	L1143 V1161 L1179 F1219 W1220 I1249	L1143-L1181 HydrophobicContact CD2-CD2 4.37Å; V1161-L1181 HydrophobicContact CG1-CD2 4.45Å; L1179-L1181 PolarHBondContact O-N 3.45Å; L1179-L1181 VanDerWaalsContact O-N 3.11Å; L1181-F1219 HydrophobicContact CD1-CB 4.22Å; L1181-W1220 HydrophobicContact CD1-CH2 4.26Å; L1181-W1220 HydrophobicContact CD1-CZ2 3.72Å; L1181-W1220 HydrophobicContact CD2-CH2 4.33Å; L1181-W1220 HydrophobicContact CD2-CZ2 3.82Å; L1181-W1220 HydrophobicContact CG-CZ2 3.79Å; L1181-I1249 HydrophobicContact CD2-CG2 4.11Å
1182	S	71.9	Confident	59.1	Low	51 Å²	51	62.8 Å²	62.8	36%	0.357	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.6	170.6	162.8	0	0	0	0	108.5	K1180 T1250	K1180-S1182 PolarHBondContact O-N 3.13Å; S1182-T1250 WeakPolarHBondContact CA-O 3.18Å; S1182-T1250 WeakPolarHBondContact CB-O 3.23Å; S1182-T1250 VanDerWaalsContact CB-OG1 3.31Å; S1182-T1250 WeakPolarHBondContact CB-OG1 3.49Å; S1182-T1250 PolarHBondContact N-O 3.04Å; S1182-T1250 PolarHBondContact O-N 2.77Å; S1182-T1250 VanDerWaalsContact O-O 3.1Å; S1182-T1250 PolarHBondContact O-OG1 3.38Å; S1182-T1250 PolarHBondContact OG-OG1 2.68Å
1183	I	74.9	Confident	57.2	Low	34 Å²	34	64.2 Å²	64.2	17%	0.174	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.5	-175	-52	160.2	0	0	0	108.6	V1209 F1235 L1247	I1183-V1209 HydrophobicContact CB-CG1 3.65Å; I1183-V1209 HydrophobicContact CD1-CG1 3.67Å; I1183-V1209 HydrophobicContact CG1-CG1 4.28Å; I1183-V1209 HydrophobicContact CG2-CB 4.42Å; I1183-V1209 HydrophobicContact CG2-CG1 3.47Å; I1183-V1209 VanDerWaalsContact CG2-CG1 3.47Å; I1183-V1209 HydrophobicContact CG2-CG2 4.05Å; I1183-F1235 HydrophobicContact CD1-CB 4.37Å; I1183-F1235 HydrophobicContact CD1-CD1 4.05Å; I1183-F1235 HydrophobicContact CD1-CD2 3.73Å; I1183-F1235 HydrophobicContact CD1-CE1 4.26Å; I1183-F1235 HydrophobicContact CD1-CE2 3.92Å; I1183-F1235 HydrophobicContact CD1-CG 3.79Å; I1183-F1235 HydrophobicContact CD1-CZ 4.19Å; I1183-F1235 HydrophobicContact CG1-CE2 4.35Å; I1183-F1235 HydrophobicContact CG1-CZ 4.29Å; I1183-F1235 HydrophobicContact CG2-CD2 4.47Å; I1183-F1235 HydrophobicContact CG2-CE2 3.68Å; I1183-F1235 HydrophobicContact CG2-CZ 3.94Å; I1183-L1247 HydrophobicContact CG2-CD1 3.81Å
1184	I	69.1	Low	55.6	Low	56 Å²	56	69.6 Å²	69.6	29%	0.287	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.4	-172.1	-53.6	-178.9	0	0	0	109.7	L1247 M1248 T1250	I1184-L1247 WeakPolarHBondContact O-CA 3.28Å; I1184-M1248 PolarHBondContact N-O 3.11Å; I1184-M1248 PolarHBondContact O-N 2.8Å; I1184-T1250 HydrophobicContact CD1-CG2 3.67Å
1185	S	61.7	Low	53.7	Low	30 Å²	30	62.7 Å²	62.7	21%	0.21	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	109.1	167.7	61.6	0	0	0	0	109.4	K1246	S1185-K1246 WeakPolarHBondContact CA-O 3.39Å
1186	D	57.6	Low	51.8	Low	59 Å²	59	68.1 Å²	68.1	32%	0.316	37%	0.373	S	S	.	.	S	Bend	trans	35.3	131.7	-176.1	-51.8	-47.5	0	0	0	119.2	S1245 K1246	D1186-S1245 WeakPolarHBondContact OD2-CA 3.47Å; D1186-S1245 WeakPolarHBondContact OD2-CB 3.29Å; D1186-S1245 PolarHBondContact OD2-OG 2.93Å; D1186-K1246 PolarHBondContact OD1-N 2.89Å; D1186-K1246 PolarHBondContact OD2-N 2.99Å
1187	H	44.6	Very low	49.8	Very low	103 Å²	103	73.4 Å²	73.4	48%	0.477	40%	0.396	S	S	.	.			cis	-115	137.9	16.8	-73.1	-133.3	0	0	0	111.8	T1189 N1790	H1187-T1189 PolarHBondContact O-N 3.23Å; H1187-N1790 WeakPolarHBondContact CB-ND2 3.26Å; H1187-N1790 PolarHBondContact CD2-ND2 2.83Å; H1187-N1790 VanDerWaalsContact CD2-ND2 3.31Å; H1187-N1790 PolarHBondContact CE1-OD1 3.37Å; H1187-N1790 PolarHBondContact ND1-ND2 2.88Å; H1187-N1790 PolarHBondContact ND1-OD1 2.85Å
1188	V	31.4	Very low	47.9	Very low	70 Å²	70	75.6 Å²	75.6	42%	0.424	41%	0.411	S	S	.	.			trans	-89.7	96.4	166.3	-178.1	0	0	0	0	109.3
1189	T	30	Very low	46	Very low	62 Å²	62	78.7 Å²	78.7	38%	0.38	44%	0.436	S	S	.	.			trans	-120.5	125.9	159.2	51.8	0	0	0	0	108.3	H1187 K1789	H1187-T1189 PolarHBondContact O-N 3.23Å; T1189-K1789 HydrophobicContact CG2-CD 4.49Å
1190	H	30.9	Very low	43.9	Very low	146 Å²	146	83.6 Å²	83.6	68%	0.676	47%	0.47	S	S	*	.			trans	-86	124.5	-176.2	-62.8	-108.8	0	0	0	111.9	K1789	H1190-K1789 VanDerWaalsContact C-NZ 3.34Å; H1190-K1789 PolarHBondContact O-NZ 2.93Å
1191	S	30	Very low	42.2	Very low	58 Å²	58	87.7 Å²	87.7	41%	0.406	49%	0.491	S	S	.	.				-153.5	-171.2	123.3	24.1	0	0	0	0	109.2	E1788 K1789	S1191-E1788 WeakPolarHBondContact CB-OE1 3.39Å; S1191-E1788 PolarHBondContact N-OE1 2.88Å; S1191-E1788 PolarHBondContact N-OE2 3.32Å; S1191-E1788 PolarHBondContact OG-OE1 3.36Å; S1191-K1789 PolarHBondContact OG-NZ 2.97Å
1192	T	32.1	Very low	40.5	Very low	101 Å²	101	92.8 Å²	92.8	62%	0.62	52%	0.518	S	S	*	.			trans	-143.3	131.4	-158.6	56.9	0	0	0	0	116.5
1193	S	32.1	Very low	39.1	Very low	72 Å²	72	94.8 Å²	94.8	50%	0.503	53%	0.532	S	S	.	.			trans	106	139.3	132.7	84.1	0	0	0	0	121.5	Q1786	S1193-Q1786 PolarHBondContact O-NE2 3.45Å; S1193-Q1786 PolarHBondContact O-OE1 3.16Å
1194	T	31.7	Very low	37.7	Very low	127 Å²	127	100.3 Å²	100.3	78%	0.779	56%	0.555	S	S	*	*			trans	90.4	64.9	160.8	68.1	0	0	0	0	121.8
1195	G	27.6	Very low	37.1	Very low	33 Å²	33	104.1 Å²	104.1	34%	0.34	57%	0.566	S	S	.	*			trans	97.2	133.9	145.6	0	0	0	0	0	116.7	F1784 I1785 Q1786	G1195-F1784 CarbonylContact C-O 3.56Å; G1195-F1784 VanDerWaalsContact C-O 3.24Å; G1195-I1785 WeakPolarHBondContact O-CA 2.97Å; G1195-Q1786 VanDerWaalsContact O-CB 3.31Å; G1195-Q1786 WeakPolarHBondContact O-CB 3.22Å; G1195-Q1786 VanDerWaalsContact O-CG 3.27Å; G1195-Q1786 WeakPolarHBondContact O-CG 3.33Å
1196	H	30.2	Very low	37.3	Very low	141 Å²	141	104.2 Å²	104.2	65%	0.653	56%	0.563	S	S	*	*			cis	-154.3	-48.8	-3.4	-128.7	138.3	0	0	0	119.3	F1784	H1196-F1784 HydrophobicContact CB-CB 4.24Å; H1196-F1784 HydrophobicContact CB-CD1 3.95Å; H1196-F1784 PolarHBondContact N-O 3.05Å
1197	K	29.7	Very low	37.8	Very low	111 Å²	111	101.4 Å²	101.4	48%	0.483	55%	0.548	S	S	.	.			trans	-161.8	155	-176.8	-39.2	173	-162.3	158.3	0	115.5	F1784 I1785	K1197-F1784 HydrophobicContact CB-CB 3.97Å; K1197-F1784 HydrophobicContact CB-CD1 4.09Å; K1197-F1784 HydrophobicContact CB-CD2 3.87Å; K1197-F1784 HydrophobicContact CB-CE2 4.5Å; K1197-F1784 HydrophobicContact CB-CG 3.68Å; K1197-F1784 HydrophobicContact CD-CD1 3.78Å; K1197-F1784 HydrophobicContact CD-CD2 4.16Å; K1197-F1784 HydrophobicContact CD-CE1 3.65Å; K1197-F1784 HydrophobicContact CD-CE2 4Å; K1197-F1784 HydrophobicContact CD-CG 4.09Å; K1197-F1784 HydrophobicContact CD-CZ 3.78Å; K1197-F1784 VanDerWaalsContact CE-CE1 3.46Å; K1197-F1784 HydrophobicContact CG-CD1 3.81Å; K1197-F1784 HydrophobicContact CG-CD2 4.36Å; K1197-F1784 HydrophobicContact CG-CE1 4.22Å; K1197-F1784 HydrophobicContact CG-CG 3.95Å; K1197-F1784 VanDerWaalsContact NZ-CZ 3.3Å; K1197-F1784 WeakPolarHBondContact O-CB 3.32Å; K1197-I1785 VanDerWaalsContact C-CB 3.41Å; K1197-I1785 VanDerWaalsContact N-CB 3.25Å; K1197-I1785 WeakPolarHBondContact O-CB 3.47Å; K1197-I1785 WeakPolarHBondContact O-CG2 3.49Å; K1197-I1785 PolarHBondContact O-N 2.99Å
1198	E	28.3	Very low	39.2	Very low	175 Å²	175	102 Å²	102	82%	0.818	55%	0.547	S	S	*	.			trans	-170	173.7	143.9	-136.8	-179.1	-150.3	0	0	109.1	I1785	E1198-I1785 HydrophobicContact CB-CG2 4.31Å
1199	S	29.8	Very low	41.1	Very low	100 Å²	100	99.7 Å²	99.7	70%	0.699	53%	0.532	S	S	*	.			trans	-116.2	136.4	-153.4	57.1	0	0	0	0	118.3
1200	S	30.5	Very low	42.8	Very low	104 Å²	104	98.8 Å²	98.8	73%	0.727	53%	0.527	S	S	*	.			trans	60.4	93.7	148.2	61.3	0	0	0	0	119.9
1201	H	37.4	Very low	44	Very low	192 Å²	192	97.8 Å²	97.8	89%	0.889	52%	0.523	S	S	*	.			trans	-133.5	139.6	139.4	-96.8	-82.6	0	0	0	110	S1203	H1201-S1203 VanDerWaalsContact C-N 3.34Å; H1201-S1203 PolarHBondContact O-N 2.96Å
1202	D	38.4	Very low	44.9	Very low	123 Å²	123	102 Å²	102	66%	0.658	55%	0.546	S	S	*	.			trans	-83	70	-168.2	-168.5	45.5	0	0	0	112.8
1203	S	42.3	Very low	45.5	Very low	94 Å²	94	107.4 Å²	107.4	66%	0.657	56%	0.557	S	S	*	*			trans	-58.5	138.9	165.3	52	0	0	0	0	109.7	H1201 R1205	H1201-S1203 VanDerWaalsContact C-N 3.34Å; H1201-S1203 PolarHBondContact O-N 2.96Å; S1203-R1205 PolarHBondContact O-N 3.12Å
1204	K	46.1	Very low	46.6	Very low	149 Å²	149	106.8 Å²	106.8	65%	0.648	55%	0.55	S	S	*	.			trans	-62	86	-168.3	-73.6	179.4	177.7	174.7	0	112.9	I1206	K1204-I1206 PolarHBondContact O-N 2.72Å; K1204-I1206 VanDerWaalsContact O-N 3.11Å
1205	R	56.9	Low	47.7	Very low	137 Å²	137	104.8 Å²	104.8	52%	0.517	54%	0.539	S	S	.	.			trans	-58.6	113.7	167.8	-66.5	-176.8	-177.7	177.8	1.5	109	S1203 I1240 A1241	S1203-R1205 PolarHBondContact O-N 3.12Å; R1205-I1240 HydrophobicContact CB-CD1 3.85Å; R1205-I1240 WeakPolarHBondContact O-CD1 3.36Å; R1205-I1240 WeakPolarHBondContact O-CG1 3.46Å; R1205-A1241 WeakPolarHBondContact O-CB 3.38Å
1206	I	65.7	Low	48.9	Very low	31 Å²	31	104.1 Å²	104.1	16%	0.159	53%	0.53	C	S	.	.	S	Bend	trans	-76.4	-45.3	175.3	-71.7	166	0	0	0	109.3	K1204 I1240 A1241 T1244 V1273	K1204-I1206 PolarHBondContact O-N 2.72Å; K1204-I1206 VanDerWaalsContact O-N 3.11Å; I1206-I1240 WeakPolarHBondContact O-CG1 3.32Å; I1206-I1240 PolarHBondContact O-N 2.79Å; I1206-A1241 PolarHBondContact O-N 2.93Å; I1206-A1241 VanDerWaalsContact O-N 3.15Å; I1206-T1244 WeakPolarHBondContact CD1-O 3.43Å; I1206-V1273 HydrophobicContact CG2-CB 3.77Å; I1206-V1273 HydrophobicContact CG2-CG2 3.49Å; I1206-V1273 VanDerWaalsContact CG2-CG2 3.49Å
1207	L	69.1	Low	50.4	Low	1 Å²	1	101.8 Å²	101.8	1%	0.005	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	137.1	172.7	-58	173.3	0	0	0	110.2	V1237 R1238 L1247 I1271 V1273	L1207-V1237 HydrophobicContact CB-CG1 4.42Å; L1207-V1237 HydrophobicContact CD1-CG1 4.22Å; L1207-V1237 HydrophobicContact CD2-CG1 3.79Å; L1207-V1237 HydrophobicContact CG-CG1 4.37Å; L1207-R1238 CarbonylContact C-O 3.59Å; L1207-R1238 WeakPolarHBondContact CA-O 3.48Å; L1207-L1247 HydrophobicContact CD1-CB 4.27Å; L1207-L1247 HydrophobicContact CD1-CD1 4.37Å; L1207-I1271 HydrophobicContact CD1-CB 4.42Å; L1207-I1271 HydrophobicContact CD1-CD1 4.07Å; L1207-I1271 HydrophobicContact CD2-CG2 4.01Å; L1207-V1273 HydrophobicContact CD2-CG2 3.39Å; L1207-V1273 HydrophobicContact CG-CG2 4.35Å
1208	R	73	Confident	52.1	Low	116 Å²	116	99.7 Å²	99.7	44%	0.438	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	116.7	161.8	-179.1	-174.6	76.6	155.3	3.9	107.4	E1156 R1238 I1240	E1156-R1208 IonicContact OE1-CZ 3.47Å; E1156-R1208 IonicContact OE1-NH2 3.92Å; E1156-R1208 PolarHBondContact OE1-NH2 3.03Å; R1208-R1238 HydrophobicContact CB-CB 4.25Å; R1208-R1238 PolarHBondContact N-O 2.86Å; R1208-R1238 PolarHBondContact O-N 3.39Å; R1208-I1240 HydrophobicContact CB-CB 4.33Å; R1208-I1240 HydrophobicContact CB-CD1 3.81Å; R1208-I1240 HydrophobicContact CB-CG1 3.88Å; R1208-I1240 HydrophobicContact CB-CG2 3.52Å
1209	V	72	Confident	54	Low	21 Å²	21	92.4 Å²	92.4	13%	0.127	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-103.6	148.5	169.3	177.4	0	0	0	0	107.2	I1183 F1235 L1247	I1183-V1209 HydrophobicContact CB-CG1 3.65Å; I1183-V1209 HydrophobicContact CD1-CG1 3.67Å; I1183-V1209 HydrophobicContact CG1-CG1 4.28Å; I1183-V1209 HydrophobicContact CG2-CB 4.42Å; I1183-V1209 HydrophobicContact CG2-CG1 3.47Å; I1183-V1209 VanDerWaalsContact CG2-CG1 3.47Å; I1183-V1209 HydrophobicContact CG2-CG2 4.05Å; V1209-F1235 HydrophobicContact CG1-CD2 4.49Å; V1209-L1247 HydrophobicContact CG2-CD1 4.39Å
1210	P	65.8	Low	56.1	Low	42 Å²	42	88.1 Å²	88.1	27%	0.273	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-51.5	140.7	170.5	17.6	-31	0	0	0	112.3	V1214 F1219 F1235 T1236	P1210-V1214 HydrophobicContact CB-CG2 4.5Å; P1210-F1219 HydrophobicContact CB-CE1 3.94Å; P1210-F1219 HydrophobicContact CB-CZ 4.1Å; P1210-F1219 HydrophobicContact CG-CE1 3.5Å; P1210-F1219 HydrophobicContact CG-CZ 3.91Å; P1210-F1235 HydrophobicContact CG-CB 4.04Å; P1210-T1236 WeakPolarHBondContact CD-O 3.32Å
1211	E	55.4	Low	58	Low	126 Å²	126	87.4 Å²	87.4	59%	0.589	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-72.1	152.6	-171.1	-61.1	-171.6	153.2	0	0	113	Y1213 V1214	E1211-Y1213 PolarHBondContact O-N 3.31Å; E1211-V1214 WeakPolarHBondContact O-CB 3.25Å; E1211-V1214 WeakPolarHBondContact O-CG2 2.96Å; E1211-V1214 PolarHBondContact O-N 3.41Å
1212	T	49.5	Very low	59.4	Low	145 Å²	145	79.5 Å²	79.5	89%	0.89	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-1.4	-177.8	47.7	0	0	0	0	115.3
1213	Y	44.6	Very low	60.4	Low	215 Å²	215	78.2 Å²	78.2	84%	0.843	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-11.3	169.3	-76.4	-78.4	0	0	0	113.7	E1211	E1211-Y1213 PolarHBondContact O-N 3.31Å
1214	V	55.1	Low	61.1	Low	59 Å²	59	79.6 Å²	79.6	36%	0.358	41%	0.411	S	S	.	.	S	Bend	trans	-73.2	121.1	171.1	178.1	0	0	0	0	108.2	P1210 E1211 S1216 S1218 F1219	P1210-V1214 HydrophobicContact CB-CG2 4.5Å; E1211-V1214 WeakPolarHBondContact O-CB 3.25Å; E1211-V1214 WeakPolarHBondContact O-CG2 2.96Å; E1211-V1214 PolarHBondContact O-N 3.41Å; V1214-S1216 PolarHBondContact O-N 2.97Å; V1214-S1218 WeakPolarHBondContact CG1-OG 3.15Å; V1214-F1219 HydrophobicContact CB-CZ 4.1Å; V1214-F1219 HydrophobicContact CG1-CE1 4.17Å; V1214-F1219 HydrophobicContact CG1-CE2 4.37Å; V1214-F1219 HydrophobicContact CG1-CZ 3.84Å
1215	P	53.7	Low	61.5	Low	86 Å²	86	76.3 Å²	76.3	56%	0.558	41%	0.407	S	S	*	.			trans	-63.7	135.8	-176.5	25	-33.4	0	0	0	111.1	D1217 S1218	P1215-D1217 PolarHBondContact O-N 2.68Å; P1215-S1218 WeakPolarHBondContact O-CB 3.26Å; P1215-S1218 PolarHBondContact O-N 3.27Å; P1215-S1218 PolarHBondContact O-OG 3.44Å
1216	S	54.2	Low	61.4	Low	19 Å²	19	73.9 Å²	73.9	13%	0.133	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-45.3	-40.3	-177.3	34.7	0	0	0	0	113.9	V1214 S1218 F1219	V1214-S1216 PolarHBondContact O-N 2.97Å; S1216-S1218 PolarHBondContact O-N 2.83Å; S1216-S1218 VanDerWaalsContact O-N 3.1Å; S1216-F1219 PolarHBondContact O-N 2.92Å
1217	D	60.7	Low	60.8	Low	91 Å²	91	76 Å²	76	49%	0.487	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-59	-21.7	-176.7	-54.2	39	0	0	0	113	P1215	P1215-D1217 PolarHBondContact O-N 2.68Å
1218	S	65.8	Low	60.4	Low	68 Å²	68	84.5 Å²	84.5	48%	0.476	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-89.2	-13.6	-176.4	67.2	0	0	0	0	115.1	V1214 P1215 S1216 W1220	V1214-S1218 WeakPolarHBondContact CG1-OG 3.15Å; P1215-S1218 WeakPolarHBondContact O-CB 3.26Å; P1215-S1218 PolarHBondContact O-N 3.27Å; P1215-S1218 PolarHBondContact O-OG 3.44Å; S1216-S1218 PolarHBondContact O-N 2.83Å; S1216-S1218 VanDerWaalsContact O-N 3.1Å; S1218-W1220 VanDerWaalsContact C-N 3.3Å
1219	F	68.9	Low	60.1	Low	21 Å²	21	82.8 Å²	82.8	9%	0.092	46%	0.463	C	S	.	.	S	Bend	trans	-77	-19.7	171.8	-62.8	-58.8	0	0	0	112.7	L1181 P1210 V1214 S1216 I1221 G1233 Q1234 F1235	L1181-F1219 HydrophobicContact CD1-CB 4.22Å; P1210-F1219 HydrophobicContact CB-CE1 3.94Å; P1210-F1219 HydrophobicContact CB-CZ 4.1Å; P1210-F1219 HydrophobicContact CG-CE1 3.5Å; P1210-F1219 HydrophobicContact CG-CZ 3.91Å; V1214-F1219 HydrophobicContact CB-CZ 4.1Å; V1214-F1219 HydrophobicContact CG1-CE1 4.17Å; V1214-F1219 HydrophobicContact CG1-CE2 4.37Å; V1214-F1219 HydrophobicContact CG1-CZ 3.84Å; S1216-F1219 PolarHBondContact O-N 2.92Å; F1219-I1221 PolarHBondContact O-N 3.03Å; F1219-G1233 CarbonylContact O-C 3.51Å; F1219-G1233 WeakPolarHBondContact O-CA 3.26Å; F1219-Q1234 PolarHBondContact O-N 2.79Å; F1219-F1235 HydrophobicContact CD1-CB 4.01Å; F1219-F1235 HydrophobicContact CE1-CB 4.2Å
1220	W	73.5	Confident	59.6	Low	11 Å²	11	85.4 Å²	85.4	4%	0.042	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	100.5	-178.2	-66.6	107.7	0	0	0	111.1	A1163 A1176 L1179 L1181 S1218 C1222 C1231	A1163-W1220 HydrophobicContact CB-CH2 3.74Å; A1163-W1220 HydrophobicContact CB-CZ3 4.28Å; A1176-W1220 HydrophobicContact CB-CD2 4.02Å; A1176-W1220 HydrophobicContact CB-CE3 3.87Å; A1176-W1220 HydrophobicContact CB-CZ3 4.16Å; A1176-W1220 VanDerWaalsContact O-CE2 3.28Å; A1176-W1220 PolarHBondContact O-NE1 3.48Å; A1176-W1220 VanDerWaalsContact O-NE1 3.16Å; L1179-W1220 HydrophobicContact CB-CZ2 3.8Å; L1179-W1220 HydrophobicContact CD1-CH2 4.34Å; L1179-W1220 HydrophobicContact CD1-CZ2 4.13Å; L1179-W1220 PolarHBondContact O-NE1 2.87Å; L1181-W1220 HydrophobicContact CD1-CH2 4.26Å; L1181-W1220 HydrophobicContact CD1-CZ2 3.72Å; L1181-W1220 HydrophobicContact CD2-CH2 4.33Å; L1181-W1220 HydrophobicContact CD2-CZ2 3.82Å; L1181-W1220 HydrophobicContact CG-CZ2 3.79Å; S1218-W1220 VanDerWaalsContact C-N 3.3Å; W1220-C1222 PolarHBondContact O-N 3.27Å; W1220-C1231 HydrophobicContact CE3-CB 4.18Å
1221	I	69.9	Low	59.7	Low	88 Å²	88	83.9 Å²	83.9	45%	0.451	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	113.9	167.3	-67.9	-162.7	0	0	0	108.7	F1219 C1231 S1232 Q1234	F1219-I1221 PolarHBondContact O-N 3.03Å; I1221-C1231 VanDerWaalsContact O-CA 3.29Å; I1221-C1231 WeakPolarHBondContact O-CA 3.28Å; I1221-C1231 VanDerWaalsContact O-CB 3.26Å; I1221-C1231 WeakPolarHBondContact O-CB 3.36Å; I1221-S1232 PolarHBondContact N-O 3.32Å; I1221-S1232 PolarHBondContact O-N 2.82Å; I1221-Q1234 HydrophobicContact CD1-CG 3.77Å; I1221-Q1234 VanDerWaalsContact CD1-NE2 3.34Å; I1221-Q1234 HydrophobicContact CG1-CG 3.86Å
1222	C	67.7	Low	60.4	Low	26 Å²	26	80.1 Å²	80.1	18%	0.176	46%	0.459	C	S	.	.			trans	-120.9	136.2	171.6	-56.6	0	0	0	0	107.3	W1220 S1224 C1231	W1220-C1222 PolarHBondContact O-N 3.27Å; C1222-S1224 PolarHBondContact O-N 2.98Å; C1222-C1231 VanDerWaalsContact CA-SG 3.51Å; C1222-C1231 HydrophobicContact CB-CB 4.13Å; C1222-C1231 WeakPolarHBondContact CB-SG 3.29Å; C1222-C1231 WeakPolarHBondContact SG-CB 3.08Å; C1222-C1231 CovalentContact SG-SG 2.03Å; C1222-C1231 PolarHBondContact SG-SG 3.11Å
1223	D	59.6	Low	61.5	Low	97 Å²	97	73.2 Å²	73.2	52%	0.519	42%	0.416	S	S	.	.			trans	-65	132.6	165.2	-161.9	-60.2	0	0	0	108.8	S1225	D1223-S1225 PolarHBondContact O-N 3.12Å; D1223-S1225 WeakPolarHBondContact OD1-CB 3.2Å; D1223-S1225 PolarHBondContact OD1-N 2.79Å; D1223-S1225 VanDerWaalsContact OD1-N 3.1Å; D1223-S1225 PolarHBondContact OD1-OG 3.05Å
1224	S	55.2	Low	63.2	Low	122 Å²	122	66.6 Å²	66.6	85%	0.853	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-5.8	-173.1	63.6	0	0	0	0	114.3	C1222	C1222-S1224 PolarHBondContact O-N 2.98Å
1225	S	55.2	Low	64.2	Low	80 Å²	80	64.1 Å²	64.1	56%	0.559	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-33	-172.3	56.5	0	0	0	0	115	D1223	D1223-S1225 PolarHBondContact O-N 3.12Å; D1223-S1225 WeakPolarHBondContact OD1-CB 3.2Å; D1223-S1225 PolarHBondContact OD1-N 2.79Å; D1223-S1225 VanDerWaalsContact OD1-N 3.1Å; D1223-S1225 PolarHBondContact OD1-OG 3.05Å
1226	N	54.6	Low	65.4	Low	86 Å²	86	63 Å²	63	46%	0.46	37%	0.369	S	S	.	.			trans	-126.5	120.5	-174.1	-82.1	-34.3	0	0	0	112.7	E1228 E1229	N1226-E1228 PolarHBondContact O-N 3.01Å; N1226-E1229 HydrophobicContact CB-CB 4.35Å; N1226-E1229 HydrophobicContact CB-CG 3.84Å; N1226-E1229 WeakPolarHBondContact CB-OE1 3.16Å; N1226-E1229 PolarHBondContact ND2-OE1 3.08Å; N1226-E1229 PolarHBondContact O-N 3.37Å
1227	A	54.3	Low	66.6	Low	77 Å²	77	62.1 Å²	62.1	64%	0.636	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-20.3	-179.6	0	0	0	0	0	114.3	S1173	S1173-A1227 PolarHBondContact OG-O 2.93Å
1228	E	60.8	Low	67.6	Low	179 Å²	179	61 Å²	61	84%	0.836	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-6.1	-176.1	-58.4	-164.7	137.1	0	0	114.1	N1226	N1226-E1228 PolarHBondContact O-N 3.01Å
1229	E	65.6	Low	68.1	Low	80 Å²	80	57.8 Å²	57.8	37%	0.374	33%	0.33	S	S	.	.	S	Bend	trans	-73.6	146.9	-179.1	-80.6	179.7	-150.7	0	0	112.9	S1173 N1226	S1173-E1229 PolarHBondContact N-O 2.87Å; N1226-E1229 HydrophobicContact CB-CB 4.35Å; N1226-E1229 HydrophobicContact CB-CG 3.84Å; N1226-E1229 WeakPolarHBondContact CB-OE1 3.16Å; N1226-E1229 PolarHBondContact ND2-OE1 3.08Å; N1226-E1229 PolarHBondContact O-N 3.37Å
1230	P	62.3	Low	68.3	Low	75 Å²	75	60.6 Å²	60.6	49%	0.487	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-78.6	129.9	-178.6	31.6	-33.9	0	0	0	111	T1170	T1170-P1230 VanDerWaalsContact OG1-CB 3.25Å; T1170-P1230 WeakPolarHBondContact OG1-CB 2.97Å
1231	C	67.6	Low	68	Low	10 Å²	10	61.1 Å²	61.1	7%	0.068	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-93.1	138.3	178.9	-51.9	0	0	0	0	111.5	S1173 A1176 W1220 I1221 C1222	S1173-C1231 WeakPolarHBondContact CA-SG 3.23Å; S1173-C1231 WeakPolarHBondContact CB-SG 3.48Å; A1176-C1231 HydrophobicContact CB-CB 4.21Å; W1220-C1231 HydrophobicContact CE3-CB 4.18Å; I1221-C1231 VanDerWaalsContact O-CA 3.29Å; I1221-C1231 WeakPolarHBondContact O-CA 3.28Å; I1221-C1231 VanDerWaalsContact O-CB 3.26Å; I1221-C1231 WeakPolarHBondContact O-CB 3.36Å; C1222-C1231 VanDerWaalsContact CA-SG 3.51Å; C1222-C1231 HydrophobicContact CB-CB 4.13Å; C1222-C1231 WeakPolarHBondContact CB-SG 3.29Å; C1222-C1231 WeakPolarHBondContact SG-CB 3.08Å; C1222-C1231 CovalentContact SG-SG 2.03Å; C1222-C1231 PolarHBondContact SG-SG 3.11Å
1232	S	70.6	Confident	68.2	Low	48 Å²	48	62 Å²	62	34%	0.336	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.2	167.5	53.2	0	0	0	0	109.6	I1221	I1221-S1232 PolarHBondContact N-O 3.32Å; I1221-S1232 PolarHBondContact O-N 2.82Å
1233	G	72.3	Confident	68.4	Low	0 Å²	0	62 Å²	62	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	129	163	0	0	0	0	0	108.3	V1161 F1219	V1161-G1233 PolarHBondContact N-O 3.42Å; V1161-G1233 PolarHBondContact O-N 2.92Å; F1219-G1233 CarbonylContact O-C 3.51Å; F1219-G1233 WeakPolarHBondContact O-CA 3.26Å
1234	Q	79.4	Confident	69.2	Low	75 Å²	75	61.4 Å²	61.4	35%	0.35	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	142.6	170.8	61.2	154.4	56.3	0	0	112.7	T1158 A1159 F1219 I1221	T1158-Q1234 HydrophobicContact CG2-CB 4.13Å; A1159-Q1234 WeakPolarHBondContact O-CA 3.47Å; F1219-Q1234 PolarHBondContact O-N 2.79Å; I1221-Q1234 HydrophobicContact CD1-CG 3.77Å; I1221-Q1234 VanDerWaalsContact CD1-NE2 3.34Å; I1221-Q1234 HydrophobicContact CG1-CG 3.86Å
1235	F	76.4	Confident	70	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	153.3	172.8	60.2	-77	0	0	0	110.3	L1145 A1159 V1161 I1183 V1209 P1210 F1219 V1237 L1247 I1249	L1145-F1235 HydrophobicContact CD1-CZ 4.43Å; A1159-F1235 HydrophobicContact CB-CD1 3.93Å; A1159-F1235 HydrophobicContact CB-CD2 4.04Å; A1159-F1235 HydrophobicContact CB-CE1 3.47Å; A1159-F1235 VanDerWaalsContact CB-CE1 3.47Å; A1159-F1235 HydrophobicContact CB-CE2 3.64Å; A1159-F1235 HydrophobicContact CB-CG 4.19Å; A1159-F1235 HydrophobicContact CB-CZ 3.32Å; A1159-F1235 PolarHBondContact N-O 3.22Å; A1159-F1235 PolarHBondContact O-N 2.85Å; V1161-F1235 HydrophobicContact CG2-CD1 4.13Å; V1161-F1235 HydrophobicContact CG2-CE1 3.67Å; I1183-F1235 HydrophobicContact CD1-CB 4.37Å; I1183-F1235 HydrophobicContact CD1-CD1 4.05Å; I1183-F1235 HydrophobicContact CD1-CD2 3.73Å; I1183-F1235 HydrophobicContact CD1-CE1 4.26Å; I1183-F1235 HydrophobicContact CD1-CE2 3.92Å; I1183-F1235 HydrophobicContact CD1-CG 3.79Å; I1183-F1235 HydrophobicContact CD1-CZ 4.19Å; I1183-F1235 HydrophobicContact CG1-CE2 4.35Å; I1183-F1235 HydrophobicContact CG1-CZ 4.29Å; I1183-F1235 HydrophobicContact CG2-CD2 4.47Å; I1183-F1235 HydrophobicContact CG2-CE2 3.68Å; I1183-F1235 HydrophobicContact CG2-CZ 3.94Å; V1209-F1235 HydrophobicContact CG1-CD2 4.49Å; P1210-F1235 HydrophobicContact CG-CB 4.04Å; F1219-F1235 HydrophobicContact CD1-CB 4.01Å; F1219-F1235 HydrophobicContact CE1-CB 4.2Å; F1235-V1237 HydrophobicContact CD2-CG2 3.76Å; F1235-V1237 HydrophobicContact CE2-CG2 3.38Å; F1235-V1237 HydrophobicContact CZ-CG2 4.3Å; F1235-L1247 HydrophobicContact CE2-CD2 4.48Å; F1235-L1247 HydrophobicContact CZ-CD2 4.46Å; F1235-I1249 HydrophobicContact CE1-CD1 3.46Å; F1235-I1249 VanDerWaalsContact CE1-CD1 3.46Å; F1235-I1249 HydrophobicContact CE1-CG1 4.28Å; F1235-I1249 HydrophobicContact CZ-CD1 3.69Å; F1235-I1249 HydrophobicContact CZ-CG1 4.08Å
1236	T	79.5	Confident	71.2	Confident	62 Å²	62	56.5 Å²	56.5	38%	0.38	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	123.8	176.4	47.3	0	0	0	0	110.4	P1210	P1210-T1236 WeakPolarHBondContact CD-O 3.32Å
1237	V	79.3	Confident	72.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.5	172	176	0	0	0	0	107.9	I1151 E1156 V1157 A1159 L1207 F1235 L1247 I1271	I1151-V1237 HydrophobicContact CD1-CG1 4Å; E1156-V1237 WeakPolarHBondContact CA-O 3.41Å; V1157-V1237 PolarHBondContact N-O 2.91Å; V1157-V1237 PolarHBondContact O-N 2.83Å; A1159-V1237 HydrophobicContact CB-CG2 3.82Å; L1207-V1237 HydrophobicContact CB-CG1 4.42Å; L1207-V1237 HydrophobicContact CD1-CG1 4.22Å; L1207-V1237 HydrophobicContact CD2-CG1 3.79Å; L1207-V1237 HydrophobicContact CG-CG1 4.37Å; F1235-V1237 HydrophobicContact CD2-CG2 3.76Å; F1235-V1237 HydrophobicContact CE2-CG2 3.38Å; F1235-V1237 HydrophobicContact CZ-CG2 4.3Å; V1237-L1247 HydrophobicContact CG2-CD2 3.86Å; V1237-I1271 HydrophobicContact CG1-CD1 4.48Å
1238	R	80.7	Confident	73.8	Confident	68 Å²	68	49.3 Å²	49.3	26%	0.257	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.9	179.7	-176.7	179.4	-144.5	131.6	4.4	111.8	G1154 D1155 E1156 L1207 R1208 I1240	G1154-R1238 PolarHBondContact O-NE 2.66Å; G1154-R1238 PolarHBondContact O-NH2 2.97Å; D1155-R1238 WeakPolarHBondContact O-CA 3.22Å; E1156-R1238 HydrophobicContact CG-CB 3.84Å; E1156-R1238 HydrophobicContact CG-CG 3.83Å; E1156-R1238 WeakPolarHBondContact OE1-CD 2.83Å; E1156-R1238 IonicContact OE1-CZ 3.57Å; E1156-R1238 IonicContact OE1-NE 3.59Å; E1156-R1238 IonicContact OE1-NH1 3.56Å; E1156-R1238 PolarHBondContact OE1-NH1 3.03Å; L1207-R1238 CarbonylContact C-O 3.59Å; L1207-R1238 WeakPolarHBondContact CA-O 3.48Å; R1208-R1238 HydrophobicContact CB-CB 4.25Å; R1208-R1238 PolarHBondContact N-O 2.86Å; R1208-R1238 PolarHBondContact O-N 3.39Å; R1238-I1240 HydrophobicContact CG-CG2 4.01Å; R1238-I1240 PolarHBondContact O-N 3.1Å
1239	G	75.9	Confident	74.7	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	120.6	165.8	0	0	0	0	0	111	G1154 D1155	G1154-G1239 WeakPolarHBondContact CA-O 3.31Å; G1154-G1239 PolarHBondContact N-O 3.39Å; D1155-G1239 PolarHBondContact O-N 3.23Å
1240	I	73	Confident	75.2	Confident	79 Å²	79	37.3 Å²	37.3	41%	0.405	21%	0.209	S	C	.	.			trans	-122.1	-19.6	179.5	55.8	155.7	0	0	0	115.1	L1153 R1205 I1206 R1208 R1238	L1153-I1240 VanDerWaalsContact CD1-C 3.44Å; R1205-I1240 HydrophobicContact CB-CD1 3.85Å; R1205-I1240 WeakPolarHBondContact O-CD1 3.36Å; R1205-I1240 WeakPolarHBondContact O-CG1 3.46Å; I1206-I1240 WeakPolarHBondContact O-CG1 3.32Å; I1206-I1240 PolarHBondContact O-N 2.79Å; R1208-I1240 HydrophobicContact CB-CB 4.33Å; R1208-I1240 HydrophobicContact CB-CD1 3.81Å; R1208-I1240 HydrophobicContact CB-CG1 3.88Å; R1208-I1240 HydrophobicContact CB-CG2 3.52Å; R1238-I1240 HydrophobicContact CG-CG2 4.01Å; R1238-I1240 PolarHBondContact O-N 3.1Å
1241	A	67.6	Low	75.8	Confident	23 Å²	23	33.7 Å²	33.7	19%	0.19	19%	0.186	C	C	.	.	S	Bend	trans	-138.1	154.4	167.3	0	0	0	0	0	110.1	R1205 I1206 V1273	R1205-A1241 WeakPolarHBondContact O-CB 3.38Å; I1206-A1241 PolarHBondContact O-N 2.93Å; I1206-A1241 VanDerWaalsContact O-N 3.15Å; A1241-V1273 VanDerWaalsContact O-CG1 3.24Å; A1241-V1273 WeakPolarHBondContact O-CG1 3.4Å
1242	L	74.6	Confident	76	Confident	106 Å²	106	38 Å²	38	56%	0.555	21%	0.207	S	C	*	.	S	Bend	trans	-73.1	133.2	-179.5	-61.8	175.2	0	0	0	111.2	L1153 A1275	L1153-L1242 HydrophobicContact CB-CD2 3.94Å; L1153-L1242 HydrophobicContact CD1-CD2 4.26Å; L1153-L1242 HydrophobicContact CD2-CD2 3.86Å; L1153-L1242 HydrophobicContact CD2-CG 4.19Å; L1153-L1242 HydrophobicContact CG-CD2 4.23Å; L1242-A1275 HydrophobicContact CD1-CB 4.32Å; L1242-A1275 HydrophobicContact CD2-CB 3.74Å; L1242-A1275 VanDerWaalsContact CD2-N 3.31Å
1243	G	72.7	Confident	75.8	Confident	26 Å²	26	36.2 Å²	36.2	27%	0.268	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	156	172.8	176.9	0	0	0	0	0	113.3	V1273	G1243-V1273 PolarHBondContact N-O 2.88Å; G1243-V1273 VanDerWaalsContact N-O 3.09Å; G1243-V1273 WeakPolarHBondContact O-CA 3.43Å; G1243-V1273 WeakPolarHBondContact O-CB 3.32Å; G1243-V1273 PolarHBondContact O-N 2.93Å
1244	T	75.8	Confident	75.2	Confident	84 Å²	84	38.1 Å²	38.1	52%	0.515	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	135.2	168.6	48	0	0	0	0	109.7	I1206 Q1272	I1206-T1244 WeakPolarHBondContact CD1-O 3.43Å; T1244-Q1272 HydrophobicContact CG2-CB 4.37Å; T1244-Q1272 HydrophobicContact CG2-CG 4.36Å
1245	S	72.2	Confident	73.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	140.9	-179	-171.6	0	0	0	0	113.3	D1186 I1271	D1186-S1245 WeakPolarHBondContact OD2-CA 3.47Å; D1186-S1245 WeakPolarHBondContact OD2-CB 3.29Å; D1186-S1245 PolarHBondContact OD2-OG 2.93Å; S1245-I1271 PolarHBondContact N-O 2.72Å; S1245-I1271 PolarHBondContact O-N 2.92Å
1246	K	79.2	Confident	72.8	Confident	98 Å²	98	37.5 Å²	37.5	43%	0.426	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	113.5	-179.3	-64.9	-177.2	-179.9	-175.3	0	110.3	S1185 D1186 V1268 E1270	S1185-K1246 WeakPolarHBondContact CA-O 3.39Å; D1186-K1246 PolarHBondContact OD1-N 2.89Å; D1186-K1246 PolarHBondContact OD2-N 2.99Å; K1246-V1268 HydrophobicContact CB-CG1 3.99Å; K1246-V1268 HydrophobicContact CD-CG1 4.49Å; K1246-V1268 HydrophobicContact CG-CG1 4.36Å; K1246-E1270 WeakPolarHBondContact CE-OE1 3.11Å; K1246-E1270 IonicContact NZ-OE1 3.08Å
1247	L	81	Confident	71.4	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	125.7	174.3	-172.7	70	0	0	0	110	L1145 V1147 I1183 I1184 L1207 V1209 F1235 V1237 V1269 I1271	L1145-L1247 HydrophobicContact CD1-CD2 4.45Å; L1145-L1247 HydrophobicContact CD2-CD2 4.09Å; L1145-L1247 HydrophobicContact CD2-CG 4.04Å; V1147-L1247 HydrophobicContact CG2-CD2 3.95Å; I1183-L1247 HydrophobicContact CG2-CD1 3.81Å; I1184-L1247 WeakPolarHBondContact O-CA 3.28Å; L1207-L1247 HydrophobicContact CD1-CB 4.27Å; L1207-L1247 HydrophobicContact CD1-CD1 4.37Å; V1209-L1247 HydrophobicContact CG2-CD1 4.39Å; F1235-L1247 HydrophobicContact CE2-CD2 4.48Å; F1235-L1247 HydrophobicContact CZ-CD2 4.46Å; V1237-L1247 HydrophobicContact CG2-CD2 3.86Å; L1247-V1269 PolarHBondContact N-O 2.77Å; L1247-V1269 PolarHBondContact O-N 2.79Å; L1247-I1271 HydrophobicContact CB-CD1 3.69Å; L1247-I1271 HydrophobicContact CB-CG1 4.42Å; L1247-I1271 HydrophobicContact CD2-CD1 3.71Å; L1247-I1271 HydrophobicContact CG-CD1 4.34Å
1248	M	83.5	Confident	70.1	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.059	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.3	172	177.3	-171.3	-77.8	0	0	108.6	I1184 T1250 Q1265 V1268	I1184-M1248 PolarHBondContact N-O 3.11Å; I1184-M1248 PolarHBondContact O-N 2.8Å; M1248-T1250 HydrophobicContact CG-CG2 4.17Å; M1248-T1250 HydrophobicContact SD-CG2 3.75Å; M1248-Q1265 HydrophobicContact CE-CB 4.19Å; M1248-Q1265 HydrophobicContact CE-CG 4.3Å; M1248-Q1265 VanDerWaalsContact CE-OE1 3.25Å; M1248-Q1265 HydrophobicContact CG-CB 4.39Å; M1248-Q1265 HydrophobicContact SD-CB 3.94Å; M1248-Q1265 VanDerWaalsContact SD-CD 3.56Å; M1248-Q1265 HydrophobicContact SD-CG 3.86Å; M1248-V1268 HydrophobicContact CE-CG2 3.48Å; M1248-V1268 VanDerWaalsContact CE-CG2 3.48Å
1249	I	78.7	Confident	68.6	Low	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	138.2	164	-57.3	172.6	0	0	0	108	L1143 L1145 V1161 L1181 F1235 Q1265 S1266	L1143-I1249 HydrophobicContact CD1-CG2 4.11Å; L1145-I1249 HydrophobicContact CD1-CD1 3.82Å; L1145-I1249 HydrophobicContact CD1-CG1 4.43Å; L1145-I1249 HydrophobicContact CD2-CG1 4.32Å; V1161-I1249 HydrophobicContact CB-CD1 4.31Å; V1161-I1249 HydrophobicContact CG1-CD1 4.02Å; V1161-I1249 HydrophobicContact CG2-CD1 3.34Å; L1181-I1249 HydrophobicContact CD2-CG2 4.11Å; F1235-I1249 HydrophobicContact CE1-CD1 3.46Å; F1235-I1249 VanDerWaalsContact CE1-CD1 3.46Å; F1235-I1249 HydrophobicContact CE1-CG1 4.28Å; F1235-I1249 HydrophobicContact CZ-CD1 3.69Å; F1235-I1249 HydrophobicContact CZ-CG1 4.08Å; I1249-Q1265 CarbonylContact O-C 3.54Å; I1249-Q1265 WeakPolarHBondContact O-CA 3.28Å; I1249-S1266 PolarHBondContact N-OG 2.83Å; I1249-S1266 PolarHBondContact O-N 3.11Å
1250	T	77.4	Confident	67.2	Low	7 Å²	7	51.4 Å²	51.4	4%	0.043	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.5	169.1	59.3	0	0	0	0	108.3	S1182 I1184 M1248 V1264 Q1265	S1182-T1250 WeakPolarHBondContact CA-O 3.18Å; S1182-T1250 WeakPolarHBondContact CB-O 3.23Å; S1182-T1250 VanDerWaalsContact CB-OG1 3.31Å; S1182-T1250 WeakPolarHBondContact CB-OG1 3.49Å; S1182-T1250 PolarHBondContact N-O 3.04Å; S1182-T1250 PolarHBondContact O-N 2.77Å; S1182-T1250 VanDerWaalsContact O-O 3.1Å; S1182-T1250 PolarHBondContact O-OG1 3.38Å; S1182-T1250 PolarHBondContact OG-OG1 2.68Å; I1184-T1250 HydrophobicContact CD1-CG2 3.67Å; M1248-T1250 HydrophobicContact CG-CG2 4.17Å; M1248-T1250 HydrophobicContact SD-CG2 3.75Å; T1250-V1264 WeakPolarHBondContact CA-O 3.16Å; T1250-Q1265 HydrophobicContact CG2-CG 4.21Å
1251	S	74.5	Confident	66.6	Low	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.5	157.4	-170.8	0	0	0	0	107.6	L1179 V1253 V1264	L1179-S1251 WeakPolarHBondContact CD2-OG 3.23Å; S1251-V1253 PolarHBondContact O-N 2.84Å; S1251-V1264 PolarHBondContact N-O 2.88Å; S1251-V1264 PolarHBondContact O-N 2.96Å
1252	I	71.1	Confident	66.4	Low	101 Å²	101	53.8 Å²	53.8	52%	0.518	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	108.9	168	-68.3	168.8	0	0	0	106.7	P1261 T1263	I1252-P1261 HydrophobicContact CG2-CB 3.62Å; I1252-T1263 HydrophobicContact CG1-CG2 3.87Å
1253	V	68	Low	66.1	Low	9 Å²	9	51.8 Å²	51.8	6%	0.055	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	155	163.5	-78.8	0	0	0	0	109	L1140 L1179 S1251 G1255 I1262 V1264	L1140-V1253 HydrophobicContact CB-CG1 4.25Å; L1140-V1253 HydrophobicContact CD2-CG1 4.18Å; L1179-V1253 HydrophobicContact CD2-CG1 3.74Å; S1251-V1253 PolarHBondContact O-N 2.84Å; V1253-G1255 PolarHBondContact O-N 3.33Å; V1253-I1262 HydrophobicContact CG2-CB 4.47Å; V1253-I1262 WeakPolarHBondContact CG2-O 3.46Å; V1253-I1262 PolarHBondContact N-O 3.48Å; V1253-I1262 PolarHBondContact O-N 3.17Å; V1253-V1264 HydrophobicContact CG2-CB 4.49Å; V1253-V1264 HydrophobicContact CG2-CG2 3.58Å
1254	P	58.7	Low	66	Low	40 Å²	40	51.6 Å²	51.6	26%	0.26	28%	0.282	S	S	.	.			trans	-58.2	141.4	170.2	-15	28.9	0	0	0	109.2	Y1036	Y1036-P1254 HydrophobicContact CD2-CG 4.46Å; Y1036-P1254 HydrophobicContact CE1-CB 4.44Å; Y1036-P1254 WeakPolarHBondContact CE1-O 3.18Å; Y1036-P1254 HydrophobicContact CE2-CB 3.78Å; Y1036-P1254 HydrophobicContact CE2-CG 4.09Å; Y1036-P1254 PolarHBondContact OH-O 3.08Å
1255	G	53.2	Low	66.1	Low	1 Å²	1	51.9 Å²	51.9	1%	0.01	28%	0.278	C	S	.	.			trans	-77.5	131.6	-172.4	0	0	0	0	0	113.7	Y1036 V1253 L1257 K1260	Y1036-G1255 PolarHBondContact OH-O 2.61Å; Y1036-G1255 VanDerWaalsContact OH-O 3.07Å; V1253-G1255 PolarHBondContact O-N 3.33Å; G1255-L1257 PolarHBondContact O-N 2.93Å; G1255-K1260 WeakPolarHBondContact CA-O 3.18Å; G1255-K1260 PolarHBondContact N-O 2.99Å; G1255-K1260 VanDerWaalsContact N-O 3.16Å
1256	L	52.9	Low	66.5	Low	70 Å²	70	52.2 Å²	52.2	37%	0.366	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-18.7	170.9	-87.3	171.3	0	0	0	114.5	Y1036 H1066 H1100 V1101 I1262	Y1036-L1256 HydrophobicContact CE1-CD2 4.38Å; Y1036-L1256 HydrophobicContact CE1-CG 4.37Å; H1066-L1256 PolarHBondContact CD2-O 3.29Å; H1066-L1256 VanDerWaalsContact CD2-O 3.27Å; H1066-L1256 PolarHBondContact NE2-O 3.12Å; H1100-L1256 HydrophobicContact CB-CD2 4.42Å; H1100-L1256 PolarHBondContact CD2-O 2.75Å; H1100-L1256 VanDerWaalsContact CD2-O 3.26Å; V1101-L1256 HydrophobicContact CB-CD2 3.87Å; V1101-L1256 HydrophobicContact CG2-CD2 3.72Å; V1101-L1256 HydrophobicContact CG2-CG 4.4Å; L1256-I1262 HydrophobicContact CB-CD1 4.1Å
1257	L	49.9	Very low	66.6	Low	92 Å²	92	51 Å²	51	48%	0.482	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	138.2	169	-72.1	105.4	0	0	0	111.3	H1066 G1255 G1259	H1066-L1257 WeakPolarHBondContact NE2-CG 2.98Å; G1255-L1257 PolarHBondContact O-N 2.93Å; L1257-G1259 VanDerWaalsContact C-N 3.27Å; L1257-G1259 PolarHBondContact O-N 3.26Å; L1257-G1259 VanDerWaalsContact O-N 3.1Å
1258	Y	50.6	Low	66.5	Low	146 Å²	146	54.7 Å²	54.7	57%	0.573	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	18.3	166.9	-59.1	-62.7	0	0	0	118	R594 K1260	R594-Y1258 HydrophobicContact CG-CE1 4.36Å; Y1258-K1260 PolarHBondContact O-N 3.26Å
1259	G	49.6	Very low	66.3	Low	65 Å²	65	54.9 Å²	54.9	67%	0.67	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	0.7	170.5	0	0	0	0	0	115.9	L1257	L1257-G1259 VanDerWaalsContact C-N 3.27Å; L1257-G1259 PolarHBondContact O-N 3.26Å; L1257-G1259 VanDerWaalsContact O-N 3.1Å
1260	K	47.6	Very low	66.3	Low	119 Å²	119	60.2 Å²	60.2	52%	0.517	33%	0.327	S	S	.	.			trans	-59.2	132	162.5	-75.8	-179.4	175.8	174.7	0	107.6	G1255 Y1258 I1262	G1255-K1260 WeakPolarHBondContact CA-O 3.18Å; G1255-K1260 PolarHBondContact N-O 2.99Å; G1255-K1260 VanDerWaalsContact N-O 3.16Å; Y1258-K1260 PolarHBondContact O-N 3.26Å; K1260-I1262 PolarHBondContact O-N 2.85Å; K1260-I1262 VanDerWaalsContact O-N 3.14Å
1261	P	59	Low	66.4	Low	85 Å²	85	59.9 Å²	59.9	55%	0.552	33%	0.325	S	S	*	.			trans	-58.7	120.9	171.5	22.5	-31.1	0	0	0	109.3	I1252 T1263	I1252-P1261 HydrophobicContact CG2-CB 3.62Å; P1261-T1263 PolarHBondContact O-N 3.04Å
1262	I	63.4	Low	66.7	Low	67 Å²	67	61.4 Å²	61.4	34%	0.344	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	110.9	168.4	-72.5	176.1	0	0	0	106.3	V1253 L1256 K1260 V1264	V1253-I1262 HydrophobicContact CG2-CB 4.47Å; V1253-I1262 WeakPolarHBondContact CG2-O 3.46Å; V1253-I1262 PolarHBondContact N-O 3.48Å; V1253-I1262 PolarHBondContact O-N 3.17Å; L1256-I1262 HydrophobicContact CB-CD1 4.1Å; K1260-I1262 PolarHBondContact O-N 2.85Å; K1260-I1262 VanDerWaalsContact O-N 3.14Å; I1262-V1264 VanDerWaalsContact C-N 3.34Å; I1262-V1264 HydrophobicContact CG2-CG2 3.96Å; I1262-V1264 PolarHBondContact O-N 2.97Å; I1262-V1264 VanDerWaalsContact O-N 3.08Å
1263	T	69	Low	67.1	Low	65 Å²	65	56.7 Å²	56.7	40%	0.399	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	95.1	159.4	37.6	0	0	0	0	107.7	I1252 P1261 Q1265	I1252-T1263 HydrophobicContact CG1-CG2 3.87Å; P1261-T1263 PolarHBondContact O-N 3.04Å; T1263-Q1265 WeakPolarHBondContact O-CG 3.23Å; T1263-Q1265 PolarHBondContact O-N 3.3Å
1264	V	71.7	Confident	67.7	Low	21 Å²	21	56.8 Å²	56.8	13%	0.127	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	111.3	164.8	173.8	0	0	0	0	105.8	L1140 L1143 T1250 S1251 V1253 I1262	L1140-V1264 HydrophobicContact CD2-CB 3.81Å; L1140-V1264 HydrophobicContact CD2-CG1 3.91Å; L1140-V1264 HydrophobicContact CD2-CG2 4.03Å; L1140-V1264 HydrophobicContact CG-CB 4.38Å; L1140-V1264 HydrophobicContact CG-CG1 4.1Å; L1140-V1264 HydrophobicContact CG-CG2 4.29Å; L1143-V1264 HydrophobicContact CD1-CG1 4.28Å; L1143-V1264 WeakPolarHBondContact CD1-O 2.97Å; L1143-V1264 HydrophobicContact CG-CG1 4.01Å; T1250-V1264 WeakPolarHBondContact CA-O 3.16Å; S1251-V1264 PolarHBondContact N-O 2.88Å; S1251-V1264 PolarHBondContact O-N 2.96Å; V1253-V1264 HydrophobicContact CG2-CB 4.49Å; V1253-V1264 HydrophobicContact CG2-CG2 3.58Å; I1262-V1264 VanDerWaalsContact C-N 3.34Å; I1262-V1264 HydrophobicContact CG2-CG2 3.96Å; I1262-V1264 PolarHBondContact O-N 2.97Å; I1262-V1264 VanDerWaalsContact O-N 3.08Å
1265	Q	76.1	Confident	68.6	Low	91 Å²	91	56.3 Å²	56.3	43%	0.425	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	144.7	178.3	-54	-169.8	-25.7	0	0	109.3	M1248 I1249 T1250 T1263	M1248-Q1265 HydrophobicContact CE-CB 4.19Å; M1248-Q1265 HydrophobicContact CE-CG 4.3Å; M1248-Q1265 VanDerWaalsContact CE-OE1 3.25Å; M1248-Q1265 HydrophobicContact CG-CB 4.39Å; M1248-Q1265 HydrophobicContact SD-CB 3.94Å; M1248-Q1265 VanDerWaalsContact SD-CD 3.56Å; M1248-Q1265 HydrophobicContact SD-CG 3.86Å; I1249-Q1265 CarbonylContact O-C 3.54Å; I1249-Q1265 WeakPolarHBondContact O-CA 3.28Å; T1250-Q1265 HydrophobicContact CG2-CG 4.21Å; T1263-Q1265 WeakPolarHBondContact O-CG 3.23Å; T1263-Q1265 PolarHBondContact O-N 3.3Å
1266	S	81.5	Confident	69.8	Low	8 Å²	8	57.1 Å²	57.1	6%	0.056	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-71.7	167.6	161.6	70.9	0	0	0	0	111	L1143 I1249 V1268	L1143-S1266 VanDerWaalsContact O-CA 3.31Å; L1143-S1266 WeakPolarHBondContact O-CA 3.37Å; I1249-S1266 PolarHBondContact N-OG 2.83Å; I1249-S1266 PolarHBondContact O-N 3.11Å; S1266-V1268 PolarHBondContact O-N 3.22Å
1267	N	81.9	Confident	71.2	Confident	72 Å²	72	54 Å²	54	39%	0.385	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-51	140.7	154.7	57.5	-68.9	0	0	0	110	L1145	L1145-N1267 PolarHBondContact N-OD1 2.79Å; L1145-N1267 PolarHBondContact O-ND2 3.48Å; L1145-N1267 PolarHBondContact O-OD1 3.17Å
1268	V	78.5	Confident	72.6	Confident	77 Å²	77	56.8 Å²	56.8	47%	0.467	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-80.7	129.2	174.6	-179.7	0	0	0	0	108.6	K1246 M1248 S1266	K1246-V1268 HydrophobicContact CB-CG1 3.99Å; K1246-V1268 HydrophobicContact CD-CG1 4.49Å; K1246-V1268 HydrophobicContact CG-CG1 4.36Å; M1248-V1268 HydrophobicContact CE-CG2 3.48Å; M1248-V1268 VanDerWaalsContact CE-CG2 3.48Å; S1266-V1268 PolarHBondContact O-N 3.22Å
1269	V	78.5	Confident	74	Confident	16 Å²	16	50.1 Å²	50.1	10%	0.097	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	116.5	168.9	-173.6	0	0	0	0	107.7	L1145 V1147 L1247 I1271	L1145-V1269 HydrophobicContact CD2-CG2 4.01Å; L1145-V1269 HydrophobicContact CG-CG2 3.99Å; V1147-V1269 HydrophobicContact CB-CG1 4.39Å; L1247-V1269 PolarHBondContact N-O 2.77Å; L1247-V1269 PolarHBondContact O-N 2.79Å; V1269-I1271 HydrophobicContact CB-CG1 4.32Å; V1269-I1271 HydrophobicContact CG1-CD1 4.38Å; V1269-I1271 HydrophobicContact CG1-CG1 3.78Å; V1269-I1271 PolarHBondContact O-N 3.45Å
1270	E	78.5	Confident	75.2	Confident	113 Å²	113	49.7 Å²	49.7	53%	0.528	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.2	169.1	-173.2	155.9	-123.7	0	0	108.3	K1246	K1246-E1270 WeakPolarHBondContact CE-OE1 3.11Å; K1246-E1270 IonicContact NZ-OE1 3.08Å
1271	I	79.2	Confident	76.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	115.5	-173.4	-62.2	179.4	0	0	0	108.9	V1147 N1149 I1151 L1207 V1237 S1245 L1247 V1269 V1273	V1147-I1271 HydrophobicContact CB-CD1 4.44Å; V1147-I1271 HydrophobicContact CG1-CD1 3.61Å; V1147-I1271 HydrophobicContact CG1-CG1 4.41Å; N1149-I1271 WeakPolarHBondContact O-CA 2.88Å; I1151-I1271 HydrophobicContact CB-CG2 4.04Å; I1151-I1271 HydrophobicContact CD1-CD1 4.26Å; I1151-I1271 HydrophobicContact CD1-CG2 3.69Å; I1151-I1271 HydrophobicContact CG1-CG2 3.71Å; L1207-I1271 HydrophobicContact CD1-CB 4.42Å; L1207-I1271 HydrophobicContact CD1-CD1 4.07Å; L1207-I1271 HydrophobicContact CD2-CG2 4.01Å; V1237-I1271 HydrophobicContact CG1-CD1 4.48Å; S1245-I1271 PolarHBondContact N-O 2.72Å; S1245-I1271 PolarHBondContact O-N 2.92Å; L1247-I1271 HydrophobicContact CB-CD1 3.69Å; L1247-I1271 HydrophobicContact CB-CG1 4.42Å; L1247-I1271 HydrophobicContact CD2-CD1 3.71Å; L1247-I1271 HydrophobicContact CG-CD1 4.34Å; V1269-I1271 HydrophobicContact CB-CG1 4.32Å; V1269-I1271 HydrophobicContact CG1-CD1 4.38Å; V1269-I1271 HydrophobicContact CG1-CG1 3.78Å; V1269-I1271 PolarHBondContact O-N 3.45Å; I1271-V1273 HydrophobicContact CG2-CG2 4.42Å; I1271-V1273 PolarHBondContact O-N 3.45Å
1272	Q	80.9	Confident	77.1	Confident	31 Å²	31	44.5 Å²	44.5	15%	0.145	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	113.6	167.8	-178.9	164.2	51.4	0	0	110.2	N1149 Q1150 I1151 T1244 F1274 P1300 S1301	N1149-Q1272 PolarHBondContact O-N 2.98Å; Q1150-Q1272 HydrophobicContact CG-CB 4.49Å; I1151-Q1272 PolarHBondContact N-O 2.83Å; I1151-Q1272 VanDerWaalsContact O-O 3.07Å; T1244-Q1272 HydrophobicContact CG2-CB 4.37Å; T1244-Q1272 HydrophobicContact CG2-CG 4.36Å; Q1272-F1274 HydrophobicContact CG-CB 4.19Å; Q1272-F1274 PolarHBondContact O-N 2.75Å; Q1272-P1300 VanDerWaalsContact OE1-CB 3.25Å; Q1272-S1301 PolarHBondContact NE2-OG 3.38Å
1273	V	79.7	Confident	77.5	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	96.6	164.8	-176.1	0	0	0	0	109.1	I1151 L1153 I1206 L1207 A1241 G1243 I1271	I1151-V1273 VanDerWaalsContact O-CA 3.26Å; I1151-V1273 WeakPolarHBondContact O-CA 3.45Å; L1153-V1273 HydrophobicContact CB-CG1 4.27Å; L1153-V1273 HydrophobicContact CD1-CG1 3.97Å; I1206-V1273 HydrophobicContact CG2-CB 3.77Å; I1206-V1273 HydrophobicContact CG2-CG2 3.49Å; I1206-V1273 VanDerWaalsContact CG2-CG2 3.49Å; L1207-V1273 HydrophobicContact CD2-CG2 3.39Å; L1207-V1273 HydrophobicContact CG-CG2 4.35Å; A1241-V1273 VanDerWaalsContact O-CG1 3.24Å; A1241-V1273 WeakPolarHBondContact O-CG1 3.4Å; G1243-V1273 PolarHBondContact N-O 2.88Å; G1243-V1273 VanDerWaalsContact N-O 3.09Å; G1243-V1273 WeakPolarHBondContact O-CA 3.43Å; G1243-V1273 WeakPolarHBondContact O-CB 3.32Å; G1243-V1273 PolarHBondContact O-N 2.93Å; I1271-V1273 HydrophobicContact CG2-CG2 4.42Å; I1271-V1273 PolarHBondContact O-N 3.45Å
1274	F	81	Confident	77.7	Confident	10 Å²	10	44.4 Å²	44.4	4%	0.044	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	153.9	180	63.2	-87.7	0	0	0	111.5	Q1150 I1151 Q1152 L1153 Q1272 G1299 P1300 Y1365	Q1150-F1274 HydrophobicContact CB-CD1 4.18Å; Q1150-F1274 HydrophobicContact CB-CE1 3.78Å; I1151-F1274 VanDerWaalsContact C-CE1 3.43Å; I1151-F1274 WeakPolarHBondContact O-CD1 3.33Å; I1151-F1274 WeakPolarHBondContact O-CE1 3.43Å; I1151-F1274 PolarHBondContact O-N 3.17Å; Q1152-F1274 CarbonylContact C-O 3.48Å; Q1152-F1274 HydrophobicContact CB-CE2 4.01Å; Q1152-F1274 HydrophobicContact CB-CZ 3.9Å; Q1152-F1274 HydrophobicContact CG-CE2 4.43Å; L1153-F1274 PolarHBondContact N-O 2.79Å; Q1272-F1274 HydrophobicContact CG-CB 4.19Å; Q1272-F1274 PolarHBondContact O-N 2.75Å; F1274-G1299 WeakPolarHBondContact CB-O 3.43Å; F1274-P1300 HydrophobicContact CB-CB 4.47Å; F1274-P1300 HydrophobicContact CD1-CB 3.98Å; F1274-P1300 HydrophobicContact CD1-CG 4.13Å; F1274-P1300 HydrophobicContact CD2-CG 4.35Å; F1274-P1300 HydrophobicContact CE1-CB 4.43Å; F1274-P1300 HydrophobicContact CE1-CG 4.14Å; F1274-P1300 HydrophobicContact CE2-CG 4.4Å; F1274-P1300 HydrophobicContact CG-CB 4.12Å; F1274-P1300 HydrophobicContact CG-CG 4.26Å; F1274-P1300 HydrophobicContact CZ-CG 4.29Å; F1274-Y1365 WeakPolarHBondContact CZ-O 3.43Å
1275	A	77.1	Confident	77.9	Confident	31 Å²	31	43.9 Å²	43.9	26%	0.256	23%	0.231	S	C	.	.			trans	-70	137.5	172.2	0	0	0	0	0	108.8	L1242 L1277 G1298 G1299	L1242-A1275 HydrophobicContact CD1-CB 4.32Å; L1242-A1275 HydrophobicContact CD2-CB 3.74Å; L1242-A1275 VanDerWaalsContact CD2-N 3.31Å; A1275-L1277 PolarHBondContact O-N 3.38Å; A1275-G1298 CarbonylContact O-C 2.88Å; A1275-G1298 VanDerWaalsContact O-CA 3.26Å; A1275-G1298 WeakPolarHBondContact O-CA 3.38Å; A1275-G1299 PolarHBondContact O-N 3.1Å
1276	P	79.9	Confident	78	Confident	17 Å²	17	39.9 Å²	39.9	11%	0.11	21%	0.213	C	C	.	.			trans	-44.2	133	178	-23.9	22.7	0	0	0	111.8	Q1152 R1278	Q1152-P1276 HydrophobicContact CG-CB 3.77Å; Q1152-P1276 HydrophobicContact CG-CG 3.52Å; Q1152-P1276 VanDerWaalsContact OE1-CA 3.26Å; P1276-R1278 HydrophobicContact CB-CG 4.31Å; P1276-R1278 WeakPolarHBondContact O-CG 3.42Å; P1276-R1278 PolarHBondContact O-N 2.84Å; P1276-R1278 VanDerWaalsContact O-N 3.08Å
1277	L	81.7	Confident	77.9	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	21%	0.21	C	C	.	.			trans	-61.4	119.4	173.8	-177.3	64.8	0	0	0	107.7	A1275 A1296 L1305 A1341 A1343 S1366 T1368	A1275-L1277 PolarHBondContact O-N 3.38Å; L1277-A1296 HydrophobicContact CD1-CB 4.26Å; L1277-L1305 HydrophobicContact CD1-CD2 3.68Å; L1277-L1305 HydrophobicContact CD2-CD2 3.92Å; L1277-L1305 HydrophobicContact CG-CD2 4.48Å; L1277-A1341 HydrophobicContact CD2-CB 4.17Å; L1277-A1341 WeakPolarHBondContact CD2-O 3.01Å; L1277-A1343 HydrophobicContact CD2-CB 4.06Å; L1277-S1366 VanDerWaalsContact CB-OG 3.22Å; L1277-S1366 WeakPolarHBondContact CB-OG 3.22Å; L1277-S1366 PolarHBondContact N-OG 3.13Å; L1277-T1368 HydrophobicContact CB-CG2 4.41Å; L1277-T1368 HydrophobicContact CD2-CG2 4.03Å; L1277-T1368 HydrophobicContact CG-CG2 3.77Å; L1277-T1368 VanDerWaalsContact O-CB 3.26Å; L1277-T1368 WeakPolarHBondContact O-CB 3.37Å
1278	R	79.3	Confident	77.9	Confident	151 Å²	151	36.3 Å²	36.3	57%	0.57	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.3	-178.2	-73.2	172.3	-179.2	-171.4	0.6	108.6	P1276 T1280 V1297	P1276-R1278 HydrophobicContact CB-CG 4.31Å; P1276-R1278 WeakPolarHBondContact O-CG 3.42Å; P1276-R1278 PolarHBondContact O-N 2.84Å; P1276-R1278 VanDerWaalsContact O-N 3.08Å; R1278-T1280 HydrophobicContact CB-CG2 4.24Å; R1278-V1297 PolarHBondContact N-O 3.32Å; R1278-V1297 PolarHBondContact O-N 3.49Å
1279	L	80.1	Confident	77.8	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.026	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	129.6	159.5	-69.6	164.6	0	0	0	107.3	P1281 C1282 L1294 H1295 A1296 F1307 I1339 A1341 T1368 C1370	L1279-P1281 CarbonylContact C-O 3.56Å; L1279-P1281 CarbonylContact O-C 3.41Å; L1279-C1282 VanDerWaalsContact O-CB 3.27Å; L1279-C1282 WeakPolarHBondContact O-CB 2.98Å; L1279-L1294 HydrophobicContact CD2-CB 4.27Å; L1279-H1295 WeakPolarHBondContact CA-O 3.43Å; L1279-A1296 HydrophobicContact CD2-CB 4.45Å; L1279-F1307 HydrophobicContact CD2-CD1 4.31Å; L1279-F1307 HydrophobicContact CD2-CE1 3.82Å; L1279-I1339 HydrophobicContact CD1-CG2 4.01Å; L1279-A1341 HydrophobicContact CD1-CB 3.87Å; L1279-A1341 HydrophobicContact CD2-CB 4.01Å; L1279-A1341 HydrophobicContact CG-CB 4.01Å; L1279-T1368 HydrophobicContact CD1-CG2 4.06Å; L1279-T1368 HydrophobicContact CG-CG2 3.85Å; L1279-C1370 HydrophobicContact CB-CB 4.07Å; L1279-C1370 HydrophobicContact CD1-CB 3.47Å; L1279-C1370 VanDerWaalsContact CD1-CB 3.47Å; L1279-C1370 HydrophobicContact CG-CB 4.4Å
1280	T	74.9	Confident	77.8	Confident	56 Å²	56	33.2 Å²	33.2	34%	0.344	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122	-178.7	57.7	0	0	0	0	109.9	R1278 H1295 V1297	R1278-T1280 HydrophobicContact CB-CG2 4.24Å; T1280-H1295 PolarHBondContact N-O 2.72Å; T1280-H1295 PolarHBondContact O-N 3.4Å; T1280-H1295 PolarHBondContact OG1-O 3.16Å; T1280-V1297 HydrophobicContact CG2-CB 4.2Å; T1280-V1297 HydrophobicContact CG2-CG2 4.16Å; T1280-V1297 WeakPolarHBondContact OG1-CG2 3.18Å
1281	P	69.6	Low	78	Confident	47 Å²	47	30 Å²	30	31%	0.305	17%	0.165	S	C	.	.	S	Bend	cis	-69.2	173.1	-8.9	35.3	-37.4	0	0	0	112	L1279 F1284 Y1292 L1294	L1279-P1281 CarbonylContact C-O 3.56Å; L1279-P1281 CarbonylContact O-C 3.41Å; P1281-F1284 HydrophobicContact CG-CD1 4.13Å; P1281-F1284 HydrophobicContact CG-CE1 4.32Å; P1281-F1284 HydrophobicContact CG-CG 4.29Å; P1281-Y1292 WeakPolarHBondContact CD-OH 3.33Å; P1281-Y1292 HydrophobicContact CG-CD1 4.4Å; P1281-Y1292 HydrophobicContact CG-CE1 3.57Å; P1281-L1294 WeakPolarHBondContact O-CD2 3.38Å
1282	C	76.9	Confident	78.1	Confident	48 Å²	48	33.4 Å²	33.4	32%	0.324	18%	0.178	S	C	.	.			trans	-149.4	164.2	171.9	-171.5	0	0	0	0	112.5	L1279 F1284 C1370	L1279-C1282 VanDerWaalsContact O-CB 3.27Å; L1279-C1282 WeakPolarHBondContact O-CB 2.98Å; C1282-F1284 PolarHBondContact O-N 2.97Å; C1282-C1370 WeakPolarHBondContact CA-SG 3.14Å; C1282-C1370 HydrophobicContact CB-CB 4.22Å; C1282-C1370 WeakPolarHBondContact CB-SG 2.86Å; C1282-C1370 WeakPolarHBondContact SG-CA 3.21Å; C1282-C1370 WeakPolarHBondContact SG-CB 3.02Å; C1282-C1370 CovalentContact SG-SG 2.04Å; C1282-C1370 PolarHBondContact SG-SG 3.41Å
1283	N	72.1	Confident	78.3	Confident	105 Å²	105	35.3 Å²	35.3	56%	0.561	19%	0.187	S	C	*	.	S	Bend	trans	54.2	37.3	-171.4	-64.6	-12.3	0	0	0	112.1	N1371	N1283-N1371 VanDerWaalsContact CA-O 3.3Å; N1283-N1371 WeakPolarHBondContact CA-O 3.01Å; N1283-N1371 PolarHBondContact N-O 3.07Å
1284	F	72.1	Confident	78.4	Confident	25 Å²	25	35.1 Å²	35.1	11%	0.11	19%	0.186	C	C	.	.			trans	-103.6	157.5	-177.9	75.7	-72.6	0	0	0	111.2	P1281 C1282 L1286 Y1292 L1294 I1328 I1372 H1373	P1281-F1284 HydrophobicContact CG-CD1 4.13Å; P1281-F1284 HydrophobicContact CG-CE1 4.32Å; P1281-F1284 HydrophobicContact CG-CG 4.29Å; C1282-F1284 PolarHBondContact O-N 2.97Å; F1284-L1286 HydrophobicContact CE2-CB 4.04Å; F1284-L1286 HydrophobicContact CE2-CD1 4.17Å; F1284-Y1292 HydrophobicContact CE2-CD1 4.36Å; F1284-Y1292 HydrophobicContact CE2-CD2 4.06Å; F1284-Y1292 AromaticContact CE2-CG 3.94Å; F1284-Y1292 HydrophobicContact CE2-CG 3.94Å; F1284-Y1292 HydrophobicContact CZ-CD1 4.12Å; F1284-Y1292 HydrophobicContact CZ-CG 4.05Å; F1284-L1294 HydrophobicContact CE1-CD2 3.88Å; F1284-L1294 HydrophobicContact CZ-CD2 4.32Å; F1284-I1328 HydrophobicContact CZ-CD1 4.46Å; F1284-I1372 HydrophobicContact CE1-CD1 4.48Å; F1284-I1372 HydrophobicContact CE1-CG1 3.87Å; F1284-I1372 HydrophobicContact CE1-CG2 4.37Å; F1284-I1372 HydrophobicContact CZ-CG1 4.44Å; F1284-I1372 HydrophobicContact CZ-CG2 4.28Å; F1284-H1373 PolarHBondContact O-N 2.71Å
1285	N	75.4	Confident	78.6	Confident	11 Å²	11	38.6 Å²	38.6	6%	0.059	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	112	179.1	-65.2	-0.5	0	0	0	108.2	H1373 V1375 S1452 I1454 V1455	N1285-H1373 CarbonylContact C-O 3.54Å; N1285-H1373 WeakPolarHBondContact CA-O 3.21Å; N1285-H1373 WeakPolarHBondContact OD1-CB 2.93Å; N1285-H1373 PolarHBondContact OD1-ND1 3.42Å; N1285-V1375 HydrophobicContact CB-CG2 3.9Å; N1285-S1452 PolarHBondContact ND2-O 2.79Å; N1285-S1452 PolarHBondContact OD1-O 3.37Å; N1285-I1454 PolarHBondContact ND2-O 3.06Å; N1285-V1455 HydrophobicContact CB-CB 4.36Å; N1285-V1455 HydrophobicContact CB-CG1 4.19Å; N1285-V1455 HydrophobicContact CB-CG2 3.92Å
1286	L	79	Confident	78.8	Confident	6 Å²	6	37.7 Å²	37.7	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.9	174.7	-176.9	63.1	0	0	0	108.1	F1284 A1290 I1328 A1330 I1372 H1373 I1374 V1375	F1284-L1286 HydrophobicContact CE2-CB 4.04Å; F1284-L1286 HydrophobicContact CE2-CD1 4.17Å; L1286-A1290 HydrophobicContact CD1-CB 3.82Å; L1286-A1290 HydrophobicContact CG-CB 4.47Å; L1286-I1328 HydrophobicContact CD2-CD1 4.12Å; L1286-A1330 HydrophobicContact CD2-CB 3.85Å; L1286-A1330 HydrophobicContact CG-CB 4.01Å; L1286-I1372 HydrophobicContact CB-CG2 3.63Å; L1286-I1372 HydrophobicContact CD2-CG2 4.16Å; L1286-H1373 PolarHBondContact N-O 2.97Å; L1286-H1373 VanDerWaalsContact O-O 3.12Å; L1286-I1374 WeakPolarHBondContact O-CA 3.37Å; L1286-V1375 PolarHBondContact O-N 2.77Å
1287	L	80.3	Confident	78.7	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	152.1	178.9	-56.2	-172.3	0	0	0	111.1	G1289 A1290 A1330 V1375 L1377 V1455 V1463 L1467 Q1529	L1287-G1289 PolarHBondContact O-N 2.88Å; L1287-A1290 HydrophobicContact CB-CB 4.29Å; L1287-A1290 VanDerWaalsContact O-CB 3.23Å; L1287-A1290 WeakPolarHBondContact O-CB 3.41Å; L1287-A1290 PolarHBondContact O-N 3.34Å; L1287-A1330 WeakPolarHBondContact O-CB 3.47Å; L1287-V1375 CarbonylContact C-O 3.44Å; L1287-V1375 VanDerWaalsContact CA-O 3.32Å; L1287-V1375 WeakPolarHBondContact CA-O 3.11Å; L1287-V1375 HydrophobicContact CD2-CG2 3.72Å; L1287-L1377 HydrophobicContact CD1-CD1 3.63Å; L1287-L1377 HydrophobicContact CD1-CG 4Å; L1287-L1377 HydrophobicContact CD2-CD1 4.44Å; L1287-L1377 HydrophobicContact CD2-CD2 4.4Å; L1287-L1377 HydrophobicContact CD2-CG 3.9Å; L1287-V1455 HydrophobicContact CD2-CG1 4.34Å; L1287-V1455 HydrophobicContact CD2-CG2 4.24Å; L1287-V1463 HydrophobicContact CB-CG1 4.43Å; L1287-V1463 HydrophobicContact CD1-CG1 4.17Å; L1287-V1463 HydrophobicContact CD1-CG2 3.84Å; L1287-V1463 HydrophobicContact CG-CG2 4.27Å; L1287-L1467 HydrophobicContact CD1-CD1 3.78Å; L1287-L1467 HydrophobicContact CD1-CG 4.45Å; L1287-Q1529 HydrophobicContact CB-CB 4.23Å; L1287-Q1529 HydrophobicContact CB-CG 3.94Å; L1287-Q1529 HydrophobicContact CD1-CB 4.13Å; L1287-Q1529 HydrophobicContact CD1-CG 4.36Å
1288	L	81.5	Confident	78.3	Confident	3 Å²	3	42 Å²	42	2%	0.016	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	140.2	170.2	-74.7	176.4	0	0	0	111.3	A1290 S1331 L1334 I1374 V1375 A1376 A1527 K1528 Q1529 I1531	L1288-A1290 PolarHBondContact O-N 3.36Å; L1288-S1331 WeakPolarHBondContact CD2-O 3.4Å; L1288-L1334 HydrophobicContact CD1-CD2 3.64Å; L1288-L1334 HydrophobicContact CD1-CG 4.11Å; L1288-L1334 HydrophobicContact CD2-CD2 4.11Å; L1288-L1334 HydrophobicContact CD2-CG 4.48Å; L1288-L1334 HydrophobicContact CG-CD2 3.79Å; L1288-I1374 HydrophobicContact CD2-CG2 3.57Å; L1288-I1374 HydrophobicContact CG-CG2 4.29Å; L1288-V1375 PolarHBondContact N-O 3.01Å; L1288-A1376 HydrophobicContact CD1-CB 4.27Å; L1288-A1527 CarbonylContact C-O 3.51Å; L1288-A1527 WeakPolarHBondContact CB-O 3.37Å; L1288-K1528 HydrophobicContact CB-CB 4.18Å; L1288-K1528 HydrophobicContact CD1-CB 3.9Å; L1288-K1528 WeakPolarHBondContact CD1-O 3.3Å; L1288-Q1529 WeakPolarHBondContact O-CG 3.37Å; L1288-I1531 HydrophobicContact CD1-CD1 3.86Å
1289	G	76.5	Confident	78.1	Confident	27 Å²	27	35.5 Å²	35.5	28%	0.278	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	-12	-178.2	0	0	0	0	0	116.2	L1287 A1330	L1287-G1289 PolarHBondContact O-N 2.88Å; G1289-A1330 WeakPolarHBondContact CA-O 3.21Å; G1289-A1330 PolarHBondContact N-O 2.7Å
1290	A	77.5	Confident	77.9	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.008	21%	0.209	C	C	.	.			trans	-76.4	150.7	-172.6	0	0	0	0	0	113.6	L1286 L1287 L1288 R1329 A1330 V1463 N1464	L1286-A1290 HydrophobicContact CD1-CB 3.82Å; L1286-A1290 HydrophobicContact CG-CB 4.47Å; L1287-A1290 HydrophobicContact CB-CB 4.29Å; L1287-A1290 VanDerWaalsContact O-CB 3.23Å; L1287-A1290 WeakPolarHBondContact O-CB 3.41Å; L1287-A1290 PolarHBondContact O-N 3.34Å; L1288-A1290 PolarHBondContact O-N 3.36Å; A1290-R1329 WeakPolarHBondContact O-CA 3.04Å; A1290-A1330 PolarHBondContact O-N 3.14Å; A1290-V1463 HydrophobicContact CB-CG1 3.66Å; A1290-N1464 VanDerWaalsContact CA-O 3.25Å; A1290-N1464 WeakPolarHBondContact CA-O 3.18Å
1291	E	84.3	Confident	77.7	Confident	47 Å²	47	37.6 Å²	37.6	22%	0.22	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	145.6	175	-61	-167.6	142.7	0	0	112.1	I1328 R1329 N1464	E1291-I1328 WeakPolarHBondContact CA-O 3.48Å; E1291-R1329 HydrophobicContact CG-CB 4.19Å; E1291-R1329 HydrophobicContact CG-CG 3.94Å; E1291-R1329 IonicContact OE1-CZ 2.72Å; E1291-R1329 IonicContact OE1-NE 3.39Å; E1291-R1329 PolarHBondContact OE1-NE 2.75Å; E1291-R1329 IonicContact OE1-NH2 3.18Å; E1291-R1329 PolarHBondContact OE1-NH2 2.73Å; E1291-N1464 PolarHBondContact N-O 2.91Å
1292	Y	80.3	Confident	77.5	Confident	70 Å²	70	43.1 Å²	43.1	28%	0.275	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	138.5	175.6	-154.4	-78.8	0	0	0	111.8	P1281 F1284 I1328	P1281-Y1292 WeakPolarHBondContact CD-OH 3.33Å; P1281-Y1292 HydrophobicContact CG-CD1 4.4Å; P1281-Y1292 HydrophobicContact CG-CE1 3.57Å; F1284-Y1292 HydrophobicContact CE2-CD1 4.36Å; F1284-Y1292 HydrophobicContact CE2-CD2 4.06Å; F1284-Y1292 AromaticContact CE2-CG 3.94Å; F1284-Y1292 HydrophobicContact CE2-CG 3.94Å; F1284-Y1292 HydrophobicContact CZ-CD1 4.12Å; F1284-Y1292 HydrophobicContact CZ-CG 4.05Å; Y1292-I1328 PolarHBondContact N-O 3.01Å; Y1292-I1328 WeakPolarHBondContact O-CG1 3.39Å; Y1292-I1328 PolarHBondContact O-N 3.31Å
1293	E	85	Confident	77.1	Confident	71 Å²	71	41.9 Å²	41.9	33%	0.332	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.5	171.9	-171.8	170.4	172.8	0	0	110.9	H1295 N1322 S1325 L1327	E1293-H1295 IonicContact OE1-CE1 3.56Å; E1293-H1295 PolarHBondContact OE1-CE1 3.09Å; E1293-N1322 PolarHBondContact OE1-ND2 3.15Å; E1293-S1325 WeakPolarHBondContact OE1-CB 3.31Å; E1293-S1325 PolarHBondContact OE1-OG 3.32Å; E1293-L1327 HydrophobicContact CB-CD1 4.18Å
1294	L	82.2	Confident	77.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.2	175.9	-77.4	171	0	0	0	110.5	L1279 P1281 F1284 S1325 V1326 I1328 I1339 I1372	L1279-L1294 HydrophobicContact CD2-CB 4.27Å; P1281-L1294 WeakPolarHBondContact O-CD2 3.38Å; F1284-L1294 HydrophobicContact CE1-CD2 3.88Å; F1284-L1294 HydrophobicContact CZ-CD2 4.32Å; L1294-S1325 CarbonylContact O-C 3.58Å; L1294-S1325 WeakPolarHBondContact O-CA 3.36Å; L1294-S1325 VanDerWaalsContact O-CB 3.3Å; L1294-S1325 WeakPolarHBondContact O-CB 3.17Å; L1294-V1326 HydrophobicContact CB-CG1 3.89Å; L1294-V1326 HydrophobicContact CD1-CG1 4.47Å; L1294-V1326 PolarHBondContact N-O 3.5Å; L1294-V1326 PolarHBondContact O-N 3.38Å; L1294-I1328 HydrophobicContact CD1-CD1 3.63Å; L1294-I1328 HydrophobicContact CD1-CG1 4.25Å; L1294-I1328 HydrophobicContact CG-CD1 4.2Å; L1294-I1339 HydrophobicContact CD1-CG2 3.72Å; L1294-I1372 HydrophobicContact CD1-CD1 3.94Å
1295	H	84.4	Confident	77.6	Confident	82 Å²	82	41.9 Å²	41.9	38%	0.38	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	134.5	172.8	-61.6	-75.8	0	0	0	110.5	L1279 T1280 E1293 V1297 S1325	L1279-H1295 WeakPolarHBondContact CA-O 3.43Å; T1280-H1295 PolarHBondContact N-O 2.72Å; T1280-H1295 PolarHBondContact O-N 3.4Å; T1280-H1295 PolarHBondContact OG1-O 3.16Å; E1293-H1295 IonicContact OE1-CE1 3.56Å; E1293-H1295 PolarHBondContact OE1-CE1 3.09Å; H1295-V1297 HydrophobicContact CB-CG2 4.34Å; H1295-S1325 WeakPolarHBondContact ND1-CB 3.2Å
1296	A	81.9	Confident	77.9	Confident	13 Å²	13	45.1 Å²	45.1	11%	0.107	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	112	168.4	0	0	0	0	0	108.6	L1277 L1279 L1305 F1307 S1324	L1277-A1296 HydrophobicContact CD1-CB 4.26Å; L1279-A1296 HydrophobicContact CD2-CB 4.45Å; A1296-L1305 HydrophobicContact CB-CD1 3.82Å; A1296-F1307 HydrophobicContact CB-CE1 4.16Å; A1296-F1307 HydrophobicContact CB-CZ 3.99Å; A1296-S1324 PolarHBondContact N-O 3.27Å
1297	V	77.1	Confident	78.2	Confident	79 Å²	79	46.1 Å²	46.1	48%	0.479	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.8	-179.4	-179.4	0	0	0	0	108.7	R1278 T1280 H1295	R1278-V1297 PolarHBondContact N-O 3.32Å; R1278-V1297 PolarHBondContact O-N 3.49Å; T1280-V1297 HydrophobicContact CG2-CB 4.2Å; T1280-V1297 HydrophobicContact CG2-CG2 4.16Å; T1280-V1297 WeakPolarHBondContact OG1-CG2 3.18Å; H1295-V1297 HydrophobicContact CB-CG2 4.34Å
1298	G	73.2	Confident	78.3	Confident	32 Å²	32	48.6 Å²	48.6	33%	0.33	28%	0.278	S	S	.	.			trans	85.1	-160.4	-170.4	0	0	0	0	0	112.7	A1275	A1275-G1298 CarbonylContact O-C 2.88Å; A1275-G1298 VanDerWaalsContact O-CA 3.26Å; A1275-G1298 WeakPolarHBondContact O-CA 3.38Å
1299	G	76.4	Confident	78.3	Confident	15 Å²	15	51.3 Å²	51.3	16%	0.155	30%	0.296	C	S	.	.	S	Bend	trans	81.3	167.4	-162.3	0	0	0	0	0	112.8	F1274 A1275	F1274-G1299 WeakPolarHBondContact CB-O 3.43Å; A1275-G1299 PolarHBondContact O-N 3.1Å
1300	P	76.4	Confident	78	Confident	10 Å²	10	53.7 Å²	53.7	7%	0.065	30%	0.3	C	S	.	.			trans	-82.8	149.1	-177.5	9.2	7.5	0	0	0	112.2	Q1272 F1274 Q1302 A1303 A1343 Y1365	Q1272-P1300 VanDerWaalsContact OE1-CB 3.25Å; F1274-P1300 HydrophobicContact CB-CB 4.47Å; F1274-P1300 HydrophobicContact CD1-CB 3.98Å; F1274-P1300 HydrophobicContact CD1-CG 4.13Å; F1274-P1300 HydrophobicContact CD2-CG 4.35Å; F1274-P1300 HydrophobicContact CE1-CB 4.43Å; F1274-P1300 HydrophobicContact CE1-CG 4.14Å; F1274-P1300 HydrophobicContact CE2-CG 4.4Å; F1274-P1300 HydrophobicContact CG-CB 4.12Å; F1274-P1300 HydrophobicContact CG-CG 4.26Å; F1274-P1300 HydrophobicContact CZ-CG 4.29Å; P1300-Q1302 PolarHBondContact O-N 2.84Å; P1300-A1303 HydrophobicContact CG-CB 4.07Å; P1300-A1303 PolarHBondContact O-N 3.41Å; P1300-A1343 HydrophobicContact CG-CB 4.38Å; P1300-Y1365 HydrophobicContact CG-CG 4.3Å
1301	S	69.7	Low	77.1	Confident	95 Å²	95	54.7 Å²	54.7	66%	0.664	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	0.2	-170.5	70.3	0	0	0	0	115.3	Q1272	Q1272-S1301 PolarHBondContact NE2-OG 3.38Å
1302	Q	66.4	Low	76	Confident	163 Å²	163	60.9 Å²	60.9	76%	0.762	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	12.7	178.2	-67.5	-175	-15.1	0	0	112.8	P1300	P1300-Q1302 PolarHBondContact O-N 2.84Å
1303	A	67	Low	74.9	Confident	22 Å²	22	60 Å²	60	18%	0.182	34%	0.344	C	S	.	.	S	Bend	trans	-103.1	143.9	176.9	0	0	0	0	0	111.2	P1300 A1343 V1344 Y1365	P1300-A1303 HydrophobicContact CG-CB 4.07Å; P1300-A1303 PolarHBondContact O-N 3.41Å; A1303-A1343 HydrophobicContact CB-CB 3.74Å; A1303-V1344 CarbonylContact C-O 3.55Å; A1303-V1344 VanDerWaalsContact CA-O 3.29Å; A1303-V1344 WeakPolarHBondContact CA-O 2.95Å; A1303-V1344 WeakPolarHBondContact CB-O 3.3Å; A1303-Y1365 HydrophobicContact CB-CD2 4.16Å
1304	S	74.9	Confident	73.9	Confident	79 Å²	79	60.8 Å²	60.8	55%	0.552	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	142.3	166.9	48.2	0	0	0	0	110.2	A1343 V1344	S1304-A1343 WeakPolarHBondContact O-CA 3.2Å; S1304-V1344 PolarHBondContact N-O 2.87Å; S1304-V1344 WeakPolarHBondContact O-CG2 3.11Å; S1304-V1344 PolarHBondContact O-N 3.16Å; S1304-V1344 PolarHBondContact OG-O 2.92Å
1305	L	79.8	Confident	73.6	Confident	52 Å²	52	62.3 Å²	62.3	27%	0.272	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	116.9	178.2	-74	171.6	0	0	0	110.8	L1277 A1296 F1307 R1342 A1343	L1277-L1305 HydrophobicContact CD1-CD2 3.68Å; L1277-L1305 HydrophobicContact CD2-CD2 3.92Å; L1277-L1305 HydrophobicContact CG-CD2 4.48Å; A1296-L1305 HydrophobicContact CB-CD1 3.82Å; L1305-F1307 HydrophobicContact CB-CE2 4.39Å; L1305-R1342 WeakPolarHBondContact CA-O 3.42Å; L1305-A1343 HydrophobicContact CD2-CB 4.22Å
1306	E	83	Confident	73.4	Confident	79 Å²	79	59 Å²	59	37%	0.369	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.8	175.9	-174.2	-172.6	-153.2	0	0	109.7	I1308 A1341 R1342 V1344	E1306-I1308 HydrophobicContact CG-CD1 4.23Å; E1306-I1308 HydrophobicContact CG-CG1 3.85Å; E1306-A1341 CarbonylContact O-C 3.49Å; E1306-A1341 WeakPolarHBondContact O-CA 3.39Å; E1306-R1342 HydrophobicContact CB-CB 4.43Å; E1306-R1342 PolarHBondContact N-O 3.27Å; E1306-R1342 PolarHBondContact O-N 2.87Å; E1306-R1342 WeakPolarHBondContact OE2-CD 3.19Å; E1306-R1342 IonicContact OE2-CZ 3.82Å; E1306-R1342 IonicContact OE2-NE 3.22Å; E1306-R1342 IonicContact OE2-NH1 3.65Å; E1306-R1342 PolarHBondContact OE2-NH1 3.05Å; E1306-V1344 HydrophobicContact CB-CG2 4.44Å
1307	F	85.1	Confident	73.4	Confident	26 Å²	26	62.4 Å²	62.4	11%	0.114	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	108.9	177.4	-60.9	-89.6	0	0	0	110.4	L1279 A1296 L1305 V1326 R1340 A1341	L1279-F1307 HydrophobicContact CD2-CD1 4.31Å; L1279-F1307 HydrophobicContact CD2-CE1 3.82Å; A1296-F1307 HydrophobicContact CB-CE1 4.16Å; A1296-F1307 HydrophobicContact CB-CZ 3.99Å; L1305-F1307 HydrophobicContact CB-CE2 4.39Å; F1307-V1326 HydrophobicContact CB-CB 4.47Å; F1307-V1326 HydrophobicContact CB-CG1 4.48Å; F1307-V1326 HydrophobicContact CD1-CB 3.91Å; F1307-V1326 HydrophobicContact CD1-CG1 3.44Å; F1307-V1326 VanDerWaalsContact CD1-CG1 3.44Å; F1307-V1326 HydrophobicContact CD2-CB 4.32Å; F1307-V1326 HydrophobicContact CE1-CB 4.1Å; F1307-V1326 HydrophobicContact CE1-CG1 3.67Å; F1307-V1326 HydrophobicContact CG-CB 4.01Å; F1307-V1326 HydrophobicContact CG-CG1 4.01Å; F1307-V1326 HydrophobicContact CZ-CB 4.4Å; F1307-V1326 HydrophobicContact CZ-CG1 4.42Å; F1307-R1340 WeakPolarHBondContact CA-O 2.85Å; F1307-A1341 HydrophobicContact CD1-CB 4.11Å; F1307-A1341 HydrophobicContact CE1-CB 4.28Å
1308	I	82.4	Confident	73.5	Confident	55 Å²	55	61.3 Å²	61.3	28%	0.282	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.3	-177.2	-48.2	177.8	0	0	0	110.3	E1306 E1310 I1339 R1340	E1306-I1308 HydrophobicContact CG-CD1 4.23Å; E1306-I1308 HydrophobicContact CG-CG1 3.85Å; I1308-E1310 HydrophobicContact CG2-CG 4.41Å; I1308-E1310 PolarHBondContact O-N 3.03Å; I1308-I1339 CarbonylContact O-C 3.54Å; I1308-I1339 WeakPolarHBondContact O-CA 3.23Å; I1308-R1340 PolarHBondContact N-O 2.82Å; I1308-R1340 PolarHBondContact O-N 2.68Å
1309	P	81	Confident	73.9	Confident	60 Å²	60	62.9 Å²	62.9	39%	0.39	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	107.4	169.7	31.5	-29.1	0	0	0	109.9	S1311 I1318 N1338	P1309-S1311 PolarHBondContact O-N 3.43Å; P1309-I1318 HydrophobicContact CG-CD1 4Å; P1309-N1338 CarbonylContact C-O 3.5Å
1310	E	69.5	Low	74.1	Confident	76 Å²	76	68 Å²	68	36%	0.355	38%	0.375	S	S	.	.			trans	-83.3	7.7	-177.4	-66.3	-168.4	95.8	0	0	113.7	I1308 I1312 N1338 R1340	I1308-E1310 HydrophobicContact CG2-CG 4.41Å; I1308-E1310 PolarHBondContact O-N 3.03Å; E1310-I1312 PolarHBondContact O-N 2.76Å; E1310-N1338 HydrophobicContact CB-CB 4.17Å; E1310-N1338 PolarHBondContact N-O 3.48Å; E1310-R1340 VanDerWaalsContact CD-NE 3.29Å; E1310-R1340 HydrophobicContact CG-CB 4.29Å; E1310-R1340 IonicContact OE1-CZ 2.8Å; E1310-R1340 IonicContact OE1-NE 2.6Å; E1310-R1340 PolarHBondContact OE1-NE 3.27Å; E1310-R1340 IonicContact OE1-NH2 2.84Å; E1310-R1340 PolarHBondContact OE1-NH2 3.14Å; E1310-R1340 WeakPolarHBondContact OE2-CB 3.25Å; E1310-R1340 IonicContact OE2-CZ 2.96Å; E1310-R1340 IonicContact OE2-NE 2.66Å; E1310-R1340 PolarHBondContact OE2-NE 2.63Å; E1310-R1340 IonicContact OE2-NH2 3.26Å; E1310-R1340 PolarHBondContact OE2-NH2 3.3Å
1311	S	60.2	Low	74.1	Confident	22 Å²	22	71.6 Å²	71.6	15%	0.154	40%	0.397	C	S	.	.			trans	-80.3	104.6	179.4	-166.3	0	0	0	0	111.9	P1309 S1313 S1314	P1309-S1311 PolarHBondContact O-N 3.43Å; S1311-S1313 PolarHBondContact O-N 3.29Å; S1311-S1314 PolarHBondContact O-N 2.94Å
1312	I	59.3	Low	74.5	Confident	177 Å²	177	69.4 Å²	69.4	91%	0.908	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-17.6	177.4	-59.3	166	0	0	0	114	E1310	E1310-I1312 PolarHBondContact O-N 2.76Å
1313	S	57.9	Low	75	Confident	53 Å²	53	67.5 Å²	67.5	37%	0.371	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	28.4	-170.5	37.1	0	0	0	0	114	S1311 R1315	S1311-S1313 PolarHBondContact O-N 3.29Å; S1313-R1315 PolarHBondContact O-N 2.99Å; S1313-R1315 PolarHBondContact OG-NE 2.73Å; S1313-R1315 PolarHBondContact OG-NH2 2.83Å; S1313-R1315 VanDerWaalsContact OG-NH2 3.1Å
1314	S	64.2	Low	75.4	Confident	87 Å²	87	69.7 Å²	69.7	61%	0.608	39%	0.394	S	S	*	.			trans	54.2	31.3	170.1	-51.3	0	0	0	0	114.7	S1311 S1331	S1311-S1314 PolarHBondContact O-N 2.94Å; S1314-S1331 WeakPolarHBondContact O-CB 3.5Å; S1314-S1331 PolarHBondContact O-OG 3.45Å
1315	R	76.8	Confident	75.7	Confident	31 Å²	31	66.1 Å²	66.1	12%	0.117	37%	0.369	C	S	.	.			trans	-75.1	-27.7	-173.2	-47.7	-165	-168.3	-176.5	8.4	112.7	S1313 S1331 S1333 L1334 A1337 I1374	S1313-R1315 PolarHBondContact O-N 2.99Å; S1313-R1315 PolarHBondContact OG-NE 2.73Å; S1313-R1315 PolarHBondContact OG-NH2 2.83Å; S1313-R1315 VanDerWaalsContact OG-NH2 3.1Å; R1315-S1331 WeakPolarHBondContact O-CB 3.31Å; R1315-S1331 PolarHBondContact O-N 3.33Å; R1315-S1333 WeakPolarHBondContact CG-OG 3.09Å; R1315-L1334 PolarHBondContact NH1-O 3.1Å; R1315-A1337 HydrophobicContact CB-CB 4.13Å; R1315-I1374 VanDerWaalsContact C-CD1 3.47Å; R1315-I1374 HydrophobicContact CB-CD1 3.57Å; R1315-I1374 WeakPolarHBondContact O-CD1 3.19Å
1316	I	79.1	Confident	75.9	Confident	12 Å²	12	63.6 Å²	63.6	6%	0.062	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	137.3	168.3	-70	176.3	0	0	0	109.1	I1328 A1337 I1372 I1374	I1316-I1328 HydrophobicContact CD1-CD1 4.4Å; I1316-I1328 HydrophobicContact CG2-CB 3.81Å; I1316-I1328 HydrophobicContact CG2-CG2 3.72Å; I1316-A1337 HydrophobicContact CD1-CB 3.55Å; I1316-A1337 HydrophobicContact CG1-CB 3.63Å; I1316-I1372 HydrophobicContact CD1-CB 4.04Å; I1316-I1372 HydrophobicContact CD1-CD1 3.48Å; I1316-I1372 VanDerWaalsContact CD1-CD1 3.48Å; I1316-I1372 HydrophobicContact CD1-CG1 4.38Å; I1316-I1372 HydrophobicContact CD1-CG2 4.24Å; I1316-I1374 HydrophobicContact CG1-CD1 3.79Å
1317	I	81.3	Confident	76.1	Confident	86 Å²	86	62 Å²	62	44%	0.441	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.5	167.2	-57.6	174.7	0	0	0	107.9	V1319 I1328 R1329	I1317-V1319 PolarHBondContact O-N 2.97Å; I1317-I1328 WeakPolarHBondContact O-CA 3.14Å; I1317-R1329 PolarHBondContact N-O 2.98Å; I1317-R1329 PolarHBondContact O-N 3.1Å
1318	I	81	Confident	76.2	Confident	55 Å²	55	60.7 Å²	60.7	28%	0.282	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.7	167.4	-68.5	175.6	0	0	0	107.6	P1309 T1321 V1326 I1328 I1339	P1309-I1318 HydrophobicContact CG-CD1 4Å; I1318-T1321 HydrophobicContact CG2-CG2 3.83Å; I1318-V1326 HydrophobicContact CB-CG2 4.42Å; I1318-V1326 HydrophobicContact CD1-CG2 4.2Å; I1318-V1326 HydrophobicContact CG1-CG2 4Å; I1318-V1326 HydrophobicContact CG2-CG2 3.72Å; I1318-I1328 HydrophobicContact CG1-CG2 4.41Å; I1318-I1339 HydrophobicContact CD1-CD1 4.3Å; I1318-I1339 HydrophobicContact CG1-CD1 4.43Å
1319	V	80.4	Confident	76.3	Confident	66 Å²	66	63.4 Å²	63.4	40%	0.4	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-37.3	-179.1	-175	0	0	0	0	110.8	I1317 L1327 R1329	I1317-V1319 PolarHBondContact O-N 2.97Å; V1319-L1327 HydrophobicContact CB-CB 4.36Å; V1319-L1327 HydrophobicContact CB-CD2 3.93Å; V1319-L1327 HydrophobicContact CB-CG 3.96Å; V1319-L1327 HydrophobicContact CG1-CD2 3.87Å; V1319-L1327 HydrophobicContact CG1-CG 4.45Å; V1319-L1327 PolarHBondContact N-O 3.49Å; V1319-R1329 HydrophobicContact CG2-CB 3.84Å
1320	K	80.5	Confident	76.2	Confident	121 Å²	121	60.7 Å²	60.7	53%	0.526	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	145.4	178.5	-170.7	-177.7	177.3	-166	0	111.3	N1322 V1326 L1327	K1320-N1322 VanDerWaalsContact CE-OD1 3.25Å; K1320-N1322 WeakPolarHBondContact CE-OD1 3.26Å; K1320-V1326 WeakPolarHBondContact O-CA 3.28Å; K1320-L1327 HydrophobicContact CB-CB 4.16Å; K1320-L1327 PolarHBondContact N-O 3.27Å; K1320-L1327 PolarHBondContact O-N 3.36Å
1321	T	77.8	Confident	76.6	Confident	86 Å²	86	58.7 Å²	58.7	53%	0.528	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.8	170.5	51.2	0	0	0	0	110.9	I1318 V1326	I1318-T1321 HydrophobicContact CG2-CG2 3.83Å; T1321-V1326 HydrophobicContact CG2-CG2 4Å
1322	N	76.7	Confident	77	Confident	50 Å²	50	64.6 Å²	64.6	27%	0.267	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	167.5	167.3	-54.9	-46.4	0	0	0	108.9	E1293 K1320 S1324 S1325	E1293-N1322 PolarHBondContact OE1-ND2 3.15Å; K1320-N1322 VanDerWaalsContact CE-OD1 3.25Å; K1320-N1322 WeakPolarHBondContact CE-OD1 3.26Å; N1322-S1324 PolarHBondContact O-N 3.32Å; N1322-S1325 PolarHBondContact N-O 3.24Å; N1322-S1325 PolarHBondContact ND2-OG 3.04Å; N1322-S1325 PolarHBondContact O-N 3.22Å; N1322-S1325 VanDerWaalsContact O-O 3.11Å
1323	P	76.5	Confident	77.6	Confident	122 Å²	122	58.1 Å²	58.1	79%	0.792	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.3	-179.5	-27.1	36.4	0	0	0	116
1324	S	75.6	Confident	78.4	Confident	68 Å²	68	56.7 Å²	56.7	48%	0.476	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.3	10.1	-178.6	55.5	0	0	0	0	114	A1296 N1322	A1296-S1324 PolarHBondContact N-O 3.27Å; N1322-S1324 PolarHBondContact O-N 3.32Å
1325	S	81.9	Confident	78.9	Confident	4 Å²	4	52.6 Å²	52.6	3%	0.028	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	158.7	176.9	66.3	0	0	0	0	114.1	E1293 L1294 H1295 N1322	E1293-S1325 WeakPolarHBondContact OE1-CB 3.31Å; E1293-S1325 PolarHBondContact OE1-OG 3.32Å; L1294-S1325 CarbonylContact O-C 3.58Å; L1294-S1325 WeakPolarHBondContact O-CA 3.36Å; L1294-S1325 VanDerWaalsContact O-CB 3.3Å; L1294-S1325 WeakPolarHBondContact O-CB 3.17Å; H1295-S1325 WeakPolarHBondContact ND1-CB 3.2Å; N1322-S1325 PolarHBondContact N-O 3.24Å; N1322-S1325 PolarHBondContact ND2-OG 3.04Å; N1322-S1325 PolarHBondContact O-N 3.22Å; N1322-S1325 VanDerWaalsContact O-O 3.11Å
1326	V	84.3	Confident	78.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	125.2	176.1	62.9	0	0	0	0	110.8	L1294 F1307 I1318 K1320 T1321 I1328 I1339	L1294-V1326 HydrophobicContact CB-CG1 3.89Å; L1294-V1326 HydrophobicContact CD1-CG1 4.47Å; L1294-V1326 PolarHBondContact N-O 3.5Å; L1294-V1326 PolarHBondContact O-N 3.38Å; F1307-V1326 HydrophobicContact CB-CB 4.47Å; F1307-V1326 HydrophobicContact CB-CG1 4.48Å; F1307-V1326 HydrophobicContact CD1-CB 3.91Å; F1307-V1326 HydrophobicContact CD1-CG1 3.44Å; F1307-V1326 VanDerWaalsContact CD1-CG1 3.44Å; F1307-V1326 HydrophobicContact CD2-CB 4.32Å; F1307-V1326 HydrophobicContact CE1-CB 4.1Å; F1307-V1326 HydrophobicContact CE1-CG1 3.67Å; F1307-V1326 HydrophobicContact CG-CB 4.01Å; F1307-V1326 HydrophobicContact CG-CG1 4.01Å; F1307-V1326 HydrophobicContact CZ-CB 4.4Å; F1307-V1326 HydrophobicContact CZ-CG1 4.42Å; I1318-V1326 HydrophobicContact CB-CG2 4.42Å; I1318-V1326 HydrophobicContact CD1-CG2 4.2Å; I1318-V1326 HydrophobicContact CG1-CG2 4Å; I1318-V1326 HydrophobicContact CG2-CG2 3.72Å; K1320-V1326 WeakPolarHBondContact O-CA 3.28Å; T1321-V1326 HydrophobicContact CG2-CG2 4Å; V1326-I1328 HydrophobicContact CG1-CG2 4.45Å; V1326-I1328 HydrophobicContact CG2-CG2 4.21Å; V1326-I1339 HydrophobicContact CG1-CD1 3.82Å; V1326-I1339 HydrophobicContact CG2-CD1 4.34Å
1327	L	86.7	Confident	78.6	Confident	44 Å²	44	53.8 Å²	53.8	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	120.7	173.5	-178.7	65.3	0	0	0	108.9	E1293 V1319 K1320	E1293-L1327 HydrophobicContact CB-CD1 4.18Å; V1319-L1327 HydrophobicContact CB-CB 4.36Å; V1319-L1327 HydrophobicContact CB-CD2 3.93Å; V1319-L1327 HydrophobicContact CB-CG 3.96Å; V1319-L1327 HydrophobicContact CG1-CD2 3.87Å; V1319-L1327 HydrophobicContact CG1-CG 4.45Å; V1319-L1327 PolarHBondContact N-O 3.49Å; K1320-L1327 HydrophobicContact CB-CB 4.16Å; K1320-L1327 PolarHBondContact N-O 3.27Å; K1320-L1327 PolarHBondContact O-N 3.36Å
1328	I	86.4	Confident	78.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148	-178.9	55.3	162.4	0	0	0	111.5	F1284 L1286 E1291 Y1292 L1294 I1316 I1317 I1318 V1326 I1339 I1372	F1284-I1328 HydrophobicContact CZ-CD1 4.46Å; L1286-I1328 HydrophobicContact CD2-CD1 4.12Å; E1291-I1328 WeakPolarHBondContact CA-O 3.48Å; Y1292-I1328 PolarHBondContact N-O 3.01Å; Y1292-I1328 WeakPolarHBondContact O-CG1 3.39Å; Y1292-I1328 PolarHBondContact O-N 3.31Å; L1294-I1328 HydrophobicContact CD1-CD1 3.63Å; L1294-I1328 HydrophobicContact CD1-CG1 4.25Å; L1294-I1328 HydrophobicContact CG-CD1 4.2Å; I1316-I1328 HydrophobicContact CD1-CD1 4.4Å; I1316-I1328 HydrophobicContact CG2-CB 3.81Å; I1316-I1328 HydrophobicContact CG2-CG2 3.72Å; I1317-I1328 WeakPolarHBondContact O-CA 3.14Å; I1318-I1328 HydrophobicContact CG1-CG2 4.41Å; V1326-I1328 HydrophobicContact CG1-CG2 4.45Å; V1326-I1328 HydrophobicContact CG2-CG2 4.21Å; I1328-I1339 HydrophobicContact CG2-CD1 3.87Å; I1328-I1372 HydrophobicContact CD1-CD1 3.64Å
1329	R	84.8	Confident	79	Confident	112 Å²	112	48.9 Å²	48.9	42%	0.423	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.4	171.2	-172.4	-173.2	-64.6	171.9	-4	110.4	A1290 E1291 I1317 V1319	A1290-R1329 WeakPolarHBondContact O-CA 3.04Å; E1291-R1329 HydrophobicContact CG-CB 4.19Å; E1291-R1329 HydrophobicContact CG-CG 3.94Å; E1291-R1329 IonicContact OE1-CZ 2.72Å; E1291-R1329 IonicContact OE1-NE 3.39Å; E1291-R1329 PolarHBondContact OE1-NE 2.75Å; E1291-R1329 IonicContact OE1-NH2 3.18Å; E1291-R1329 PolarHBondContact OE1-NH2 2.73Å; I1317-R1329 PolarHBondContact N-O 2.98Å; I1317-R1329 PolarHBondContact O-N 3.1Å; V1319-R1329 HydrophobicContact CG2-CB 3.84Å
1330	A	80.4	Confident	79.2	Confident	3 Å²	3	48.6 Å²	48.6	3%	0.025	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.9	169.4	0	0	0	0	0	111.1	L1286 L1287 G1289 A1290 I1374	L1286-A1330 HydrophobicContact CD2-CB 3.85Å; L1286-A1330 HydrophobicContact CG-CB 4.01Å; L1287-A1330 WeakPolarHBondContact O-CB 3.47Å; G1289-A1330 WeakPolarHBondContact CA-O 3.21Å; G1289-A1330 PolarHBondContact N-O 2.7Å; A1290-A1330 PolarHBondContact O-N 3.14Å; A1330-I1374 HydrophobicContact CB-CD1 4.38Å; A1330-I1374 HydrophobicContact CB-CG1 4.2Å; A1330-I1374 HydrophobicContact CB-CG2 4.08Å
1331	S	76.5	Confident	79.5	Confident	33 Å²	33	42.8 Å²	42.8	23%	0.231	23%	0.232	C	C	.	.			trans	-74.3	-179.5	172.4	-164.9	0	0	0	0	111.3	L1288 S1314 R1315 S1333	L1288-S1331 WeakPolarHBondContact CD2-O 3.4Å; S1314-S1331 WeakPolarHBondContact O-CB 3.5Å; S1314-S1331 PolarHBondContact O-OG 3.45Å; R1315-S1331 WeakPolarHBondContact O-CB 3.31Å; R1315-S1331 PolarHBondContact O-N 3.33Å; S1331-S1333 PolarHBondContact O-N 2.73Å; S1331-S1333 VanDerWaalsContact O-N 3.08Å
1332	E	68.8	Low	79.8	Confident	147 Å²	147	41 Å²	41	69%	0.687	22%	0.216	S	C	*	.	S	Bend	trans	-73.6	6.7	-177	-63.5	-167.1	-132.4	0	0	115	K1528	E1332-K1528 IonicContact OE2-NZ 3.88Å; E1332-K1528 PolarHBondContact OE2-NZ 3.14Å
1333	S	72.9	Confident	80.1	Confident	40 Å²	40	38.7 Å²	38.7	28%	0.28	20%	0.204	S	C	.	.			trans	-119.2	116.9	-171.5	46.7	0	0	0	0	113.3	R1315 S1331	R1315-S1333 WeakPolarHBondContact CG-OG 3.09Å; S1331-S1333 PolarHBondContact O-N 2.73Å; S1331-S1333 VanDerWaalsContact O-N 3.08Å
1334	L	74.2	Confident	80.1	Confident	24 Å²	24	33.3 Å²	33.3	13%	0.126	17%	0.169	C	C	.	.			trans	-60.2	154.7	175.4	-64.9	170.3	0	0	0	112.9	L1288 R1315 V1375 A1376 Y1441 P1443 Y1444 I1531	L1288-L1334 HydrophobicContact CD1-CD2 3.64Å; L1288-L1334 HydrophobicContact CD1-CG 4.11Å; L1288-L1334 HydrophobicContact CD2-CD2 4.11Å; L1288-L1334 HydrophobicContact CD2-CG 4.48Å; L1288-L1334 HydrophobicContact CG-CD2 3.79Å; R1315-L1334 PolarHBondContact NH1-O 3.1Å; L1334-V1375 VanDerWaalsContact CD2-C 3.5Å; L1334-A1376 HydrophobicContact CD2-CB 4.01Å; L1334-A1376 VanDerWaalsContact CD2-N 3.32Å; L1334-Y1441 HydrophobicContact CD1-CD1 3.59Å; L1334-Y1441 HydrophobicContact CD1-CE1 3.52Å; L1334-P1443 HydrophobicContact CB-CG 4.39Å; L1334-P1443 HydrophobicContact CD1-CG 4.26Å; L1334-Y1444 WeakPolarHBondContact O-CE2 3.34Å; L1334-I1531 HydrophobicContact CD1-CD1 3.94Å; L1334-I1531 HydrophobicContact CD2-CD1 4.38Å; L1334-I1531 HydrophobicContact CG-CD1 4.46Å
1335	G	73.9	Confident	79.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	121.7	-172.8	167.3	0	0	0	0	0	113.9	I1374	G1335-I1374 PolarHBondContact N-O 3.23Å; G1335-I1374 WeakPolarHBondContact O-CB 3.32Å; G1335-I1374 PolarHBondContact O-N 2.79Å
1336	L	73.3	Confident	78.6	Confident	67 Å²	67	38.2 Å²	38.2	35%	0.351	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	134.2	-179.5	-178.6	65.1	0	0	0	111.5	N1338 N1371 F1445	L1336-N1338 WeakPolarHBondContact CD1-OD1 3.41Å; L1336-N1338 VanDerWaalsContact CG-OD1 3.3Å; L1336-N1338 WeakPolarHBondContact CG-OD1 3.45Å; L1336-N1371 HydrophobicContact CD1-CB 3.85Å; L1336-F1445 HydrophobicContact CB-CZ 4.4Å
1337	A	77.6	Confident	77.1	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.008	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	128.3	167.7	0	0	0	0	0	109.7	R1315 I1316 I1372 I1374	R1315-A1337 HydrophobicContact CB-CB 4.13Å; I1316-A1337 HydrophobicContact CD1-CB 3.55Å; I1316-A1337 HydrophobicContact CG1-CB 3.63Å; A1337-I1372 PolarHBondContact N-O 2.8Å; A1337-I1372 WeakPolarHBondContact O-CA 3.35Å; A1337-I1372 WeakPolarHBondContact O-CB 3.37Å; A1337-I1372 PolarHBondContact O-N 3.32Å; A1337-I1372 VanDerWaalsContact O-O 3.08Å; A1337-I1374 HydrophobicContact CB-CD1 3.86Å
1338	N	82.8	Confident	75	Confident	38 Å²	38	42.6 Å²	42.6	20%	0.203	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.4	-177.5	-69	13.5	0	0	0	109.4	P1309 E1310 L1336 V1369 C1370 N1371	P1309-N1338 CarbonylContact C-O 3.5Å; E1310-N1338 HydrophobicContact CB-CB 4.17Å; E1310-N1338 PolarHBondContact N-O 3.48Å; L1336-N1338 WeakPolarHBondContact CD1-OD1 3.41Å; L1336-N1338 VanDerWaalsContact CG-OD1 3.3Å; L1336-N1338 WeakPolarHBondContact CG-OD1 3.45Å; N1338-V1369 HydrophobicContact CB-CG1 3.98Å; N1338-C1370 WeakPolarHBondContact CA-O 3.13Å; N1338-N1371 VanDerWaalsContact CG-OD1 3.32Å; N1338-N1371 PolarHBondContact ND2-OD1 2.55Å; N1338-N1371 VanDerWaalsContact ND2-OD1 3.17Å; N1338-N1371 PolarHBondContact OD1-OD1 3.12Å
1339	I	86.1	Confident	72.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.2	164.8	-164.5	167.7	0	0	0	108.8	L1279 L1294 I1308 I1318 V1326 I1328 C1370 I1372	L1279-I1339 HydrophobicContact CD1-CG2 4.01Å; L1294-I1339 HydrophobicContact CD1-CG2 3.72Å; I1308-I1339 CarbonylContact O-C 3.54Å; I1308-I1339 WeakPolarHBondContact O-CA 3.23Å; I1318-I1339 HydrophobicContact CD1-CD1 4.3Å; I1318-I1339 HydrophobicContact CG1-CD1 4.43Å; V1326-I1339 HydrophobicContact CG1-CD1 3.82Å; V1326-I1339 HydrophobicContact CG2-CD1 4.34Å; I1328-I1339 HydrophobicContact CG2-CD1 3.87Å; I1339-C1370 HydrophobicContact CG2-CB 4.08Å; I1339-C1370 PolarHBondContact N-O 3.15Å; I1339-C1370 PolarHBondContact O-N 3.11Å; I1339-I1372 HydrophobicContact CB-CD1 4.29Å; I1339-I1372 HydrophobicContact CG2-CD1 3.52Å
1340	R	86.2	Confident	70.2	Confident	60 Å²	60	53 Å²	53	23%	0.226	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.8	178.5	-172.9	-171.4	-64.6	-134.5	13.2	108.7	F1307 I1308 E1310 R1342 E1367 T1368 V1369	F1307-R1340 WeakPolarHBondContact CA-O 2.85Å; I1308-R1340 PolarHBondContact N-O 2.82Å; I1308-R1340 PolarHBondContact O-N 2.68Å; E1310-R1340 VanDerWaalsContact CD-NE 3.29Å; E1310-R1340 HydrophobicContact CG-CB 4.29Å; E1310-R1340 IonicContact OE1-CZ 2.8Å; E1310-R1340 IonicContact OE1-NE 2.6Å; E1310-R1340 PolarHBondContact OE1-NE 3.27Å; E1310-R1340 IonicContact OE1-NH2 2.84Å; E1310-R1340 PolarHBondContact OE1-NH2 3.14Å; E1310-R1340 WeakPolarHBondContact OE2-CB 3.25Å; E1310-R1340 IonicContact OE2-CZ 2.96Å; E1310-R1340 IonicContact OE2-NE 2.66Å; E1310-R1340 PolarHBondContact OE2-NE 2.63Å; E1310-R1340 IonicContact OE2-NH2 3.26Å; E1310-R1340 PolarHBondContact OE2-NH2 3.3Å; R1340-R1342 HydrophobicContact CG-CG 3.86Å; R1340-E1367 IonicContact CZ-OE2 2.94Å; R1340-E1367 IonicContact NH1-OE1 2.68Å; R1340-E1367 IonicContact NH1-OE2 3.14Å; R1340-E1367 PolarHBondContact NH1-OE2 2.68Å; R1340-T1368 WeakPolarHBondContact CA-O 3.41Å; R1340-V1369 HydrophobicContact CB-CG2 4.3Å; R1340-V1369 HydrophobicContact CG-CG2 3.96Å
1341	A	85.4	Confident	68	Low	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.8	163.9	0	0	0	0	0	108.9	L1277 L1279 E1306 F1307 E1367 T1368	L1277-A1341 HydrophobicContact CD2-CB 4.17Å; L1277-A1341 WeakPolarHBondContact CD2-O 3.01Å; L1279-A1341 HydrophobicContact CD1-CB 3.87Å; L1279-A1341 HydrophobicContact CD2-CB 4.01Å; L1279-A1341 HydrophobicContact CG-CB 4.01Å; E1306-A1341 CarbonylContact O-C 3.49Å; E1306-A1341 WeakPolarHBondContact O-CA 3.39Å; F1307-A1341 HydrophobicContact CD1-CB 4.11Å; F1307-A1341 HydrophobicContact CE1-CB 4.28Å; A1341-E1367 WeakPolarHBondContact O-CA 3.38Å; A1341-T1368 HydrophobicContact CB-CG2 3.91Å; A1341-T1368 PolarHBondContact N-O 3.15Å; A1341-T1368 PolarHBondContact O-N 3.06Å
1342	R	85.7	Confident	65.7	Low	49 Å²	49	63.9 Å²	63.9	19%	0.185	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125	176.5	-55.9	170.3	67.4	-145.1	5.4	109	L1305 E1306 R1340 V1344 E1367	L1305-R1342 WeakPolarHBondContact CA-O 3.42Å; E1306-R1342 HydrophobicContact CB-CB 4.43Å; E1306-R1342 PolarHBondContact N-O 3.27Å; E1306-R1342 PolarHBondContact O-N 2.87Å; E1306-R1342 WeakPolarHBondContact OE2-CD 3.19Å; E1306-R1342 IonicContact OE2-CZ 3.82Å; E1306-R1342 IonicContact OE2-NE 3.22Å; E1306-R1342 IonicContact OE2-NH1 3.65Å; E1306-R1342 PolarHBondContact OE2-NH1 3.05Å; R1340-R1342 HydrophobicContact CG-CG 3.86Å; R1342-V1344 HydrophobicContact CB-CG1 4.12Å; R1342-V1344 PolarHBondContact O-N 3.16Å; R1342-E1367 HydrophobicContact CG-CB 4.47Å
1343	A	82	Confident	63.9	Low	1 Å²	1	62.1 Å²	62.1	1%	0.008	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	99.3	161.4	0	0	0	0	0	108.2	L1277 P1300 A1303 S1304 L1305 Y1365 S1366	L1277-A1343 HydrophobicContact CD2-CB 4.06Å; P1300-A1343 HydrophobicContact CG-CB 4.38Å; A1303-A1343 HydrophobicContact CB-CB 3.74Å; S1304-A1343 WeakPolarHBondContact O-CA 3.2Å; L1305-A1343 HydrophobicContact CD2-CB 4.22Å; A1343-Y1365 PolarHBondContact O-N 3.26Å; A1343-S1366 WeakPolarHBondContact CB-O 3.14Å; A1343-S1366 PolarHBondContact N-O 2.72Å
1344	V	77.2	Confident	61.9	Low	9 Å²	9	65.2 Å²	65.2	6%	0.055	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	148.9	-178.1	-82.6	0	0	0	0	112.1	A1303 S1304 E1306 R1342 V1363 I1364	A1303-V1344 CarbonylContact C-O 3.55Å; A1303-V1344 VanDerWaalsContact CA-O 3.29Å; A1303-V1344 WeakPolarHBondContact CA-O 2.95Å; A1303-V1344 WeakPolarHBondContact CB-O 3.3Å; S1304-V1344 PolarHBondContact N-O 2.87Å; S1304-V1344 WeakPolarHBondContact O-CG2 3.11Å; S1304-V1344 PolarHBondContact O-N 3.16Å; S1304-V1344 PolarHBondContact OG-O 2.92Å; E1306-V1344 HydrophobicContact CB-CG2 4.44Å; R1342-V1344 HydrophobicContact CB-CG1 4.12Å; R1342-V1344 PolarHBondContact O-N 3.16Å; V1344-V1363 WeakPolarHBondContact CA-O 3.18Å; V1344-I1364 HydrophobicContact CG1-CG1 4.17Å
1345	G	67.2	Low	59.8	Low	11 Å²	11	71.3 Å²	71.3	11%	0.113	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	176.7	167.9	0	0	0	0	0	112.9	V1363	G1345-V1363 PolarHBondContact N-O 3.25Å; G1345-V1363 PolarHBondContact O-N 3.47Å
1346	M	58.6	Low	57.8	Low	163 Å²	163	78.1 Å²	78.1	80%	0.803	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.2	-171.4	-62.2	165.8	68.6	0	0	110.4	Y1362	M1346-Y1362 HydrophobicContact CG-CD1 4.48Å; M1346-Y1362 HydrophobicContact CG-CE1 4.41Å
1347	T	52.3	Low	55.9	Low	70 Å²	70	84 Å²	84	43%	0.429	47%	0.469	S	S	.	.			trans	-87.7	115.3	171.9	41.6	0	0	0	0	111.7	V1363	T1347-V1363 HydrophobicContact CG2-CB 3.89Å; T1347-V1363 HydrophobicContact CG2-CG1 4.42Å; T1347-V1363 HydrophobicContact CG2-CG2 3.52Å; T1347-V1363 WeakPolarHBondContact OG1-CG2 3.32Å
1348	G	42.2	Very low	53.6	Low	66 Å²	66	94 Å²	94	68%	0.68	51%	0.512	S	S	*	.			trans	-71.5	140.2	160.3	0	0	0	0	0	111
1349	N	39.5	Very low	51.6	Low	171 Å²	171	103 Å²	103	91%	0.914	54%	0.543	S	S	*	.			trans	85.3	74.8	174.4	-52.3	-20.9	0	0	0	117.2
1350	K	31.5	Very low	49.4	Very low	159 Å²	159	109.6 Å²	109.6	69%	0.691	58%	0.578	S	S	*	*			trans	-93.7	127.3	159.1	-163.2	176.2	-169.6	176.4	0	108.9	D1361	K1350-D1361 IonicContact NZ-OD1 2.76Å; K1350-D1361 IonicContact NZ-OD2 3.91Å; K1350-D1361 PolarHBondContact NZ-OD2 2.82Å
1351	L	33.7	Very low	47.7	Very low	163 Å²	163	111.2 Å²	111.2	85%	0.853	59%	0.592	S	S	*	*			trans	-142.3	64.5	175.9	-127	141.4	0	0	0	113.6
1352	S	29.6	Very low	46.5	Very low	103 Å²	103	117.8 Å²	117.8	72%	0.72	62%	0.618	S	S	*	*			trans	38.2	117.7	142.3	61.5	0	0	0	0	121.2
1353	S	29.5	Very low	45.5	Very low	109 Å²	109	118 Å²	118	76%	0.762	62%	0.624	S	S	*	*				-143.6	139.9	123.9	57.1	0	0	0	0	109.4
1354	S	31.3	Very low	45	Very low	106 Å²	106	121.1 Å²	121.1	74%	0.741	64%	0.64	S	S	*	*	S	Bend	trans	49.6	106.1	-174	42	0	0	0	0	116.4
1355	L	30.4	Very low	44.8	Very low	151 Å²	151	122.8 Å²	122.8	79%	0.791	65%	0.645	S	S	*	*				51.9	113.2	96.9	-78.5	81.3	0	0	0	112
1356	D	32.8	Very low	45.2	Very low	143 Å²	143	122.6 Å²	122.6	77%	0.765	64%	0.643	S	S	*	*			cis	-155.7	171.2	37.3	-94.7	-38.4	0	0	0	116.1
1357	E	32.7	Very low	46.4	Very low	192 Å²	192	119.2 Å²	119.2	90%	0.897	63%	0.625	S	S	*	*			trans	57.5	145.2	163.8	-61.4	-151.3	129	0	0	122.2
1358	K	29.1	Very low	47.9	Very low	211 Å²	211	117.1 Å²	117.1	92%	0.917	61%	0.612	S	S	*	*			trans	-90.5	128.8	-165	-61.1	167.2	-179.8	171.4	0	113.1
1359	R	40.6	Very low	49.8	Very low	225 Å²	225	116.4 Å²	116.4	85%	0.849	59%	0.594	S	S	*	*			trans	-148.4	157.5	145.6	-126	171.7	-179.1	163.7	-0.4	108.7	D1361	R1359-D1361 PolarHBondContact O-N 3.47Å
1360	D	40.3	Very low	51.8	Low	139 Å²	139	108.3 Å²	108.3	74%	0.743	55%	0.551	S	S	*	*			trans	-69.4	115.1	-179.8	-56.2	-71	0	0	0	109.9	Y1362	D1360-Y1362 VanDerWaalsContact C-N 3.34Å; D1360-Y1362 HydrophobicContact CB-CD2 4.38Å; D1360-Y1362 HydrophobicContact CB-CE2 3.98Å; D1360-Y1362 WeakPolarHBondContact O-CD2 3.34Å; D1360-Y1362 PolarHBondContact O-N 2.83Å
1361	D	49.8	Very low	54.2	Low	95 Å²	95	103.3 Å²	103.3	51%	0.508	53%	0.532	S	S	.	.			trans	-76.6	77.9	-170.3	-69.9	-54.2	0	0	0	112.5	K1350 R1359	K1350-D1361 IonicContact NZ-OD1 2.76Å; K1350-D1361 IonicContact NZ-OD2 3.91Å; K1350-D1361 PolarHBondContact NZ-OD2 2.82Å; R1359-D1361 PolarHBondContact O-N 3.47Å
1362	Y	61.3	Low	56.4	Low	138 Å²	138	95.6 Å²	95.6	54%	0.541	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	118.6	160.4	-62.9	-86.7	0	0	0	109.6	M1346 D1360	M1346-Y1362 HydrophobicContact CG-CD1 4.48Å; M1346-Y1362 HydrophobicContact CG-CE1 4.41Å; D1360-Y1362 VanDerWaalsContact C-N 3.34Å; D1360-Y1362 HydrophobicContact CB-CD2 4.38Å; D1360-Y1362 HydrophobicContact CB-CE2 3.98Å; D1360-Y1362 WeakPolarHBondContact O-CD2 3.34Å; D1360-Y1362 PolarHBondContact O-N 2.83Å
1363	V	65	Low	58.6	Low	53 Å²	53	91.5 Å²	91.5	32%	0.321	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	130.6	173.1	168.7	0	0	0	0	109.6	V1344 G1345 T1347 Y1365	V1344-V1363 WeakPolarHBondContact CA-O 3.18Å; G1345-V1363 PolarHBondContact N-O 3.25Å; G1345-V1363 PolarHBondContact O-N 3.47Å; T1347-V1363 HydrophobicContact CG2-CB 3.89Å; T1347-V1363 HydrophobicContact CG2-CG1 4.42Å; T1347-V1363 HydrophobicContact CG2-CG2 3.52Å; T1347-V1363 WeakPolarHBondContact OG1-CG2 3.32Å; V1363-Y1365 HydrophobicContact CG1-CD1 3.91Å; V1363-Y1365 HydrophobicContact CG1-CE1 3.88Å; V1363-Y1365 HydrophobicContact CG1-CG 4.47Å; V1363-Y1365 PolarHBondContact O-N 2.77Å
1364	I	70.6	Confident	61	Low	66 Å²	66	86.3 Å²	86.3	34%	0.338	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	104.8	172.3	-55.6	174.1	0	0	0	106.7	V1344 E1367	V1344-I1364 HydrophobicContact CG1-CG1 4.17Å; I1364-E1367 HydrophobicContact CG2-CB 3.67Å; I1364-E1367 HydrophobicContact CG2-CG 3.9Å
1365	Y	72.5	Confident	63	Low	44 Å²	44	81.4 Å²	81.4	17%	0.173	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-28.7	178.5	-65.2	-65.3	0	0	0	112.3	Q1150 F1274 P1300 A1303 A1343 V1363	Q1150-Y1365 HydrophobicContact CB-CD1 4.16Å; Q1150-Y1365 VanDerWaalsContact CD-CD1 3.48Å; Q1150-Y1365 HydrophobicContact CG-CD1 4.09Å; Q1150-Y1365 HydrophobicContact CG-CE1 4.21Å; Q1150-Y1365 VanDerWaalsContact OE1-CB 3.24Å; Q1150-Y1365 VanDerWaalsContact OE1-CD1 3.24Å; F1274-Y1365 WeakPolarHBondContact CZ-O 3.43Å; P1300-Y1365 HydrophobicContact CG-CG 4.3Å; A1303-Y1365 HydrophobicContact CB-CD2 4.16Å; A1343-Y1365 PolarHBondContact O-N 3.26Å; V1363-Y1365 HydrophobicContact CG1-CD1 3.91Å; V1363-Y1365 HydrophobicContact CG1-CE1 3.88Å; V1363-Y1365 HydrophobicContact CG1-CG 4.47Å; V1363-Y1365 PolarHBondContact O-N 2.77Å
1366	S	76.6	Confident	65.2	Low	8 Å²	8	74.2 Å²	74.2	6%	0.056	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	131.5	170.7	-164.1	0	0	0	0	108.2	Q1152 L1277 A1343	Q1152-S1366 PolarHBondContact OE1-OG 3.05Å; L1277-S1366 VanDerWaalsContact CB-OG 3.22Å; L1277-S1366 WeakPolarHBondContact CB-OG 3.22Å; L1277-S1366 PolarHBondContact N-OG 3.13Å; A1343-S1366 WeakPolarHBondContact CB-O 3.14Å; A1343-S1366 PolarHBondContact N-O 2.72Å
1367	E	83.9	Confident	67.4	Low	91 Å²	91	67.4 Å²	67.4	43%	0.425	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.2	167.2	57.2	172.4	-169.6	0	0	110.7	R1340 A1341 R1342 I1364	R1340-E1367 IonicContact CZ-OE2 2.94Å; R1340-E1367 IonicContact NH1-OE1 2.68Å; R1340-E1367 IonicContact NH1-OE2 3.14Å; R1340-E1367 PolarHBondContact NH1-OE2 2.68Å; A1341-E1367 WeakPolarHBondContact O-CA 3.38Å; R1342-E1367 HydrophobicContact CG-CB 4.47Å; I1364-E1367 HydrophobicContact CG2-CB 3.67Å; I1364-E1367 HydrophobicContact CG2-CG 3.9Å
1368	T	83.2	Confident	69.4	Low	26 Å²	26	59.5 Å²	59.5	16%	0.16	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	116.9	169.6	-173.7	0	0	0	0	108.3	L1277 L1279 R1340 A1341	L1277-T1368 HydrophobicContact CB-CG2 4.41Å; L1277-T1368 HydrophobicContact CD2-CG2 4.03Å; L1277-T1368 HydrophobicContact CG-CG2 3.77Å; L1277-T1368 VanDerWaalsContact O-CB 3.26Å; L1277-T1368 WeakPolarHBondContact O-CB 3.37Å; L1279-T1368 HydrophobicContact CD1-CG2 4.06Å; L1279-T1368 HydrophobicContact CG-CG2 3.85Å; R1340-T1368 WeakPolarHBondContact CA-O 3.41Å; A1341-T1368 HydrophobicContact CB-CG2 3.91Å; A1341-T1368 PolarHBondContact N-O 3.15Å; A1341-T1368 PolarHBondContact O-N 3.06Å
1369	V	82.6	Confident	71.5	Confident	52 Å²	52	50.2 Å²	50.2	32%	0.315	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	121.9	165.9	178.9	0	0	0	0	106.4	N1338 R1340	N1338-V1369 HydrophobicContact CB-CG1 3.98Å; R1340-V1369 HydrophobicContact CB-CG2 4.3Å; R1340-V1369 HydrophobicContact CG-CG2 3.96Å
1370	C	81.8	Confident	73.1	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.6	169.4	-165.4	0	0	0	0	111.4	L1279 C1282 N1338 I1339	L1279-C1370 HydrophobicContact CB-CB 4.07Å; L1279-C1370 HydrophobicContact CD1-CB 3.47Å; L1279-C1370 VanDerWaalsContact CD1-CB 3.47Å; L1279-C1370 HydrophobicContact CG-CB 4.4Å; C1282-C1370 WeakPolarHBondContact CA-SG 3.14Å; C1282-C1370 HydrophobicContact CB-CB 4.22Å; C1282-C1370 WeakPolarHBondContact CB-SG 2.86Å; C1282-C1370 WeakPolarHBondContact SG-CA 3.21Å; C1282-C1370 WeakPolarHBondContact SG-CB 3.02Å; C1282-C1370 CovalentContact SG-SG 2.04Å; C1282-C1370 PolarHBondContact SG-SG 3.41Å; N1338-C1370 WeakPolarHBondContact CA-O 3.13Å; I1339-C1370 HydrophobicContact CG2-CB 4.08Å; I1339-C1370 PolarHBondContact N-O 3.15Å; I1339-C1370 PolarHBondContact O-N 3.11Å
1371	N	80.8	Confident	74.7	Confident	55 Å²	55	40.1 Å²	40.1	29%	0.294	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.1	172.5	-63.7	-19.1	0	0	0	108.1	N1283 L1336 N1338	N1283-N1371 VanDerWaalsContact CA-O 3.3Å; N1283-N1371 WeakPolarHBondContact CA-O 3.01Å; N1283-N1371 PolarHBondContact N-O 3.07Å; L1336-N1371 HydrophobicContact CD1-CB 3.85Å; N1338-N1371 VanDerWaalsContact CG-OD1 3.32Å; N1338-N1371 PolarHBondContact ND2-OD1 2.55Å; N1338-N1371 VanDerWaalsContact ND2-OD1 3.17Å; N1338-N1371 PolarHBondContact OD1-OD1 3.12Å
1372	I	79.5	Confident	75.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	114.8	177.8	-58.8	156	0	0	0	106.4	F1284 L1286 L1294 I1316 I1328 A1337 I1339 I1374	F1284-I1372 HydrophobicContact CE1-CD1 4.48Å; F1284-I1372 HydrophobicContact CE1-CG1 3.87Å; F1284-I1372 HydrophobicContact CE1-CG2 4.37Å; F1284-I1372 HydrophobicContact CZ-CG1 4.44Å; F1284-I1372 HydrophobicContact CZ-CG2 4.28Å; L1286-I1372 HydrophobicContact CB-CG2 3.63Å; L1286-I1372 HydrophobicContact CD2-CG2 4.16Å; L1294-I1372 HydrophobicContact CD1-CD1 3.94Å; I1316-I1372 HydrophobicContact CD1-CB 4.04Å; I1316-I1372 HydrophobicContact CD1-CD1 3.48Å; I1316-I1372 VanDerWaalsContact CD1-CD1 3.48Å; I1316-I1372 HydrophobicContact CD1-CG1 4.38Å; I1316-I1372 HydrophobicContact CD1-CG2 4.24Å; I1328-I1372 HydrophobicContact CD1-CD1 3.64Å; A1337-I1372 PolarHBondContact N-O 2.8Å; A1337-I1372 WeakPolarHBondContact O-CA 3.35Å; A1337-I1372 WeakPolarHBondContact O-CB 3.37Å; A1337-I1372 PolarHBondContact O-N 3.32Å; A1337-I1372 VanDerWaalsContact O-O 3.08Å; I1339-I1372 HydrophobicContact CB-CD1 4.29Å; I1339-I1372 HydrophobicContact CG2-CD1 3.52Å; I1372-I1374 PolarHBondContact O-N 2.66Å
1373	H	76	Confident	76.1	Confident	17 Å²	17	34.6 Å²	34.6	8%	0.079	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.8	176.8	-48.3	117.9	0	0	0	107.5	F1284 N1285 L1286 V1375 F1445	F1284-H1373 PolarHBondContact O-N 2.71Å; N1285-H1373 CarbonylContact C-O 3.54Å; N1285-H1373 WeakPolarHBondContact CA-O 3.21Å; N1285-H1373 WeakPolarHBondContact OD1-CB 2.93Å; N1285-H1373 PolarHBondContact OD1-ND1 3.42Å; L1286-H1373 PolarHBondContact N-O 2.97Å; L1286-H1373 VanDerWaalsContact O-O 3.12Å; H1373-V1375 HydrophobicContact CB-CG1 3.71Å; H1373-V1375 PolarHBondContact O-N 2.96Å; H1373-F1445 AromaticContact CD2-CE2 3.92Å; H1373-F1445 AromaticContact CD2-CZ 3.46Å; H1373-F1445 VanDerWaalsContact CD2-CZ 3.46Å; H1373-F1445 WeakPolarHBondContact CD2-CZ 3.4Å; H1373-F1445 AromaticContact NE2-CZ 3.78Å
1374	I	79.4	Confident	75.7	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	109.9	168.7	-65.1	165.4	0	0	0	107	L1286 L1288 R1315 I1316 A1330 G1335 A1337 I1372	L1286-I1374 WeakPolarHBondContact O-CA 3.37Å; L1288-I1374 HydrophobicContact CD2-CG2 3.57Å; L1288-I1374 HydrophobicContact CG-CG2 4.29Å; R1315-I1374 VanDerWaalsContact C-CD1 3.47Å; R1315-I1374 HydrophobicContact CB-CD1 3.57Å; R1315-I1374 WeakPolarHBondContact O-CD1 3.19Å; I1316-I1374 HydrophobicContact CG1-CD1 3.79Å; A1330-I1374 HydrophobicContact CB-CD1 4.38Å; A1330-I1374 HydrophobicContact CB-CG1 4.2Å; A1330-I1374 HydrophobicContact CB-CG2 4.08Å; G1335-I1374 PolarHBondContact N-O 3.23Å; G1335-I1374 WeakPolarHBondContact O-CB 3.32Å; G1335-I1374 PolarHBondContact O-N 2.79Å; A1337-I1374 HydrophobicContact CB-CD1 3.86Å; I1372-I1374 PolarHBondContact O-N 2.66Å
1375	V	74.8	Confident	74.5	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.018	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	164.9	-173.6	-53.1	0	0	0	0	110.3	N1285 L1286 L1287 L1288 L1334 H1373 A1440 V1455	N1285-V1375 HydrophobicContact CB-CG2 3.9Å; L1286-V1375 PolarHBondContact O-N 2.77Å; L1287-V1375 CarbonylContact C-O 3.44Å; L1287-V1375 VanDerWaalsContact CA-O 3.32Å; L1287-V1375 WeakPolarHBondContact CA-O 3.11Å; L1287-V1375 HydrophobicContact CD2-CG2 3.72Å; L1288-V1375 PolarHBondContact N-O 3.01Å; L1334-V1375 VanDerWaalsContact CD2-C 3.5Å; H1373-V1375 HydrophobicContact CB-CG1 3.71Å; H1373-V1375 PolarHBondContact O-N 2.96Å; V1375-A1440 HydrophobicContact CB-CB 3.76Å; V1375-A1440 HydrophobicContact CG1-CB 3.72Å; V1375-A1440 HydrophobicContact CG2-CB 3.92Å; V1375-V1455 HydrophobicContact CG2-CG2 3.93Å
1376	A	76.2	Confident	72.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	152.1	156.8	0	0	0	0	0	108.7	L1288 L1334 S1378 A1440 Y1441 Q1529 I1531	L1288-A1376 HydrophobicContact CD1-CB 4.27Å; L1334-A1376 HydrophobicContact CD2-CB 4.01Å; L1334-A1376 VanDerWaalsContact CD2-N 3.32Å; A1376-S1378 PolarHBondContact O-N 2.94Å; A1376-A1440 CarbonylContact O-C 3.44Å; A1376-Y1441 PolarHBondContact N-O 2.78Å; A1376-Y1441 PolarHBondContact O-N 3.18Å; A1376-Q1529 WeakPolarHBondContact CA-O 3.4Å; A1376-I1531 HydrophobicContact CB-CB 3.65Å; A1376-I1531 HydrophobicContact CB-CD1 3.53Å; A1376-I1531 HydrophobicContact CB-CG1 3.44Å; A1376-I1531 VanDerWaalsContact CB-CG1 3.44Å
1377	L	78	Confident	70.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	121	169.7	-68	165.9	0	0	0	109.1	L1287 T1439 V1455 M1460 L1467 Q1529 I1530 I1531 L1543	L1287-L1377 HydrophobicContact CD1-CD1 3.63Å; L1287-L1377 HydrophobicContact CD1-CG 4Å; L1287-L1377 HydrophobicContact CD2-CD1 4.44Å; L1287-L1377 HydrophobicContact CD2-CD2 4.4Å; L1287-L1377 HydrophobicContact CD2-CG 3.9Å; L1377-T1439 WeakPolarHBondContact CA-O 3.17Å; L1377-V1455 HydrophobicContact CD2-CB 4.03Å; L1377-V1455 HydrophobicContact CD2-CG2 3.69Å; L1377-M1460 HydrophobicContact CD1-CE 3.79Å; L1377-M1460 HydrophobicContact CD2-CE 3.83Å; L1377-M1460 HydrophobicContact CD2-CG 4.44Å; L1377-M1460 HydrophobicContact CD2-SD 4.29Å; L1377-M1460 HydrophobicContact CG-CE 4.5Å; L1377-L1467 HydrophobicContact CD1-CD1 3.4Å; L1377-L1467 HydrophobicContact CD1-CD2 4.3Å; L1377-Q1529 PolarHBondContact N-O 3.14Å; L1377-I1530 HydrophobicContact CB-CG1 3.76Å; L1377-I1530 HydrophobicContact CD1-CG1 4.17Å; L1377-I1530 CarbonylContact O-C 3.56Å; L1377-I1530 VanDerWaalsContact O-CA 3.23Å; L1377-I1530 WeakPolarHBondContact O-CA 3.16Å; L1377-I1531 PolarHBondContact O-N 2.65Å; L1377-L1543 HydrophobicContact CB-CD1 3.46Å; L1377-L1543 VanDerWaalsContact CB-CD1 3.46Å
1378	S	75.8	Confident	68	Low	26 Å²	26	41.1 Å²	41.1	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-10.7	179.7	55.1	0	0	0	0	114.8	A1376 T1439 I1531	A1376-S1378 PolarHBondContact O-N 2.94Å; S1378-T1439 PolarHBondContact N-O 2.85Å; S1378-T1439 PolarHBondContact OG-O 2.81Å; S1378-T1439 VanDerWaalsContact OG-O 3.06Å; S1378-T1439 PolarHBondContact OG-OG1 2.81Å; S1378-I1531 WeakPolarHBondContact CA-O 3.46Å; S1378-I1531 VanDerWaalsContact CB-O 3.31Å; S1378-I1531 WeakPolarHBondContact CB-O 3.37Å
1379	G	72.6	Confident	65.5	Low	17 Å²	17	44.1 Å²	44.1	18%	0.175	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.2	167.2	-175.8	0	0	0	0	0	107.9	T1439	G1379-T1439 WeakPolarHBondContact CA-OG1 3.43Å; G1379-T1439 PolarHBondContact N-OG1 2.77Å; G1379-T1439 PolarHBondContact O-N 2.89Å; G1379-T1439 PolarHBondContact O-OG1 3.2Å
1380	V	74.9	Confident	63.1	Low	11 Å²	11	47.4 Å²	47.4	7%	0.067	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153	169.1	-73.8	0	0	0	0	108.7	V1436 E1437 M1460 L1518 V1520 L1543 A1545	V1380-V1436 HydrophobicContact CB-CG1 3.91Å; V1380-V1436 HydrophobicContact CG1-CG1 3.78Å; V1380-E1437 CarbonylContact C-O 2.7Å; V1380-E1437 WeakPolarHBondContact CA-O 3.07Å; V1380-M1460 HydrophobicContact CG1-CE 3.91Å; V1380-L1518 HydrophobicContact CB-CD2 4.04Å; V1380-L1518 HydrophobicContact CG2-CD2 3.84Å; V1380-L1518 HydrophobicContact CG2-CG 4.36Å; V1380-V1520 HydrophobicContact CG1-CB 4.11Å; V1380-V1520 HydrophobicContact CG1-CG2 3.89Å; V1380-V1520 HydrophobicContact CG2-CG2 4.29Å; V1380-L1543 HydrophobicContact CG1-CB 4.19Å; V1380-L1543 HydrophobicContact CG1-CD1 4.17Å; V1380-L1543 HydrophobicContact CG2-CB 3.89Å; V1380-A1545 HydrophobicContact CG2-CB 3.95Å; V1380-A1545 WeakPolarHBondContact O-CB 3.41Å
1381	R	74.3	Confident	60.7	Low	140 Å²	140	56 Å²	56	53%	0.528	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.7	174.6	-65.9	177.1	-179.5	175.8	1.7	107.2	E1437 T1439	R1381-E1437 HydrophobicContact CB-CB 4.27Å; R1381-E1437 PolarHBondContact N-O 2.98Å; R1381-E1437 PolarHBondContact O-N 2.84Å; R1381-T1439 HydrophobicContact CG-CG2 4Å; R1381-T1439 VanDerWaalsContact NE-CG2 3.3Å
1382	I	70.7	Confident	58.4	Low	10 Å²	10	61 Å²	61	5%	0.051	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.5	167.3	-58.8	156	0	0	0	105.5	L1434 W1471 V1516 L1518 A1545 L1547	I1382-L1434 HydrophobicContact CG2-CB 4.37Å; I1382-L1434 HydrophobicContact CG2-CD1 3.96Å; I1382-L1434 HydrophobicContact CG2-CD2 3.79Å; I1382-L1434 HydrophobicContact CG2-CG 4.25Å; I1382-W1471 HydrophobicContact CB-CZ3 4.31Å; I1382-W1471 HydrophobicContact CD1-CZ3 4.21Å; I1382-W1471 HydrophobicContact CG1-CH2 4.28Å; I1382-W1471 HydrophobicContact CG1-CZ3 3.75Å; I1382-W1471 HydrophobicContact CG2-CH2 3.97Å; I1382-W1471 HydrophobicContact CG2-CZ3 3.64Å; I1382-V1516 HydrophobicContact CD1-CB 4.16Å; I1382-V1516 HydrophobicContact CD1-CG1 3.82Å; I1382-V1516 WeakPolarHBondContact CD1-O 3.34Å; I1382-L1518 HydrophobicContact CD1-CB 3.85Å; I1382-L1518 HydrophobicContact CG1-CB 3.9Å; I1382-L1518 HydrophobicContact CG1-CD2 4Å; I1382-A1545 HydrophobicContact CD1-CB 3.89Å; I1382-A1545 HydrophobicContact CG1-CB 3.79Å; I1382-L1547 HydrophobicContact CB-CB 4.11Å; I1382-L1547 HydrophobicContact CB-CD2 3.65Å; I1382-L1547 HydrophobicContact CD1-CB 3.85Å; I1382-L1547 HydrophobicContact CG2-CD2 3.36Å
1383	R	67.9	Low	56.1	Low	107 Å²	107	65.1 Å²	65.1	40%	0.404	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	163.4	176.9	-88.9	-125	-71.3	-168.6	-4.5	111	W1435 E1437	R1383-W1435 HydrophobicContact CB-CZ2 4.01Å; R1383-W1435 PolarHBondContact N-O 2.88Å; R1383-W1435 PolarHBondContact O-N 3.02Å; R1383-E1437 IonicContact CZ-OE1 3.95Å; R1383-E1437 VanDerWaalsContact CZ-OE1 3.24Å; R1383-E1437 IonicContact CZ-OE2 2.66Å; R1383-E1437 IonicContact NE-OE1 2.85Å; R1383-E1437 PolarHBondContact NE-OE1 3.19Å; R1383-E1437 IonicContact NE-OE2 2.66Å; R1383-E1437 PolarHBondContact NE-OE2 3.18Å; R1383-E1437 IonicContact NH2-OE1 3.85Å; R1383-E1437 PolarHBondContact NH2-OE1 2.95Å; R1383-E1437 IonicContact NH2-OE2 2.81Å; R1383-E1437 PolarHBondContact NH2-OE2 3.41Å
1384	C	57.3	Low	53.8	Low	14 Å²	14	68.1 Å²	68.1	10%	0.095	37%	0.371	C	S	.	.			trans	-151.8	158.2	-172.6	69.9	0	0	0	0	112.1	L1386 F1417 T1432 P1433 L1434	C1384-L1386 PolarHBondContact O-N 2.86Å; C1384-F1417 HydrophobicContact CB-CE2 4.47Å; C1384-F1417 VanDerWaalsContact SG-CD2 3.55Å; C1384-F1417 VanDerWaalsContact SG-CE2 3.52Å; C1384-T1432 HydrophobicContact CB-CG2 3.38Å; C1384-P1433 VanDerWaalsContact CA-O 3.28Å; C1384-P1433 WeakPolarHBondContact CA-O 3.48Å; C1384-P1433 WeakPolarHBondContact CB-O 3.06Å; C1384-L1434 HydrophobicContact CB-CD2 3.87Å
1385	P	45	Very low	51.4	Low	67 Å²	67	75 Å²	75	44%	0.435	40%	0.403	S	S	.	.			trans	-93.4	70.8	-173.8	36.5	-31.4	0	0	0	111	A1387 P1433 W1435	P1385-A1387 PolarHBondContact O-N 2.79Å; P1385-P1433 WeakPolarHBondContact CD-O 3.49Å; P1385-P1433 HydrophobicContact CG-CB 3.91Å; P1385-P1433 HydrophobicContact CG-CG 3.77Å; P1385-W1435 HydrophobicContact CB-CH2 3.8Å; P1385-W1435 HydrophobicContact CB-CZ3 3.72Å; P1385-W1435 HydrophobicContact CG-CH2 4.32Å; P1385-W1435 HydrophobicContact CG-CZ3 3.77Å
1386	L	39.5	Very low	49.1	Very low	83 Å²	83	82.6 Å²	82.6	44%	0.435	44%	0.442	S	S	.	.			trans	-78.2	109.6	163.2	-71.9	169.5	0	0	0	108.1	C1384 N1388 F1417	C1384-L1386 PolarHBondContact O-N 2.86Å; L1386-N1388 PolarHBondContact O-N 3.06Å; L1386-F1417 HydrophobicContact CD1-CB 4.34Å; L1386-F1417 HydrophobicContact CD1-CD1 4.01Å; L1386-F1417 HydrophobicContact CD1-CG 4.35Å
1387	A	28.5	Very low	46.6	Very low	94 Å²	94	87.1 Å²	87.1	78%	0.777	47%	0.473	S	S	*	.			trans	-77.3	111.7	174.9	0	0	0	0	0	109.5	P1385	P1385-A1387 PolarHBondContact O-N 2.79Å
1388	N	30.1	Very low	44.1	Very low	142 Å²	142	94.3 Å²	94.3	76%	0.759	51%	0.512	S	S	*	.			trans	-127.1	157.2	168	-160.5	9.2	0	0	0	109.8	L1386	L1386-N1388 PolarHBondContact O-N 3.06Å
1389	L	30.5	Very low	41.8	Very low	88 Å²	88	96.7 Å²	96.7	46%	0.461	53%	0.529	S	S	.	.	S	Bend	trans	-85	174.6	-172.9	-146.9	81.8	0	0	0	112.4	E1391 Q1565	L1389-E1391 VanDerWaalsContact C-N 3.28Å; L1389-E1391 PolarHBondContact O-N 2.99Å; L1389-E1391 VanDerWaalsContact O-N 3.14Å; L1389-Q1565 HydrophobicContact CD1-CB 4.21Å; L1389-Q1565 HydrophobicContact CD1-CG 4.04Å
1390	D	31	Very low	39.5	Very low	122 Å²	122	100.8 Å²	100.8	65%	0.652	55%	0.554	S	S	*	*	S	Bend	trans	68.8	-5.5	171.7	-56.5	-27.9	0	0	0	118.4	T1393	D1390-T1393 WeakPolarHBondContact O-CB 3.28Å; D1390-T1393 VanDerWaalsContact O-CG2 3.23Å; D1390-T1393 WeakPolarHBondContact O-CG2 3.49Å; D1390-T1393 PolarHBondContact O-OG1 3.07Å
1391	E	32.4	Very low	37.2	Very low	179 Å²	179	107.4 Å²	107.4	84%	0.836	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.1	89.2	-179.8	-169.6	-178.5	-117.3	0	0	110.6	L1389	L1389-E1391 VanDerWaalsContact C-N 3.28Å; L1389-E1391 PolarHBondContact O-N 2.99Å; L1389-E1391 VanDerWaalsContact O-N 3.14Å
1392	I	32.1	Very low	35	Very low	161 Å²	161	104.3 Å²	104.3	83%	0.826	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	cis	-112.8	94.6	45.2	-49.7	177.5	0	0	0	111.3
1393	T	31.3	Very low	32.8	Very low	87 Å²	87	107 Å²	107	53%	0.534	61%	0.608	S	S	.	*			trans	-51.1	152.1	166.8	7.1	0	0	0	0	113.4	D1390	D1390-T1393 WeakPolarHBondContact O-CB 3.28Å; D1390-T1393 VanDerWaalsContact O-CG2 3.23Å; D1390-T1393 WeakPolarHBondContact O-CG2 3.49Å; D1390-T1393 PolarHBondContact O-OG1 3.07Å
1394	S	26.7	Very low	30.8	Very low	80 Å²	80	108.6 Å²	108.6	56%	0.559	62%	0.624	S	S	*	*	S	Bend	trans	11.8	136.8	146	57.4	0	0	0	0	121.2
1395	Q	30.6	Very low	29.3	Very low	145 Å²	145	110.8 Å²	110.8	68%	0.678	64%	0.638	S	S	*	*			trans	71.3	67.3	142.1	-60.6	154.6	-11	0	0	118.9
1396	I	25.2	Very low	28.2	Very low	162 Å²	162	113.9 Å²	113.9	83%	0.831	65%	0.646	S	S	*	*	S	Bend	trans	-140	88	146	-43.2	174.2	0	0	0	108.4
1397	S	24.4	Very low	27.6	Very low	94 Å²	94	113.6 Å²	113.6	66%	0.657	65%	0.645	S	S	*	*	S	Bend	cis	-131.4	168.3	-0.7	52.2	0	0	0	0	108.4	S1399	S1397-S1399 VanDerWaalsContact CB-N 3.32Å; S1397-S1399 WeakPolarHBondContact CB-OG 2.94Å
1398	D	25.8	Very low	27.5	Very low	152 Å²	152	112.3 Å²	112.3	81%	0.813	63%	0.63	S	S	*	*	S	Bend	cis	-72.8	97.2	22.9	-63	-52.9	0	0	0	115.4	S1400	D1398-S1400 PolarHBondContact O-N 2.97Å
1399	S	26.3	Very low	27.2	Very low	76 Å²	76	111.6 Å²	111.6	53%	0.531	63%	0.626	S	S	.	*			trans	-94.9	72.5	172.1	55.3	0	0	0	0	109.6	S1397 N1401	S1397-S1399 VanDerWaalsContact CB-N 3.32Å; S1397-S1399 WeakPolarHBondContact CB-OG 2.94Å; S1399-N1401 PolarHBondContact O-N 2.66Å
1400	S	25.6	Very low	27.1	Very low	102 Å²	102	109.3 Å²	109.3	71%	0.713	62%	0.618	S	S	*	*			trans	-81.7	91.3	164.9	65.1	0	0	0	0	109.6	D1398	D1398-S1400 PolarHBondContact O-N 2.97Å
1401	N	26.1	Very low	27	Very low	150 Å²	150	108.7 Å²	108.7	80%	0.802	61%	0.614	S	S	*	*	S	Bend	trans	69.3	111.2	169.7	-50	-39.7	0	0	0	117.3	S1399	S1399-N1401 PolarHBondContact O-N 2.66Å
1402	A	27.8	Very low	26.9	Very low	75 Å²	75	110.2 Å²	110.2	62%	0.62	61%	0.613	S	S	*	*				115	88.1	112.1	0	0	0	0	0	122.6
1403	N	24.7	Very low	26.8	Very low	66 Å²	66	105.6 Å²	105.6	35%	0.353	59%	0.594	S	S	.	*				80.9	102.5	106.5	-55.8	-14.9	0	0	0	123.9	N2447 T2448	N1403-N2447 WeakPolarHBondContact ND2-CA 3.37Å; N1403-T2448 WeakPolarHBondContact CA-O 3.26Å; N1403-T2448 WeakPolarHBondContact CB-O 3.48Å; N1403-T2448 WeakPolarHBondContact CB-OG1 3.21Å; N1403-T2448 PolarHBondContact OD1-O 3.12Å
1404	I	26.9	Very low	26.9	Very low	142 Å²	142	105.2 Å²	105.2	73%	0.728	59%	0.589	S	S	*	*			trans	-146.1	131.5	151.9	-67.2	-169.4	0	0	0	112.6	S2449 Y2450	I1404-S2449 CarbonylContact O-C 3.58Å; I1404-S2449 WeakPolarHBondContact O-CA 3.29Å; I1404-Y2450 WeakPolarHBondContact O-CA 3.46Å; I1404-Y2450 PolarHBondContact O-N 3.29Å
1405	P	24.3	Very low	28	Very low	60 Å²	60	106.9 Å²	106.9	39%	0.39	58%	0.583	S	S	.	*			trans	-103.1	-149.1	-174.8	45.1	-39	0	0	0	114.8	T2448 S2449 Y2450 N2451	P1405-T2448 HydrophobicContact CB-CG2 4.3Å; P1405-T2448 HydrophobicContact CG-CG2 3.75Å; P1405-S2449 VanDerWaalsContact CA-C 3.45Å; P1405-S2449 WeakPolarHBondContact CA-O 3.43Å; P1405-S2449 VanDerWaalsContact CB-O 3.3Å; P1405-S2449 WeakPolarHBondContact CB-O 3.43Å; P1405-Y2450 CarbonylContact C-O 3.58Å; P1405-Y2450 WeakPolarHBondContact CA-O 3.39Å; P1405-N2451 CarbonylContact C-O 3.34Å; P1405-N2451 VanDerWaalsContact O-O 3.12Å
1406	E	23.3	Very low	28.1	Very low	131 Å²	131	104.1 Å²	104.1	61%	0.612	57%	0.57	S	S	*	*				-148	107.8	-77.1	-169.6	-177.5	-124.2	0	0	112.9	Y2450 N2451	E1406-Y2450 WeakPolarHBondContact CA-O 3.44Å; E1406-Y2450 WeakPolarHBondContact CB-O 2.77Å; E1406-Y2450 WeakPolarHBondContact CG-O 3.11Å; E1406-Y2450 PolarHBondContact N-O 2.97Å; E1406-N2451 CarbonylContact C-O 3.51Å; E1406-N2451 WeakPolarHBondContact CA-O 2.76Å; E1406-N2451 HydrophobicContact CG-CB 4.29Å; E1406-N2451 PolarHBondContact N-O 3.22Å; E1406-N2451 VanDerWaalsContact N-O 3.14Å
1407	L	27.1	Very low	29.3	Very low	78 Å²	78	99.1 Å²	99.1	41%	0.408	54%	0.542	S	S	.	.			trans	-163.7	80.6	178.4	-131.9	129.5	0	0	0	113.3	N2451 N2452 T2453 Q2454	L1407-N2451 PolarHBondContact N-O 3.12Å; L1407-N2452 VanDerWaalsContact CB-O 3.23Å; L1407-N2452 WeakPolarHBondContact CB-O 3.45Å; L1407-N2452 CarbonylContact O-C 3.5Å; L1407-N2452 WeakPolarHBondContact O-CB 3.4Å; L1407-T2453 PolarHBondContact O-OG1 3.07Å; L1407-Q2454 HydrophobicContact CD2-CG 4.05Å
1408	S	25.5	Very low	30.2	Very low	67 Å²	67	99.2 Å²	99.2	47%	0.469	54%	0.535	S	S	.	.			trans	-18	159.6	141.3	71.6	0	0	0	0	117.3	T2453	S1408-T2453 PolarHBondContact O-OG1 2.61Å
1409	N	24.7	Very low	31.2	Very low	126 Å²	126	92.2 Å²	92.2	67%	0.674	50%	0.497	S	S	*	.			trans	59.9	109.9	157	-60.5	-60.2	0	0	0	117.9	T2453 Q2454	N1409-T2453 PolarHBondContact O-OG1 3.46Å; N1409-Q2454 WeakPolarHBondContact O-CG 3.5Å; N1409-Q2454 PolarHBondContact O-NE2 2.99Å
1410	S	26.8	Very low	31.9	Very low	41 Å²	41	89.2 Å²	89.2	29%	0.287	48%	0.477	S	S	.	.				-167.7	127.6	104.8	63.6	0	0	0	0	113.3	R2455	S1410-R2455 WeakPolarHBondContact OG-CG 3.25Å
1411	D	28.7	Very low	32.9	Very low	109 Å²	109	84.4 Å²	84.4	58%	0.583	44%	0.444	S	S	*	.			trans	42.3	124.8	131	-108.7	8.2	0	0	0	120.8	S1413	D1411-S1413 PolarHBondContact O-N 3.47Å
1412	R	32.2	Very low	33.6	Very low	211 Å²	211	77.9 Å²	77.9	80%	0.796	41%	0.41	S	S	*	.				46.9	73.3	125.8	-59.4	172.8	177.3	134.4	-11.2	117.5
1413	S	28	Very low	34.1	Very low	63 Å²	63	74.8 Å²	74.8	44%	0.441	38%	0.383	S	S	.	.				-145.4	123	122.8	46.3	0	0	0	0	109.3	D1411 R1415 S2457	D1411-S1413 PolarHBondContact O-N 3.47Å; S1413-R1415 PolarHBondContact O-N 2.89Å; S1413-S2457 VanDerWaalsContact CB-OG 3.22Å; S1413-S2457 WeakPolarHBondContact CB-OG 3.38Å; S1413-S2457 VanDerWaalsContact OG-CB 3.22Å; S1413-S2457 WeakPolarHBondContact OG-CB 3.36Å; S1413-S2457 PolarHBondContact OG-OG 2.89Å
1414	D	34.2	Very low	34.9	Very low	79 Å²	79	75.7 Å²	75.7	42%	0.422	41%	0.408	S	S	.	.			trans	-24.7	123.6	179.9	-64.1	-81.6	0	0	0	114	H1416	D1414-H1416 VanDerWaalsContact C-N 3.33Å; D1414-H1416 PolarHBondContact O-N 2.98Å; D1414-H1416 PolarHBondContact O-ND1 3Å
1415	R	49	Very low	35.4	Very low	116 Å²	116	75.2 Å²	75.2	44%	0.438	40%	0.397	S	S	.	.				41.7	64.1	97.8	-52.8	170.2	177.3	121.9	-5.9	110.6	S1413 Q1546 T1548	S1413-R1415 PolarHBondContact O-N 2.89Å; R1415-Q1546 VanDerWaalsContact CD-O 3.29Å; R1415-Q1546 WeakPolarHBondContact CD-O 3.33Å; R1415-Q1546 VanDerWaalsContact CZ-CG 3.48Å; R1415-Q1546 PolarHBondContact NE-O 2.81Å; R1415-T1548 CarbonylContact C-O 3.53Å; R1415-T1548 CarbonylContact O-C 3.48Å; R1415-T1548 VanDerWaalsContact O-C 3.25Å; R1415-T1548 VanDerWaalsContact O-CA 3.3Å; R1415-T1548 WeakPolarHBondContact O-CA 3.28Å; R1415-T1548 WeakPolarHBondContact O-CB 2.84Å; R1415-T1548 PolarHBondContact O-OG1 2.8Å
1416	H	33.9	Very low	36.1	Very low	86 Å²	86	74.9 Å²	74.9	40%	0.398	40%	0.396	S	S	.	.			trans	-133.9	75.2	178.1	-79.2	25.5	0	0	0	106.7	D1414 L1418 V1550	D1414-H1416 VanDerWaalsContact C-N 3.33Å; D1414-H1416 PolarHBondContact O-N 2.98Å; D1414-H1416 PolarHBondContact O-ND1 3Å; H1416-L1418 PolarHBondContact O-N 3.23Å; H1416-V1550 HydrophobicContact CB-CG2 3.65Å; H1416-V1550 WeakPolarHBondContact CD2-CG2 3.38Å; H1416-V1550 VanDerWaalsContact CG-CG2 3.43Å
1417	F	50.5	Low	37	Very low	58 Å²	58	73.4 Å²	73.4	25%	0.254	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	123.9	168.4	-80.9	-40.4	0	0	0	108.4	C1384 L1386 L1419 L1547 T1548 I1549 V1550	C1384-F1417 HydrophobicContact CB-CE2 4.47Å; C1384-F1417 VanDerWaalsContact SG-CD2 3.55Å; C1384-F1417 VanDerWaalsContact SG-CE2 3.52Å; L1386-F1417 HydrophobicContact CD1-CB 4.34Å; L1386-F1417 HydrophobicContact CD1-CD1 4.01Å; L1386-F1417 HydrophobicContact CD1-CG 4.35Å; F1417-L1419 PolarHBondContact O-N 2.79Å; F1417-L1419 VanDerWaalsContact O-N 3.09Å; F1417-L1547 HydrophobicContact CD2-CD1 3.45Å; F1417-L1547 VanDerWaalsContact CD2-CD1 3.45Å; F1417-L1547 HydrophobicContact CD2-CD2 3.57Å; F1417-L1547 HydrophobicContact CD2-CG 3.93Å; F1417-L1547 HydrophobicContact CE2-CD1 3.48Å; F1417-L1547 VanDerWaalsContact CE2-CD1 3.48Å; F1417-L1547 HydrophobicContact CE2-CD2 3.54Å; F1417-L1547 HydrophobicContact CE2-CG 4.09Å; F1417-L1547 HydrophobicContact CG-CD1 4.23Å; F1417-L1547 HydrophobicContact CZ-CD1 4.32Å; F1417-T1548 PolarHBondContact N-O 3.17Å; F1417-I1549 HydrophobicContact CB-CG1 4.24Å; F1417-V1550 CarbonylContact O-C 3.04Å; F1417-V1550 PolarHBondContact O-N 3.05Å
1418	L	41.9	Very low	37.8	Very low	96 Å²	96	72 Å²	72	50%	0.503	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	86.6	-179.9	-54.6	-176.6	0	0	0	108.1	H1416 A1420 V1550 L1552	H1416-L1418 PolarHBondContact O-N 3.23Å; L1418-A1420 PolarHBondContact O-N 2.82Å; L1418-V1550 CarbonylContact C-O 2.85Å; L1418-V1550 WeakPolarHBondContact CA-O 3.47Å; L1418-V1550 HydrophobicContact CD2-CB 4.07Å; L1418-V1550 HydrophobicContact CD2-CG1 4.37Å; L1418-L1552 HydrophobicContact CB-CB 4.42Å; L1418-L1552 HydrophobicContact CB-CD1 4.23Å; L1418-L1552 HydrophobicContact CD1-CD1 4Å; L1418-L1552 HydrophobicContact CD2-CD1 3.85Å; L1418-L1552 HydrophobicContact CD2-CG 4.23Å; L1418-L1552 HydrophobicContact CG-CD1 4.22Å
1419	L	48.2	Very low	38.7	Very low	4 Å²	4	68.9 Å²	68.9	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109.5	-177.9	-149.5	-175	0	0	0	108.7	F1417 C1421 G1430 T1432 V1482 L1506 I1549 V1550 V1551 L1552	F1417-L1419 PolarHBondContact O-N 2.79Å; F1417-L1419 VanDerWaalsContact O-N 3.09Å; L1419-C1421 PolarHBondContact O-N 3.31Å; L1419-G1430 VanDerWaalsContact CD2-O 3.25Å; L1419-G1430 WeakPolarHBondContact CD2-O 3.19Å; L1419-T1432 WeakPolarHBondContact CD2-OG1 3.08Å; L1419-T1432 WeakPolarHBondContact CG-OG1 3.02Å; L1419-V1482 HydrophobicContact CD1-CG1 4.4Å; L1419-L1506 HydrophobicContact CD1-CD2 3.93Å; L1419-L1506 HydrophobicContact CD1-CG 4.28Å; L1419-I1549 HydrophobicContact CB-CG2 3.5Å; L1419-I1549 VanDerWaalsContact CB-CG2 3.5Å; L1419-I1549 HydrophobicContact CD1-CG2 3.87Å; L1419-I1549 HydrophobicContact CG-CG2 4.26Å; L1419-V1550 PolarHBondContact N-O 3.03Å; L1419-V1551 HydrophobicContact CB-CG2 4.42Å; L1419-V1551 CarbonylContact O-C 3.42Å; L1419-V1551 WeakPolarHBondContact O-CA 3.49Å; L1419-V1551 VanDerWaalsContact O-CG1 3.29Å; L1419-V1551 WeakPolarHBondContact O-CG1 3.06Å; L1419-L1552 PolarHBondContact O-N 2.83Å
1420	A	41.3	Very low	39.6	Very low	14 Å²	14	64 Å²	64	12%	0.116	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	111	-173.6	0	0	0	0	0	113.6	L1418 G1430 L1552 R1554 W1580	L1418-A1420 PolarHBondContact O-N 2.82Å; A1420-G1430 PolarHBondContact O-N 3.43Å; A1420-G1430 VanDerWaalsContact O-N 3.1Å; A1420-L1552 CarbonylContact C-O 2.74Å; A1420-L1552 WeakPolarHBondContact CA-O 3.48Å; A1420-R1554 HydrophobicContact CB-CB 3.48Å; A1420-R1554 VanDerWaalsContact CB-CB 3.48Å; A1420-R1554 HydrophobicContact CB-CG 3.94Å; A1420-W1580 HydrophobicContact CB-CH2 4.09Å; A1420-W1580 HydrophobicContact CB-CZ3 3.58Å
1421	C	45.1	Very low	41.1	Very low	1 Å²	1	64.8 Å²	64.8	1%	0.007	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	123.1	159.9	-98.6	0	0	0	0	109.8	L1419 P1423 C1429 P1511 V1551 L1552 W1580	L1419-C1421 PolarHBondContact O-N 3.31Å; C1421-P1423 WeakPolarHBondContact O-CD 3.44Å; C1421-C1429 WeakPolarHBondContact CA-SG 3.49Å; C1421-C1429 HydrophobicContact CB-CB 3.86Å; C1421-C1429 WeakPolarHBondContact CB-SG 3.17Å; C1421-C1429 WeakPolarHBondContact SG-CB 3.16Å; C1421-C1429 CovalentContact SG-SG 2.03Å; C1421-C1429 PolarHBondContact SG-SG 3.45Å; C1421-P1511 HydrophobicContact CB-CG 4.34Å; C1421-P1511 VanDerWaalsContact SG-CD 3.52Å; C1421-V1551 HydrophobicContact CB-CG1 4.11Å; C1421-V1551 WeakPolarHBondContact SG-CG1 3.48Å; C1421-L1552 PolarHBondContact N-O 3.19Å; C1421-W1580 WeakPolarHBondContact O-CZ3 3.16Å
1422	P	40.8	Very low	42.5	Very low	13 Å²	13	60.2 Å²	60.2	8%	0.084	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-74.7	127	161.3	29.1	-22.5	0	0	0	108.6	R1425 D1428 C1429 H1561 W1580	P1422-R1425 HydrophobicContact CG-CB 4.47Å; P1422-R1425 PolarHBondContact O-N 3.34Å; P1422-D1428 WeakPolarHBondContact CG-O 3.44Å; P1422-C1429 VanDerWaalsContact CD-CA 3.48Å; P1422-H1561 WeakPolarHBondContact CB-NE2 3.48Å; P1422-W1580 VanDerWaalsContact CA-CZ3 3.45Å; P1422-W1580 HydrophobicContact CB-CE3 4.45Å; P1422-W1580 HydrophobicContact CB-CH2 3.78Å; P1422-W1580 HydrophobicContact CB-CZ2 4.05Å; P1422-W1580 HydrophobicContact CB-CZ3 4.01Å; P1422-W1580 HydrophobicContact CG-CH2 4.47Å; P1422-W1580 VanDerWaalsContact N-CZ3 3.32Å
1423	P	38.9	Very low	44	Very low	9 Å²	9	52.7 Å²	52.7	6%	0.058	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	146.1	-175	-9	1.1	0	0	0	114.4	C1421 R1425 W1580 T1581 D1582	C1421-P1423 WeakPolarHBondContact O-CD 3.44Å; P1423-R1425 PolarHBondContact O-N 3.12Å; P1423-R1425 VanDerWaalsContact O-N 3.12Å; P1423-W1580 HydrophobicContact CG-CB 3.5Å; P1423-W1580 HydrophobicContact CG-CG 4.1Å; P1423-T1581 WeakPolarHBondContact CB-OG1 3.48Å; P1423-T1581 VanDerWaalsContact CG-CA 3.44Å; P1423-T1581 WeakPolarHBondContact CG-OG1 3.25Å; P1423-D1582 VanDerWaalsContact CA-CG 3.45Å; P1423-D1582 WeakPolarHBondContact CA-OD1 3.36Å; P1423-D1582 WeakPolarHBondContact CA-OD2 3.32Å; P1423-D1582 HydrophobicContact CB-CB 4.1Å; P1423-D1582 WeakPolarHBondContact CB-OD1 3.29Å; P1423-D1582 WeakPolarHBondContact CD-OD2 3.41Å; P1423-D1582 HydrophobicContact CG-CB 4.01Å; P1423-D1582 VanDerWaalsContact CG-N 3.34Å
1424	G	41.1	Very low	46	Very low	86 Å²	86	49.7 Å²	49.7	89%	0.887	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	8.9	175.1	0	0	0	0	0	114.6
1425	R	37.4	Very low	47.7	Very low	132 Å²	132	48.3 Å²	48.3	50%	0.498	27%	0.271	S	S	.	.			trans	-125.6	71	178.6	-159.4	177.3	-161.6	-175.1	2.1	112	P1422 P1423 D1427 D1428	P1422-R1425 HydrophobicContact CG-CB 4.47Å; P1422-R1425 PolarHBondContact O-N 3.34Å; P1423-R1425 PolarHBondContact O-N 3.12Å; P1423-R1425 VanDerWaalsContact O-N 3.12Å; R1425-D1427 PolarHBondContact O-N 3.04Å; R1425-D1428 PolarHBondContact O-N 3.17Å; R1425-D1428 VanDerWaalsContact O-N 3.15Å
1426	S	39.3	Very low	48.9	Very low	52 Å²	52	42.8 Å²	42.8	36%	0.364	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-6.3	-178.3	53.5	0	0	0	0	115.4	L2468	S1426-L2468 WeakPolarHBondContact O-CB 3.43Å; S1426-L2468 WeakPolarHBondContact O-CD2 3.04Å; S1426-L2468 WeakPolarHBondContact OG-CD1 3.44Å
1427	D	42.1	Very low	50.9	Low	100 Å²	100	39.1 Å²	39.1	54%	0.535	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-30	173.7	-62.6	-97.6	0	0	0	114.1	R1425 L2468	R1425-D1427 PolarHBondContact O-N 3.04Å; D1427-L2468 HydrophobicContact CB-CD1 4.16Å; D1427-L2468 HydrophobicContact CB-CD2 4.25Å; D1427-L2468 VanDerWaalsContact OD1-CD1 3.25Å; D1427-L2468 WeakPolarHBondContact OD1-CD1 3.1Å; D1427-L2468 VanDerWaalsContact OD2-CD1 3.3Å; D1427-L2468 WeakPolarHBondContact OD2-CD1 3.38Å
1428	D	44.3	Very low	51.9	Low	48 Å²	48	36.4 Å²	36.4	26%	0.257	22%	0.222	S	C	.	.			trans	-148.6	47.1	-155.7	-146.3	26	0	0	0	110.7	P1422 R1425 R1490	P1422-D1428 WeakPolarHBondContact CG-O 3.44Å; R1425-D1428 PolarHBondContact O-N 3.17Å; R1425-D1428 VanDerWaalsContact O-N 3.15Å; D1428-R1490 IonicContact OD1-CZ 3.59Å; D1428-R1490 IonicContact OD1-NH1 3.21Å; D1428-R1490 PolarHBondContact OD1-NH1 2.94Å; D1428-R1490 VanDerWaalsContact OD1-NH1 3.15Å; D1428-R1490 IonicContact OD1-NH2 2.73Å; D1428-R1490 PolarHBondContact OD1-NH2 3.35Å
1429	C	45	Very low	53.4	Low	3 Å²	3	33.1 Å²	33.1	2%	0.02	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	134.7	160.6	-60.3	0	0	0	0	109.1	C1421 P1422 S1431 G1508 V1551	C1421-C1429 WeakPolarHBondContact CA-SG 3.49Å; C1421-C1429 HydrophobicContact CB-CB 3.86Å; C1421-C1429 WeakPolarHBondContact CB-SG 3.17Å; C1421-C1429 WeakPolarHBondContact SG-CB 3.16Å; C1421-C1429 CovalentContact SG-SG 2.03Å; C1421-C1429 PolarHBondContact SG-SG 3.45Å; P1422-C1429 VanDerWaalsContact CD-CA 3.48Å; C1429-S1431 PolarHBondContact O-N 3.21Å; C1429-G1508 WeakPolarHBondContact CA-O 3.06Å; C1429-G1508 VanDerWaalsContact CB-O 3.28Å; C1429-G1508 WeakPolarHBondContact CB-O 3.24Å; C1429-G1508 PolarHBondContact N-O 2.95Å; C1429-G1508 WeakPolarHBondContact O-CA 2.85Å; C1429-G1508 PolarHBondContact O-N 2.65Å; C1429-V1551 HydrophobicContact CB-CG1 4.11Å
1430	G	43.9	Very low	54.3	Low	24 Å²	24	33.4 Å²	33.4	25%	0.247	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-42.1	125.5	-143.6	0	0	0	0	0	115.9	L1419 A1420 T1432	L1419-G1430 VanDerWaalsContact CD2-O 3.25Å; L1419-G1430 WeakPolarHBondContact CD2-O 3.19Å; A1420-G1430 PolarHBondContact O-N 3.43Å; A1420-G1430 VanDerWaalsContact O-N 3.1Å; G1430-T1432 PolarHBondContact O-N 3.3Å; G1430-T1432 PolarHBondContact O-OG1 3.45Å
1431	S	56.6	Low	55.6	Low	56 Å²	56	36.8 Å²	36.8	39%	0.392	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	100.9	169.5	61.2	0	0	0	0	109.2	C1429 P1433	C1429-S1431 PolarHBondContact O-N 3.21Å; S1431-P1433 WeakPolarHBondContact O-CD 3.35Å
1432	T	58.3	Low	56.3	Low	13 Å²	13	37.3 Å²	37.3	8%	0.08	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	107.5	-174.3	-72.6	0	0	0	0	108.3	C1384 L1419 G1430 L1434 L1506	C1384-T1432 HydrophobicContact CB-CG2 3.38Å; L1419-T1432 WeakPolarHBondContact CD2-OG1 3.08Å; L1419-T1432 WeakPolarHBondContact CG-OG1 3.02Å; G1430-T1432 PolarHBondContact O-N 3.3Å; G1430-T1432 PolarHBondContact O-OG1 3.45Å; T1432-L1434 PolarHBondContact O-N 2.8Å; T1432-L1506 PolarHBondContact N-O 2.75Å; T1432-L1506 WeakPolarHBondContact O-CA 3.28Å; T1432-L1506 VanDerWaalsContact O-CB 3.31Å; T1432-L1506 WeakPolarHBondContact O-CB 3.14Å; T1432-L1506 PolarHBondContact O-N 3.2Å
1433	P	63.7	Low	56.9	Low	53 Å²	53	40 Å²	40	34%	0.344	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.9	134.2	174.1	-27.9	33.9	0	0	0	111.3	C1384 P1385 S1431 M1504	C1384-P1433 VanDerWaalsContact CA-O 3.28Å; C1384-P1433 WeakPolarHBondContact CA-O 3.48Å; C1384-P1433 WeakPolarHBondContact CB-O 3.06Å; P1385-P1433 WeakPolarHBondContact CD-O 3.49Å; P1385-P1433 HydrophobicContact CG-CB 3.91Å; P1385-P1433 HydrophobicContact CG-CG 3.77Å; S1431-P1433 WeakPolarHBondContact O-CD 3.35Å; P1433-M1504 CarbonylContact C-O 3.49Å; P1433-M1504 VanDerWaalsContact CA-O 3.27Å; P1433-M1504 WeakPolarHBondContact CA-O 3.4Å
1434	L	69.7	Low	57.8	Low	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.7	167.6	-66.4	-174.2	0	0	0	110.1	I1382 C1384 T1432 W1471 L1484 M1504 L1506 V1516	I1382-L1434 HydrophobicContact CG2-CB 4.37Å; I1382-L1434 HydrophobicContact CG2-CD1 3.96Å; I1382-L1434 HydrophobicContact CG2-CD2 3.79Å; I1382-L1434 HydrophobicContact CG2-CG 4.25Å; C1384-L1434 HydrophobicContact CB-CD2 3.87Å; T1432-L1434 PolarHBondContact O-N 2.8Å; L1434-W1471 HydrophobicContact CB-CH2 3.79Å; L1434-W1471 HydrophobicContact CB-CZ3 4.09Å; L1434-W1471 HydrophobicContact CD1-CE3 4.46Å; L1434-W1471 HydrophobicContact CD1-CH2 4.39Å; L1434-W1471 HydrophobicContact CD1-CZ3 3.83Å; L1434-L1484 HydrophobicContact CD1-CD1 3.83Å; L1434-M1504 HydrophobicContact CB-CB 3.95Å; L1434-M1504 PolarHBondContact N-O 2.9Å; L1434-L1506 HydrophobicContact CD1-CB 3.65Å; L1434-L1506 HydrophobicContact CD1-CD1 4.06Å; L1434-L1506 HydrophobicContact CD1-CD2 4.14Å; L1434-L1506 HydrophobicContact CD1-CG 4.15Å; L1434-L1506 HydrophobicContact CD2-CB 4.02Å; L1434-L1506 HydrophobicContact CD2-CD2 3.97Å; L1434-L1506 HydrophobicContact CG-CB 3.51Å; L1434-L1506 HydrophobicContact CG-CD2 4.27Å; L1434-L1506 HydrophobicContact CG-CG 4.37Å; L1434-V1516 HydrophobicContact CD1-CG1 4.04Å; L1434-V1516 HydrophobicContact CD1-CG2 4.15Å
1435	W	70.8	Confident	58.1	Low	50 Å²	50	44.9 Å²	44.9	19%	0.189	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	158.8	167.6	65.5	76.3	0	0	0	111.2	R1383 P1385 E1437 P1457 A1501	R1383-W1435 HydrophobicContact CB-CZ2 4.01Å; R1383-W1435 PolarHBondContact N-O 2.88Å; R1383-W1435 PolarHBondContact O-N 3.02Å; P1385-W1435 HydrophobicContact CB-CH2 3.8Å; P1385-W1435 HydrophobicContact CB-CZ3 3.72Å; P1385-W1435 HydrophobicContact CG-CH2 4.32Å; P1385-W1435 HydrophobicContact CG-CZ3 3.77Å; W1435-E1437 PolarHBondContact NE1-OE1 2.69Å; W1435-P1457 HydrophobicContact CB-CB 3.96Å; W1435-P1457 HydrophobicContact CB-CG 3.43Å; W1435-P1457 VanDerWaalsContact CB-CG 3.43Å; W1435-P1457 HydrophobicContact CD2-CG 4.47Å; W1435-P1457 HydrophobicContact CG-CG 3.49Å; W1435-P1457 VanDerWaalsContact CG-CG 3.49Å; W1435-A1501 CarbonylContact C-O 3.4Å; W1435-A1501 VanDerWaalsContact CA-O 3.28Å; W1435-A1501 WeakPolarHBondContact CA-O 3.41Å
1436	V	75.1	Confident	58.3	Low	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.9	170.9	-172.1	0	0	0	0	108.8	V1380 P1457 M1460 Y1469 W1471 A1501 L1518 V1520	V1380-V1436 HydrophobicContact CB-CG1 3.91Å; V1380-V1436 HydrophobicContact CG1-CG1 3.78Å; V1436-P1457 WeakPolarHBondContact O-CA 3.26Å; V1436-P1457 WeakPolarHBondContact O-CG 3.42Å; V1436-M1460 HydrophobicContact CB-SD 4.2Å; V1436-M1460 HydrophobicContact CG1-CE 3.72Å; V1436-M1460 HydrophobicContact CG1-SD 3.68Å; V1436-Y1469 HydrophobicContact CB-CD1 4.42Å; V1436-Y1469 HydrophobicContact CB-CE1 4.21Å; V1436-Y1469 HydrophobicContact CG1-CE1 4.32Å; V1436-Y1469 HydrophobicContact CG2-CD1 3.81Å; V1436-Y1469 HydrophobicContact CG2-CE1 4.09Å; V1436-W1471 HydrophobicContact CG2-CH2 3.86Å; V1436-W1471 HydrophobicContact CG2-CZ2 3.34Å; V1436-A1501 HydrophobicContact CB-CB 4.39Å; V1436-A1501 PolarHBondContact N-O 2.81Å; V1436-L1518 HydrophobicContact CB-CD2 4.04Å; V1436-L1518 HydrophobicContact CG1-CD2 3.55Å; V1436-L1518 HydrophobicContact CG2-CD1 3.83Å; V1436-L1518 HydrophobicContact CG2-CD2 3.42Å; V1436-L1518 VanDerWaalsContact CG2-CD2 3.42Å; V1436-L1518 HydrophobicContact CG2-CG 4.26Å; V1436-V1520 HydrophobicContact CG1-CG2 4.28Å
1437	E	74.5	Confident	58.6	Low	10 Å²	10	48.7 Å²	48.7	5%	0.047	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.1	160.2	-85.4	171.3	-161.5	0	0	109.3	V1380 R1381 R1383 W1435 I1454	V1380-E1437 CarbonylContact C-O 2.7Å; V1380-E1437 WeakPolarHBondContact CA-O 3.07Å; R1381-E1437 HydrophobicContact CB-CB 4.27Å; R1381-E1437 PolarHBondContact N-O 2.98Å; R1381-E1437 PolarHBondContact O-N 2.84Å; R1383-E1437 IonicContact CZ-OE1 3.95Å; R1383-E1437 VanDerWaalsContact CZ-OE1 3.24Å; R1383-E1437 IonicContact CZ-OE2 2.66Å; R1383-E1437 IonicContact NE-OE1 2.85Å; R1383-E1437 PolarHBondContact NE-OE1 3.19Å; R1383-E1437 IonicContact NE-OE2 2.66Å; R1383-E1437 PolarHBondContact NE-OE2 3.18Å; R1383-E1437 IonicContact NH2-OE1 3.85Å; R1383-E1437 PolarHBondContact NH2-OE1 2.95Å; R1383-E1437 IonicContact NH2-OE2 2.81Å; R1383-E1437 PolarHBondContact NH2-OE2 3.41Å; W1435-E1437 PolarHBondContact NE1-OE1 2.69Å; E1437-I1454 HydrophobicContact CB-CG2 3.88Å; E1437-I1454 VanDerWaalsContact CD-CG2 3.44Å; E1437-I1454 HydrophobicContact CG-CG2 3.43Å; E1437-I1454 VanDerWaalsContact CG-CG2 3.43Å
1438	G	72.7	Confident	58.6	Low	1 Å²	1	47.5 Å²	47.5	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.8	169.6	0	0	0	0	0	109.6	A1440 I1454 V1455 M1460	G1438-A1440 PolarHBondContact O-N 2.7Å; G1438-I1454 CarbonylContact O-C 2.76Å; G1438-I1454 WeakPolarHBondContact O-CA 3.36Å; G1438-V1455 PolarHBondContact N-O 3.4Å; G1438-V1455 PolarHBondContact O-N 2.98Å; G1438-M1460 PolarHBondContact N-SD 3.32Å
1439	T	71.7	Confident	58.5	Low	26 Å²	26	50.4 Å²	50.4	16%	0.16	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	122.4	161.4	58.7	0	0	0	0	107.7	L1377 S1378 G1379 R1381	L1377-T1439 WeakPolarHBondContact CA-O 3.17Å; S1378-T1439 PolarHBondContact N-O 2.85Å; S1378-T1439 PolarHBondContact OG-O 2.81Å; S1378-T1439 VanDerWaalsContact OG-O 3.06Å; S1378-T1439 PolarHBondContact OG-OG1 2.81Å; G1379-T1439 WeakPolarHBondContact CA-OG1 3.43Å; G1379-T1439 PolarHBondContact N-OG1 2.77Å; G1379-T1439 PolarHBondContact O-N 2.89Å; G1379-T1439 PolarHBondContact O-OG1 3.2Å; R1381-T1439 HydrophobicContact CG-CG2 4Å; R1381-T1439 VanDerWaalsContact NE-CG2 3.3Å
1440	A	68.8	Low	58.4	Low	11 Å²	11	54 Å²	54	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	140.1	169.2	0	0	0	0	0	110	V1375 A1376 G1438 N1453 V1455	V1375-A1440 HydrophobicContact CB-CB 3.76Å; V1375-A1440 HydrophobicContact CG1-CB 3.72Å; V1375-A1440 HydrophobicContact CG2-CB 3.92Å; A1376-A1440 CarbonylContact O-C 3.44Å; G1438-A1440 PolarHBondContact O-N 2.7Å; A1440-N1453 PolarHBondContact N-O 2.85Å; A1440-V1455 HydrophobicContact CB-CG2 4.39Å
1441	Y	68	Low	58.3	Low	84 Å²	84	59.1 Å²	59.1	33%	0.329	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.8	153.3	169.2	-111.4	0	0	0	109.1	L1334 A1376 P1443 I1531 V1533	L1334-Y1441 HydrophobicContact CD1-CD1 3.59Å; L1334-Y1441 HydrophobicContact CD1-CE1 3.52Å; A1376-Y1441 PolarHBondContact N-O 2.78Å; A1376-Y1441 PolarHBondContact O-N 3.18Å; Y1441-P1443 HydrophobicContact CE2-CB 4.43Å; Y1441-I1531 HydrophobicContact CD1-CB 4.27Å; Y1441-I1531 HydrophobicContact CD1-CG2 3.84Å; Y1441-I1531 HydrophobicContact CE1-CG2 4.01Å; Y1441-V1533 HydrophobicContact CD2-CG2 3.5Å; Y1441-V1533 HydrophobicContact CE2-CG2 3.97Å; Y1441-V1533 HydrophobicContact CG-CG2 3.8Å
1442	S	58.9	Low	57.8	Low	12 Å²	12	57.9 Å²	57.9	8%	0.084	30%	0.302	C	S	.	.			trans	-143.8	112.8	173.1	-177.9	0	0	0	0	107.6	Y1444 F1445	S1442-Y1444 PolarHBondContact O-N 3.33Å; S1442-F1445 WeakPolarHBondContact OG-CD2 3.31Å
1443	P	54.6	Low	57.8	Low	70 Å²	70	59.3 Å²	59.3	46%	0.455	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	22.4	-175.4	31.7	-36.7	0	0	0	113.6	L1334 Y1441	L1334-P1443 HydrophobicContact CB-CG 4.39Å; L1334-P1443 HydrophobicContact CD1-CG 4.26Å; Y1441-P1443 HydrophobicContact CE2-CB 4.43Å
1444	Y	56.8	Low	57.7	Low	150 Å²	150	58.8 Å²	58.8	59%	0.588	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	-2.2	-174.3	-70.2	-76.3	0	0	0	114.1	L1334 S1442	L1334-Y1444 WeakPolarHBondContact O-CE2 3.34Å; S1442-Y1444 PolarHBondContact O-N 3.33Å
1445	F	48.5	Very low	57.7	Low	47 Å²	47	58.8 Å²	58.8	21%	0.206	30%	0.303	C	S	.	.			trans	-106.6	126.2	176	-75.2	-92	0	0	0	110.7	L1336 H1373 S1442 Q1449	L1336-F1445 HydrophobicContact CB-CZ 4.4Å; H1373-F1445 AromaticContact CD2-CE2 3.92Å; H1373-F1445 AromaticContact CD2-CZ 3.46Å; H1373-F1445 VanDerWaalsContact CD2-CZ 3.46Å; H1373-F1445 WeakPolarHBondContact CD2-CZ 3.4Å; H1373-F1445 AromaticContact NE2-CZ 3.78Å; S1442-F1445 WeakPolarHBondContact OG-CD2 3.31Å; F1445-Q1449 HydrophobicContact CD1-CB 4.24Å; F1445-Q1449 VanDerWaalsContact CE1-OE1 3.27Å
1446	S	41.8	Very low	57.4	Low	79 Å²	79	59.1 Å²	59.1	55%	0.552	31%	0.313	S	S	*	.			trans	-73.2	164.7	167	54.1	0	0	0	0	111	D1448	S1446-D1448 PolarHBondContact O-N 3.06Å; S1446-D1448 VanDerWaalsContact O-N 3.1Å
1447	E	44.6	Very low	56.9	Low	185 Å²	185	60.1 Å²	60.1	86%	0.864	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-19	-162.5	-59.7	-175.1	108.6	0	0	114.5	Q1449	E1447-Q1449 PolarHBondContact O-N 2.98Å
1448	D	42.3	Very low	56.4	Low	75 Å²	75	65.9 Å²	65.9	40%	0.401	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-24.1	-173.7	-50	-64.6	0	0	0	115.1	S1446 S1450	S1446-D1448 PolarHBondContact O-N 3.06Å; S1446-D1448 VanDerWaalsContact O-N 3.1Å; D1448-S1450 PolarHBondContact O-N 3.3Å; D1448-S1450 VanDerWaalsContact O-N 3.1Å
1449	Q	42.6	Very low	56	Low	110 Å²	110	67 Å²	67	51%	0.514	36%	0.361	S	S	.	.			trans	-88.6	41.3	-177.7	-62.3	-165.2	4.7	0	0	112.6	F1445 E1447 I1451 S1452	F1445-Q1449 HydrophobicContact CD1-CB 4.24Å; F1445-Q1449 VanDerWaalsContact CE1-OE1 3.27Å; E1447-Q1449 PolarHBondContact O-N 2.98Å; Q1449-I1451 PolarHBondContact O-N 2.79Å; Q1449-S1452 PolarHBondContact O-N 2.67Å; Q1449-S1452 VanDerWaalsContact O-N 3.07Å; Q1449-S1452 PolarHBondContact O-OG 3.06Å
1450	S	41.7	Very low	56.1	Low	77 Å²	77	65.7 Å²	65.7	54%	0.538	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-24	-169.6	63	0	0	0	0	116	D1448	D1448-S1450 PolarHBondContact O-N 3.3Å; D1448-S1450 VanDerWaalsContact O-N 3.1Å
1451	I	42.7	Very low	56	Low	133 Å²	133	67.4 Å²	67.4	68%	0.682	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-30.5	-179	-56.5	176.1	0	0	0	112.5	Q1449	Q1449-I1451 PolarHBondContact O-N 2.79Å
1452	S	45.1	Very low	55.7	Low	29 Å²	29	65.8 Å²	65.8	20%	0.203	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-20.3	-179.3	65.5	0	0	0	0	113.3	N1285 Q1449 I1454	N1285-S1452 PolarHBondContact ND2-O 2.79Å; N1285-S1452 PolarHBondContact OD1-O 3.37Å; Q1449-S1452 PolarHBondContact O-N 2.67Å; Q1449-S1452 VanDerWaalsContact O-N 3.07Å; Q1449-S1452 PolarHBondContact O-OG 3.06Å; S1452-I1454 PolarHBondContact O-N 3Å
1453	N	58.6	Low	56.2	Low	43 Å²	43	65.9 Å²	65.9	23%	0.23	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	16.4	-178.1	-72.6	-39.4	0	0	0	114.4	A1440	A1440-N1453 PolarHBondContact N-O 2.85Å
1454	I	62.3	Low	56.9	Low	42 Å²	42	66.7 Å²	66.7	22%	0.215	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	107.5	-173.9	-61	179.8	0	0	0	109.6	N1285 E1437 G1438 S1452 S1456	N1285-I1454 PolarHBondContact ND2-O 3.06Å; E1437-I1454 HydrophobicContact CB-CG2 3.88Å; E1437-I1454 VanDerWaalsContact CD-CG2 3.44Å; E1437-I1454 HydrophobicContact CG-CG2 3.43Å; E1437-I1454 VanDerWaalsContact CG-CG2 3.43Å; G1438-I1454 CarbonylContact O-C 2.76Å; G1438-I1454 WeakPolarHBondContact O-CA 3.36Å; S1452-I1454 PolarHBondContact O-N 3Å; I1454-S1456 PolarHBondContact O-N 3.37Å
1455	V	68.6	Low	57.7	Low	1 Å²	1	60.2 Å²	60.2	1%	0.006	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	116.9	168.4	-165.1	0	0	0	0	107.8	N1285 L1287 V1375 L1377 G1438 A1440 M1460	N1285-V1455 HydrophobicContact CB-CB 4.36Å; N1285-V1455 HydrophobicContact CB-CG1 4.19Å; N1285-V1455 HydrophobicContact CB-CG2 3.92Å; L1287-V1455 HydrophobicContact CD2-CG1 4.34Å; L1287-V1455 HydrophobicContact CD2-CG2 4.24Å; V1375-V1455 HydrophobicContact CG2-CG2 3.93Å; L1377-V1455 HydrophobicContact CD2-CB 4.03Å; L1377-V1455 HydrophobicContact CD2-CG2 3.69Å; G1438-V1455 PolarHBondContact N-O 3.4Å; G1438-V1455 PolarHBondContact O-N 2.98Å; A1440-V1455 HydrophobicContact CB-CG2 4.39Å; V1455-M1460 HydrophobicContact CB-CG 3.84Å; V1455-M1460 HydrophobicContact CG1-CB 4.49Å; V1455-M1460 HydrophobicContact CG1-CG 3.45Å; V1455-M1460 VanDerWaalsContact CG1-CG 3.45Å
1456	S	64.5	Low	58.9	Low	57 Å²	57	60.8 Å²	60.8	40%	0.399	36%	0.356	S	S	.	.			trans	-68.5	157.8	-175.7	75.6	0	0	0	0	111.9	I1454 L1458 G1459 M1460	I1454-S1456 PolarHBondContact O-N 3.37Å; S1456-L1458 VanDerWaalsContact C-N 3.28Å; S1456-L1458 PolarHBondContact O-N 3.01Å; S1456-G1459 CarbonylContact O-C 3.31Å; S1456-G1459 WeakPolarHBondContact O-CA 3.32Å; S1456-G1459 PolarHBondContact O-N 2.81Å; S1456-G1459 PolarHBondContact OG-N 3.09Å; S1456-G1459 VanDerWaalsContact OG-N 3.17Å; S1456-M1460 WeakPolarHBondContact O-CG 3.38Å; S1456-M1460 PolarHBondContact O-N 3.4Å
1457	P	65.1	Low	60.6	Low	21 Å²	21	57.5 Å²	57.5	14%	0.136	33%	0.333	C	S	.	.	H	α-helix	trans	-57.6	-41.2	-177.6	-23.8	33	0	0	0	112.8	W1435 V1436 M1460 A1461 A1501	W1435-P1457 HydrophobicContact CB-CB 3.96Å; W1435-P1457 HydrophobicContact CB-CG 3.43Å; W1435-P1457 VanDerWaalsContact CB-CG 3.43Å; W1435-P1457 HydrophobicContact CD2-CG 4.47Å; W1435-P1457 HydrophobicContact CG-CG 3.49Å; W1435-P1457 VanDerWaalsContact CG-CG 3.49Å; V1436-P1457 WeakPolarHBondContact O-CA 3.26Å; V1436-P1457 WeakPolarHBondContact O-CG 3.42Å; P1457-M1460 PolarHBondContact O-N 2.8Å; P1457-A1461 VanDerWaalsContact O-CB 3.3Å; P1457-A1461 WeakPolarHBondContact O-CB 3.18Å; P1457-A1461 PolarHBondContact O-N 2.83Å; P1457-A1501 HydrophobicContact CB-CB 4.31Å; P1457-A1501 VanDerWaalsContact O-CB 3.3Å; P1457-A1501 WeakPolarHBondContact O-CB 3.05Å
1458	L	63.7	Low	62.2	Low	131 Å²	131	52.2 Å²	52.2	69%	0.686	31%	0.305	S	S	*	.	H	α-helix	trans	-67.2	-40.3	174.9	-171.1	68	0	0	0	111.2	S1456 M1460 A1461 A1462	S1456-L1458 VanDerWaalsContact C-N 3.28Å; S1456-L1458 PolarHBondContact O-N 3.01Å; L1458-M1460 VanDerWaalsContact C-N 3.25Å; L1458-M1460 PolarHBondContact O-N 2.73Å; L1458-A1461 PolarHBondContact O-N 3.43Å; L1458-A1462 VanDerWaalsContact O-CB 3.27Å; L1458-A1462 WeakPolarHBondContact O-CB 2.99Å; L1458-A1462 PolarHBondContact O-N 3.38Å
1459	G	64.5	Low	64	Low	23 Å²	23	48.8 Å²	48.8	24%	0.237	29%	0.286	C	S	.	.	H	α-helix	trans	-66.7	-21.3	175.5	0	0	0	0	0	114.3	S1456 V1463	S1456-G1459 CarbonylContact O-C 3.31Å; S1456-G1459 WeakPolarHBondContact O-CA 3.32Å; S1456-G1459 PolarHBondContact O-N 2.81Å; S1456-G1459 PolarHBondContact OG-N 3.09Å; S1456-G1459 VanDerWaalsContact OG-N 3.17Å; G1459-V1463 WeakPolarHBondContact O-CG2 2.99Å
1460	M	74.7	Confident	65.8	Low	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-92	-29.2	170.4	-54.4	179	64.3	0	0	113.1	L1377 V1380 V1436 G1438 V1455 S1456 P1457 L1458 V1463 L1467 Y1469 V1520	L1377-M1460 HydrophobicContact CD1-CE 3.79Å; L1377-M1460 HydrophobicContact CD2-CE 3.83Å; L1377-M1460 HydrophobicContact CD2-CG 4.44Å; L1377-M1460 HydrophobicContact CD2-SD 4.29Å; L1377-M1460 HydrophobicContact CG-CE 4.5Å; V1380-M1460 HydrophobicContact CG1-CE 3.91Å; V1436-M1460 HydrophobicContact CB-SD 4.2Å; V1436-M1460 HydrophobicContact CG1-CE 3.72Å; V1436-M1460 HydrophobicContact CG1-SD 3.68Å; G1438-M1460 PolarHBondContact N-SD 3.32Å; V1455-M1460 HydrophobicContact CB-CG 3.84Å; V1455-M1460 HydrophobicContact CG1-CB 4.49Å; V1455-M1460 HydrophobicContact CG1-CG 3.45Å; V1455-M1460 VanDerWaalsContact CG1-CG 3.45Å; S1456-M1460 WeakPolarHBondContact O-CG 3.38Å; S1456-M1460 PolarHBondContact O-N 3.4Å; P1457-M1460 PolarHBondContact O-N 2.8Å; L1458-M1460 VanDerWaalsContact C-N 3.25Å; L1458-M1460 PolarHBondContact O-N 2.73Å; M1460-V1463 WeakPolarHBondContact O-CG2 3.39Å; M1460-L1467 HydrophobicContact CB-CD1 4.1Å; M1460-L1467 HydrophobicContact CE-CD1 4.15Å; M1460-Y1469 WeakPolarHBondContact CB-OH 3.38Å; M1460-Y1469 HydrophobicContact CE-CE1 3.96Å; M1460-Y1469 PolarHBondContact O-OH 3.1Å; M1460-V1520 HydrophobicContact CE-CG1 4.23Å
1461	A	66.2	Low	67.6	Low	47 Å²	47	44.8 Å²	44.8	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-79.9	-32.9	179.3	0	0	0	0	0	113.3	P1457 L1458 V1463 A1501	P1457-A1461 VanDerWaalsContact O-CB 3.3Å; P1457-A1461 WeakPolarHBondContact O-CB 3.18Å; P1457-A1461 PolarHBondContact O-N 2.83Å; L1458-A1461 PolarHBondContact O-N 3.43Å; A1461-V1463 VanDerWaalsContact C-N 3.31Å; A1461-V1463 PolarHBondContact O-N 2.9Å; A1461-A1501 HydrophobicContact CB-CB 4.01Å
1462	A	62.4	Low	69.4	Low	49 Å²	49	42.7 Å²	42.7	41%	0.405	24%	0.242	S	C	.	.	S	Bend	trans	-90.7	16.3	-178.7	0	0	0	0	0	113.9	L1458	L1458-A1462 VanDerWaalsContact O-CB 3.27Å; L1458-A1462 WeakPolarHBondContact O-CB 2.99Å; L1458-A1462 PolarHBondContact O-N 3.38Å
1463	V	68.4	Low	71	Confident	15 Å²	15	41.9 Å²	41.9	9%	0.091	24%	0.235	C	C	.	.			trans	-72.9	133.1	177.9	-170.6	0	0	0	0	109.3	L1287 A1290 G1459 M1460 A1461 P1465 P1466 L1467 Q1529	L1287-V1463 HydrophobicContact CB-CG1 4.43Å; L1287-V1463 HydrophobicContact CD1-CG1 4.17Å; L1287-V1463 HydrophobicContact CD1-CG2 3.84Å; L1287-V1463 HydrophobicContact CG-CG2 4.27Å; A1290-V1463 HydrophobicContact CB-CG1 3.66Å; G1459-V1463 WeakPolarHBondContact O-CG2 2.99Å; M1460-V1463 WeakPolarHBondContact O-CG2 3.39Å; A1461-V1463 VanDerWaalsContact C-N 3.31Å; A1461-V1463 PolarHBondContact O-N 2.9Å; V1463-P1465 VanDerWaalsContact CG1-O 3.29Å; V1463-P1465 WeakPolarHBondContact CG1-O 3.38Å; V1463-P1465 CarbonylContact O-C 2.75Å; V1463-P1466 WeakPolarHBondContact O-CA 3.13Å; V1463-L1467 HydrophobicContact CG2-CD1 4.33Å; V1463-Q1529 VanDerWaalsContact CG1-NE2 3.32Å
1464	N	69.3	Low	71.8	Confident	87 Å²	87	43.4 Å²	43.4	47%	0.465	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-116.7	119.1	166.1	-177	42.1	0	0	0	109	A1290 E1291	A1290-N1464 VanDerWaalsContact CA-O 3.25Å; A1290-N1464 WeakPolarHBondContact CA-O 3.18Å; E1291-N1464 PolarHBondContact N-O 2.91Å
1465	P	74.9	Confident	72.3	Confident	14 Å²	14	43.4 Å²	43.4	9%	0.091	25%	0.246	C	C	.	.	S	Bend	cis	-70.4	152.5	-2	29	-34.7	0	0	0	113	V1463 E1524 A1527 Q1529	V1463-P1465 VanDerWaalsContact CG1-O 3.29Å; V1463-P1465 WeakPolarHBondContact CG1-O 3.38Å; V1463-P1465 CarbonylContact O-C 2.75Å; P1465-E1524 HydrophobicContact CB-CB 4.04Å; P1465-E1524 HydrophobicContact CB-CG 3.78Å; P1465-E1524 HydrophobicContact CG-CB 3.8Å; P1465-E1524 HydrophobicContact CG-CG 4.03Å; P1465-A1527 HydrophobicContact CG-CB 4Å; P1465-Q1529 PolarHBondContact O-NE2 3.19Å
1466	P	72.9	Confident	72.5	Confident	58 Å²	58	47 Å²	47	38%	0.377	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-76.3	163.9	-167.3	27.8	-34.8	0	0	0	116	V1463 V1523	V1463-P1466 WeakPolarHBondContact O-CA 3.13Å; P1466-V1523 HydrophobicContact CG-CB 4.21Å; P1466-V1523 HydrophobicContact CG-CG2 4.07Å; P1466-V1523 VanDerWaalsContact O-CB 3.23Å; P1466-V1523 WeakPolarHBondContact O-CB 3.4Å; P1466-V1523 VanDerWaalsContact O-CG2 3.28Å; P1466-V1523 WeakPolarHBondContact O-CG2 3.44Å; P1466-V1523 PolarHBondContact O-N 3.14Å
1467	L	78	Confident	72.4	Confident	11 Å²	11	48.6 Å²	48.6	6%	0.058	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	145.6	170.3	-61.3	174	0	0	0	110.6	L1287 L1377 M1460 V1463 Y1469 V1520 P1522 Q1529 I1530	L1287-L1467 HydrophobicContact CD1-CD1 3.78Å; L1287-L1467 HydrophobicContact CD1-CG 4.45Å; L1377-L1467 HydrophobicContact CD1-CD1 3.4Å; L1377-L1467 HydrophobicContact CD1-CD2 4.3Å; M1460-L1467 HydrophobicContact CB-CD1 4.1Å; M1460-L1467 HydrophobicContact CE-CD1 4.15Å; V1463-L1467 HydrophobicContact CG2-CD1 4.33Å; L1467-Y1469 HydrophobicContact CB-CE2 3.89Å; L1467-Y1469 VanDerWaalsContact O-CE2 3.25Å; L1467-Y1469 WeakPolarHBondContact O-CE2 2.85Å; L1467-V1520 HydrophobicContact CB-CG1 4.27Å; L1467-V1520 HydrophobicContact CD1-CG1 4.4Å; L1467-P1522 HydrophobicContact CD2-CB 3.96Å; L1467-Q1529 HydrophobicContact CD2-CB 4.4Å; L1467-Q1529 VanDerWaalsContact CD2-OE1 3.27Å; L1467-I1530 HydrophobicContact CD2-CD1 4.41Å
1468	R	77.8	Confident	72.1	Confident	74 Å²	74	51.5 Å²	51.5	28%	0.279	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	134.6	174.1	166.6	176.2	-95	162.4	-6.4	110.6	R1470 H1499 V1520 E1521	R1468-R1470 HydrophobicContact CG-CG 4.25Å; R1468-H1499 PolarHBondContact NE-NE2 2.89Å; R1468-V1520 WeakPolarHBondContact O-CA 3.25Å; R1468-E1521 HydrophobicContact CB-CG 3.98Å; R1468-E1521 VanDerWaalsContact CD-OE1 3.25Å; R1468-E1521 WeakPolarHBondContact CD-OE1 3.19Å; R1468-E1521 HydrophobicContact CG-CG 4.08Å; R1468-E1521 PolarHBondContact N-O 3.41Å; R1468-E1521 PolarHBondContact O-N 2.83Å
1469	Y	80.7	Confident	72.1	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.012	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.1	-179.4	-55.9	-95.4	0	0	0	110.7	V1436 M1460 L1467 H1499 A1501 L1518 T1519 V1520	V1436-Y1469 HydrophobicContact CB-CD1 4.42Å; V1436-Y1469 HydrophobicContact CB-CE1 4.21Å; V1436-Y1469 HydrophobicContact CG1-CE1 4.32Å; V1436-Y1469 HydrophobicContact CG2-CD1 3.81Å; V1436-Y1469 HydrophobicContact CG2-CE1 4.09Å; M1460-Y1469 WeakPolarHBondContact CB-OH 3.38Å; M1460-Y1469 HydrophobicContact CE-CE1 3.96Å; M1460-Y1469 PolarHBondContact O-OH 3.1Å; L1467-Y1469 HydrophobicContact CB-CE2 3.89Å; L1467-Y1469 VanDerWaalsContact O-CE2 3.25Å; L1467-Y1469 WeakPolarHBondContact O-CE2 2.85Å; Y1469-H1499 WeakPolarHBondContact CD2-O 2.88Å; Y1469-H1499 PolarHBondContact O-CE1 2.93Å; Y1469-H1499 PolarHBondContact O-ND1 3.06Å; Y1469-A1501 HydrophobicContact CD1-CB 4.17Å; Y1469-A1501 HydrophobicContact CE1-CB 3.57Å; Y1469-A1501 HydrophobicContact CE2-CB 4.14Å; Y1469-L1518 HydrophobicContact CD1-CD1 4.5Å; Y1469-T1519 CarbonylContact C-O 3.53Å; Y1469-V1520 HydrophobicContact CD1-CG1 4.39Å; Y1469-V1520 HydrophobicContact CD1-CG2 3.55Å; Y1469-V1520 HydrophobicContact CE1-CG1 4.11Å; Y1469-V1520 HydrophobicContact CE1-CG2 3.83Å; Y1469-V1520 HydrophobicContact CG-CG2 4.47Å
1470	R	79.8	Confident	72.5	Confident	84 Å²	84	49.2 Å²	49.2	32%	0.317	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	89	179.7	-40.5	179.1	78.3	131.9	2.1	110.1	R1468 H1472 T1519 E1521	R1468-R1470 HydrophobicContact CG-CG 4.25Å; R1470-H1472 VanDerWaalsContact C-CE1 3.45Å; R1470-H1472 PolarHBondContact O-CE1 2.99Å; R1470-T1519 PolarHBondContact N-O 3.33Å; R1470-T1519 PolarHBondContact O-N 3.05Å; R1470-E1521 WeakPolarHBondContact CD-OE1 3.3Å; R1470-E1521 IonicContact CZ-OE1 3.48Å; R1470-E1521 IonicContact NH1-OE1 3.61Å; R1470-E1521 PolarHBondContact NH1-OE1 2.9Å
1471	W	78.4	Confident	72.3	Confident	19 Å²	19	50.8 Å²	50.8	7%	0.072	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	139.5	173.8	-62.3	92.8	0	0	0	110.7	I1382 L1434 V1436 L1484 L1500 M1504 V1516 L1518	I1382-W1471 HydrophobicContact CB-CZ3 4.31Å; I1382-W1471 HydrophobicContact CD1-CZ3 4.21Å; I1382-W1471 HydrophobicContact CG1-CH2 4.28Å; I1382-W1471 HydrophobicContact CG1-CZ3 3.75Å; I1382-W1471 HydrophobicContact CG2-CH2 3.97Å; I1382-W1471 HydrophobicContact CG2-CZ3 3.64Å; L1434-W1471 HydrophobicContact CB-CH2 3.79Å; L1434-W1471 HydrophobicContact CB-CZ3 4.09Å; L1434-W1471 HydrophobicContact CD1-CE3 4.46Å; L1434-W1471 HydrophobicContact CD1-CH2 4.39Å; L1434-W1471 HydrophobicContact CD1-CZ3 3.83Å; V1436-W1471 HydrophobicContact CG2-CH2 3.86Å; V1436-W1471 HydrophobicContact CG2-CZ2 3.34Å; W1471-L1484 HydrophobicContact CB-CD2 3.73Å; W1471-L1484 HydrophobicContact CE3-CD1 4.15Å; W1471-L1484 HydrophobicContact CG-CD2 4.16Å; W1471-L1500 PolarHBondContact NE1-O 3.38Å; W1471-M1504 HydrophobicContact CB-CE 4.1Å; W1471-M1504 HydrophobicContact CD2-CG 4.26Å; W1471-M1504 HydrophobicContact CG-CE 3.77Å; W1471-M1504 HydrophobicContact CG-CG 4.44Å; W1471-M1504 HydrophobicContact CZ2-CB 4.45Å; W1471-M1504 HydrophobicContact CZ2-CG 4.09Å; W1471-V1516 HydrophobicContact CE3-CG1 3.86Å; W1471-V1516 HydrophobicContact CZ3-CG1 4.05Å; W1471-L1518 HydrophobicContact CD2-CD1 3.82Å; W1471-L1518 HydrophobicContact CE3-CB 4.2Å; W1471-L1518 HydrophobicContact CE3-CD1 4.19Å; W1471-L1518 HydrophobicContact CG-CD1 4.15Å; W1471-L1518 HydrophobicContact CZ2-CD1 4.36Å; W1471-L1518 HydrophobicContact CZ3-CB 4.45Å
1472	H	81.6	Confident	72.6	Confident	89 Å²	89	48.6 Å²	48.6	41%	0.412	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	142.6	171	56.5	-71.8	0	0	0	111.3	R1470 H1517 T1519	R1470-H1472 VanDerWaalsContact C-CE1 3.45Å; R1470-H1472 PolarHBondContact O-CE1 2.99Å; H1472-H1517 PolarHBondContact CE1-O 2.91Å; H1472-H1517 PolarHBondContact N-O 2.96Å; H1472-H1517 WeakPolarHBondContact O-CA 3.43Å; H1472-H1517 WeakPolarHBondContact O-CB 3.29Å; H1472-H1517 PolarHBondContact O-N 3.47Å; H1472-H1517 VanDerWaalsContact O-O 3.09Å; H1472-T1519 PolarHBondContact NE2-OG1 2.9Å
1473	L	78	Confident	73.3	Confident	11 Å²	11	49.6 Å²	49.6	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	154.6	178.1	-67.3	157.6	0	0	0	110.8	P1476 E1477 V1482 L1484 L1506 V1514 V1516	L1473-P1476 WeakPolarHBondContact O-CA 3.12Å; L1473-P1476 WeakPolarHBondContact O-CB 3.21Å; L1473-E1477 HydrophobicContact CD1-CG 3.66Å; L1473-E1477 WeakPolarHBondContact CD1-OE1 3.4Å; L1473-V1482 WeakPolarHBondContact CD1-O 3.33Å; L1473-L1484 HydrophobicContact CD1-CB 3.84Å; L1473-L1484 HydrophobicContact CD2-CB 4.38Å; L1473-L1484 HydrophobicContact CD2-CD1 4.23Å; L1473-L1484 HydrophobicContact CG-CB 4.19Å; L1473-L1484 HydrophobicContact CG-CD1 4.46Å; L1473-L1506 HydrophobicContact CD2-CD1 4.26Å; L1473-V1514 HydrophobicContact CD2-CG1 3.66Å; L1473-V1516 HydrophobicContact CD2-CB 4.45Å; L1473-V1516 HydrophobicContact CD2-CG2 3.64Å
1474	N	76.3	Confident	73.6	Confident	75 Å²	75	50.1 Å²	50.1	40%	0.401	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	112.2	171.1	177	40.1	0	0	0	109.5	T1515 H1517	N1474-T1515 WeakPolarHBondContact CA-O 3.3Å; N1474-T1515 WeakPolarHBondContact CB-OG1 3.16Å; N1474-T1515 PolarHBondContact N-O 3.27Å; N1474-T1515 PolarHBondContact ND2-OG1 2.96Å; N1474-T1515 PolarHBondContact O-N 2.74Å; N1474-T1515 PolarHBondContact O-OG1 2.79Å; N1474-H1517 WeakPolarHBondContact CB-CD2 3.44Å; N1474-H1517 VanDerWaalsContact CB-NE2 3.34Å; N1474-H1517 WeakPolarHBondContact CB-NE2 3.4Å; N1474-H1517 PolarHBondContact ND2-NE2 3.12Å
1475	P	73.4	Confident	73.5	Confident	42 Å²	42	46.9 Å²	46.9	27%	0.273	24%	0.238	S	C	.	.	S	Bend	cis	-61.6	141	-3.2	23.4	-30.8	0	0	0	111.9	N1479 S1480 F1481	P1475-N1479 HydrophobicContact CB-CB 4.12Å; P1475-S1480 WeakPolarHBondContact O-CA 3.25Å; P1475-S1480 VanDerWaalsContact O-CB 3.26Å; P1475-S1480 WeakPolarHBondContact O-CB 3.03Å; P1475-S1480 PolarHBondContact O-N 3.44Å; P1475-F1481 HydrophobicContact CG-CD2 4.49Å; P1475-F1481 HydrophobicContact CG-CE2 4.39Å
1476	P	71.2	Confident	73.2	Confident	76 Å²	76	47.9 Å²	47.9	49%	0.494	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-65.6	159.4	-177.1	25.9	-34.5	0	0	0	112.3	L1473 N1479 S1480	L1473-P1476 WeakPolarHBondContact O-CA 3.12Å; L1473-P1476 WeakPolarHBondContact O-CB 3.21Å; P1476-N1479 WeakPolarHBondContact O-CA 3.34Å; P1476-N1479 WeakPolarHBondContact O-CB 3.37Å; P1476-N1479 PolarHBondContact O-N 2.66Å; P1476-S1480 PolarHBondContact O-N 2.73Å
1477	E	63.7	Low	72.3	Confident	92 Å²	92	47.6 Å²	47.6	43%	0.43	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	139.1	170.5	-90.7	174.4	-133.1	0	0	111.2	L1473 R1483 L1484	L1473-E1477 HydrophobicContact CD1-CG 3.66Å; L1473-E1477 WeakPolarHBondContact CD1-OE1 3.4Å; E1477-R1483 WeakPolarHBondContact OE1-CA 3.44Å; E1477-R1483 VanDerWaalsContact OE1-CG 3.22Å; E1477-R1483 WeakPolarHBondContact OE1-CG 3.1Å; E1477-L1484 PolarHBondContact OE1-N 2.88Å
1478	P	57.8	Low	71.1	Confident	81 Å²	81	48.9 Å²	48.9	53%	0.526	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.9	10	5.2	37.9	-37.7	0	0	0	114.8
1479	N	64.7	Low	70	Confident	106 Å²	106	47.4 Å²	47.4	57%	0.567	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-14.2	-174.6	-70.4	-11.4	0	0	0	114	P1475 P1476	P1475-N1479 HydrophobicContact CB-CB 4.12Å; P1476-N1479 WeakPolarHBondContact O-CA 3.34Å; P1476-N1479 WeakPolarHBondContact O-CB 3.37Å; P1476-N1479 PolarHBondContact O-N 2.66Å
1480	S	71.6	Confident	68.4	Low	1 Å²	1	50.5 Å²	50.5	1%	0.007	25%	0.248	C	C	.	.			trans	-50.7	154.4	175	-164.3	0	0	0	0	113.9	P1475 P1476 V1482 K1510 V1514	P1475-S1480 WeakPolarHBondContact O-CA 3.25Å; P1475-S1480 VanDerWaalsContact O-CB 3.26Å; P1475-S1480 WeakPolarHBondContact O-CB 3.03Å; P1475-S1480 PolarHBondContact O-N 3.44Å; P1476-S1480 PolarHBondContact O-N 2.73Å; S1480-V1482 VanDerWaalsContact C-N 3.28Å; S1480-V1482 VanDerWaalsContact CB-O 3.22Å; S1480-V1482 WeakPolarHBondContact CB-O 3.46Å; S1480-V1482 PolarHBondContact OG-N 3.06Å; S1480-V1482 PolarHBondContact OG-O 3.35Å; S1480-K1510 WeakPolarHBondContact O-CE 3.21Å; S1480-V1514 WeakPolarHBondContact OG-CG1 2.93Å; S1480-V1514 VanDerWaalsContact OG-CG2 3.25Å; S1480-V1514 WeakPolarHBondContact OG-CG2 3.48Å
1481	F	71.1	Confident	66.7	Low	33 Å²	33	49 Å²	49	15%	0.145	24%	0.244	C	C	.	.	S	Bend	trans	-85.7	-3.7	163.3	-53	-111.6	0	0	0	113.2	P1475 L1509 K1510 P1511 T1513 V1514	P1475-F1481 HydrophobicContact CG-CD2 4.49Å; P1475-F1481 HydrophobicContact CG-CE2 4.39Å; F1481-L1509 WeakPolarHBondContact O-CB 3.38Å; F1481-L1509 PolarHBondContact O-N 2.83Å; F1481-K1510 HydrophobicContact CB-CD 4.32Å; F1481-K1510 HydrophobicContact CB-CG 3.93Å; F1481-K1510 HydrophobicContact CD1-CD 3.55Å; F1481-K1510 HydrophobicContact CD1-CG 3.84Å; F1481-K1510 HydrophobicContact CE1-CD 4.19Å; F1481-K1510 HydrophobicContact CG-CD 4.19Å; F1481-K1510 VanDerWaalsContact CG-CE 3.48Å; F1481-K1510 HydrophobicContact CG-CG 4.29Å; F1481-K1510 PolarHBondContact O-N 2.96Å; F1481-P1511 WeakPolarHBondContact CD1-O 3.45Å; F1481-T1513 WeakPolarHBondContact CD2-O 3.19Å; F1481-V1514 HydrophobicContact CB-CG2 3.58Å; F1481-V1514 HydrophobicContact CD2-CG2 3.7Å; F1481-V1514 HydrophobicContact CG-CG2 4.11Å
1482	V	71.6	Confident	64.9	Low	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	124	-170.9	-160.4	0	0	0	0	108.9	L1419 L1473 S1480 L1506 V1507 V1514 V1551	L1419-V1482 HydrophobicContact CD1-CG1 4.4Å; L1473-V1482 WeakPolarHBondContact CD1-O 3.33Å; S1480-V1482 VanDerWaalsContact C-N 3.28Å; S1480-V1482 VanDerWaalsContact CB-O 3.22Å; S1480-V1482 WeakPolarHBondContact CB-O 3.46Å; S1480-V1482 PolarHBondContact OG-N 3.06Å; S1480-V1482 PolarHBondContact OG-O 3.35Å; V1482-L1506 HydrophobicContact CB-CD1 3.92Å; V1482-L1506 HydrophobicContact CB-CG 4.43Å; V1482-L1506 HydrophobicContact CG1-CB 4.48Å; V1482-L1506 HydrophobicContact CG1-CD1 3.19Å; V1482-L1506 HydrophobicContact CG1-CD2 3.99Å; V1482-L1506 HydrophobicContact CG1-CG 3.26Å; V1482-V1507 CarbonylContact C-O 3.5Å; V1482-V1507 VanDerWaalsContact CA-O 3.27Å; V1482-V1507 WeakPolarHBondContact CA-O 3.41Å; V1482-V1507 WeakPolarHBondContact CG1-O 3.04Å; V1482-V1514 HydrophobicContact CB-CB 4.25Å; V1482-V1514 HydrophobicContact CB-CG1 4.3Å; V1482-V1514 HydrophobicContact CB-CG2 4.25Å; V1482-V1514 HydrophobicContact CG2-CB 3.76Å; V1482-V1514 HydrophobicContact CG2-CG1 4.34Å; V1482-V1514 HydrophobicContact CG2-CG2 3.79Å; V1482-V1551 HydrophobicContact CG2-CG2 3.49Å; V1482-V1551 VanDerWaalsContact CG2-CG2 3.49Å
1483	R	77.7	Confident	63.4	Low	71 Å²	71	46.8 Å²	46.8	27%	0.268	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	153.2	179.3	-162.1	175.5	169.5	-148.4	-24.8	110.5	E1477 E1485 L1506 V1507 L1509	E1477-R1483 WeakPolarHBondContact OE1-CA 3.44Å; E1477-R1483 VanDerWaalsContact OE1-CG 3.22Å; E1477-R1483 WeakPolarHBondContact OE1-CG 3.1Å; R1483-E1485 HydrophobicContact CG-CG 4.11Å; R1483-E1485 IonicContact CZ-OE1 2.68Å; R1483-E1485 IonicContact NE-OE1 2.97Å; R1483-E1485 IonicContact NH1-OE1 3.19Å; R1483-E1485 PolarHBondContact NH1-OE1 3.46Å; R1483-E1485 IonicContact NH2-OE1 3.91Å; R1483-E1485 PolarHBondContact NH2-OE1 2.88Å; R1483-L1506 CarbonylContact O-C 3.53Å; R1483-L1506 VanDerWaalsContact O-CA 3.31Å; R1483-L1506 WeakPolarHBondContact O-CA 3.4Å; R1483-V1507 HydrophobicContact CB-CB 4.35Å; R1483-V1507 PolarHBondContact N-O 2.98Å; R1483-V1507 PolarHBondContact O-N 3.16Å; R1483-L1509 HydrophobicContact CB-CD1 4.05Å; R1483-L1509 HydrophobicContact CB-CD2 4Å; R1483-L1509 HydrophobicContact CB-CG 4.08Å
1484	L	75.9	Confident	61.9	Low	25 Å²	25	52 Å²	52	13%	0.131	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	84.4	179.4	-161.8	136.5	0	0	0	109.6	L1434 W1471 L1473 E1477 M1504 L1506 V1516	L1434-L1484 HydrophobicContact CD1-CD1 3.83Å; W1471-L1484 HydrophobicContact CB-CD2 3.73Å; W1471-L1484 HydrophobicContact CE3-CD1 4.15Å; W1471-L1484 HydrophobicContact CG-CD2 4.16Å; L1473-L1484 HydrophobicContact CD1-CB 3.84Å; L1473-L1484 HydrophobicContact CD2-CB 4.38Å; L1473-L1484 HydrophobicContact CD2-CD1 4.23Å; L1473-L1484 HydrophobicContact CG-CB 4.19Å; L1473-L1484 HydrophobicContact CG-CD1 4.46Å; E1477-L1484 PolarHBondContact OE1-N 2.88Å; L1484-M1504 HydrophobicContact CD2-CE 3.46Å; L1484-M1504 VanDerWaalsContact CD2-CE 3.46Å; L1484-M1504 HydrophobicContact CD2-CG 4.19Å; L1484-M1504 HydrophobicContact CD2-SD 3.59Å; L1484-M1504 VanDerWaalsContact CD2-SD 3.59Å; L1484-L1506 HydrophobicContact CD1-CD1 4.4Å; L1484-V1516 HydrophobicContact CD1-CG1 3.69Å; L1484-V1516 HydrophobicContact CD1-CG2 4.27Å
1485	E	67.3	Low	60.8	Low	19 Å²	19	52.3 Å²	52.3	9%	0.089	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	159.9	178.4	-54.1	-172.8	135.7	0	0	110.6	R1483 R1490 M1504 V1505 V1507	R1483-E1485 HydrophobicContact CG-CG 4.11Å; R1483-E1485 IonicContact CZ-OE1 2.68Å; R1483-E1485 IonicContact NE-OE1 2.97Å; R1483-E1485 IonicContact NH1-OE1 3.19Å; R1483-E1485 PolarHBondContact NH1-OE1 3.46Å; R1483-E1485 IonicContact NH2-OE1 3.91Å; R1483-E1485 PolarHBondContact NH2-OE1 2.88Å; E1485-R1490 WeakPolarHBondContact OE2-CG 3.19Å; E1485-R1490 IonicContact OE2-CZ 3.27Å; E1485-R1490 IonicContact OE2-NE 2.62Å; E1485-R1490 PolarHBondContact OE2-NE 2.9Å; E1485-R1490 IonicContact OE2-NH2 2.68Å; E1485-M1504 CarbonylContact O-C 3.5Å; E1485-M1504 WeakPolarHBondContact O-CA 3.27Å; E1485-V1505 PolarHBondContact N-O 2.65Å; E1485-V1505 PolarHBondContact O-N 3.01Å; E1485-V1507 HydrophobicContact CG-CG2 4.17Å; E1485-V1507 WeakPolarHBondContact OE2-CG2 3.07Å
1486	Y	67	Low	59.5	Low	35 Å²	35	55 Å²	55	14%	0.137	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	148.3	158.8	-177.5	-110.5	0	0	0	110.1	L1488 D1489 M1495 L1500 G1503	Y1486-L1488 HydrophobicContact CD1-CB 3.74Å; Y1486-L1488 HydrophobicContact CD1-CG 4.3Å; Y1486-L1488 HydrophobicContact CE1-CB 3.62Å; Y1486-L1488 HydrophobicContact CE1-CD1 3.93Å; Y1486-L1488 HydrophobicContact CE1-CG 3.67Å; Y1486-L1488 PolarHBondContact O-N 2.87Å; Y1486-D1489 PolarHBondContact N-OD2 3.21Å; Y1486-D1489 WeakPolarHBondContact O-CB 3.3Å; Y1486-D1489 PolarHBondContact O-N 3.04Å; Y1486-M1495 HydrophobicContact CD1-CB 4.04Å; Y1486-M1495 HydrophobicContact CD1-CG 3.49Å; Y1486-M1495 VanDerWaalsContact CD1-CG 3.49Å; Y1486-M1495 HydrophobicContact CE1-CB 4.48Å; Y1486-M1495 HydrophobicContact CE1-CE 4.43Å; Y1486-M1495 HydrophobicContact CE1-CG 3.58Å; Y1486-M1495 HydrophobicContact CG-CG 4.42Å; Y1486-L1500 HydrophobicContact CD2-CD1 4.02Å; Y1486-L1500 HydrophobicContact CE1-CD1 4.43Å; Y1486-L1500 HydrophobicContact CE2-CD1 3.29Å; Y1486-G1503 WeakPolarHBondContact CD2-O 3.38Å
1487	W	54.1	Low	58.5	Low	53 Å²	53	58.1 Å²	58.1	20%	0.201	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.3	-172.3	78.2	-77.6	0	0	0	113.9	F1491 G1503 V1505 Y1811	W1487-F1491 HydrophobicContact CE3-CD2 4.26Å; W1487-F1491 AromaticContact CE3-CE2 3.92Å; W1487-F1491 HydrophobicContact CE3-CE2 3.92Å; W1487-F1491 HydrophobicContact CZ3-CD2 4.24Å; W1487-F1491 AromaticContact CZ3-CE2 3.79Å; W1487-F1491 HydrophobicContact CZ3-CE2 3.79Å; W1487-G1503 PolarHBondContact N-O 2.8Å; W1487-V1505 HydrophobicContact CB-CG2 3.68Å; W1487-Y1811 AromaticContact CH2-CD2 3.92Å; W1487-Y1811 HydrophobicContact CH2-CD2 3.92Å; W1487-Y1811 AromaticContact CZ2-CD2 3.96Å; W1487-Y1811 HydrophobicContact CZ2-CD2 3.96Å
1488	L	53.9	Low	57.9	Low	37 Å²	37	57 Å²	57	19%	0.194	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-13.7	171.4	-66.4	-175.1	0	0	0	114	Y1486 R1490 F1491 G1492 I1493	Y1486-L1488 HydrophobicContact CD1-CB 3.74Å; Y1486-L1488 HydrophobicContact CD1-CG 4.3Å; Y1486-L1488 HydrophobicContact CE1-CB 3.62Å; Y1486-L1488 HydrophobicContact CE1-CD1 3.93Å; Y1486-L1488 HydrophobicContact CE1-CG 3.67Å; Y1486-L1488 PolarHBondContact O-N 2.87Å; L1488-R1490 PolarHBondContact O-N 3.11Å; L1488-F1491 HydrophobicContact CD2-CD2 4.02Å; L1488-F1491 CarbonylContact O-C 3.56Å; L1488-F1491 WeakPolarHBondContact O-CA 3.36Å; L1488-F1491 WeakPolarHBondContact O-CB 3.25Å; L1488-F1491 PolarHBondContact O-N 3.48Å; L1488-G1492 PolarHBondContact O-N 3.28Å; L1488-I1493 CarbonylContact C-O 3.57Å; L1488-I1493 HydrophobicContact CB-CB 4.12Å; L1488-I1493 PolarHBondContact O-N 2.81Å
1489	D	54.8	Low	58	Low	43 Å²	43	56.1 Å²	56.1	23%	0.23	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-64.3	-34.1	171.4	-57.6	-18.5	0	0	0	110	Y1486 F1491 G1492	Y1486-D1489 PolarHBondContact N-OD2 3.21Å; Y1486-D1489 WeakPolarHBondContact O-CB 3.3Å; Y1486-D1489 PolarHBondContact O-N 3.04Å; D1489-F1491 PolarHBondContact O-N 3.07Å; D1489-G1492 PolarHBondContact O-N 3.29Å
1490	R	47.7	Very low	57.9	Low	69 Å²	69	54 Å²	54	26%	0.26	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-67.4	-11.5	169.9	-71.8	-169.5	169.3	-144.3	-8.1	113.1	D1428 E1485 L1488 S1681 I1682	D1428-R1490 IonicContact OD1-CZ 3.59Å; D1428-R1490 IonicContact OD1-NH1 3.21Å; D1428-R1490 PolarHBondContact OD1-NH1 2.94Å; D1428-R1490 VanDerWaalsContact OD1-NH1 3.15Å; D1428-R1490 IonicContact OD1-NH2 2.73Å; D1428-R1490 PolarHBondContact OD1-NH2 3.35Å; E1485-R1490 WeakPolarHBondContact OE2-CG 3.19Å; E1485-R1490 IonicContact OE2-CZ 3.27Å; E1485-R1490 IonicContact OE2-NE 2.62Å; E1485-R1490 PolarHBondContact OE2-NE 2.9Å; E1485-R1490 IonicContact OE2-NH2 2.68Å; L1488-R1490 PolarHBondContact O-N 3.11Å; R1490-S1681 CarbonylContact O-C 3Å; R1490-S1681 WeakPolarHBondContact O-CA 3.21Å; R1490-S1681 WeakPolarHBondContact O-CB 3.41Å; R1490-I1682 PolarHBondContact O-N 2.8Å
1491	F	42.1	Very low	57.7	Low	53 Å²	53	53.9 Å²	53.9	23%	0.232	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-101.6	7.7	167.9	-71.2	-83.2	0	0	0	113	W1487 L1488 D1489 I1493 I1682 L1696	W1487-F1491 HydrophobicContact CE3-CD2 4.26Å; W1487-F1491 AromaticContact CE3-CE2 3.92Å; W1487-F1491 HydrophobicContact CE3-CE2 3.92Å; W1487-F1491 HydrophobicContact CZ3-CD2 4.24Å; W1487-F1491 AromaticContact CZ3-CE2 3.79Å; W1487-F1491 HydrophobicContact CZ3-CE2 3.79Å; L1488-F1491 HydrophobicContact CD2-CD2 4.02Å; L1488-F1491 CarbonylContact O-C 3.56Å; L1488-F1491 WeakPolarHBondContact O-CA 3.36Å; L1488-F1491 WeakPolarHBondContact O-CB 3.25Å; L1488-F1491 PolarHBondContact O-N 3.48Å; D1489-F1491 PolarHBondContact O-N 3.07Å; F1491-I1493 VanDerWaalsContact C-N 3.31Å; F1491-I1493 PolarHBondContact O-N 3.4Å; F1491-I1682 CarbonylContact C-O 3.14Å; F1491-I1682 HydrophobicContact CD1-CD1 4.1Å; F1491-L1696 HydrophobicContact CB-CD2 4.32Å; F1491-L1696 HydrophobicContact CD1-CD2 4.03Å
1492	G	42.4	Very low	57.3	Low	34 Å²	34	55 Å²	55	35%	0.351	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	1.9	-178.8	0	0	0	0	0	114.9	L1488 D1489 N1494 I1682	L1488-G1492 PolarHBondContact O-N 3.28Å; D1489-G1492 PolarHBondContact O-N 3.29Å; G1492-N1494 PolarHBondContact O-N 3Å; G1492-I1682 PolarHBondContact N-O 2.03Å
1493	I	48.2	Very low	56.8	Low	26 Å²	26	55.8 Å²	55.8	13%	0.133	29%	0.288	C	S	.	.			trans	-95.9	84.9	-178.1	-54.2	169.8	0	0	0	108.5	L1488 F1491 M1495	L1488-I1493 CarbonylContact C-O 3.57Å; L1488-I1493 HydrophobicContact CB-CB 4.12Å; L1488-I1493 PolarHBondContact O-N 2.81Å; F1491-I1493 VanDerWaalsContact C-N 3.31Å; F1491-I1493 PolarHBondContact O-N 3.4Å; I1493-M1495 PolarHBondContact O-N 2.96Å
1494	N	47.9	Very low	56.6	Low	120 Å²	120	52.5 Å²	52.5	64%	0.642	28%	0.276	S	S	*	.			trans	-66.5	110.7	-180	178.8	68	0	0	0	111.4	G1492 D1496	G1492-N1494 PolarHBondContact O-N 3Å; N1494-D1496 PolarHBondContact O-N 3.46Å
1495	M	52.2	Low	56.2	Low	82 Å²	82	51.9 Å²	51.9	40%	0.404	27%	0.273	S	S	.	.			trans	-86.1	107.5	-178.1	-71.2	-75.2	-77.1	0	0	111.8	Y1486 I1493 E1497 L1500	Y1486-M1495 HydrophobicContact CD1-CB 4.04Å; Y1486-M1495 HydrophobicContact CD1-CG 3.49Å; Y1486-M1495 VanDerWaalsContact CD1-CG 3.49Å; Y1486-M1495 HydrophobicContact CE1-CB 4.48Å; Y1486-M1495 HydrophobicContact CE1-CE 4.43Å; Y1486-M1495 HydrophobicContact CE1-CG 3.58Å; Y1486-M1495 HydrophobicContact CG-CG 4.42Å; I1493-M1495 PolarHBondContact O-N 2.96Å; M1495-E1497 PolarHBondContact O-N 2.91Å; M1495-L1500 HydrophobicContact CE-CD1 4.26Å
1496	D	47.8	Very low	56.4	Low	100 Å²	100	51 Å²	51	54%	0.535	27%	0.269	S	S	.	.	S	Bend	trans	-59.7	130.3	172.8	-71.9	-31.7	0	0	0	111.5	N1494 K1692	N1494-D1496 PolarHBondContact O-N 3.46Å; D1496-K1692 WeakPolarHBondContact OD2-CE 3.39Å; D1496-K1692 IonicContact OD2-NZ 3.53Å; D1496-K1692 PolarHBondContact OD2-NZ 3.03Å
1497	E	49.5	Very low	56.6	Low	140 Å²	140	49.5 Å²	49.5	65%	0.654	26%	0.264	S	S	*	.	S	Bend	trans	64.2	110.9	-177.9	-53.3	-160	144.8	0	0	115.8	M1495 H1499	M1495-E1497 PolarHBondContact O-N 2.91Å; E1497-H1499 PolarHBondContact O-N 3.31Å; E1497-H1499 IonicContact OE2-CD2 2.69Å
1498	T	51.9	Low	57	Low	69 Å²	69	47 Å²	47	42%	0.423	25%	0.254	S	S	.	.			trans	-74.5	54.1	-175.7	47.1	0	0	0	0	114	M1504	T1498-M1504 VanDerWaalsContact CB-CE 3.43Å; T1498-M1504 HydrophobicContact CG2-CE 3.6Å
1499	H	58.8	Low	57.4	Low	62 Å²	62	46.3 Å²	46.3	29%	0.287	25%	0.25	S	S	.	.			trans	-94.7	22.4	-173.4	-73.1	-22.2	0	0	0	114.6	R1468 Y1469 E1497	R1468-H1499 PolarHBondContact NE-NE2 2.89Å; Y1469-H1499 WeakPolarHBondContact CD2-O 2.88Å; Y1469-H1499 PolarHBondContact O-CE1 2.93Å; Y1469-H1499 PolarHBondContact O-ND1 3.06Å; E1497-H1499 PolarHBondContact O-N 3.31Å; E1497-H1499 IonicContact OE2-CD2 2.69Å
1500	L	62.9	Low	57.3	Low	61 Å²	61	45.7 Å²	45.7	32%	0.319	25%	0.245	S	C	.	.			trans	-104	137.3	-177.4	-63.2	171.6	0	0	0	112.1	W1471 Y1486 M1495 S1502	W1471-L1500 PolarHBondContact NE1-O 3.38Å; Y1486-L1500 HydrophobicContact CD2-CD1 4.02Å; Y1486-L1500 HydrophobicContact CE1-CD1 4.43Å; Y1486-L1500 HydrophobicContact CE2-CD1 3.29Å; M1495-L1500 HydrophobicContact CE-CD1 4.26Å; L1500-S1502 WeakPolarHBondContact CB-O 3.35Å; L1500-S1502 PolarHBondContact O-N 3.09Å
1501	A	66.8	Low	57.9	Low	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-72.8	-16.9	174.9	0	0	0	0	0	113	W1435 V1436 P1457 A1461 Y1469	W1435-A1501 CarbonylContact C-O 3.4Å; W1435-A1501 VanDerWaalsContact CA-O 3.28Å; W1435-A1501 WeakPolarHBondContact CA-O 3.41Å; V1436-A1501 HydrophobicContact CB-CB 4.39Å; V1436-A1501 PolarHBondContact N-O 2.81Å; P1457-A1501 HydrophobicContact CB-CB 4.31Å; P1457-A1501 VanDerWaalsContact O-CB 3.3Å; P1457-A1501 WeakPolarHBondContact O-CB 3.05Å; A1461-A1501 HydrophobicContact CB-CB 4.01Å; Y1469-A1501 HydrophobicContact CD1-CB 4.17Å; Y1469-A1501 HydrophobicContact CE1-CB 3.57Å; Y1469-A1501 HydrophobicContact CE2-CB 4.14Å
1502	S	62.5	Low	58.9	Low	56 Å²	56	43.9 Å²	43.9	39%	0.392	25%	0.252	S	S	.	.	S	Bend	trans	-145	171.1	-174.8	-162.4	0	0	0	0	110.3	L1500 M1504	L1500-S1502 WeakPolarHBondContact CB-O 3.35Å; L1500-S1502 PolarHBondContact O-N 3.09Å; S1502-M1504 PolarHBondContact O-N 3Å
1503	G	62.1	Low	59.9	Low	16 Å²	16	44.6 Å²	44.6	17%	0.165	25%	0.249	C	C	.	.			trans	76.5	3.7	-179.9	0	0	0	0	0	113.9	Y1486 W1487	Y1486-G1503 WeakPolarHBondContact CD2-O 3.38Å; W1487-G1503 PolarHBondContact N-O 2.8Å
1504	M	72.4	Confident	61.1	Low	2 Å²	2	43.4 Å²	43.4	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	147.5	162.4	-72.9	-57.8	-156.3	0	0	109.8	P1433 L1434 W1471 L1484 E1485 T1498 S1502	P1433-M1504 CarbonylContact C-O 3.49Å; P1433-M1504 VanDerWaalsContact CA-O 3.27Å; P1433-M1504 WeakPolarHBondContact CA-O 3.4Å; L1434-M1504 HydrophobicContact CB-CB 3.95Å; L1434-M1504 PolarHBondContact N-O 2.9Å; W1471-M1504 HydrophobicContact CB-CE 4.1Å; W1471-M1504 HydrophobicContact CD2-CG 4.26Å; W1471-M1504 HydrophobicContact CG-CE 3.77Å; W1471-M1504 HydrophobicContact CG-CG 4.44Å; W1471-M1504 HydrophobicContact CZ2-CB 4.45Å; W1471-M1504 HydrophobicContact CZ2-CG 4.09Å; L1484-M1504 HydrophobicContact CD2-CE 3.46Å; L1484-M1504 VanDerWaalsContact CD2-CE 3.46Å; L1484-M1504 HydrophobicContact CD2-CG 4.19Å; L1484-M1504 HydrophobicContact CD2-SD 3.59Å; L1484-M1504 VanDerWaalsContact CD2-SD 3.59Å; E1485-M1504 CarbonylContact O-C 3.5Å; E1485-M1504 WeakPolarHBondContact O-CA 3.27Å; T1498-M1504 VanDerWaalsContact CB-CE 3.43Å; T1498-M1504 HydrophobicContact CG2-CE 3.6Å; S1502-M1504 PolarHBondContact O-N 3Å
1505	V	67.5	Low	62.6	Low	12 Å²	12	38.7 Å²	38.7	7%	0.073	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	108.6	-179.8	-176	0	0	0	0	107.8	E1485 W1487 V1507	E1485-V1505 PolarHBondContact N-O 2.65Å; E1485-V1505 PolarHBondContact O-N 3.01Å; W1487-V1505 HydrophobicContact CB-CG2 3.68Å; V1505-V1507 HydrophobicContact CG1-CG2 3.9Å; V1505-V1507 PolarHBondContact O-N 2.92Å
1506	L	72.8	Confident	63.8	Low	1 Å²	1	34.8 Å²	34.8	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	103.9	175	179.7	78.1	0	0	0	108.6	L1419 T1432 L1434 L1473 V1482 R1483 L1484 V1516 I1549	L1419-L1506 HydrophobicContact CD1-CD2 3.93Å; L1419-L1506 HydrophobicContact CD1-CG 4.28Å; T1432-L1506 PolarHBondContact N-O 2.75Å; T1432-L1506 WeakPolarHBondContact O-CA 3.28Å; T1432-L1506 VanDerWaalsContact O-CB 3.31Å; T1432-L1506 WeakPolarHBondContact O-CB 3.14Å; T1432-L1506 PolarHBondContact O-N 3.2Å; L1434-L1506 HydrophobicContact CD1-CB 3.65Å; L1434-L1506 HydrophobicContact CD1-CD1 4.06Å; L1434-L1506 HydrophobicContact CD1-CD2 4.14Å; L1434-L1506 HydrophobicContact CD1-CG 4.15Å; L1434-L1506 HydrophobicContact CD2-CB 4.02Å; L1434-L1506 HydrophobicContact CD2-CD2 3.97Å; L1434-L1506 HydrophobicContact CG-CB 3.51Å; L1434-L1506 HydrophobicContact CG-CD2 4.27Å; L1434-L1506 HydrophobicContact CG-CG 4.37Å; L1473-L1506 HydrophobicContact CD2-CD1 4.26Å; V1482-L1506 HydrophobicContact CB-CD1 3.92Å; V1482-L1506 HydrophobicContact CB-CG 4.43Å; V1482-L1506 HydrophobicContact CG1-CB 4.48Å; V1482-L1506 HydrophobicContact CG1-CD1 3.19Å; V1482-L1506 HydrophobicContact CG1-CD2 3.99Å; V1482-L1506 HydrophobicContact CG1-CG 3.26Å; R1483-L1506 CarbonylContact O-C 3.53Å; R1483-L1506 VanDerWaalsContact O-CA 3.31Å; R1483-L1506 WeakPolarHBondContact O-CA 3.4Å; L1484-L1506 HydrophobicContact CD1-CD1 4.4Å; L1506-V1516 HydrophobicContact CD1-CG2 3.52Å; L1506-V1516 HydrophobicContact CD2-CG2 4.35Å; L1506-I1549 HydrophobicContact CD1-CD1 4.45Å; L1506-I1549 HydrophobicContact CD2-CB 4.44Å; L1506-I1549 HydrophobicContact CD2-CD1 3.45Å; L1506-I1549 VanDerWaalsContact CD2-CD1 3.45Å; L1506-I1549 HydrophobicContact CD2-CG1 3.6Å; L1506-I1549 HydrophobicContact CD2-CG2 4.43Å
1507	V	69.8	Low	65.5	Low	4 Å²	4	31.7 Å²	31.7	2%	0.024	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.2	-178.8	-176.5	0	0	0	0	108.9	V1482 R1483 E1485 V1505 L1509	V1482-V1507 CarbonylContact C-O 3.5Å; V1482-V1507 VanDerWaalsContact CA-O 3.27Å; V1482-V1507 WeakPolarHBondContact CA-O 3.41Å; V1482-V1507 WeakPolarHBondContact CG1-O 3.04Å; R1483-V1507 HydrophobicContact CB-CB 4.35Å; R1483-V1507 PolarHBondContact N-O 2.98Å; R1483-V1507 PolarHBondContact O-N 3.16Å; E1485-V1507 HydrophobicContact CG-CG2 4.17Å; E1485-V1507 WeakPolarHBondContact OE2-CG2 3.07Å; V1505-V1507 HydrophobicContact CG1-CG2 3.9Å; V1505-V1507 PolarHBondContact O-N 2.92Å; V1507-L1509 PolarHBondContact O-N 3.36Å
1508	G	62.9	Low	67	Low	0 Å²	0	25 Å²	25	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	127.7	168.9	0	0	0	0	0	110.5	C1429	C1429-G1508 WeakPolarHBondContact CA-O 3.06Å; C1429-G1508 VanDerWaalsContact CB-O 3.28Å; C1429-G1508 WeakPolarHBondContact CB-O 3.24Å; C1429-G1508 PolarHBondContact N-O 2.95Å; C1429-G1508 WeakPolarHBondContact O-CA 2.85Å; C1429-G1508 PolarHBondContact O-N 2.65Å
1509	L	63.3	Low	68.5	Low	22 Å²	22	22.3 Å²	22.3	12%	0.115	13%	0.134	C	C	.	.			trans	-98.8	-17.6	175.8	-61.4	175.9	0	0	0	112.7	F1481 R1483 V1507 V2469	F1481-L1509 WeakPolarHBondContact O-CB 3.38Å; F1481-L1509 PolarHBondContact O-N 2.83Å; R1483-L1509 HydrophobicContact CB-CD1 4.05Å; R1483-L1509 HydrophobicContact CB-CD2 4Å; R1483-L1509 HydrophobicContact CB-CG 4.08Å; V1507-L1509 PolarHBondContact O-N 3.36Å; L1509-V2469 HydrophobicContact CD1-CG2 4.11Å
1510	K	52	Low	69.7	Low	30 Å²	30	19.4 Å²	19.4	13%	0.13	12%	0.12	C	C	.	.	S	Bend	trans	-178.4	155.7	-173.5	42	176.5	176.6	171.2	0	109.4	S1480 F1481 V1551	S1480-K1510 WeakPolarHBondContact O-CE 3.21Å; F1481-K1510 HydrophobicContact CB-CD 4.32Å; F1481-K1510 HydrophobicContact CB-CG 3.93Å; F1481-K1510 HydrophobicContact CD1-CD 3.55Å; F1481-K1510 HydrophobicContact CD1-CG 3.84Å; F1481-K1510 HydrophobicContact CE1-CD 4.19Å; F1481-K1510 HydrophobicContact CG-CD 4.19Å; F1481-K1510 VanDerWaalsContact CG-CE 3.48Å; F1481-K1510 HydrophobicContact CG-CG 4.29Å; F1481-K1510 PolarHBondContact O-N 2.96Å; K1510-V1551 WeakPolarHBondContact O-CB 3.42Å; K1510-V1551 WeakPolarHBondContact O-CG1 3.39Å
1511	P	60	Low	70.5	Confident	67 Å²	67	17 Å²	17	44%	0.435	11%	0.108	S	C	.	.	S	Bend	trans	-53.6	150.4	166.9	-25	35.4	0	0	0	112.1	C1421 F1481 V1551	C1421-P1511 HydrophobicContact CB-CG 4.34Å; C1421-P1511 VanDerWaalsContact SG-CD 3.52Å; F1481-P1511 WeakPolarHBondContact CD1-O 3.45Å; P1511-V1551 WeakPolarHBondContact CA-O 3.49Å
1512	G	62.6	Low	71	Confident	18 Å²	18	18.1 Å²	18.1	19%	0.186	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	124.6	-176.4	178.6	0	0	0	0	0	115.2	V1551	G1512-V1551 PolarHBondContact N-O 2.89Å; G1512-V1551 PolarHBondContact O-N 3.06Å
1513	T	64.3	Low	71.7	Confident	49 Å²	49	19.4 Å²	19.4	30%	0.301	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129	-167	47.5	0	0	0	0	114.5	F1481 I1549 V1550	F1481-T1513 WeakPolarHBondContact CD2-O 3.19Å; T1513-I1549 VanDerWaalsContact CA-O 3.27Å; T1513-I1549 WeakPolarHBondContact CA-O 3.17Å; T1513-V1550 HydrophobicContact CG2-CG2 3.95Å
1514	V	73.9	Confident	72.4	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.006	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129.3	172.4	163.1	0	0	0	0	111.9	L1473 S1480 F1481 V1482 V1516 T1548 I1549	L1473-V1514 HydrophobicContact CD2-CG1 3.66Å; S1480-V1514 WeakPolarHBondContact OG-CG1 2.93Å; S1480-V1514 VanDerWaalsContact OG-CG2 3.25Å; S1480-V1514 WeakPolarHBondContact OG-CG2 3.48Å; F1481-V1514 HydrophobicContact CB-CG2 3.58Å; F1481-V1514 HydrophobicContact CD2-CG2 3.7Å; F1481-V1514 HydrophobicContact CG-CG2 4.11Å; V1482-V1514 HydrophobicContact CB-CB 4.25Å; V1482-V1514 HydrophobicContact CB-CG1 4.3Å; V1482-V1514 HydrophobicContact CB-CG2 4.25Å; V1482-V1514 HydrophobicContact CG2-CB 3.76Å; V1482-V1514 HydrophobicContact CG2-CG1 4.34Å; V1482-V1514 HydrophobicContact CG2-CG2 3.79Å; V1514-V1516 HydrophobicContact CG1-CG2 4.5Å; V1514-T1548 CarbonylContact O-C 3.55Å; V1514-T1548 WeakPolarHBondContact O-CA 3.44Å; V1514-I1549 PolarHBondContact N-O 2.86Å; V1514-I1549 PolarHBondContact O-N 2.82Å
1515	T	78.4	Confident	72.1	Confident	21 Å²	21	26.1 Å²	26.1	13%	0.129	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	108	164	21.8	0	0	0	0	110.8	N1474 L1547 T1548	N1474-T1515 WeakPolarHBondContact CA-O 3.3Å; N1474-T1515 WeakPolarHBondContact CB-OG1 3.16Å; N1474-T1515 PolarHBondContact N-O 3.27Å; N1474-T1515 PolarHBondContact ND2-OG1 2.96Å; N1474-T1515 PolarHBondContact O-N 2.74Å; N1474-T1515 PolarHBondContact O-OG1 2.79Å; T1515-L1547 CarbonylContact C-O 3.5Å; T1515-L1547 VanDerWaalsContact CA-O 3.29Å; T1515-L1547 WeakPolarHBondContact CA-O 3.32Å; T1515-T1548 HydrophobicContact CG2-CG2 4.04Å
1516	V	77.8	Confident	72.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.4	159.1	-179.4	0	0	0	0	107.5	I1382 L1434 W1471 L1473 L1484 L1506 V1514 Q1546 L1547 I1549	I1382-V1516 HydrophobicContact CD1-CB 4.16Å; I1382-V1516 HydrophobicContact CD1-CG1 3.82Å; I1382-V1516 WeakPolarHBondContact CD1-O 3.34Å; L1434-V1516 HydrophobicContact CD1-CG1 4.04Å; L1434-V1516 HydrophobicContact CD1-CG2 4.15Å; W1471-V1516 HydrophobicContact CE3-CG1 3.86Å; W1471-V1516 HydrophobicContact CZ3-CG1 4.05Å; L1473-V1516 HydrophobicContact CD2-CB 4.45Å; L1473-V1516 HydrophobicContact CD2-CG2 3.64Å; L1484-V1516 HydrophobicContact CD1-CG1 3.69Å; L1484-V1516 HydrophobicContact CD1-CG2 4.27Å; L1506-V1516 HydrophobicContact CD1-CG2 3.52Å; L1506-V1516 HydrophobicContact CD2-CG2 4.35Å; V1514-V1516 HydrophobicContact CG1-CG2 4.5Å; V1516-Q1546 CarbonylContact O-C 3.53Å; V1516-Q1546 VanDerWaalsContact O-CA 3.26Å; V1516-Q1546 WeakPolarHBondContact O-CA 3.02Å; V1516-L1547 PolarHBondContact N-O 3.5Å; V1516-L1547 PolarHBondContact O-N 3.19Å; V1516-I1549 HydrophobicContact CB-CD1 4.14Å; V1516-I1549 HydrophobicContact CG2-CD1 3.37Å
1517	H	82.4	Confident	72	Confident	35 Å²	35	34.1 Å²	34.1	16%	0.162	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	151.3	169.4	-65	-101.3	0	0	0	110.6	H1472 N1474 A1545 Q1546	H1472-H1517 PolarHBondContact CE1-O 2.91Å; H1472-H1517 PolarHBondContact N-O 2.96Å; H1472-H1517 WeakPolarHBondContact O-CA 3.43Å; H1472-H1517 WeakPolarHBondContact O-CB 3.29Å; H1472-H1517 PolarHBondContact O-N 3.47Å; H1472-H1517 VanDerWaalsContact O-O 3.09Å; N1474-H1517 WeakPolarHBondContact CB-CD2 3.44Å; N1474-H1517 VanDerWaalsContact CB-NE2 3.34Å; N1474-H1517 WeakPolarHBondContact CB-NE2 3.4Å; N1474-H1517 PolarHBondContact ND2-NE2 3.12Å; H1517-A1545 WeakPolarHBondContact CA-O 3.23Å; H1517-Q1546 PolarHBondContact CE1-OE1 3.27Å; H1517-Q1546 WeakPolarHBondContact ND1-CB 3.42Å
1518	L	82.8	Confident	72	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	140.1	177.1	165.2	74.6	0	0	0	108.9	V1380 I1382 V1436 Y1469 W1471 V1520 H1544 A1545	V1380-L1518 HydrophobicContact CB-CD2 4.04Å; V1380-L1518 HydrophobicContact CG2-CD2 3.84Å; V1380-L1518 HydrophobicContact CG2-CG 4.36Å; I1382-L1518 HydrophobicContact CD1-CB 3.85Å; I1382-L1518 HydrophobicContact CG1-CB 3.9Å; I1382-L1518 HydrophobicContact CG1-CD2 4Å; V1436-L1518 HydrophobicContact CB-CD2 4.04Å; V1436-L1518 HydrophobicContact CG1-CD2 3.55Å; V1436-L1518 HydrophobicContact CG2-CD1 3.83Å; V1436-L1518 HydrophobicContact CG2-CD2 3.42Å; V1436-L1518 VanDerWaalsContact CG2-CD2 3.42Å; V1436-L1518 HydrophobicContact CG2-CG 4.26Å; Y1469-L1518 HydrophobicContact CD1-CD1 4.5Å; W1471-L1518 HydrophobicContact CD2-CD1 3.82Å; W1471-L1518 HydrophobicContact CE3-CB 4.2Å; W1471-L1518 HydrophobicContact CE3-CD1 4.19Å; W1471-L1518 HydrophobicContact CG-CD1 4.15Å; W1471-L1518 HydrophobicContact CZ2-CD1 4.36Å; W1471-L1518 HydrophobicContact CZ3-CB 4.45Å; L1518-V1520 HydrophobicContact CD1-CG2 4Å; L1518-V1520 HydrophobicContact CD2-CG2 4.15Å; L1518-V1520 HydrophobicContact CG-CG2 4.05Å; L1518-H1544 WeakPolarHBondContact O-CA 3.4Å; L1518-A1545 HydrophobicContact CB-CB 4.2Å; L1518-A1545 HydrophobicContact CD2-CB 4.23Å; L1518-A1545 PolarHBondContact N-O 3.24Å; L1518-A1545 PolarHBondContact O-N 3.09Å
1519	T	83.5	Confident	72.6	Confident	12 Å²	12	38.8 Å²	38.8	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.9	168.4	-35	0	0	0	0	109.2	Y1469 R1470 H1472 R1542 L1543	Y1469-T1519 CarbonylContact C-O 3.53Å; R1470-T1519 PolarHBondContact N-O 3.33Å; R1470-T1519 PolarHBondContact O-N 3.05Å; H1472-T1519 PolarHBondContact NE2-OG1 2.9Å; T1519-R1542 HydrophobicContact CG2-CB 4.49Å; T1519-L1543 CarbonylContact C-O 3.19Å; T1519-L1543 WeakPolarHBondContact CA-O 3.19Å
1520	V	82.3	Confident	73.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.2	172.1	-179.1	0	0	0	0	109.9	V1380 V1436 M1460 L1467 R1468 Y1469 L1518 R1542 L1543	V1380-V1520 HydrophobicContact CG1-CB 4.11Å; V1380-V1520 HydrophobicContact CG1-CG2 3.89Å; V1380-V1520 HydrophobicContact CG2-CG2 4.29Å; V1436-V1520 HydrophobicContact CG1-CG2 4.28Å; M1460-V1520 HydrophobicContact CE-CG1 4.23Å; L1467-V1520 HydrophobicContact CB-CG1 4.27Å; L1467-V1520 HydrophobicContact CD1-CG1 4.4Å; R1468-V1520 WeakPolarHBondContact O-CA 3.25Å; Y1469-V1520 HydrophobicContact CD1-CG1 4.39Å; Y1469-V1520 HydrophobicContact CD1-CG2 3.55Å; Y1469-V1520 HydrophobicContact CE1-CG1 4.11Å; Y1469-V1520 HydrophobicContact CE1-CG2 3.83Å; Y1469-V1520 HydrophobicContact CG-CG2 4.47Å; L1518-V1520 HydrophobicContact CD1-CG2 4Å; L1518-V1520 HydrophobicContact CD2-CG2 4.15Å; L1518-V1520 HydrophobicContact CG-CG2 4.05Å; V1520-R1542 CarbonylContact O-C 3.42Å; V1520-R1542 VanDerWaalsContact O-CA 3.27Å; V1520-R1542 WeakPolarHBondContact O-CA 3.46Å; V1520-L1543 PolarHBondContact N-O 2.87Å; V1520-L1543 PolarHBondContact O-N 3.31Å
1521	E	80.9	Confident	73.8	Confident	12 Å²	12	39.5 Å²	39.5	6%	0.056	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	145.9	-178.6	59.7	-167.3	176.4	0	0	110.2	R1468 R1470 R1542	R1468-E1521 HydrophobicContact CB-CG 3.98Å; R1468-E1521 VanDerWaalsContact CD-OE1 3.25Å; R1468-E1521 WeakPolarHBondContact CD-OE1 3.19Å; R1468-E1521 HydrophobicContact CG-CG 4.08Å; R1468-E1521 PolarHBondContact N-O 3.41Å; R1468-E1521 PolarHBondContact O-N 2.83Å; R1470-E1521 WeakPolarHBondContact CD-OE1 3.3Å; R1470-E1521 IonicContact CZ-OE1 3.48Å; R1470-E1521 IonicContact NH1-OE1 3.61Å; R1470-E1521 PolarHBondContact NH1-OE1 2.9Å; E1521-R1542 IonicContact OE1-NH2 3.34Å; E1521-R1542 IonicContact OE2-CZ 3.78Å; E1521-R1542 IonicContact OE2-NE 3.95Å; E1521-R1542 PolarHBondContact OE2-NE 3.05Å; E1521-R1542 IonicContact OE2-NH2 2.66Å; E1521-R1542 PolarHBondContact OE2-NH2 3.3Å
1522	P	76.8	Confident	73.6	Confident	23 Å²	23	37.2 Å²	37.2	15%	0.149	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	145.8	-176.3	34.5	-29.3	0	0	0	110.9	L1467 I1530 D1541	L1467-P1522 HydrophobicContact CD2-CB 3.96Å; P1522-I1530 HydrophobicContact CB-CD1 4.3Å; P1522-I1530 HydrophobicContact CG-CD1 4.07Å; P1522-D1541 WeakPolarHBondContact CD-O 3.29Å
1523	V	76.9	Confident	73	Confident	83 Å²	83	40.8 Å²	40.8	50%	0.503	21%	0.214	S	C	.	.	S	Bend	trans	-73.8	-33	176.8	174.4	0	0	0	0	111.5	P1466	P1466-V1523 HydrophobicContact CG-CB 4.21Å; P1466-V1523 HydrophobicContact CG-CG2 4.07Å; P1466-V1523 VanDerWaalsContact O-CB 3.23Å; P1466-V1523 WeakPolarHBondContact O-CB 3.4Å; P1466-V1523 VanDerWaalsContact O-CG2 3.28Å; P1466-V1523 WeakPolarHBondContact O-CG2 3.44Å; P1466-V1523 PolarHBondContact O-N 3.14Å
1524	E	76.4	Confident	72.2	Confident	105 Å²	105	40.7 Å²	40.7	49%	0.491	22%	0.215	S	C	.	.			trans	-114.3	103.1	171.5	-68.3	-170.5	-169.4	0	0	111.2	P1465 Y1526 A1527	P1465-E1524 HydrophobicContact CB-CB 4.04Å; P1465-E1524 HydrophobicContact CB-CG 3.78Å; P1465-E1524 HydrophobicContact CG-CB 3.8Å; P1465-E1524 HydrophobicContact CG-CG 4.03Å; E1524-Y1526 PolarHBondContact O-N 3.01Å; E1524-A1527 WeakPolarHBondContact O-CB 3.03Å; E1524-A1527 PolarHBondContact O-N 3.12Å; E1524-A1527 VanDerWaalsContact O-N 3.15Å
1525	P	66.4	Low	70.9	Confident	53 Å²	53	47.4 Å²	47.4	34%	0.344	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-64.8	-22.7	-177.9	25.1	-33.9	0	0	0	113.2	A1527	P1525-A1527 PolarHBondContact O-N 3.32Å
1526	Y	69.7	Low	69.3	Low	169 Å²	169	52 Å²	52	66%	0.663	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-68	-19	177.1	-58	-72.4	0	0	0	113.9	E1524 K1528	E1524-Y1526 PolarHBondContact O-N 3.01Å; Y1526-K1528 PolarHBondContact O-N 2.86Å
1527	A	68.2	Low	67.5	Low	13 Å²	13	55.6 Å²	55.6	11%	0.107	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-71.5	-10.8	-178.7	0	0	0	0	0	113.7	L1288 P1465 E1524 P1525 Q1529	L1288-A1527 CarbonylContact C-O 3.51Å; L1288-A1527 WeakPolarHBondContact CB-O 3.37Å; P1465-A1527 HydrophobicContact CG-CB 4Å; E1524-A1527 WeakPolarHBondContact O-CB 3.03Å; E1524-A1527 PolarHBondContact O-N 3.12Å; E1524-A1527 VanDerWaalsContact O-N 3.15Å; P1525-A1527 PolarHBondContact O-N 3.32Å; A1527-Q1529 HydrophobicContact CB-CG 3.75Å; A1527-Q1529 PolarHBondContact O-N 3.49Å; A1527-Q1529 VanDerWaalsContact O-N 3.13Å
1528	K	70.4	Confident	65.8	Low	101 Å²	101	56.5 Å²	56.5	44%	0.439	32%	0.322	S	S	.	.			trans	58.5	20.8	-179.3	-56.6	176.4	179.5	179	0	114.6	L1288 E1332 Y1526 I1530	L1288-K1528 HydrophobicContact CB-CB 4.18Å; L1288-K1528 HydrophobicContact CD1-CB 3.9Å; L1288-K1528 WeakPolarHBondContact CD1-O 3.3Å; E1332-K1528 IonicContact OE2-NZ 3.88Å; E1332-K1528 PolarHBondContact OE2-NZ 3.14Å; Y1526-K1528 PolarHBondContact O-N 2.86Å; K1528-I1530 PolarHBondContact O-N 2.79Å
1529	Q	74.7	Confident	64.2	Low	1 Å²	1	59 Å²	59	1%	0.005	34%	0.34	C	S	.	.			trans	-60.1	-17.7	-176.2	-69.9	172.6	-13.9	0	0	114.7	L1287 L1288 A1376 L1377 V1463 P1465 L1467 A1527	L1287-Q1529 HydrophobicContact CB-CB 4.23Å; L1287-Q1529 HydrophobicContact CB-CG 3.94Å; L1287-Q1529 HydrophobicContact CD1-CB 4.13Å; L1287-Q1529 HydrophobicContact CD1-CG 4.36Å; L1288-Q1529 WeakPolarHBondContact O-CG 3.37Å; A1376-Q1529 WeakPolarHBondContact CA-O 3.4Å; L1377-Q1529 PolarHBondContact N-O 3.14Å; V1463-Q1529 VanDerWaalsContact CG1-NE2 3.32Å; P1465-Q1529 PolarHBondContact O-NE2 3.19Å; L1467-Q1529 HydrophobicContact CD2-CB 4.4Å; L1467-Q1529 VanDerWaalsContact CD2-OE1 3.27Å; A1527-Q1529 HydrophobicContact CB-CG 3.75Å; A1527-Q1529 PolarHBondContact O-N 3.49Å; A1527-Q1529 VanDerWaalsContact O-N 3.13Å
1530	I	75.1	Confident	63	Low	15 Å²	15	60.3 Å²	60.3	8%	0.077	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-125	131	-178.9	-76.3	157.7	0	0	0	109.5	L1377 L1467 P1522 K1528 T1540 L1543	L1377-I1530 HydrophobicContact CB-CG1 3.76Å; L1377-I1530 HydrophobicContact CD1-CG1 4.17Å; L1377-I1530 CarbonylContact O-C 3.56Å; L1377-I1530 VanDerWaalsContact O-CA 3.23Å; L1377-I1530 WeakPolarHBondContact O-CA 3.16Å; L1467-I1530 HydrophobicContact CD2-CD1 4.41Å; P1522-I1530 HydrophobicContact CB-CD1 4.3Å; P1522-I1530 HydrophobicContact CG-CD1 4.07Å; K1528-I1530 PolarHBondContact O-N 2.79Å; I1530-T1540 VanDerWaalsContact CG2-O 3.23Å; I1530-T1540 WeakPolarHBondContact CG2-O 3.34Å; I1530-L1543 HydrophobicContact CD1-CD1 4.32Å; I1530-L1543 HydrophobicContact CD1-CG 4.43Å; I1530-L1543 HydrophobicContact CG1-CD1 3.84Å; I1530-L1543 HydrophobicContact CG1-CG 4.24Å; I1530-L1543 HydrophobicContact CG2-CD1 4.06Å; I1530-L1543 HydrophobicContact CG2-CD2 3.85Å; I1530-L1543 HydrophobicContact CG2-CG 3.79Å
1531	I	66.4	Low	62.2	Low	51 Å²	51	62.8 Å²	62.8	26%	0.262	36%	0.361	S	S	.	.			trans	-138.4	100.4	176.6	-65.8	176	0	0	0	108.5	L1288 L1334 A1376 L1377 S1378 Y1441 V1533	L1288-I1531 HydrophobicContact CD1-CD1 3.86Å; L1334-I1531 HydrophobicContact CD1-CD1 3.94Å; L1334-I1531 HydrophobicContact CD2-CD1 4.38Å; L1334-I1531 HydrophobicContact CG-CD1 4.46Å; A1376-I1531 HydrophobicContact CB-CB 3.65Å; A1376-I1531 HydrophobicContact CB-CD1 3.53Å; A1376-I1531 HydrophobicContact CB-CG1 3.44Å; A1376-I1531 VanDerWaalsContact CB-CG1 3.44Å; L1377-I1531 PolarHBondContact O-N 2.65Å; S1378-I1531 WeakPolarHBondContact CA-O 3.46Å; S1378-I1531 VanDerWaalsContact CB-O 3.31Å; S1378-I1531 WeakPolarHBondContact CB-O 3.37Å; Y1441-I1531 HydrophobicContact CD1-CB 4.27Å; Y1441-I1531 HydrophobicContact CD1-CG2 3.84Å; Y1441-I1531 HydrophobicContact CE1-CG2 4.01Å; I1531-V1533 PolarHBondContact O-N 2.76Å
1532	A	54.8	Low	62	Low	19 Å²	19	67 Å²	67	16%	0.157	38%	0.376	C	S	.	.			trans	-69.4	117.2	-177.4	0	0	0	0	0	112.4	S1534 T1540	A1532-S1534 PolarHBondContact O-N 3.44Å; A1532-S1534 VanDerWaalsContact O-N 3.1Å; A1532-T1540 HydrophobicContact CB-CG2 4.33Å; A1532-T1540 VanDerWaalsContact CB-OG1 3.23Å; A1532-T1540 WeakPolarHBondContact CB-OG1 2.94Å
1533	V	51.7	Low	62.1	Low	94 Å²	94	66.2 Å²	66.2	57%	0.57	37%	0.371	S	S	*	.			trans	-87.2	68.9	170.8	-173.1	0	0	0	0	108.7	Y1441 I1531	Y1441-V1533 HydrophobicContact CD2-CG2 3.5Å; Y1441-V1533 HydrophobicContact CE2-CG2 3.97Å; Y1441-V1533 HydrophobicContact CG-CG2 3.8Å; I1531-V1533 PolarHBondContact O-N 2.76Å
1534	S	47.7	Very low	62.1	Low	47 Å²	47	68.1 Å²	68.1	33%	0.329	37%	0.374	S	S	.	.			trans	-74.7	143.5	165	177.9	0	0	0	0	109.8	A1532 D1536 G1537	A1532-S1534 PolarHBondContact O-N 3.44Å; A1532-S1534 VanDerWaalsContact O-N 3.1Å; S1534-D1536 PolarHBondContact O-N 3.1Å; S1534-D1536 PolarHBondContact OG-N 2.63Å; S1534-D1536 VanDerWaalsContact OG-N 3.09Å; S1534-G1537 PolarHBondContact O-N 2.94Å
1535	T	45.9	Very low	62.1	Low	141 Å²	141	63.6 Å²	63.6	87%	0.865	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.3	167.3	45.3	0	0	0	0	112.9
1536	D	45.7	Very low	62.7	Low	117 Å²	117	65.1 Å²	65.1	63%	0.626	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	8.4	-168.5	-46.3	-13.6	0	0	0	111.9	S1534 M1538	S1534-D1536 PolarHBondContact O-N 3.1Å; S1534-D1536 PolarHBondContact OG-N 2.63Å; S1534-D1536 VanDerWaalsContact OG-N 3.09Å; D1536-M1538 PolarHBondContact O-N 3.1Å
1537	G	39.7	Very low	62.8	Low	77 Å²	77	57.8 Å²	57.8	79%	0.794	33%	0.33	S	S	*	.			trans	72.8	20.4	169.9	0	0	0	0	0	116.1	S1534	S1534-G1537 PolarHBondContact O-N 2.94Å
1538	M	45.1	Very low	62.7	Low	53 Å²	53	58 Å²	58	26%	0.261	33%	0.33	S	S	.	.			trans	-108.9	136.3	-171.8	-73	-157.7	-57.4	0	0	114	N66 A67 D68 D1536	N66-M1538 CarbonylContact O-C 3.57Å; N66-M1538 WeakPolarHBondContact O-CA 3.23Å; N66-M1538 VanDerWaalsContact O-CB 3.26Å; N66-M1538 WeakPolarHBondContact O-CB 3.4Å; A67-M1538 WeakPolarHBondContact O-CE 3.31Å; D68-M1538 HydrophobicContact CB-CE 3.93Å; D68-M1538 HydrophobicContact CB-SD 3.79Å; D68-M1538 PolarHBondContact N-SD 3.43Å; D68-M1538 VanDerWaalsContact N-SD 3.41Å; D1536-M1538 PolarHBondContact O-N 3.1Å
1539	S	49.8	Very low	62.4	Low	52 Å²	52	53.3 Å²	53.3	36%	0.364	31%	0.309	S	S	.	.			trans	-83.9	117.4	-178.1	-173.9	0	0	0	0	110.6	N66 A67	N66-S1539 PolarHBondContact O-N 2.87Å; A67-S1539 WeakPolarHBondContact CB-O 3.28Å
1540	T	58.9	Low	61.6	Low	40 Å²	40	54.4 Å²	54.4	25%	0.245	32%	0.316	C	S	.	.			trans	-108.3	119.1	171.4	68.4	0	0	0	0	110.4	I1530 A1532 R1542	I1530-T1540 VanDerWaalsContact CG2-O 3.23Å; I1530-T1540 WeakPolarHBondContact CG2-O 3.34Å; A1532-T1540 HydrophobicContact CB-CG2 4.33Å; A1532-T1540 VanDerWaalsContact CB-OG1 3.23Å; A1532-T1540 WeakPolarHBondContact CB-OG1 2.94Å; T1540-R1542 PolarHBondContact O-N 2.94Å; T1540-R1542 PolarHBondContact OG1-O 3.48Å
1541	D	66.1	Low	60.8	Low	52 Å²	52	53.9 Å²	53.9	28%	0.278	31%	0.314	S	S	.	.	S	Bend	trans	-72.6	11.8	179	-39.2	-65.9	0	0	0	113	L15 P1522	L15-D1541 HydrophobicContact CD2-CB 4.49Å; L15-D1541 WeakPolarHBondContact CD2-OD2 3.16Å; P1522-D1541 WeakPolarHBondContact CD-O 3.29Å
1542	R	75.8	Confident	60	Low	100 Å²	100	54.3 Å²	54.3	38%	0.377	32%	0.316	S	S	.	.	S	Bend	trans	-147.1	143.8	-173.8	-21.1	178.6	90.3	165.3	8.7	107.9	T1519 V1520 E1521 T1540	T1519-R1542 HydrophobicContact CG2-CB 4.49Å; V1520-R1542 CarbonylContact O-C 3.42Å; V1520-R1542 VanDerWaalsContact O-CA 3.27Å; V1520-R1542 WeakPolarHBondContact O-CA 3.46Å; E1521-R1542 IonicContact OE1-NH2 3.34Å; E1521-R1542 IonicContact OE2-CZ 3.78Å; E1521-R1542 IonicContact OE2-NE 3.95Å; E1521-R1542 PolarHBondContact OE2-NE 3.05Å; E1521-R1542 IonicContact OE2-NH2 2.66Å; E1521-R1542 PolarHBondContact OE2-NH2 3.3Å; T1540-R1542 PolarHBondContact O-N 2.94Å; T1540-R1542 PolarHBondContact OG1-O 3.48Å
1543	L	78.1	Confident	59.8	Low	7 Å²	7	54.7 Å²	54.7	4%	0.037	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.8	178.7	-59.7	174.8	0	0	0	110	L1377 V1380 T1519 V1520 I1530	L1377-L1543 HydrophobicContact CB-CD1 3.46Å; L1377-L1543 VanDerWaalsContact CB-CD1 3.46Å; V1380-L1543 HydrophobicContact CG1-CB 4.19Å; V1380-L1543 HydrophobicContact CG1-CD1 4.17Å; V1380-L1543 HydrophobicContact CG2-CB 3.89Å; T1519-L1543 CarbonylContact C-O 3.19Å; T1519-L1543 WeakPolarHBondContact CA-O 3.19Å; V1520-L1543 PolarHBondContact N-O 2.87Å; V1520-L1543 PolarHBondContact O-N 3.31Å; I1530-L1543 HydrophobicContact CD1-CD1 4.32Å; I1530-L1543 HydrophobicContact CD1-CG 4.43Å; I1530-L1543 HydrophobicContact CG1-CD1 3.84Å; I1530-L1543 HydrophobicContact CG1-CG 4.24Å; I1530-L1543 HydrophobicContact CG2-CD1 4.06Å; I1530-L1543 HydrophobicContact CG2-CD2 3.85Å; I1530-L1543 HydrophobicContact CG2-CG 3.79Å
1544	H	78.2	Confident	59.9	Low	123 Å²	123	53.8 Å²	53.8	57%	0.569	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.9	-176.9	-64.3	-73	0	0	0	110.8	L1518	L1518-H1544 WeakPolarHBondContact O-CA 3.4Å
1545	A	76.5	Confident	60.3	Low	11 Å²	11	52 Å²	52	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	149.9	160.2	0	0	0	0	0	109.3	V1380 I1382 H1517 L1518	V1380-A1545 HydrophobicContact CG2-CB 3.95Å; V1380-A1545 WeakPolarHBondContact O-CB 3.41Å; I1382-A1545 HydrophobicContact CD1-CB 3.89Å; I1382-A1545 HydrophobicContact CG1-CB 3.79Å; H1517-A1545 WeakPolarHBondContact CA-O 3.23Å; L1518-A1545 HydrophobicContact CB-CB 4.2Å; L1518-A1545 HydrophobicContact CD2-CB 4.23Å; L1518-A1545 PolarHBondContact N-O 3.24Å; L1518-A1545 PolarHBondContact O-N 3.09Å
1546	Q	78.7	Confident	60.8	Low	85 Å²	85	45.3 Å²	45.3	40%	0.397	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	143.3	161.7	74.8	-172.3	-70.3	0	0	109.1	R1415 V1516 H1517	R1415-Q1546 VanDerWaalsContact CD-O 3.29Å; R1415-Q1546 WeakPolarHBondContact CD-O 3.33Å; R1415-Q1546 VanDerWaalsContact CZ-CG 3.48Å; R1415-Q1546 PolarHBondContact NE-O 2.81Å; V1516-Q1546 CarbonylContact O-C 3.53Å; V1516-Q1546 VanDerWaalsContact O-CA 3.26Å; V1516-Q1546 WeakPolarHBondContact O-CA 3.02Å; H1517-Q1546 PolarHBondContact CE1-OE1 3.27Å; H1517-Q1546 WeakPolarHBondContact ND1-CB 3.42Å
1547	L	72	Confident	61.5	Low	15 Å²	15	39.7 Å²	39.7	8%	0.079	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	109.3	-168.7	168.4	68.7	0	0	0	108.1	I1382 F1417 T1515 V1516 I1549	I1382-L1547 HydrophobicContact CB-CB 4.11Å; I1382-L1547 HydrophobicContact CB-CD2 3.65Å; I1382-L1547 HydrophobicContact CD1-CB 3.85Å; I1382-L1547 HydrophobicContact CG2-CD2 3.36Å; F1417-L1547 HydrophobicContact CD2-CD1 3.45Å; F1417-L1547 VanDerWaalsContact CD2-CD1 3.45Å; F1417-L1547 HydrophobicContact CD2-CD2 3.57Å; F1417-L1547 HydrophobicContact CD2-CG 3.93Å; F1417-L1547 HydrophobicContact CE2-CD1 3.48Å; F1417-L1547 VanDerWaalsContact CE2-CD1 3.48Å; F1417-L1547 HydrophobicContact CE2-CD2 3.54Å; F1417-L1547 HydrophobicContact CE2-CG 4.09Å; F1417-L1547 HydrophobicContact CG-CD1 4.23Å; F1417-L1547 HydrophobicContact CZ-CD1 4.32Å; T1515-L1547 CarbonylContact C-O 3.5Å; T1515-L1547 VanDerWaalsContact CA-O 3.29Å; T1515-L1547 WeakPolarHBondContact CA-O 3.32Å; V1516-L1547 PolarHBondContact N-O 3.5Å; V1516-L1547 PolarHBondContact O-N 3.19Å; L1547-I1549 HydrophobicContact CD2-CD1 3.93Å; L1547-I1549 HydrophobicContact CD2-CG1 4.3Å; L1547-I1549 HydrophobicContact CG-CD1 3.93Å; L1547-I1549 HydrophobicContact CG-CG1 4.26Å; L1547-I1549 WeakPolarHBondContact O-CD1 3.47Å
1548	T	66.4	Low	62.5	Low	18 Å²	18	36.3 Å²	36.3	11%	0.11	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	136.6	165.4	-15.7	0	0	0	0	109.8	R1415 F1417 V1514 T1515	R1415-T1548 CarbonylContact C-O 3.53Å; R1415-T1548 CarbonylContact O-C 3.48Å; R1415-T1548 VanDerWaalsContact O-C 3.25Å; R1415-T1548 VanDerWaalsContact O-CA 3.3Å; R1415-T1548 WeakPolarHBondContact O-CA 3.28Å; R1415-T1548 WeakPolarHBondContact O-CB 2.84Å; R1415-T1548 PolarHBondContact O-OG1 2.8Å; F1417-T1548 PolarHBondContact N-O 3.17Å; V1514-T1548 CarbonylContact O-C 3.55Å; V1514-T1548 WeakPolarHBondContact O-CA 3.44Å; T1515-T1548 HydrophobicContact CG2-CG2 4.04Å
1549	I	63.3	Low	62.9	Low	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.6	170.3	-67.6	105.2	0	0	0	106	F1417 L1419 L1506 T1513 V1514 V1516 L1547 V1551	F1417-I1549 HydrophobicContact CB-CG1 4.24Å; L1419-I1549 HydrophobicContact CB-CG2 3.5Å; L1419-I1549 VanDerWaalsContact CB-CG2 3.5Å; L1419-I1549 HydrophobicContact CD1-CG2 3.87Å; L1419-I1549 HydrophobicContact CG-CG2 4.26Å; L1506-I1549 HydrophobicContact CD1-CD1 4.45Å; L1506-I1549 HydrophobicContact CD2-CB 4.44Å; L1506-I1549 HydrophobicContact CD2-CD1 3.45Å; L1506-I1549 VanDerWaalsContact CD2-CD1 3.45Å; L1506-I1549 HydrophobicContact CD2-CG1 3.6Å; L1506-I1549 HydrophobicContact CD2-CG2 4.43Å; T1513-I1549 VanDerWaalsContact CA-O 3.27Å; T1513-I1549 WeakPolarHBondContact CA-O 3.17Å; V1514-I1549 PolarHBondContact N-O 2.86Å; V1514-I1549 PolarHBondContact O-N 2.82Å; V1516-I1549 HydrophobicContact CB-CD1 4.14Å; V1516-I1549 HydrophobicContact CG2-CD1 3.37Å; L1547-I1549 HydrophobicContact CD2-CD1 3.93Å; L1547-I1549 HydrophobicContact CD2-CG1 4.3Å; L1547-I1549 HydrophobicContact CG-CD1 3.93Å; L1547-I1549 HydrophobicContact CG-CG1 4.26Å; L1547-I1549 WeakPolarHBondContact O-CD1 3.47Å; I1549-V1551 HydrophobicContact CG2-CG2 4.08Å
1550	V	57.4	Low	63.3	Low	25 Å²	25	32.5 Å²	32.5	15%	0.152	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	106	164.2	176.5	0	0	0	0	105.4	H1416 F1417 L1418 L1419 T1513 L1552	H1416-V1550 HydrophobicContact CB-CG2 3.65Å; H1416-V1550 WeakPolarHBondContact CD2-CG2 3.38Å; H1416-V1550 VanDerWaalsContact CG-CG2 3.43Å; F1417-V1550 CarbonylContact O-C 3.04Å; F1417-V1550 PolarHBondContact O-N 3.05Å; L1418-V1550 CarbonylContact C-O 2.85Å; L1418-V1550 WeakPolarHBondContact CA-O 3.47Å; L1418-V1550 HydrophobicContact CD2-CB 4.07Å; L1418-V1550 HydrophobicContact CD2-CG1 4.37Å; L1419-V1550 PolarHBondContact N-O 3.03Å; T1513-V1550 HydrophobicContact CG2-CG2 3.95Å; V1550-L1552 HydrophobicContact CG1-CB 4.24Å; V1550-L1552 HydrophobicContact CG1-CG 3.97Å; V1550-L1552 PolarHBondContact O-N 2.87Å
1551	V	57.9	Low	62.9	Low	3 Å²	3	34.8 Å²	34.8	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	105.6	166.4	-169.3	0	0	0	0	106.6	L1419 C1421 C1429 V1482 K1510 P1511 G1512 I1549	L1419-V1551 HydrophobicContact CB-CG2 4.42Å; L1419-V1551 CarbonylContact O-C 3.42Å; L1419-V1551 WeakPolarHBondContact O-CA 3.49Å; L1419-V1551 VanDerWaalsContact O-CG1 3.29Å; L1419-V1551 WeakPolarHBondContact O-CG1 3.06Å; C1421-V1551 HydrophobicContact CB-CG1 4.11Å; C1421-V1551 WeakPolarHBondContact SG-CG1 3.48Å; C1429-V1551 HydrophobicContact CB-CG1 4.11Å; V1482-V1551 HydrophobicContact CG2-CG2 3.49Å; V1482-V1551 VanDerWaalsContact CG2-CG2 3.49Å; K1510-V1551 WeakPolarHBondContact O-CB 3.42Å; K1510-V1551 WeakPolarHBondContact O-CG1 3.39Å; P1511-V1551 WeakPolarHBondContact CA-O 3.49Å; G1512-V1551 PolarHBondContact N-O 2.89Å; G1512-V1551 PolarHBondContact O-N 3.06Å; I1549-V1551 HydrophobicContact CG2-CG2 4.08Å
1552	L	50.6	Low	62.2	Low	61 Å²	61	37.3 Å²	37.3	32%	0.319	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	166.1	-172.6	-128.7	-156.2	0	0	0	109.7	L1418 L1419 A1420 C1421 V1550	L1418-L1552 HydrophobicContact CB-CB 4.42Å; L1418-L1552 HydrophobicContact CB-CD1 4.23Å; L1418-L1552 HydrophobicContact CD1-CD1 4Å; L1418-L1552 HydrophobicContact CD2-CD1 3.85Å; L1418-L1552 HydrophobicContact CD2-CG 4.23Å; L1418-L1552 HydrophobicContact CG-CD1 4.22Å; L1419-L1552 PolarHBondContact O-N 2.83Å; A1420-L1552 CarbonylContact C-O 2.74Å; A1420-L1552 WeakPolarHBondContact CA-O 3.48Å; C1421-L1552 PolarHBondContact N-O 3.19Å; V1550-L1552 HydrophobicContact CG1-CB 4.24Å; V1550-L1552 HydrophobicContact CG1-CG 3.97Å; V1550-L1552 PolarHBondContact O-N 2.87Å
1553	S	50.8	Low	61	Low	26 Å²	26	35.3 Å²	35.3	18%	0.182	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	138.4	154.9	51.6	0	0	0	0	111	D1582 Q1661	S1553-D1582 WeakPolarHBondContact CB-O 3.47Å; S1553-D1582 PolarHBondContact OG-O 3.31Å; S1553-Q1661 PolarHBondContact O-NE2 2.81Å
1554	R	54	Low	59.6	Low	76 Å²	76	35.5 Å²	35.5	29%	0.287	17%	0.172	S	C	.	.			trans	-104.9	146.3	-177.7	170.6	-146.5	-151.6	160.6	10.6	107.1	A1420 G1556 E1563 W1580	A1420-R1554 HydrophobicContact CB-CB 3.48Å; A1420-R1554 VanDerWaalsContact CB-CB 3.48Å; A1420-R1554 HydrophobicContact CB-CG 3.94Å; R1554-G1556 PolarHBondContact O-N 2.58Å; R1554-E1563 WeakPolarHBondContact CD-OE1 3.36Å; R1554-E1563 WeakPolarHBondContact CG-OE1 3.44Å; R1554-E1563 VanDerWaalsContact CZ-CB 3.42Å; R1554-E1563 IonicContact CZ-OE1 2.63Å; R1554-E1563 IonicContact CZ-OE2 3.13Å; R1554-E1563 VanDerWaalsContact CZ-OE2 3.27Å; R1554-E1563 IonicContact NE-OE1 3.52Å; R1554-E1563 PolarHBondContact NE-OE1 2.9Å; R1554-E1563 IonicContact NE-OE2 2.6Å; R1554-E1563 PolarHBondContact NE-OE2 3.35Å; R1554-E1563 VanDerWaalsContact NE-OE2 3.13Å; R1554-E1563 VanDerWaalsContact NH2-CD 3.34Å; R1554-E1563 IonicContact NH2-OE1 3.85Å; R1554-E1563 IonicContact NH2-OE2 3.44Å; R1554-E1563 PolarHBondContact NH2-OE2 2.83Å; R1554-W1580 HydrophobicContact CB-CD2 4.49Å; R1554-W1580 HydrophobicContact CB-CE3 3.74Å; R1554-W1580 HydrophobicContact CB-CZ3 3.89Å; R1554-W1580 HydrophobicContact CG-CE3 4.43Å; R1554-W1580 HydrophobicContact CG-CZ3 4.42Å; R1554-W1580 VanDerWaalsContact NH1-CZ2 3.32Å; R1554-W1580 WeakPolarHBondContact O-CB 3.32Å
1555	L	54.7	Low	58.6	Low	9 Å²	9	32 Å²	32	5%	0.047	16%	0.156	C	C	.	.			trans	-73.1	58.1	159.4	-166.8	82.1	0	0	0	109.7	P1579 L1583 I1638 Q1661 L1663	L1555-P1579 HydrophobicContact CD1-CB 4.28Å; L1555-L1583 HydrophobicContact CD1-CD1 3.83Å; L1555-L1583 HydrophobicContact CD1-CD2 3.8Å; L1555-L1583 HydrophobicContact CD1-CG 4.31Å; L1555-I1638 HydrophobicContact CD2-CG2 3.75Å; L1555-Q1661 HydrophobicContact CB-CB 3.56Å; L1555-Q1661 HydrophobicContact CB-CG 4.41Å; L1555-Q1661 HydrophobicContact CD2-CB 4.31Å; L1555-Q1661 WeakPolarHBondContact CD2-O 3.46Å; L1555-Q1661 HydrophobicContact CG-CB 4.41Å; L1555-L1663 HydrophobicContact CD2-CB 3.86Å; L1555-L1663 WeakPolarHBondContact O-CD2 3.31Å
1556	G	57.5	Low	58.3	Low	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.166	C	C	.	.			trans	-72.9	173.6	169.2	0	0	0	0	0	109.3	R1554 I1578 W1580	R1554-G1556 PolarHBondContact O-N 2.58Å; G1556-I1578 CarbonylContact O-C 3.25Å; G1556-W1580 VanDerWaalsContact O-CD1 3.24Å
1557	L	60.5	Low	58.2	Low	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.147	C	C	.	.			trans	-94.1	130.2	164.9	-50.6	-175.4	0	0	0	108.1	P1560 H1561 L1577 I1578 W1580 I1638 L1663 L1665	L1557-P1560 CarbonylContact C-O 3.16Å; L1557-P1560 HydrophobicContact CB-CG 4.42Å; L1557-P1560 WeakPolarHBondContact CB-O 3.38Å; L1557-P1560 HydrophobicContact CD1-CG 4.42Å; L1557-H1561 CarbonylContact O-C 2.81Å; L1557-H1561 WeakPolarHBondContact O-CA 3.37Å; L1557-L1577 HydrophobicContact CD1-CB 3.93Å; L1557-L1577 HydrophobicContact CD1-CD2 3.77Å; L1557-L1577 HydrophobicContact CD1-CG 4.37Å; L1557-L1577 HydrophobicContact CD2-CB 3.68Å; L1557-L1577 HydrophobicContact CG-CB 4.34Å; L1557-I1578 CarbonylContact C-O 3.03Å; L1557-I1578 WeakPolarHBondContact CA-O 3.2Å; L1557-W1580 PolarHBondContact O-NE1 3.19Å; L1557-I1638 HydrophobicContact CD2-CD1 4.31Å; L1557-L1663 HydrophobicContact CD1-CD2 4.27Å; L1557-L1663 HydrophobicContact CD2-CD2 3.2Å; L1557-L1663 HydrophobicContact CG-CD2 3.66Å; L1557-L1665 HydrophobicContact CD1-CD1 3.5Å; L1557-L1665 VanDerWaalsContact CD1-CD1 3.5Å; L1557-L1665 HydrophobicContact CD1-CD2 4.16Å; L1557-L1665 HydrophobicContact CD1-CG 4.49Å; L1557-L1665 HydrophobicContact CD2-CD1 4.27Å; L1557-L1665 HydrophobicContact CG-CD1 4.43Å
1558	S	60.2	Low	58.6	Low	6 Å²	6	31 Å²	31	4%	0.042	15%	0.149	C	C	.	.	S	Bend	trans	-96	-19.8	-176.9	106.1	0	0	0	0	112.7	H1561 I1578 W1580 F2199	S1558-H1561 PolarHBondContact O-ND1 3.49Å; S1558-I1578 PolarHBondContact N-O 2.7Å; S1558-I1578 WeakPolarHBondContact OG-CG2 3.38Å; S1558-W1580 VanDerWaalsContact CB-CD1 3.5Å; S1558-F2199 VanDerWaalsContact OG-CD1 3.24Å; S1558-F2199 WeakPolarHBondContact OG-CD1 3.48Å
1559	S	54.5	Low	59.2	Low	16 Å²	16	30.1 Å²	30.1	11%	0.112	14%	0.144	C	C	.	.	S	Bend	trans	-126.3	140.8	135.7	171	0	0	0	0	108.2	N1576 L1577 I1578	S1559-N1576 CarbonylContact C-O 2.61Å; S1559-N1576 VanDerWaalsContact CB-CB 3.47Å; S1559-N1576 CarbonylContact O-C 3.54Å; S1559-N1576 WeakPolarHBondContact O-CB 3.49Å; S1559-L1577 WeakPolarHBondContact O-CA 3.41Å; S1559-L1577 PolarHBondContact O-N 3.12Å; S1559-I1578 WeakPolarHBondContact O-CG1 3.32Å; S1559-I1578 PolarHBondContact O-N 2.67Å
1560	P	56.3	Low	59.9	Low	9 Å²	9	30.1 Å²	30.1	6%	0.058	14%	0.144	C	C	.	.	S	Bend	cis	-58.2	146.3	-17.7	31.9	-28.3	0	0	0	107.2	L1557 R1562 P1564 L1575 N1576 D1717	L1557-P1560 CarbonylContact C-O 3.16Å; L1557-P1560 HydrophobicContact CB-CG 4.42Å; L1557-P1560 WeakPolarHBondContact CB-O 3.38Å; L1557-P1560 HydrophobicContact CD1-CG 4.42Å; P1560-R1562 CarbonylContact C-O 2.95Å; P1560-R1562 CarbonylContact O-C 3.56Å; P1560-R1562 PolarHBondContact O-N 2.03Å; P1560-P1564 HydrophobicContact CG-CG 3.59Å; P1560-L1575 HydrophobicContact CB-CD1 3.76Å; P1560-L1575 HydrophobicContact CB-CG 4.37Å; P1560-L1575 HydrophobicContact CG-CD1 3.81Å; P1560-L1575 HydrophobicContact CG-CD2 3.81Å; P1560-L1575 HydrophobicContact CG-CG 3.97Å; P1560-N1576 WeakPolarHBondContact CD-O 3.3Å; P1560-D1717 HydrophobicContact CB-CB 3.75Å; P1560-D1717 HydrophobicContact CG-CB 3.86Å
1561	H	52.1	Low	60.7	Low	87 Å²	87	29 Å²	29	40%	0.403	14%	0.137	S	C	.	.	S	Bend	trans	-71.7	4.8	-176.3	-146.1	74.9	0	0	0	113.1	P1422 L1557 S1558	P1422-H1561 WeakPolarHBondContact CB-NE2 3.48Å; L1557-H1561 CarbonylContact O-C 2.81Å; L1557-H1561 WeakPolarHBondContact O-CA 3.37Å; S1558-H1561 PolarHBondContact O-ND1 3.49Å
1562	R	50.6	Low	61.4	Low	105 Å²	105	29.4 Å²	29.4	40%	0.396	14%	0.139	S	C	.	.	S	Bend	trans	-90.9	147.9	164.4	-68.5	169.3	172.7	155.8	-2.8	107.9	P1560 P1564 D1717	P1560-R1562 CarbonylContact C-O 2.95Å; P1560-R1562 CarbonylContact O-C 3.56Å; P1560-R1562 PolarHBondContact O-N 2.03Å; R1562-P1564 HydrophobicContact CB-CG 4.13Å; R1562-P1564 WeakPolarHBondContact O-CD 3.1Å; R1562-P1564 WeakPolarHBondContact O-CG 3.38Å; R1562-D1717 WeakPolarHBondContact CD-OD1 3.42Å; R1562-D1717 IonicContact CZ-OD1 3.36Å; R1562-D1717 IonicContact NE-OD1 3.64Å; R1562-D1717 IonicContact NH1-OD1 2.82Å; R1562-D1717 PolarHBondContact NH1-OD1 2.86Å
1563	E	50.1	Low	62.5	Low	59 Å²	59	26.5 Å²	26.5	28%	0.276	12%	0.124	S	C	.	.			trans	-90.8	109.2	162.3	174.8	-168.4	-98.2	0	0	108	R1554 L1663	R1554-E1563 WeakPolarHBondContact CD-OE1 3.36Å; R1554-E1563 WeakPolarHBondContact CG-OE1 3.44Å; R1554-E1563 VanDerWaalsContact CZ-CB 3.42Å; R1554-E1563 IonicContact CZ-OE1 2.63Å; R1554-E1563 IonicContact CZ-OE2 3.13Å; R1554-E1563 VanDerWaalsContact CZ-OE2 3.27Å; R1554-E1563 IonicContact NE-OE1 3.52Å; R1554-E1563 PolarHBondContact NE-OE1 2.9Å; R1554-E1563 IonicContact NE-OE2 2.6Å; R1554-E1563 PolarHBondContact NE-OE2 3.35Å; R1554-E1563 VanDerWaalsContact NE-OE2 3.13Å; R1554-E1563 VanDerWaalsContact NH2-CD 3.34Å; R1554-E1563 IonicContact NH2-OE1 3.85Å; R1554-E1563 IonicContact NH2-OE2 3.44Å; R1554-E1563 PolarHBondContact NH2-OE2 2.83Å; E1563-L1663 HydrophobicContact CG-CD1 3.76Å
1564	P	49.3	Very low	63.6	Low	11 Å²	11	25.2 Å²	25.2	7%	0.071	12%	0.115	C	C	.	.			trans	-115	99.3	-175.5	6.3	21.1	0	0	0	106.8	P1560 R1562 Q1566 I1567 L1665	P1560-P1564 HydrophobicContact CG-CG 3.59Å; R1562-P1564 HydrophobicContact CB-CG 4.13Å; R1562-P1564 WeakPolarHBondContact O-CD 3.1Å; R1562-P1564 WeakPolarHBondContact O-CG 3.38Å; P1564-Q1566 WeakPolarHBondContact CB-O 3.18Å; P1564-Q1566 PolarHBondContact O-N 3.38Å; P1564-I1567 HydrophobicContact CB-CB 4.35Å; P1564-I1567 HydrophobicContact CB-CG2 3.77Å; P1564-I1567 HydrophobicContact CG-CG2 3.57Å; P1564-I1567 WeakPolarHBondContact O-CG1 3.29Å; P1564-L1665 WeakPolarHBondContact O-CD2 3.18Å
1565	Q	58.1	Low	64.7	Low	49 Å²	49	21.6 Å²	21.6	23%	0.229	10%	0.102	C	C	.	.	S	Bend	trans	-44.8	-33.4	166.4	-84	-83.3	-3.9	0	0	112.3	L1389 I1664 D1666	L1389-Q1565 HydrophobicContact CD1-CB 4.21Å; L1389-Q1565 HydrophobicContact CD1-CG 4.04Å; Q1565-I1664 PolarHBondContact OE1-O 2.85Å; Q1565-I1664 VanDerWaalsContact OE1-O 3.14Å; Q1565-D1666 WeakPolarHBondContact O-CB 3.43Å; Q1565-D1666 PolarHBondContact O-N 2.87Å
1566	Q	69.5	Low	65.4	Low	66 Å²	66	21.2 Å²	21.2	31%	0.308	10%	0.1	S	C	.	.	B	Isolated β-bridge	trans	-125.2	127.4	171.3	-108.1	172.7	41.6	0	0	108.6	P1564 I1568 D1666 L2340 L2341	P1564-Q1566 WeakPolarHBondContact CB-O 3.18Å; P1564-Q1566 PolarHBondContact O-N 3.38Å; Q1566-I1568 VanDerWaalsContact O-CG1 3.29Å; Q1566-I1568 WeakPolarHBondContact O-CG1 3.15Å; Q1566-D1666 HydrophobicContact CG-CB 4.06Å; Q1566-D1666 PolarHBondContact NE2-OD2 2.86Å; Q1566-L2340 HydrophobicContact CG-CB 3.83Å; Q1566-L2340 HydrophobicContact CG-CD2 4.41Å; Q1566-L2340 WeakPolarHBondContact CG-O 3.43Å; Q1566-L2340 VanDerWaalsContact NE2-CB 3.32Å; Q1566-L2340 VanDerWaalsContact NE2-CD1 3.3Å; Q1566-L2341 HydrophobicContact CB-CB 4.34Å; Q1566-L2341 HydrophobicContact CB-CD1 3.67Å; Q1566-L2341 HydrophobicContact CG-CB 4.22Å; Q1566-L2341 HydrophobicContact CG-CD1 3.74Å; Q1566-L2341 HydrophobicContact CG-CG 4.33Å
1567	I	76.4	Confident	66.2	Low	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.1	C	C	.	.			trans	-126.2	84	-150.6	-10.5	161.4	0	0	0	109.8	P1564 L1569 L1575 L1665 D1666 V1667 D1717 L2341 N2342	P1564-I1567 HydrophobicContact CB-CB 4.35Å; P1564-I1567 HydrophobicContact CB-CG2 3.77Å; P1564-I1567 HydrophobicContact CG-CG2 3.57Å; P1564-I1567 WeakPolarHBondContact O-CG1 3.29Å; I1567-L1569 VanDerWaalsContact C-CD1 3.48Å; I1567-L1569 HydrophobicContact CB-CD1 4.45Å; I1567-L1569 HydrophobicContact CG2-CD1 4.49Å; I1567-L1569 WeakPolarHBondContact O-CB 3.1Å; I1567-L1569 WeakPolarHBondContact O-CD1 3.15Å; I1567-L1569 WeakPolarHBondContact O-CG 3.44Å; I1567-L1569 PolarHBondContact O-N 3.28Å; I1567-L1575 HydrophobicContact CB-CD2 4.29Å; I1567-L1575 HydrophobicContact CG2-CD2 3.28Å; I1567-L1665 HydrophobicContact CD1-CB 3.49Å; I1567-L1665 VanDerWaalsContact CD1-CB 3.49Å; I1567-L1665 HydrophobicContact CD1-CD1 3.74Å; I1567-L1665 HydrophobicContact CD1-CD2 3.96Å; I1567-L1665 HydrophobicContact CD1-CG 3.92Å; I1567-L1665 HydrophobicContact CG1-CD2 4.3Å; I1567-D1666 WeakPolarHBondContact CD1-O 3.43Å; I1567-D1666 WeakPolarHBondContact CG1-O 3.09Å; I1567-V1667 HydrophobicContact CD1-CG2 4.43Å; I1567-D1717 WeakPolarHBondContact CA-OD2 3.4Å; I1567-L2341 CarbonylContact C-O 3.46Å; I1567-L2341 WeakPolarHBondContact CA-O 3.37Å; I1567-L2341 WeakPolarHBondContact CB-O 3.47Å; I1567-L2341 WeakPolarHBondContact CD1-O 3.29Å; I1567-L2341 WeakPolarHBondContact CG1-O 3.27Å; I1567-L2341 PolarHBondContact N-O 2.82Å; I1567-L2341 CarbonylContact O-C 3.58Å; I1567-L2341 VanDerWaalsContact O-CB 3.32Å; I1567-L2341 WeakPolarHBondContact O-CB 3.49Å; I1567-N2342 HydrophobicContact CB-CB 4.35Å; I1567-N2342 HydrophobicContact CD1-CB 4.09Å; I1567-N2342 WeakPolarHBondContact CD1-ND2 3.36Å; I1567-N2342 WeakPolarHBondContact O-CA 2.97Å; I1567-N2342 PolarHBondContact O-N 3.41Å
1568	I	81.2	Confident	66.3	Low	24 Å²	24	21.2 Å²	21.2	12%	0.123	10%	0.1	C	C	.	.				-83.5	65.2	-123.8	-45.8	157.5	0	0	0	117.8	Q1566 R1714 V1715 F1716 D1717 L2341	Q1566-I1568 VanDerWaalsContact O-CG1 3.29Å; Q1566-I1568 WeakPolarHBondContact O-CG1 3.15Å; I1568-R1714 HydrophobicContact CB-CB 4.47Å; I1568-R1714 HydrophobicContact CD1-CB 3.86Å; I1568-R1714 HydrophobicContact CG1-CB 4.37Å; I1568-R1714 HydrophobicContact CG2-CB 3.43Å; I1568-R1714 VanDerWaalsContact CG2-CB 3.43Å; I1568-V1715 WeakPolarHBondContact CB-O 3.42Å; I1568-V1715 WeakPolarHBondContact CD1-O 3.33Å; I1568-F1716 WeakPolarHBondContact O-CA 3.13Å; I1568-F1716 WeakPolarHBondContact O-CD1 3.24Å; I1568-F1716 WeakPolarHBondContact O-CD2 3.01Å; I1568-F1716 WeakPolarHBondContact O-CE1 3.43Å; I1568-F1716 WeakPolarHBondContact O-CG 3.45Å; I1568-D1717 PolarHBondContact N-OD2 2.97Å; I1568-L2341 HydrophobicContact CB-CD1 3.91Å; I1568-L2341 HydrophobicContact CB-CD2 4.32Å; I1568-L2341 HydrophobicContact CG1-CD1 3.83Å; I1568-L2341 HydrophobicContact CG2-CD1 3.67Å; I1568-L2341 HydrophobicContact CG2-CD2 3.92Å; I1568-L2341 HydrophobicContact CG2-CG 4.4Å
1569	L	79.1	Confident	66.5	Low	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.099	C	C	.	.	B	Isolated β-bridge	trans	-130.5	-176.7	-139.4	-73.4	167.4	0	0	0	121.9	I1567 L1575 L1668 I1669 K1670 F1716 D1717 A1718 N2342 F2343	I1567-L1569 VanDerWaalsContact C-CD1 3.48Å; I1567-L1569 HydrophobicContact CB-CD1 4.45Å; I1567-L1569 HydrophobicContact CG2-CD1 4.49Å; I1567-L1569 WeakPolarHBondContact O-CB 3.1Å; I1567-L1569 WeakPolarHBondContact O-CD1 3.15Å; I1567-L1569 WeakPolarHBondContact O-CG 3.44Å; I1567-L1569 PolarHBondContact O-N 3.28Å; L1569-L1575 HydrophobicContact CD1-CB 3.99Å; L1569-L1575 HydrophobicContact CD1-CD1 3.68Å; L1569-L1575 HydrophobicContact CD1-CD2 3.56Å; L1569-L1575 HydrophobicContact CD1-CG 3.93Å; L1569-L1668 CarbonylContact C-O 3.52Å; L1569-I1669 CarbonylContact O-C 3.57Å; L1569-I1669 VanDerWaalsContact O-C 3.31Å; L1569-I1669 WeakPolarHBondContact O-CA 3.4Å; L1569-K1670 WeakPolarHBondContact O-CB 3.39Å; L1569-K1670 PolarHBondContact O-N 3.17Å; L1569-F1716 VanDerWaalsContact C-CE1 3.41Å; L1569-F1716 VanDerWaalsContact CA-CD1 3.47Å; L1569-F1716 HydrophobicContact CD2-CB 3.8Å; L1569-F1716 HydrophobicContact CD2-CD1 3.86Å; L1569-F1716 HydrophobicContact CD2-CG 4.28Å; L1569-D1717 HydrophobicContact CD1-CB 4.08Å; L1569-D1717 VanDerWaalsContact CD2-N 3.26Å; L1569-A1718 WeakPolarHBondContact CD2-O 3.42Å; L1569-N2342 CarbonylContact C-O 3.49Å; L1569-N2342 WeakPolarHBondContact CB-O 3.47Å; L1569-F2343 HydrophobicContact CB-CB 3.68Å; L1569-F2343 HydrophobicContact CB-CD1 4.5Å; L1569-F2343 HydrophobicContact CB-CD2 3.44Å; L1569-F2343 VanDerWaalsContact CB-CD2 3.44Å; L1569-F2343 HydrophobicContact CB-CE2 4.34Å; L1569-F2343 HydrophobicContact CB-CG 3.61Å; L1569-F2343 HydrophobicContact CD1-CB 3.48Å; L1569-F2343 VanDerWaalsContact CD1-CB 3.48Å; L1569-F2343 HydrophobicContact CD1-CD1 4.04Å; L1569-F2343 HydrophobicContact CD1-CD2 4.43Å; L1569-F2343 HydrophobicContact CD1-CG 3.72Å; L1569-F2343 HydrophobicContact CD2-CB 4.17Å; L1569-F2343 HydrophobicContact CD2-CD1 3.52Å; L1569-F2343 HydrophobicContact CD2-CD2 3.6Å; L1569-F2343 HydrophobicContact CD2-CE1 3.98Å; L1569-F2343 HydrophobicContact CD2-CE2 3.96Å; L1569-F2343 HydrophobicContact CD2-CG 3.46Å; L1569-F2343 VanDerWaalsContact CD2-CG 3.46Å; L1569-F2343 HydrophobicContact CD2-CZ 4.19Å; L1569-F2343 HydrophobicContact CG-CB 3.91Å; L1569-F2343 HydrophobicContact CG-CD1 4.18Å; L1569-F2343 HydrophobicContact CG-CD2 3.97Å; L1569-F2343 HydrophobicContact CG-CG 3.74Å
1570	S	76.9	Confident	66.9	Low	1 Å²	1	20.7 Å²	20.7	1%	0.007	10%	0.095	C	C	.	.			trans	-135	-178.9	-172.8	101.3	0	0	0	0	119.2	A1621 K1670 T2152 F2343	S1570-A1621 WeakPolarHBondContact O-CB 3.47Å; S1570-K1670 WeakPolarHBondContact CB-O 3.2Å; S1570-T2152 PolarHBondContact OG-O 2.92Å; S1570-F2343 VanDerWaalsContact N-CE2 3.32Å; S1570-F2343 WeakPolarHBondContact O-CD2 3.46Å; S1570-F2343 VanDerWaalsContact O-CE2 3.31Å; S1570-F2343 WeakPolarHBondContact O-CE2 3.38Å; S1570-F2343 WeakPolarHBondContact OG-CE2 3.16Å
1571	P	74.3	Confident	66.6	Low	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-70.1	162.1	179.2	-26.4	35.4	0	0	0	121.3	S1573 N1622 D1623 C1625 I1669 S2151 T2152 S2153 K2154	P1571-S1573 WeakPolarHBondContact O-CB 3.41Å; P1571-S1573 PolarHBondContact O-N 2.88Å; P1571-S1573 PolarHBondContact O-OG 2.91Å; P1571-N1622 WeakPolarHBondContact CB-O 3.33Å; P1571-D1623 HydrophobicContact CB-CB 4.43Å; P1571-C1625 HydrophobicContact CG-CB 4.2Å; P1571-I1669 HydrophobicContact CB-CG2 4.38Å; P1571-I1669 HydrophobicContact CG-CG2 3.31Å; P1571-S2151 WeakPolarHBondContact CD-O 3.44Å; P1571-T2152 VanDerWaalsContact CD-N 3.3Å; P1571-T2152 WeakPolarHBondContact CD-O 3.49Å; P1571-T2152 VanDerWaalsContact CG-N 3.32Å; P1571-S2153 CarbonylContact O-C 3.59Å; P1571-S2153 PolarHBondContact O-OG 3.15Å; P1571-K2154 PolarHBondContact O-N 3.18Å
1572	N	72	Confident	66.5	Low	12 Å²	12	21 Å²	21	6%	0.064	10%	0.101	C	C	.	.	S	Bend	trans	31.1	4.9	-175.1	-39.4	-25.3	0	0	0	119.6	A1621 N1622 D1623 S2153 K2154 D2155 S2344 W2345	N1572-A1621 WeakPolarHBondContact CA-O 3.43Å; N1572-A1621 PolarHBondContact N-O 2.98Å; N1572-A1621 PolarHBondContact OD1-O 3.19Å; N1572-N1622 VanDerWaalsContact OD1-CA 3.26Å; N1572-N1622 WeakPolarHBondContact OD1-CA 3.43Å; N1572-N1622 PolarHBondContact OD1-OD1 2.99Å; N1572-D1623 WeakPolarHBondContact ND2-CB 3.24Å; N1572-D1623 PolarHBondContact OD1-N 3.42Å; N1572-S2153 WeakPolarHBondContact CB-O 3.4Å; N1572-S2153 VanDerWaalsContact CG-O 3.24Å; N1572-S2153 PolarHBondContact ND2-O 3.31Å; N1572-K2154 VanDerWaalsContact C-C 3.41Å; N1572-K2154 CarbonylContact C-O 3.6Å; N1572-K2154 CarbonylContact O-C 3.59Å; N1572-D2155 PolarHBondContact O-N 3Å; N1572-S2344 CarbonylContact C-O 3.46Å; N1572-S2344 WeakPolarHBondContact CA-OG 3.46Å; N1572-S2344 CarbonylContact O-C 3.42Å; N1572-W2345 PolarHBondContact O-N 3.15Å
1573	S	75.1	Confident	66.5	Low	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	S	Bend	trans	-124.1	128.6	-172.8	50.7	0	0	0	0	109	P1571 V1719 S2153 F2343 S2344 W2345	P1571-S1573 WeakPolarHBondContact O-CB 3.41Å; P1571-S1573 PolarHBondContact O-N 2.88Å; P1571-S1573 PolarHBondContact O-OG 2.91Å; S1573-V1719 WeakPolarHBondContact CB-O 3.15Å; S1573-S2153 PolarHBondContact OG-OG 3.05Å; S1573-F2343 VanDerWaalsContact C-CZ 3.44Å; S1573-F2343 CarbonylContact O-C 3.59Å; S1573-F2343 WeakPolarHBondContact O-CD1 3.2Å; S1573-F2343 WeakPolarHBondContact O-CD2 3.46Å; S1573-F2343 WeakPolarHBondContact O-CE1 3.31Å; S1573-F2343 WeakPolarHBondContact O-CE2 3.35Å; S1573-F2343 WeakPolarHBondContact O-CG 3.43Å; S1573-F2343 WeakPolarHBondContact O-CZ 3.26Å; S1573-F2343 WeakPolarHBondContact OG-CE2 3.36Å; S1573-F2343 WeakPolarHBondContact OG-CZ 3.48Å; S1573-S2344 VanDerWaalsContact CA-C 3.45Å; S1573-S2344 VanDerWaalsContact O-CA 3.24Å; S1573-S2344 WeakPolarHBondContact O-CA 3.35Å; S1573-S2344 PolarHBondContact O-N 3.22Å; S1573-W2345 VanDerWaalsContact C-N 3.27Å; S1573-W2345 VanDerWaalsContact CA-N 3.35Å
1574	Q	72.4	Confident	66.6	Low	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.			trans	-103.1	153.7	-148.2	-113.7	95.9	-144.7	0	0	116.6	I1618 L1619 A1718 L2298 F2343 S2344 W2345 L2348	Q1574-I1618 HydrophobicContact CG-CB 4.39Å; Q1574-I1618 HydrophobicContact CG-CG2 3.17Å; Q1574-L1619 VanDerWaalsContact CD-O 3.29Å; Q1574-L1619 WeakPolarHBondContact CG-O 3.45Å; Q1574-L1619 PolarHBondContact OE1-O 2.83Å; Q1574-A1718 WeakPolarHBondContact O-CB 3.45Å; Q1574-L2298 HydrophobicContact CB-CB 4.01Å; Q1574-L2298 HydrophobicContact CG-CB 3.37Å; Q1574-F2343 VanDerWaalsContact O-CD1 3.26Å; Q1574-F2343 WeakPolarHBondContact O-CD1 3.02Å; Q1574-S2344 VanDerWaalsContact CA-C 3.44Å; Q1574-S2344 VanDerWaalsContact CA-CA 3.43Å; Q1574-S2344 VanDerWaalsContact CB-C 3.48Å; Q1574-S2344 VanDerWaalsContact CD-O 3.22Å; Q1574-S2344 PolarHBondContact NE2-O 3.38Å; Q1574-S2344 PolarHBondContact OE1-O 2.93Å; Q1574-W2345 VanDerWaalsContact CA-N 3.34Å; Q1574-W2345 HydrophobicContact CB-CB 3.49Å; Q1574-W2345 VanDerWaalsContact CB-CB 3.49Å; Q1574-W2345 HydrophobicContact CB-CD2 4.32Å; Q1574-W2345 HydrophobicContact CB-CG 3.51Å; Q1574-W2345 HydrophobicContact CG-CB 4.02Å; Q1574-W2345 HydrophobicContact CG-CG 4.15Å; Q1574-W2345 PolarHBondContact N-O 2.96Å; Q1574-L2348 WeakPolarHBondContact O-CB 3.32Å; Q1574-L2348 WeakPolarHBondContact O-CD2 3.27Å; Q1574-L2348 WeakPolarHBondContact O-CG 3.35Å
1575	L	77.5	Confident	66.6	Low	0 Å²	0	25 Å²	25	0%	0	14%	0.135	C	C	.	.			trans	-101.9	167	153.1	-151.2	68.8	0	0	0	111.4	P1560 I1567 L1569 L1577 I1618 L1619 D1717 A1718 N2342 F2343	P1560-L1575 HydrophobicContact CB-CD1 3.76Å; P1560-L1575 HydrophobicContact CB-CG 4.37Å; P1560-L1575 HydrophobicContact CG-CD1 3.81Å; P1560-L1575 HydrophobicContact CG-CD2 3.81Å; P1560-L1575 HydrophobicContact CG-CG 3.97Å; I1567-L1575 HydrophobicContact CB-CD2 4.29Å; I1567-L1575 HydrophobicContact CG2-CD2 3.28Å; L1569-L1575 HydrophobicContact CD1-CB 3.99Å; L1569-L1575 HydrophobicContact CD1-CD1 3.68Å; L1569-L1575 HydrophobicContact CD1-CD2 3.56Å; L1569-L1575 HydrophobicContact CD1-CG 3.93Å; L1575-L1577 HydrophobicContact CD2-CD2 3.74Å; L1575-I1618 CarbonylContact O-C 3.58Å; L1575-I1618 WeakPolarHBondContact O-CA 3.01Å; L1575-L1619 PolarHBondContact O-N 2.92Å; L1575-D1717 HydrophobicContact CD1-CB 3.5Å; L1575-D1717 VanDerWaalsContact CD1-O 3.28Å; L1575-D1717 WeakPolarHBondContact CD1-O 3.3Å; L1575-D1717 HydrophobicContact CD2-CB 4.44Å; L1575-A1718 HydrophobicContact CD1-CB 3.61Å; L1575-N2342 WeakPolarHBondContact CB-OD1 3.49Å; L1575-N2342 WeakPolarHBondContact CD2-OD1 3.32Å; L1575-F2343 HydrophobicContact CB-CB 3.77Å; L1575-F2343 HydrophobicContact CB-CD1 4.26Å
1576	N	70.8	Confident	66.2	Low	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-104.8	176.2	154.9	-124.8	21.9	0	0	0	110.7	S1559 P1560 I1578 G1617 I1618 F2199 T2297 L2298 W2345	S1559-N1576 CarbonylContact C-O 2.61Å; S1559-N1576 VanDerWaalsContact CB-CB 3.47Å; S1559-N1576 CarbonylContact O-C 3.54Å; S1559-N1576 WeakPolarHBondContact O-CB 3.49Å; P1560-N1576 WeakPolarHBondContact CD-O 3.3Å; N1576-I1578 HydrophobicContact CB-CD1 3.7Å; N1576-I1578 HydrophobicContact CB-CG1 3.57Å; N1576-I1578 WeakPolarHBondContact ND2-CD1 3.3Å; N1576-I1578 VanDerWaalsContact ND2-CG1 3.28Å; N1576-I1578 WeakPolarHBondContact ND2-CG1 3.3Å; N1576-G1617 CarbonylContact C-O 3.37Å; N1576-G1617 WeakPolarHBondContact CA-O 3.17Å; N1576-G1617 WeakPolarHBondContact CB-O 3.3Å; N1576-G1617 PolarHBondContact ND2-O 2.81Å; N1576-G1617 PolarHBondContact OD1-O 2.65Å; N1576-I1618 PolarHBondContact OD1-N 3.19Å; N1576-F2199 VanDerWaalsContact ND2-CD2 3.29Å; N1576-F2199 WeakPolarHBondContact ND2-CD2 3.24Å; N1576-F2199 WeakPolarHBondContact ND2-CE2 3.4Å; N1576-T2297 VanDerWaalsContact OD1-C 3.29Å; N1576-T2297 VanDerWaalsContact OD1-CA 3.22Å; N1576-T2297 WeakPolarHBondContact OD1-CA 3.36Å; N1576-L2298 PolarHBondContact OD1-N 2.66Å; N1576-W2345 HydrophobicContact CB-CZ2 3.8Å; N1576-W2345 WeakPolarHBondContact ND2-CH2 3.24Å; N1576-W2345 WeakPolarHBondContact ND2-CZ2 3.22Å; N1576-W2345 WeakPolarHBondContact OD1-CH2 3.48Å; N1576-W2345 WeakPolarHBondContact OD1-CZ2 2.89Å
1577	L	72.4	Confident	65.4	Low	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.142	C	C	.	.			trans	-147.1	94.2	168.7	-36.4	160.9	0	0	0	104.8	L1557 S1559 L1575 G1617 I1618 L1619 L1636 I1638 L1665 I2295 N2342	L1557-L1577 HydrophobicContact CD1-CB 3.93Å; L1557-L1577 HydrophobicContact CD1-CD2 3.77Å; L1557-L1577 HydrophobicContact CD1-CG 4.37Å; L1557-L1577 HydrophobicContact CD2-CB 3.68Å; L1557-L1577 HydrophobicContact CG-CB 4.34Å; S1559-L1577 WeakPolarHBondContact O-CA 3.41Å; S1559-L1577 PolarHBondContact O-N 3.12Å; L1575-L1577 HydrophobicContact CD2-CD2 3.74Å; L1577-G1617 CarbonylContact C-O 3.44Å; L1577-G1617 PolarHBondContact N-O 2.89Å; L1577-G1617 CarbonylContact O-C 3.53Å; L1577-G1617 VanDerWaalsContact O-CA 3.22Å; L1577-G1617 WeakPolarHBondContact O-CA 2.9Å; L1577-I1618 WeakPolarHBondContact CD1-O 3.48Å; L1577-I1618 WeakPolarHBondContact CG-O 3.16Å; L1577-I1618 VanDerWaalsContact N-N 3.13Å; L1577-L1619 HydrophobicContact CD1-CD1 3.77Å; L1577-L1619 HydrophobicContact CD1-CD2 4.44Å; L1577-L1636 HydrophobicContact CD1-CD2 3.41Å; L1577-L1636 VanDerWaalsContact CD1-CD2 3.41Å; L1577-I1638 HydrophobicContact CB-CD1 4.05Å; L1577-I1638 HydrophobicContact CD1-CD1 4.03Å; L1577-L1665 HydrophobicContact CB-CD1 4.11Å; L1577-L1665 HydrophobicContact CD1-CD1 3.83Å; L1577-L1665 HydrophobicContact CD2-CD1 3.5Å; L1577-L1665 HydrophobicContact CG-CD1 3.95Å; L1577-I2295 HydrophobicContact CB-CG2 4.47Å; L1577-I2295 VanDerWaalsContact O-CB 3.22Å; L1577-I2295 WeakPolarHBondContact O-CB 3.33Å; L1577-I2295 WeakPolarHBondContact O-CG2 3.22Å; L1577-N2342 WeakPolarHBondContact CD2-ND2 3.47Å
1578	I	64.2	Low	64.7	Low	1 Å²	1	25.9 Å²	25.9	1%	0.005	15%	0.145	C	C	.	.			trans	-118.9	123.5	-162.1	-41.4	-178.5	0	0	0	109.3	G1556 L1557 S1558 S1559 N1576 W1580 F2199 I2202	G1556-I1578 CarbonylContact O-C 3.25Å; L1557-I1578 CarbonylContact C-O 3.03Å; L1557-I1578 WeakPolarHBondContact CA-O 3.2Å; S1558-I1578 PolarHBondContact N-O 2.7Å; S1558-I1578 WeakPolarHBondContact OG-CG2 3.38Å; S1559-I1578 WeakPolarHBondContact O-CG1 3.32Å; S1559-I1578 PolarHBondContact O-N 2.67Å; N1576-I1578 HydrophobicContact CB-CD1 3.7Å; N1576-I1578 HydrophobicContact CB-CG1 3.57Å; N1576-I1578 WeakPolarHBondContact ND2-CD1 3.3Å; N1576-I1578 VanDerWaalsContact ND2-CG1 3.28Å; N1576-I1578 WeakPolarHBondContact ND2-CG1 3.3Å; I1578-W1580 PolarHBondContact O-N 2.93Å; I1578-W1580 VanDerWaalsContact O-N 3.11Å; I1578-F2199 HydrophobicContact CD1-CB 3.64Å; I1578-F2199 HydrophobicContact CD1-CD1 3.08Å; I1578-F2199 HydrophobicContact CD1-CD2 3.13Å; I1578-F2199 HydrophobicContact CD1-CE1 3.34Å; I1578-F2199 HydrophobicContact CD1-CE2 3.4Å; I1578-F2199 HydrophobicContact CD1-CG 2.97Å; I1578-F2199 HydrophobicContact CD1-CZ 3.51Å; I1578-F2199 HydrophobicContact CG1-CD1 4.48Å; I1578-F2199 HydrophobicContact CG1-CD2 4.49Å; I1578-F2199 HydrophobicContact CG1-CG 4.34Å; I1578-F2199 HydrophobicContact CG2-CB 3.88Å; I1578-F2199 HydrophobicContact CG2-CD1 4.41Å; I1578-F2199 HydrophobicContact CG2-CG 4.27Å; I1578-I2202 HydrophobicContact CB-CD1 4.06Å; I1578-I2202 HydrophobicContact CG1-CD1 4.24Å; I1578-I2202 HydrophobicContact CG2-CD1 3.34Å; I1578-I2202 HydrophobicContact CG2-CG1 3.82Å
1579	P	64.7	Low	64.1	Low	3 Å²	3	25 Å²	25	2%	0.019	14%	0.141	C	C	.	.			trans	-37.7	126.9	155.2	26.8	-42.2	0	0	0	109.8	L1555 T1581 L1583 L1589 E2201 I2202 I2295	L1555-P1579 HydrophobicContact CD1-CB 4.28Å; P1579-T1581 PolarHBondContact O-N 2.93Å; P1579-L1583 HydrophobicContact CB-CD1 3.69Å; P1579-L1583 HydrophobicContact CB-CD2 3.5Å; P1579-L1583 HydrophobicContact CB-CG 4.11Å; P1579-L1589 HydrophobicContact CG-CD2 4.01Å; P1579-E2201 VanDerWaalsContact C-OE2 3.27Å; P1579-E2201 VanDerWaalsContact CB-OE2 3.29Å; P1579-E2201 WeakPolarHBondContact CB-OE2 3.5Å; P1579-E2201 VanDerWaalsContact O-OE2 3.12Å; P1579-I2202 HydrophobicContact CG-CD1 4.33Å; P1579-I2202 HydrophobicContact CG-CG1 3.9Å; P1579-I2295 HydrophobicContact CG-CD1 3.96Å
1580	W	61.1	Low	63.6	Low	7 Å²	7	26 Å²	26	3%	0.027	15%	0.145	C	C	.	.			trans	-62.3	119.7	171.3	-87.6	19.6	0	0	0	107.2	A1420 C1421 P1422 P1423 R1554 G1556 L1557 S1558 I1578 D1582 L1583 E2201	A1420-W1580 HydrophobicContact CB-CH2 4.09Å; A1420-W1580 HydrophobicContact CB-CZ3 3.58Å; C1421-W1580 WeakPolarHBondContact O-CZ3 3.16Å; P1422-W1580 VanDerWaalsContact CA-CZ3 3.45Å; P1422-W1580 HydrophobicContact CB-CE3 4.45Å; P1422-W1580 HydrophobicContact CB-CH2 3.78Å; P1422-W1580 HydrophobicContact CB-CZ2 4.05Å; P1422-W1580 HydrophobicContact CB-CZ3 4.01Å; P1422-W1580 HydrophobicContact CG-CH2 4.47Å; P1422-W1580 VanDerWaalsContact N-CZ3 3.32Å; P1423-W1580 HydrophobicContact CG-CB 3.5Å; P1423-W1580 HydrophobicContact CG-CG 4.1Å; R1554-W1580 HydrophobicContact CB-CD2 4.49Å; R1554-W1580 HydrophobicContact CB-CE3 3.74Å; R1554-W1580 HydrophobicContact CB-CZ3 3.89Å; R1554-W1580 HydrophobicContact CG-CE3 4.43Å; R1554-W1580 HydrophobicContact CG-CZ3 4.42Å; R1554-W1580 VanDerWaalsContact NH1-CZ2 3.32Å; R1554-W1580 WeakPolarHBondContact O-CB 3.32Å; G1556-W1580 VanDerWaalsContact O-CD1 3.24Å; L1557-W1580 PolarHBondContact O-NE1 3.19Å; S1558-W1580 VanDerWaalsContact CB-CD1 3.5Å; I1578-W1580 PolarHBondContact O-N 2.93Å; I1578-W1580 VanDerWaalsContact O-N 3.11Å; W1580-D1582 CarbonylContact O-C 3.49Å; W1580-D1582 PolarHBondContact O-N 2.88Å; W1580-L1583 WeakPolarHBondContact O-CD1 3.47Å; W1580-L1583 PolarHBondContact O-N 2.91Å; W1580-E2201 VanDerWaalsContact O-OE2 3.06Å
1581	T	51.5	Low	63.4	Low	49 Å²	49	26.2 Å²	26.2	30%	0.301	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-37.8	12.5	170.5	5.7	0	0	0	0	119.9	P1423 P1579 P2200 E2201	P1423-T1581 WeakPolarHBondContact CB-OG1 3.48Å; P1423-T1581 VanDerWaalsContact CG-CA 3.44Å; P1423-T1581 WeakPolarHBondContact CG-OG1 3.25Å; P1579-T1581 PolarHBondContact O-N 2.93Å; T1581-P2200 HydrophobicContact CG2-CG 3.73Å; T1581-E2201 WeakPolarHBondContact CA-OE1 3.47Å; T1581-E2201 WeakPolarHBondContact CA-OE2 3.48Å; T1581-E2201 HydrophobicContact CG2-CB 3.71Å; T1581-E2201 PolarHBondContact N-OE2 2.79Å; T1581-E2201 VanDerWaalsContact N-OE2 3.13Å
1582	D	48.8	Very low	63.3	Low	54 Å²	54	30.8 Å²	30.8	29%	0.289	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.8	12.4	170.5	-66.3	-32.7	0	0	0	109.9	P1423 S1553 W1580 E2201	P1423-D1582 VanDerWaalsContact CA-CG 3.45Å; P1423-D1582 WeakPolarHBondContact CA-OD1 3.36Å; P1423-D1582 WeakPolarHBondContact CA-OD2 3.32Å; P1423-D1582 HydrophobicContact CB-CB 4.1Å; P1423-D1582 WeakPolarHBondContact CB-OD1 3.29Å; P1423-D1582 WeakPolarHBondContact CD-OD2 3.41Å; P1423-D1582 HydrophobicContact CG-CB 4.01Å; P1423-D1582 VanDerWaalsContact CG-N 3.34Å; S1553-D1582 WeakPolarHBondContact CB-O 3.47Å; S1553-D1582 PolarHBondContact OG-O 3.31Å; W1580-D1582 CarbonylContact O-C 3.49Å; W1580-D1582 PolarHBondContact O-N 2.88Å; D1582-E2201 PolarHBondContact N-OE1 2.82Å
1583	L	51.9	Low	63.2	Low	14 Å²	14	33 Å²	33	7%	0.073	18%	0.177	C	C	.	.	S	Bend	trans	-60.1	152.8	167.4	-105.8	73.8	0	0	0	107	L1555 P1579 W1580 S1585 S1587 E2201	L1555-L1583 HydrophobicContact CD1-CD1 3.83Å; L1555-L1583 HydrophobicContact CD1-CD2 3.8Å; L1555-L1583 HydrophobicContact CD1-CG 4.31Å; P1579-L1583 HydrophobicContact CB-CD1 3.69Å; P1579-L1583 HydrophobicContact CB-CD2 3.5Å; P1579-L1583 HydrophobicContact CB-CG 4.11Å; W1580-L1583 WeakPolarHBondContact O-CD1 3.47Å; W1580-L1583 PolarHBondContact O-N 2.91Å; L1583-S1585 PolarHBondContact O-N 3.04Å; L1583-S1587 WeakPolarHBondContact CB-OG 3.36Å; L1583-S1587 WeakPolarHBondContact CG-OG 3.19Å; L1583-E2201 WeakPolarHBondContact CB-OE1 3.35Å; L1583-E2201 PolarHBondContact N-OE1 3.25Å
1584	H	52.5	Low	62.6	Low	136 Å²	136	35.7 Å²	35.7	63%	0.63	19%	0.191	S	C	*	.			trans	-62.3	141.9	169.4	-110.8	48.2	0	0	0	109.2	D1586 S1587	H1584-D1586 PolarHBondContact O-N 2.8Å; H1584-D1586 VanDerWaalsContact O-N 3.08Å; H1584-S1587 WeakPolarHBondContact CA-OG 3.29Å; H1584-S1587 PolarHBondContact N-OG 2.93Å; H1584-S1587 WeakPolarHBondContact O-CA 3.44Å; H1584-S1587 WeakPolarHBondContact O-CB 3.19Å; H1584-S1587 PolarHBondContact O-N 3.2Å; H1584-S1587 PolarHBondContact O-OG 3.36Å
1585	S	48.3	Very low	61.7	Low	110 Å²	110	39.8 Å²	39.8	77%	0.769	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.4	176.3	-43.2	0	0	0	0	112.9	L1583	L1583-S1585 PolarHBondContact O-N 3.04Å
1586	D	49.3	Very low	60.2	Low	105 Å²	105	42 Å²	42	56%	0.561	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	11.8	175.6	-52.2	-59.1	0	0	0	112.3	H1584 N1643	H1584-D1586 PolarHBondContact O-N 2.8Å; H1584-D1586 VanDerWaalsContact O-N 3.08Å; D1586-N1643 HydrophobicContact CB-CB 4.38Å; D1586-N1643 WeakPolarHBondContact O-CB 3.25Å; D1586-N1643 PolarHBondContact O-N 3.43Å
1587	S	53.7	Low	58.6	Low	17 Å²	17	45.3 Å²	45.3	12%	0.119	25%	0.251	C	S	.	.			trans	-105.1	146.5	167.1	69.3	0	0	0	0	109.7	L1583 H1584	L1583-S1587 WeakPolarHBondContact CB-OG 3.36Å; L1583-S1587 WeakPolarHBondContact CG-OG 3.19Å; H1584-S1587 WeakPolarHBondContact CA-OG 3.29Å; H1584-S1587 PolarHBondContact N-OG 2.93Å; H1584-S1587 WeakPolarHBondContact O-CA 3.44Å; H1584-S1587 WeakPolarHBondContact O-CB 3.19Å; H1584-S1587 PolarHBondContact O-N 3.2Å; H1584-S1587 PolarHBondContact O-OG 3.36Å
1588	I	60.6	Low	57	Low	11 Å²	11	50.7 Å²	50.7	6%	0.056	28%	0.276	C	S	.	.			trans	-150.8	155.6	-139.6	27	156.4	0	0	0	108.7	S1640 M1641 N1643 P2290 G2291 D2292 S2293 L2323	I1588-S1640 WeakPolarHBondContact O-CA 3.45Å; I1588-S1640 PolarHBondContact O-OG 2.76Å; I1588-S1640 VanDerWaalsContact O-OG 3.08Å; I1588-M1641 VanDerWaalsContact CG1-O 3.23Å; I1588-M1641 WeakPolarHBondContact CG1-O 3.31Å; I1588-N1643 HydrophobicContact CD1-CB 3.56Å; I1588-N1643 HydrophobicContact CG1-CB 4.19Å; I1588-P2290 WeakPolarHBondContact CG2-O 3.19Å; I1588-G2291 VanDerWaalsContact CB-C 3.49Å; I1588-D2292 VanDerWaalsContact CB-N 3.3Å; I1588-D2292 VanDerWaalsContact CD1-OD1 3.26Å; I1588-D2292 WeakPolarHBondContact CD1-OD1 3.48Å; I1588-D2292 VanDerWaalsContact CG1-OD2 3.28Å; I1588-D2292 WeakPolarHBondContact CG1-OD2 3.14Å; I1588-D2292 CarbonylContact O-C 3.47Å; I1588-D2292 WeakPolarHBondContact O-CA 3.49Å; I1588-D2292 PolarHBondContact O-N 2.82Å; I1588-D2292 VanDerWaalsContact O-N 3.07Å; I1588-D2292 VanDerWaalsContact O-OD2 3.13Å; I1588-S2293 PolarHBondContact O-N 3.36Å; I1588-S2293 PolarHBondContact O-OG 3.31Å; I1588-L2323 HydrophobicContact CD1-CB 4.47Å; I1588-L2323 HydrophobicContact CD1-CD1 4.13Å; I1588-L2323 HydrophobicContact CD1-CD2 3.76Å; I1588-L2323 HydrophobicContact CD1-CG 4.33Å
1589	L	69	Low	55.7	Low	6 Å²	6	56.5 Å²	56.5	3%	0.031	31%	0.307	C	S	.	.			trans	-77.6	0	170	-36.3	-175.6	0	0	0	123.9	P1579 G2291 D2292 S2293 P2294 I2295 I2320 S2322	P1579-L1589 HydrophobicContact CG-CD2 4.01Å; L1589-G2291 CarbonylContact C-O 3.57Å; L1589-G2291 VanDerWaalsContact CA-C 3.45Å; L1589-G2291 CarbonylContact O-C 3.44Å; L1589-G2291 WeakPolarHBondContact O-CA 3.09Å; L1589-D2292 PolarHBondContact O-N 3.36Å; L1589-S2293 VanDerWaalsContact C-CA 3.41Å; L1589-S2293 VanDerWaalsContact CA-C 3.41Å; L1589-S2293 WeakPolarHBondContact CA-OG 3.33Å; L1589-S2293 VanDerWaalsContact CD2-OG 3.25Å; L1589-S2293 WeakPolarHBondContact CD2-OG 3.17Å; L1589-S2293 PolarHBondContact N-OG 3.33Å; L1589-P2294 VanDerWaalsContact C-N 3.28Å; L1589-P2294 HydrophobicContact CB-CB 4.15Å; L1589-P2294 VanDerWaalsContact CB-CD 3.43Å; L1589-P2294 HydrophobicContact CB-CG 3.96Å; L1589-P2294 WeakPolarHBondContact O-CD 3.27Å; L1589-I2295 HydrophobicContact CB-CG1 4.48Å; L1589-I2295 HydrophobicContact CD1-CD1 3.43Å; L1589-I2295 VanDerWaalsContact CD1-CD1 3.43Å; L1589-I2295 HydrophobicContact CD1-CG1 3.63Å; L1589-I2295 HydrophobicContact CD2-CD1 3.7Å; L1589-I2295 HydrophobicContact CD2-CG1 3.84Å; L1589-I2295 HydrophobicContact CG-CD1 4.18Å; L1589-I2295 HydrophobicContact CG-CG1 4.19Å; L1589-I2320 HydrophobicContact CD1-CD1 3.92Å; L1589-S2322 VanDerWaalsContact O-CA 3.26Å; L1589-S2322 WeakPolarHBondContact O-CA 3.29Å; L1589-S2322 WeakPolarHBondContact O-CB 3.36Å
1590	Q	67.8	Low	54.6	Low	19 Å²	19	67.8 Å²	67.8	9%	0.089	35%	0.349	C	S	.	.				0	64	0	-116.9	-177.9	-42.1	0	0	127.6	Q1639 M1641 D2292 S2293 P2294 S2322 N2324 Q2325	Q1590-Q1639 HydrophobicContact CB-CB 4.16Å; Q1590-Q1639 WeakPolarHBondContact O-CG 3.15Å; Q1590-Q1639 PolarHBondContact O-N 2.86Å; Q1590-M1641 HydrophobicContact CB-CE 4.24Å; Q1590-D2292 WeakPolarHBondContact CA-O 3.17Å; Q1590-D2292 HydrophobicContact CB-CB 3.96Å; Q1590-D2292 WeakPolarHBondContact CB-O 3.14Å; Q1590-S2293 CarbonylContact C-O 3.57Å; Q1590-S2293 VanDerWaalsContact N-C 3.3Å; Q1590-S2293 VanDerWaalsContact N-CA 3.31Å; Q1590-S2293 CarbonylContact O-C 3.59Å; Q1590-S2293 WeakPolarHBondContact O-CA 2.97Å; Q1590-P2294 VanDerWaalsContact CA-N 3.32Å; Q1590-P2294 VanDerWaalsContact N-N 3.15Å; Q1590-S2322 WeakPolarHBondContact CB-OG 3.26Å; Q1590-S2322 VanDerWaalsContact CD-OG 3.24Å; Q1590-S2322 WeakPolarHBondContact CG-OG 3.34Å; Q1590-S2322 PolarHBondContact OE1-OG 3.47Å; Q1590-N2324 VanDerWaalsContact OE1-CA 3.3Å; Q1590-Q2325 HydrophobicContact CG-CB 4.21Å
1591	Y	74.3	Confident	53.6	Low	7 Å²	7	73.9 Å²	73.9	3%	0.027	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	167.7	-168.7	-161.2	27.9	0	0	0	121.9	V1613 P1615 L1619 L1636 Q1637 I1638 P2294 I2295 D2296 Q2325	Y1591-V1613 HydrophobicContact CD2-CG1 3.7Å; Y1591-V1613 HydrophobicContact CE1-CG1 4.09Å; Y1591-V1613 HydrophobicContact CE2-CB 4.45Å; Y1591-V1613 HydrophobicContact CE2-CG1 2.98Å; Y1591-V1613 HydrophobicContact CG-CG1 4.5Å; Y1591-V1613 WeakPolarHBondContact OH-CG1 3.3Å; Y1591-P1615 HydrophobicContact CD2-CB 3.99Å; Y1591-P1615 HydrophobicContact CD2-CG 3.82Å; Y1591-P1615 HydrophobicContact CE2-CG 4.46Å; Y1591-L1619 VanDerWaalsContact OH-CD1 3.24Å; Y1591-L1619 WeakPolarHBondContact OH-CD1 3.13Å; Y1591-L1636 HydrophobicContact CD1-CD1 4.26Å; Y1591-L1636 HydrophobicContact CD1-CG 4.19Å; Y1591-L1636 HydrophobicContact CE1-CD1 3.42Å; Y1591-L1636 VanDerWaalsContact CE1-CD1 3.42Å; Y1591-L1636 HydrophobicContact CE1-CD2 3.56Å; Y1591-L1636 HydrophobicContact CE1-CG 3.31Å; Y1591-L1636 WeakPolarHBondContact OH-CD2 3.26Å; Y1591-Q1637 WeakPolarHBondContact CA-O 3.36Å; Y1591-Q1637 WeakPolarHBondContact CD1-O 3.36Å; Y1591-I1638 HydrophobicContact CE1-CG1 4.34Å; Y1591-P2294 VanDerWaalsContact CB-CG 3.4Å; Y1591-P2294 WeakPolarHBondContact CB-O 3.35Å; Y1591-P2294 WeakPolarHBondContact CD1-O 3.07Å; Y1591-P2294 HydrophobicContact CD2-CB 3.69Å; Y1591-P2294 HydrophobicContact CD2-CG 3.8Å; Y1591-P2294 VanDerWaalsContact CE1-C 3.41Å; Y1591-P2294 WeakPolarHBondContact CE1-O 3.44Å; Y1591-P2294 HydrophobicContact CE2-CB 4.01Å; Y1591-P2294 HydrophobicContact CG-CB 3.94Å; Y1591-P2294 HydrophobicContact CG-CG 3.99Å; Y1591-I2295 VanDerWaalsContact CZ-C 3.45Å; Y1591-I2295 PolarHBondContact OH-N 2.87Å; Y1591-D2296 HydrophobicContact CE2-CB 3.47Å; Y1591-D2296 VanDerWaalsContact CE2-CB 3.47Å; Y1591-D2296 WeakPolarHBondContact OH-CB 3.23Å; Y1591-D2296 PolarHBondContact OH-N 3.08Å; Y1591-Q2325 PolarHBondContact O-NE2 3.09Å
1592	K	71.4	Confident	53	Low	96 Å²	96	76.3 Å²	76.3	42%	0.417	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	143.3	165.8	-99.9	147.3	167.2	178.9	0	113.6	L1594 L1636 Q1637	K1592-L1594 HydrophobicContact CB-CD2 4.12Å; K1592-L1594 HydrophobicContact CB-CG 4.3Å; K1592-L1594 HydrophobicContact CD-CD2 4.02Å; K1592-L1594 HydrophobicContact CG-CD2 4.23Å; K1592-L1636 WeakPolarHBondContact O-CA 3.49Å; K1592-L1636 WeakPolarHBondContact O-CD1 3.43Å; K1592-Q1637 HydrophobicContact CB-CB 4.26Å; K1592-Q1637 PolarHBondContact N-O 2.94Å; K1592-Q1637 PolarHBondContact O-N 3.07Å
1593	I	70.8	Confident	52.4	Low	57 Å²	57	77.9 Å²	77.9	29%	0.292	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	140.3	139.6	-48.2	-177.5	0	0	0	107.8	T1595 L1611 V1613 V1634 T1635 L1636	I1593-T1595 HydrophobicContact CG2-CG2 3.95Å; I1593-L1611 WeakPolarHBondContact CD1-O 3.3Å; I1593-V1613 HydrophobicContact CD1-CB 3.61Å; I1593-V1613 HydrophobicContact CD1-CG2 3.48Å; I1593-V1613 VanDerWaalsContact CD1-CG2 3.48Å; I1593-V1613 HydrophobicContact CG1-CB 3.48Å; I1593-V1613 VanDerWaalsContact CG1-CB 3.48Å; I1593-V1613 HydrophobicContact CG1-CG1 3.93Å; I1593-V1613 HydrophobicContact CG1-CG2 3.41Å; I1593-V1613 VanDerWaalsContact CG1-CG2 3.41Å; I1593-V1634 HydrophobicContact CG2-CG1 3.58Å; I1593-T1635 WeakPolarHBondContact CA-O 3.04Å; I1593-T1635 WeakPolarHBondContact CG2-O 3.47Å; I1593-L1636 HydrophobicContact CG1-CD1 4.28Å
1594	L	62.5	Low	51.7	Low	58 Å²	58	83.9 Å²	83.9	30%	0.304	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	142.5	166.3	-58.4	170.9	0	0	0	109	K1592 T1635 Q1637	K1592-L1594 HydrophobicContact CB-CD2 4.12Å; K1592-L1594 HydrophobicContact CB-CG 4.3Å; K1592-L1594 HydrophobicContact CD-CD2 4.02Å; K1592-L1594 HydrophobicContact CG-CD2 4.23Å; L1594-T1635 WeakPolarHBondContact CB-OG1 3.24Å; L1594-T1635 PolarHBondContact N-O 2.96Å; L1594-T1635 PolarHBondContact O-N 2.84Å; L1594-T1635 VanDerWaalsContact O-N 3.14Å; L1594-T1635 PolarHBondContact O-OG1 2.85Å; L1594-Q1637 HydrophobicContact CD1-CB 4.2Å
1595	T	53.5	Low	51.4	Low	85 Å²	85	84.7 Å²	84.7	52%	0.521	44%	0.444	S	S	.	.			trans	-136.5	109.4	-174.8	52.5	0	0	0	0	111.3	I1593 A1607	I1593-T1595 HydrophobicContact CG2-CG2 3.95Å; T1595-A1607 HydrophobicContact CG2-CB 3.64Å
1596	V	45.9	Very low	51.5	Low	46 Å²	46	81.6 Å²	81.6	28%	0.279	42%	0.417	S	S	.	.			trans	-142.4	110	177.9	-146.8	0	0	0	0	112	F2338 Y2339	V1596-F2338 PolarHBondContact O-N 2.91Å; V1596-Y2339 VanDerWaalsContact O-CD1 3.23Å; V1596-Y2339 WeakPolarHBondContact O-CD1 3.26Å; V1596-Y2339 WeakPolarHBondContact O-CE1 3.4Å
1597	P	36.6	Very low	51.7	Low	70 Å²	70	78 Å²	78	46%	0.455	40%	0.402	S	S	.	.			trans	-86.9	157.6	-162.4	33.9	-37.6	0	0	0	114.9	L1604	P1597-L1604 HydrophobicContact CG-CD1 4.46Å
1598	H	38.7	Very low	51.8	Low	114 Å²	114	80 Å²	80	53%	0.528	42%	0.416	S	S	.	.			trans	-155	63.4	166.1	-116.4	76	0	0	0	112.4	F2338 Y2339	H1598-F2338 HydrophobicContact CB-CD1 4.19Å; H1598-F2338 HydrophobicContact CB-CE1 3.55Å; H1598-F2338 HydrophobicContact CB-CZ 4.34Å; H1598-F2338 AromaticContact CD2-CZ 4Å; H1598-F2338 AromaticContact CG-CE1 3.74Å; H1598-Y2339 HydrophobicContact CB-CE2 4.06Å; H1598-Y2339 PolarHBondContact N-OH 3.1Å
1599	N	36.1	Very low	51.9	Low	123 Å²	123	81.1 Å²	81.1	66%	0.658	42%	0.42	S	S	*	.	S	Bend	trans	-153.2	138.6	135.7	-133.8	-14.9	0	0	0	108.2	N1601	N1599-N1601 VanDerWaalsContact C-N 3.26Å; N1599-N1601 PolarHBondContact O-N 2.93Å
1600	R	43.1	Very low	52	Low	240 Å²	240	82 Å²	82	91%	0.906	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	2.1	-154.6	-71.8	-175.2	175.1	177.8	-0.8	116.6
1601	N	40.4	Very low	52.2	Low	135 Å²	135	81.1 Å²	81.1	72%	0.722	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	1.7	-163.5	-69.1	29.4	0	0	0	116.1	N1599	N1599-N1601 VanDerWaalsContact C-N 3.26Å; N1599-N1601 PolarHBondContact O-N 2.93Å
1602	L	38.7	Very low	52.2	Low	100 Å²	100	81.8 Å²	81.8	52%	0.524	43%	0.425	S	S	.	.	S	Bend	trans	-105.8	135.9	166.6	-86.6	83.1	0	0	0	110.5	F1610	L1602-F1610 HydrophobicContact CD2-CE2 4.26Å; L1602-F1610 HydrophobicContact CD2-CZ 3.8Å
1603	S	36.1	Very low	52.3	Low	87 Å²	87	78.6 Å²	78.6	61%	0.608	41%	0.414	S	S	*	.			trans	-79	159.4	-176.3	53.8	0	0	0	0	112.7	E1605	S1603-E1605 VanDerWaalsContact C-N 3.27Å; S1603-E1605 PolarHBondContact O-N 2.79Å; S1603-E1605 VanDerWaalsContact O-N 3.11Å
1604	L	36.6	Very low	52.4	Low	139 Å²	139	76 Å²	76	73%	0.728	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.6	-155.4	-144.1	74.4	0	0	0	116	P1597	P1597-L1604 HydrophobicContact CG-CD1 4.46Å
1605	E	45.6	Very low	52.7	Low	154 Å²	154	74.2 Å²	74.2	72%	0.72	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-0.8	-162.3	-61.5	177.2	141.4	0	0	114.5	S1603	S1603-E1605 VanDerWaalsContact C-N 3.27Å; S1603-E1605 PolarHBondContact O-N 2.79Å; S1603-E1605 VanDerWaalsContact O-N 3.11Å
1606	H	51.5	Low	53.2	Low	45 Å²	45	70.2 Å²	70.2	21%	0.208	37%	0.367	C	S	.	.			trans	-107.9	1.6	-163.4	-64.7	61.2	0	0	0	114.5	S1608 Q1609 F1610	H1606-S1608 PolarHBondContact O-N 2.72Å; H1606-Q1609 HydrophobicContact CB-CG 4.44Å; H1606-Q1609 PolarHBondContact CD2-NE2 3.36Å; H1606-Q1609 PolarHBondContact CD2-OE1 2.86Å; H1606-Q1609 PolarHBondContact NE2-NE2 3.11Å; H1606-Q1609 WeakPolarHBondContact O-CA 3.49Å; H1606-Q1609 WeakPolarHBondContact O-CB 3.48Å; H1606-Q1609 PolarHBondContact O-N 3.14Å; H1606-F1610 HydrophobicContact CB-CE2 3.87Å; H1606-F1610 HydrophobicContact CB-CZ 3.94Å; H1606-F1610 VanDerWaalsContact O-CD2 3.31Å; H1606-F1610 WeakPolarHBondContact O-CD2 3.22Å; H1606-F1610 PolarHBondContact O-N 2.8Å; H1606-F1610 VanDerWaalsContact O-N 3.07Å
1607	A	53	Low	54.5	Low	29 Å²	29	68 Å²	68	24%	0.24	35%	0.354	C	S	.	.	H	α-helix	trans	-62.5	-40.1	-175.3	0	0	0	0	0	114	T1595 Q1609 F1610 L1611	T1595-A1607 HydrophobicContact CG2-CB 3.64Å; A1607-Q1609 PolarHBondContact O-N 3.2Å; A1607-F1610 PolarHBondContact O-N 3.38Å; A1607-L1611 PolarHBondContact O-N 2.82Å
1608	S	57	Low	56.3	Low	60 Å²	60	64.7 Å²	64.7	42%	0.42	33%	0.332	S	S	.	.	H	α-helix	trans	-67.5	-20.3	172.2	51.2	0	0	0	0	112.9	H1606 L1611 T1612	H1606-S1608 PolarHBondContact O-N 2.72Å; S1608-L1611 WeakPolarHBondContact CA-O 3.43Å; S1608-L1611 CarbonylContact O-C 3.57Å; S1608-T1612 WeakPolarHBondContact O-CG2 3.35Å
1609	Q	62.8	Low	58.2	Low	33 Å²	33	59.2 Å²	59.2	15%	0.154	31%	0.307	C	S	.	.	H	α-helix	trans	-80.5	-33.5	175.2	-47.6	-178.4	24.3	0	0	110.9	H1606 A1607 N1622 K1624	H1606-Q1609 HydrophobicContact CB-CG 4.44Å; H1606-Q1609 PolarHBondContact CD2-NE2 3.36Å; H1606-Q1609 PolarHBondContact CD2-OE1 2.86Å; H1606-Q1609 PolarHBondContact NE2-NE2 3.11Å; H1606-Q1609 WeakPolarHBondContact O-CA 3.49Å; H1606-Q1609 WeakPolarHBondContact O-CB 3.48Å; H1606-Q1609 PolarHBondContact O-N 3.14Å; A1607-Q1609 PolarHBondContact O-N 3.2Å; Q1609-N1622 WeakPolarHBondContact O-CB 3.24Å; Q1609-N1622 PolarHBondContact O-ND2 2.86Å; Q1609-K1624 HydrophobicContact CB-CD 3.7Å
1610	F	69.2	Low	60.2	Low	26 Å²	26	54.1 Å²	54.1	11%	0.114	28%	0.279	C	S	.	.	H	α-helix	trans	-76.4	-44.3	172.2	-54.2	-49.1	0	0	0	112.2	L1602 H1606 A1607 A1621 N1622 K1624 C1625 I1669	L1602-F1610 HydrophobicContact CD2-CE2 4.26Å; L1602-F1610 HydrophobicContact CD2-CZ 3.8Å; H1606-F1610 HydrophobicContact CB-CE2 3.87Å; H1606-F1610 HydrophobicContact CB-CZ 3.94Å; H1606-F1610 VanDerWaalsContact O-CD2 3.31Å; H1606-F1610 WeakPolarHBondContact O-CD2 3.22Å; H1606-F1610 PolarHBondContact O-N 2.8Å; H1606-F1610 VanDerWaalsContact O-N 3.07Å; A1607-F1610 PolarHBondContact O-N 3.38Å; F1610-A1621 CarbonylContact O-C 3.54Å; F1610-A1621 WeakPolarHBondContact O-CA 3.37Å; F1610-N1622 PolarHBondContact O-N 3.08Å; F1610-K1624 HydrophobicContact CD1-CB 4.31Å; F1610-K1624 HydrophobicContact CE1-CB 4.39Å; F1610-C1625 WeakPolarHBondContact CD1-SG 3.43Å; F1610-I1669 HydrophobicContact CB-CD1 4.32Å; F1610-I1669 VanDerWaalsContact O-CD1 3.28Å; F1610-I1669 WeakPolarHBondContact O-CD1 3.16Å
1611	L	72.3	Confident	61.7	Low	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	108.6	179.9	-164.5	88	0	0	0	111.4	I1593 A1607 S1608 V1613 L1619 R1620 V1634 V1667 I1669	I1593-L1611 WeakPolarHBondContact CD1-O 3.3Å; A1607-L1611 PolarHBondContact O-N 2.82Å; S1608-L1611 WeakPolarHBondContact CA-O 3.43Å; S1608-L1611 CarbonylContact O-C 3.57Å; L1611-V1613 HydrophobicContact CD2-CG2 3.72Å; L1611-V1613 HydrophobicContact CG-CG2 4.1Å; L1611-L1619 HydrophobicContact CD1-CB 4.37Å; L1611-L1619 HydrophobicContact CD1-CD2 4.18Å; L1611-L1619 HydrophobicContact CD1-CG 3.95Å; L1611-L1619 HydrophobicContact CD2-CD2 3.83Å; L1611-L1619 HydrophobicContact CD2-CG 3.95Å; L1611-L1619 HydrophobicContact CG-CD2 4.46Å; L1611-L1619 HydrophobicContact CG-CG 4.18Å; L1611-R1620 CarbonylContact C-O 3.57Å; L1611-R1620 WeakPolarHBondContact CA-O 3.4Å; L1611-V1634 HydrophobicContact CB-CG1 4.22Å; L1611-V1634 HydrophobicContact CB-CG2 4.33Å; L1611-V1634 HydrophobicContact CD2-CB 4.41Å; L1611-V1634 HydrophobicContact CD2-CG1 3.73Å; L1611-V1667 HydrophobicContact CD1-CG1 3.51Å; L1611-V1667 HydrophobicContact CD2-CB 4.2Å; L1611-V1667 HydrophobicContact CD2-CG1 3.58Å; L1611-V1667 HydrophobicContact CD2-CG2 4.19Å; L1611-V1667 HydrophobicContact CG-CG1 4.1Å; L1611-I1669 HydrophobicContact CD1-CD1 4.42Å
1612	T	75	Confident	63	Low	21 Å²	21	37 Å²	37	13%	0.129	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	146.7	167.1	48.2	0	0	0	0	111.4	S1608 R1620 R2317	S1608-T1612 WeakPolarHBondContact O-CG2 3.35Å; T1612-R1620 PolarHBondContact N-O 2.87Å; T1612-R1620 WeakPolarHBondContact O-CB 3.43Å; T1612-R1620 PolarHBondContact O-N 3.2Å; T1612-R1620 WeakPolarHBondContact OG1-CB 3.24Å; T1612-R2317 PolarHBondContact O-NH2 2.96Å; T1612-R2317 PolarHBondContact OG1-NH1 2.73Å
1613	V	73.3	Confident	64.2	Low	29 Å²	29	35.1 Å²	35.1	18%	0.176	20%	0.196	C	C	.	.			trans	-141.5	105	-175.7	174.2	0	0	0	0	110.6	Y1591 I1593 L1611 P1615 L1619 L1636 D2296	Y1591-V1613 HydrophobicContact CD2-CG1 3.7Å; Y1591-V1613 HydrophobicContact CE1-CG1 4.09Å; Y1591-V1613 HydrophobicContact CE2-CB 4.45Å; Y1591-V1613 HydrophobicContact CE2-CG1 2.98Å; Y1591-V1613 HydrophobicContact CG-CG1 4.5Å; Y1591-V1613 WeakPolarHBondContact OH-CG1 3.3Å; I1593-V1613 HydrophobicContact CD1-CB 3.61Å; I1593-V1613 HydrophobicContact CD1-CG2 3.48Å; I1593-V1613 VanDerWaalsContact CD1-CG2 3.48Å; I1593-V1613 HydrophobicContact CG1-CB 3.48Å; I1593-V1613 VanDerWaalsContact CG1-CB 3.48Å; I1593-V1613 HydrophobicContact CG1-CG1 3.93Å; I1593-V1613 HydrophobicContact CG1-CG2 3.41Å; I1593-V1613 VanDerWaalsContact CG1-CG2 3.41Å; L1611-V1613 HydrophobicContact CD2-CG2 3.72Å; L1611-V1613 HydrophobicContact CG-CG2 4.1Å; V1613-P1615 VanDerWaalsContact O-CD 3.26Å; V1613-P1615 WeakPolarHBondContact O-CD 3.36Å; V1613-L1619 HydrophobicContact CB-CD1 4.49Å; V1613-L1619 HydrophobicContact CG1-CD1 4.33Å; V1613-L1619 HydrophobicContact CG2-CD1 3.53Å; V1613-L1619 HydrophobicContact CG2-CG 4.1Å; V1613-L1636 HydrophobicContact CG1-CD1 3.98Å; V1613-L1636 HydrophobicContact CG2-CD1 3.89Å; V1613-D2296 VanDerWaalsContact CA-CG 3.45Å; V1613-D2296 WeakPolarHBondContact CA-OD2 3.32Å; V1613-D2296 HydrophobicContact CB-CB 4.2Å; V1613-D2296 HydrophobicContact CG1-CB 3.6Å
1614	T	73.4	Confident	65.4	Low	1 Å²	1	31.3 Å²	31.3	1%	0.006	17%	0.168	C	C	.	.			trans	-104.5	85.3	175.3	70.6	0	0	0	0	111.9	D1616 I1618 W2160 D2296 R2317 I2318 N2319	T1614-D1616 PolarHBondContact O-N 2.77Å; T1614-I1618 WeakPolarHBondContact OG1-CD1 3.13Å; T1614-W2160 HydrophobicContact CG2-CD2 4.18Å; T1614-W2160 HydrophobicContact CG2-CE3 3.89Å; T1614-W2160 HydrophobicContact CG2-CH2 3.58Å; T1614-W2160 HydrophobicContact CG2-CZ2 3.95Å; T1614-W2160 HydrophobicContact CG2-CZ3 3.56Å; T1614-D2296 VanDerWaalsContact CA-OD1 3.25Å; T1614-D2296 WeakPolarHBondContact CA-OD1 3.41Å; T1614-D2296 WeakPolarHBondContact CB-OD1 3.11Å; T1614-D2296 VanDerWaalsContact N-CB 3.31Å; T1614-D2296 PolarHBondContact N-OD1 3.28Å; T1614-D2296 WeakPolarHBondContact O-CA 3.34Å; T1614-D2296 VanDerWaalsContact O-CB 3.26Å; T1614-D2296 WeakPolarHBondContact O-CB 3.16Å; T1614-D2296 PolarHBondContact OG1-OD1 2.94Å; T1614-R2317 HydrophobicContact CG2-CG 4.42Å; T1614-R2317 VanDerWaalsContact OG1-CD 3.27Å; T1614-R2317 WeakPolarHBondContact OG1-CD 2.99Å; T1614-R2317 WeakPolarHBondContact OG1-CG 3.37Å; T1614-R2317 PolarHBondContact OG1-NE 2.85Å; T1614-I2318 CarbonylContact C-O 3.46Å; T1614-I2318 WeakPolarHBondContact CB-O 3.47Å; T1614-I2318 CarbonylContact O-C 3.59Å; T1614-I2318 PolarHBondContact OG1-O 3.07Å; T1614-N2319 VanDerWaalsContact CA-CG 3.47Å; T1614-N2319 VanDerWaalsContact CA-OD1 3.27Å; T1614-N2319 WeakPolarHBondContact CA-OD1 3.1Å; T1614-N2319 VanDerWaalsContact CB-ND2 3.32Å; T1614-N2319 WeakPolarHBondContact CB-ND2 3.38Å; T1614-N2319 WeakPolarHBondContact O-CA 3.27Å
1615	P	68.3	Low	66.5	Low	22 Å²	22	24.7 Å²	24.7	14%	0.143	13%	0.134	C	C	.	.	S	Bend	trans	-16.8	17.2	176.4	-28.1	9.6	0	0	0	131.3	Y1591 V1613 P2294 I2295 N2319 I2320	Y1591-P1615 HydrophobicContact CD2-CB 3.99Å; Y1591-P1615 HydrophobicContact CD2-CG 3.82Å; Y1591-P1615 HydrophobicContact CE2-CG 4.46Å; V1613-P1615 VanDerWaalsContact O-CD 3.26Å; V1613-P1615 WeakPolarHBondContact O-CD 3.36Å; P1615-P2294 HydrophobicContact CB-CB 4.36Å; P1615-P2294 HydrophobicContact CB-CG 3.73Å; P1615-P2294 VanDerWaalsContact O-CB 3.25Å; P1615-P2294 WeakPolarHBondContact O-CB 3.41Å; P1615-P2294 WeakPolarHBondContact O-CG 3.12Å; P1615-I2295 CarbonylContact C-O 3.5Å; P1615-I2295 WeakPolarHBondContact CA-O 3.41Å; P1615-N2319 WeakPolarHBondContact CB-OD1 3.4Å; P1615-N2319 WeakPolarHBondContact CD-OD1 3.07Å; P1615-N2319 VanDerWaalsContact CG-OD1 3.27Å; P1615-N2319 WeakPolarHBondContact CG-OD1 3.26Å; P1615-I2320 CarbonylContact C-O 3.53Å; P1615-I2320 WeakPolarHBondContact CB-O 3.47Å; P1615-I2320 CarbonylContact O-C 3.57Å; P1615-I2320 WeakPolarHBondContact O-CA 3.41Å; P1615-I2320 PolarHBondContact O-N 3Å
1616	D	64.8	Low	66.7	Low	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	-108.3	137.5	143.1	-68.4	-119.6	0	0	0	104.8	T1614 I2202 C2288 I2295 D2296 T2297 I2318 N2319 I2320	T1614-D1616 PolarHBondContact O-N 2.77Å; D1616-I2202 HydrophobicContact CB-CG2 3.65Å; D1616-I2202 WeakPolarHBondContact OD1-CG2 3.37Å; D1616-C2288 WeakPolarHBondContact OD1-CB 3.27Å; D1616-C2288 PolarHBondContact OD1-SG 2.82Å; D1616-I2295 CarbonylContact C-O 3.56Å; D1616-I2295 WeakPolarHBondContact CA-O 3.32Å; D1616-I2295 PolarHBondContact N-O 3.48Å; D1616-D2296 CarbonylContact O-C 3.59Å; D1616-D2296 WeakPolarHBondContact O-CA 3.34Å; D1616-T2297 HydrophobicContact CB-CG2 4.22Å; D1616-T2297 WeakPolarHBondContact CB-OG1 3.48Å; D1616-T2297 WeakPolarHBondContact O-CA 3.47Å; D1616-T2297 WeakPolarHBondContact O-CB 3.24Å; D1616-T2297 PolarHBondContact O-N 2.84Å; D1616-T2297 PolarHBondContact O-OG1 3.4Å; D1616-I2318 HydrophobicContact CB-CB 3.71Å; D1616-I2318 HydrophobicContact CB-CD1 3.79Å; D1616-I2318 HydrophobicContact CB-CG1 4.18Å; D1616-I2318 WeakPolarHBondContact OD2-CB 3.33Å; D1616-N2319 VanDerWaalsContact N-CA 3.33Å; D1616-N2319 WeakPolarHBondContact OD2-CA 3.25Å; D1616-N2319 PolarHBondContact OD2-N 3.34Å; D1616-I2320 HydrophobicContact CB-CG1 4.18Å; D1616-I2320 WeakPolarHBondContact OD1-CD1 3.47Å; D1616-I2320 WeakPolarHBondContact OD1-CG1 3.43Å; D1616-I2320 WeakPolarHBondContact OD2-CG1 3.1Å; D1616-I2320 PolarHBondContact OD2-N 2.84Å; D1616-I2320 VanDerWaalsContact OD2-N 3.08Å
1617	G	71.4	Confident	66.6	Low	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	-70.9	0	-159.2	0	0	0	0	0	137.1	N1576 L1577 I2295 D2296 T2297	N1576-G1617 CarbonylContact C-O 3.37Å; N1576-G1617 WeakPolarHBondContact CA-O 3.17Å; N1576-G1617 WeakPolarHBondContact CB-O 3.3Å; N1576-G1617 PolarHBondContact ND2-O 2.81Å; N1576-G1617 PolarHBondContact OD1-O 2.65Å; L1577-G1617 CarbonylContact C-O 3.44Å; L1577-G1617 PolarHBondContact N-O 2.89Å; L1577-G1617 CarbonylContact O-C 3.53Å; L1577-G1617 VanDerWaalsContact O-CA 3.22Å; L1577-G1617 WeakPolarHBondContact O-CA 2.9Å; G1617-I2295 VanDerWaalsContact CA-CA 3.47Å; G1617-I2295 VanDerWaalsContact N-CD1 3.28Å; G1617-I2295 PolarHBondContact N-O 2.8Å; G1617-D2296 CarbonylContact C-O 3.53Å; G1617-D2296 VanDerWaalsContact CA-CA 3.46Å; G1617-D2296 WeakPolarHBondContact CA-O 2.95Å; G1617-T2297 VanDerWaalsContact C-CG2 3.41Å; G1617-T2297 VanDerWaalsContact CA-CA 3.45Å; G1617-T2297 VanDerWaalsContact N-CG2 3.27Å; G1617-T2297 WeakPolarHBondContact O-CA 3.31Å; G1617-T2297 WeakPolarHBondContact O-CG2 3.32Å
1618	I	75.3	Confident	66.1	Low	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.	B	Isolated β-bridge		0	169.1	0	-62.1	56.1	0	0	0	100	Q1574 L1575 N1576 L1577 T1614 R1620 D2296 T2297 L2298 R2317	Q1574-I1618 HydrophobicContact CG-CB 4.39Å; Q1574-I1618 HydrophobicContact CG-CG2 3.17Å; L1575-I1618 CarbonylContact O-C 3.58Å; L1575-I1618 WeakPolarHBondContact O-CA 3.01Å; N1576-I1618 PolarHBondContact OD1-N 3.19Å; L1577-I1618 WeakPolarHBondContact CD1-O 3.48Å; L1577-I1618 WeakPolarHBondContact CG-O 3.16Å; L1577-I1618 VanDerWaalsContact N-N 3.13Å; T1614-I1618 WeakPolarHBondContact OG1-CD1 3.13Å; I1618-R1620 HydrophobicContact CG2-CG 4.31Å; I1618-D2296 CarbonylContact C-O 3.57Å; I1618-D2296 WeakPolarHBondContact CA-O 3.45Å; I1618-D2296 HydrophobicContact CB-CB 4.24Å; I1618-D2296 VanDerWaalsContact CB-CG 3.42Å; I1618-D2296 WeakPolarHBondContact CB-O 3.44Å; I1618-D2296 WeakPolarHBondContact CB-OD2 3.48Å; I1618-D2296 HydrophobicContact CD1-CB 4.23Å; I1618-D2296 WeakPolarHBondContact CD1-OD1 3.41Å; I1618-D2296 HydrophobicContact CG1-CB 4.3Å; I1618-D2296 WeakPolarHBondContact CG1-OD1 3.42Å; I1618-D2296 PolarHBondContact N-O 2.91Å; I1618-T2297 WeakPolarHBondContact CD1-O 3.33Å; I1618-T2297 WeakPolarHBondContact CG1-O 3.34Å; I1618-L2298 HydrophobicContact CB-CB 4.28Å; I1618-L2298 VanDerWaalsContact CB-N 3.31Å; I1618-L2298 HydrophobicContact CD1-CD1 3.94Å; I1618-L2298 HydrophobicContact CG1-CB 4Å; I1618-L2298 HydrophobicContact CG1-CD1 3.53Å; I1618-L2298 HydrophobicContact CG1-CG 4.17Å; I1618-L2298 HydrophobicContact CG2-CB 3.76Å; I1618-L2298 HydrophobicContact CG2-CD1 4.03Å; I1618-L2298 HydrophobicContact CG2-CG 4.5Å; I1618-R2317 HydrophobicContact CD1-CB 4.18Å; I1618-R2317 HydrophobicContact CD1-CG 3.55Å; I1618-R2317 HydrophobicContact CG1-CG 4.47Å
1619	L	79.1	Confident	65.6	Low	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.104	C	C	.	.				-136.7	162.5	116.8	-135.8	50	0	0	0	111.5	Q1574 L1575 L1577 Y1591 L1611 V1613 L1636 V1667 D2296 N2342 F2343 S2344	Q1574-L1619 VanDerWaalsContact CD-O 3.29Å; Q1574-L1619 WeakPolarHBondContact CG-O 3.45Å; Q1574-L1619 PolarHBondContact OE1-O 2.83Å; L1575-L1619 PolarHBondContact O-N 2.92Å; L1577-L1619 HydrophobicContact CD1-CD1 3.77Å; L1577-L1619 HydrophobicContact CD1-CD2 4.44Å; Y1591-L1619 VanDerWaalsContact OH-CD1 3.24Å; Y1591-L1619 WeakPolarHBondContact OH-CD1 3.13Å; L1611-L1619 HydrophobicContact CD1-CB 4.37Å; L1611-L1619 HydrophobicContact CD1-CD2 4.18Å; L1611-L1619 HydrophobicContact CD1-CG 3.95Å; L1611-L1619 HydrophobicContact CD2-CD2 3.83Å; L1611-L1619 HydrophobicContact CD2-CG 3.95Å; L1611-L1619 HydrophobicContact CG-CD2 4.46Å; L1611-L1619 HydrophobicContact CG-CG 4.18Å; V1613-L1619 HydrophobicContact CB-CD1 4.49Å; V1613-L1619 HydrophobicContact CG1-CD1 4.33Å; V1613-L1619 HydrophobicContact CG2-CD1 3.53Å; V1613-L1619 HydrophobicContact CG2-CG 4.1Å; L1619-L1636 HydrophobicContact CD1-CD1 3.8Å; L1619-L1636 HydrophobicContact CD1-CD2 3.7Å; L1619-L1636 HydrophobicContact CD1-CG 4.36Å; L1619-L1636 HydrophobicContact CD2-CB 4.49Å; L1619-L1636 HydrophobicContact CD2-CD1 4.05Å; L1619-L1636 HydrophobicContact CD2-CD2 3.6Å; L1619-L1636 HydrophobicContact CD2-CG 4.25Å; L1619-L1636 HydrophobicContact CG-CD2 4.37Å; L1619-V1667 HydrophobicContact CD2-CB 4.46Å; L1619-V1667 HydrophobicContact CD2-CG1 4.06Å; L1619-V1667 HydrophobicContact CD2-CG2 3.49Å; L1619-V1667 VanDerWaalsContact CD2-CG2 3.49Å; L1619-D2296 WeakPolarHBondContact CA-OD2 3.36Å; L1619-D2296 HydrophobicContact CD1-CB 4.25Å; L1619-D2296 WeakPolarHBondContact CD1-OD2 3.49Å; L1619-N2342 HydrophobicContact CB-CB 3.87Å; L1619-N2342 WeakPolarHBondContact CB-OD1 3.4Å; L1619-N2342 HydrophobicContact CD2-CB 3.41Å; L1619-N2342 VanDerWaalsContact CD2-CB 3.41Å; L1619-N2342 VanDerWaalsContact CD2-CG 3.49Å; L1619-N2342 WeakPolarHBondContact CD2-ND2 3.5Å; L1619-N2342 HydrophobicContact CG-CB 4.21Å; L1619-F2343 CarbonylContact C-O 3.46Å; L1619-F2343 CarbonylContact O-C 3.57Å; L1619-S2344 VanDerWaalsContact O-CA 3.24Å; L1619-S2344 WeakPolarHBondContact O-CA 3.39Å; L1619-S2344 PolarHBondContact O-N 2.9Å
1620	R	77.5	Confident	65.1	Low	16 Å²	16	19.3 Å²	19.3	6%	0.06	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	83.6	179.4	-92.1	-148.3	-156.4	-168.3	-3.3	119.2	L1611 T1612 I1618 S2156 Y2157 R2317 F2343 S2344	L1611-R1620 CarbonylContact C-O 3.57Å; L1611-R1620 WeakPolarHBondContact CA-O 3.4Å; T1612-R1620 PolarHBondContact N-O 2.87Å; T1612-R1620 WeakPolarHBondContact O-CB 3.43Å; T1612-R1620 PolarHBondContact O-N 3.2Å; T1612-R1620 WeakPolarHBondContact OG1-CB 3.24Å; I1618-R1620 HydrophobicContact CG2-CG 4.31Å; R1620-S2156 WeakPolarHBondContact CD-OG 3.37Å; R1620-S2156 VanDerWaalsContact CZ-CB 3.46Å; R1620-S2156 PolarHBondContact NE-OG 3.36Å; R1620-S2156 VanDerWaalsContact NE-OG 3.16Å; R1620-S2156 PolarHBondContact NH1-O 2.96Å; R1620-S2156 PolarHBondContact NH1-OG 2.88Å; R1620-S2156 PolarHBondContact NH2-O 3.45Å; R1620-Y2157 PolarHBondContact NH2-O 3.25Å; R1620-R2317 VanDerWaalsContact CB-NH2 3.29Å; R1620-R2317 VanDerWaalsContact CG-CZ 3.42Å; R1620-F2343 CarbonylContact C-O 3.56Å; R1620-F2343 VanDerWaalsContact C-O 3.31Å; R1620-F2343 WeakPolarHBondContact CA-O 3.48Å; R1620-F2343 PolarHBondContact N-O 3.32Å; R1620-F2343 VanDerWaalsContact N-O 3.1Å; R1620-S2344 VanDerWaalsContact CA-OG 3.3Å; R1620-S2344 WeakPolarHBondContact CA-OG 3.5Å; R1620-S2344 WeakPolarHBondContact CG-OG 3.37Å
1621	A	75.2	Confident	64.8	Low	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	141	161.8	0	0	0	0	0	114.2	S1570 N1572 F1610 I1669 F2343 S2344	S1570-A1621 WeakPolarHBondContact O-CB 3.47Å; N1572-A1621 WeakPolarHBondContact CA-O 3.43Å; N1572-A1621 PolarHBondContact N-O 2.98Å; N1572-A1621 PolarHBondContact OD1-O 3.19Å; F1610-A1621 CarbonylContact O-C 3.54Å; F1610-A1621 WeakPolarHBondContact O-CA 3.37Å; A1621-I1669 HydrophobicContact CB-CB 4.45Å; A1621-I1669 HydrophobicContact CB-CD1 3.43Å; A1621-I1669 VanDerWaalsContact CB-CD1 3.43Å; A1621-I1669 HydrophobicContact CB-CG1 3.5Å; A1621-I1669 HydrophobicContact CB-CG2 4.17Å; A1621-F2343 VanDerWaalsContact CB-O 3.27Å; A1621-F2343 WeakPolarHBondContact CB-O 3.34Å; A1621-F2343 PolarHBondContact N-O 3.41Å; A1621-S2344 VanDerWaalsContact N-CB 3.31Å; A1621-S2344 PolarHBondContact N-OG 3.36Å; A1621-S2344 WeakPolarHBondContact O-CB 3.29Å; A1621-S2344 PolarHBondContact O-OG 2.96Å
1622	N	66.4	Low	64.6	Low	15 Å²	15	20.6 Å²	20.6	8%	0.08	12%	0.116	C	C	.	.			trans	-125.1	144.5	-168.8	-137.6	2.2	0	0	0	113.3	P1571 N1572 Q1609 F1610 K1624 C1625 L2144	P1571-N1622 WeakPolarHBondContact CB-O 3.33Å; N1572-N1622 VanDerWaalsContact OD1-CA 3.26Å; N1572-N1622 WeakPolarHBondContact OD1-CA 3.43Å; N1572-N1622 PolarHBondContact OD1-OD1 2.99Å; Q1609-N1622 WeakPolarHBondContact O-CB 3.24Å; Q1609-N1622 PolarHBondContact O-ND2 2.86Å; F1610-N1622 PolarHBondContact O-N 3.08Å; N1622-K1624 HydrophobicContact CB-CD 4.46Å; N1622-K1624 HydrophobicContact CB-CG 4.26Å; N1622-K1624 PolarHBondContact O-N 2.91Å; N1622-C1625 PolarHBondContact O-N 2.84Å; N1622-L2144 WeakPolarHBondContact ND2-CB 3.44Å
1623	D	63.8	Low	64.4	Low	60 Å²	60	23.9 Å²	23.9	32%	0.321	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-66.9	-10.2	-169.6	-136.9	12.4	0	0	0	114.3	P1571 N1572 C1625 S1626 T2152 S2153	P1571-D1623 HydrophobicContact CB-CB 4.43Å; N1572-D1623 WeakPolarHBondContact ND2-CB 3.24Å; N1572-D1623 PolarHBondContact OD1-N 3.42Å; D1623-C1625 PolarHBondContact O-N 2.84Å; D1623-S1626 WeakPolarHBondContact O-CA 3.04Å; D1623-S1626 WeakPolarHBondContact O-CB 3.4Å; D1623-S1626 PolarHBondContact O-N 2.84Å; D1623-S1626 VanDerWaalsContact OD1-CB 3.29Å; D1623-S1626 WeakPolarHBondContact OD1-CB 3.12Å; D1623-T2152 WeakPolarHBondContact OD1-CA 3.46Å; D1623-S2153 PolarHBondContact OD1-N 3.03Å
1624	K	61.8	Low	64.4	Low	8 Å²	8	22.9 Å²	22.9	4%	0.035	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-37.6	-52.5	159.9	-55.5	-172.6	154.4	-105	0	110.3	Q1609 F1610 N1622 S1626 Q2145 E2146 D2147 S2148	Q1609-K1624 HydrophobicContact CB-CD 3.7Å; F1610-K1624 HydrophobicContact CD1-CB 4.31Å; F1610-K1624 HydrophobicContact CE1-CB 4.39Å; N1622-K1624 HydrophobicContact CB-CD 4.46Å; N1622-K1624 HydrophobicContact CB-CG 4.26Å; N1622-K1624 PolarHBondContact O-N 2.91Å; K1624-S1626 PolarHBondContact O-N 2.58Å; K1624-Q2145 VanDerWaalsContact CE-C 3.42Å; K1624-Q2145 WeakPolarHBondContact CE-O 3.4Å; K1624-Q2145 PolarHBondContact NZ-O 2.93Å; K1624-E2146 WeakPolarHBondContact CB-O 3.46Å; K1624-E2146 WeakPolarHBondContact CD-O 3.36Å; K1624-E2146 WeakPolarHBondContact CE-O 3.11Å; K1624-E2146 WeakPolarHBondContact CG-O 3.43Å; K1624-E2146 PolarHBondContact NZ-O 2.82Å; K1624-D2147 CarbonylContact C-O 3.51Å; K1624-D2147 CarbonylContact O-C 3.57Å; K1624-D2147 VanDerWaalsContact O-C 3.24Å; K1624-S2148 WeakPolarHBondContact O-CA 3.36Å; K1624-S2148 PolarHBondContact O-N 2.82Å
1625	C	60.1	Low	64.4	Low	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-61.2	-24.8	179.5	-61.8	0	0	0	0	112.4	P1571 F1610 N1622 D1623 E1627 C1632 I1669 H2149 M2150 S2151	P1571-C1625 HydrophobicContact CG-CB 4.2Å; F1610-C1625 WeakPolarHBondContact CD1-SG 3.43Å; N1622-C1625 PolarHBondContact O-N 2.84Å; D1623-C1625 PolarHBondContact O-N 2.84Å; C1625-E1627 PolarHBondContact O-N 2.82Å; C1625-E1627 VanDerWaalsContact O-N 3.16Å; C1625-C1632 HydrophobicContact CB-CB 3.93Å; C1625-C1632 WeakPolarHBondContact CB-SG 3.36Å; C1625-C1632 WeakPolarHBondContact SG-CB 3.25Å; C1625-C1632 CovalentContact SG-SG 2.07Å; C1625-C1632 PolarHBondContact SG-SG 2.75Å; C1625-I1669 HydrophobicContact CB-CG2 3.7Å; C1625-H2149 VanDerWaalsContact C-C 3.5Å; C1625-H2149 CarbonylContact C-O 3.59Å; C1625-H2149 VanDerWaalsContact C-O 3.31Å; C1625-H2149 WeakPolarHBondContact CA-O 3.43Å; C1625-H2149 WeakPolarHBondContact CB-O 3.36Å; C1625-H2149 CarbonylContact O-C 3.53Å; C1625-H2149 WeakPolarHBondContact O-CA 3.43Å; C1625-M2150 HydrophobicContact CB-CB 3.97Å; C1625-M2150 CarbonylContact O-C 3.58Å; C1625-M2150 WeakPolarHBondContact O-CA 3.38Å; C1625-M2150 PolarHBondContact O-N 2.82Å; C1625-S2151 PolarHBondContact O-N 2.85Å
1626	S	50	Low	64.7	Low	27 Å²	27	22.3 Å²	22.3	19%	0.189	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-50.8	-46.1	-178.8	-161.1	0	0	0	0	116.2	D1623 K1624 S1628 T2152	D1623-S1626 WeakPolarHBondContact O-CA 3.04Å; D1623-S1626 WeakPolarHBondContact O-CB 3.4Å; D1623-S1626 PolarHBondContact O-N 2.84Å; D1623-S1626 VanDerWaalsContact OD1-CB 3.29Å; D1623-S1626 WeakPolarHBondContact OD1-CB 3.12Å; K1624-S1626 PolarHBondContact O-N 2.58Å; S1626-S1628 VanDerWaalsContact C-N 3.3Å; S1626-S1628 PolarHBondContact O-N 2.73Å; S1626-T2152 WeakPolarHBondContact OG-CG2 3.44Å; S1626-T2152 PolarHBondContact OG-N 2.83Å
1627	E	49.6	Very low	65.3	Low	117 Å²	117	24 Å²	24	55%	0.547	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-64.8	-7.5	-150.8	-97.7	165.4	-175.9	0	0	118.1	C1625 D2147 S2148	C1625-E1627 PolarHBondContact O-N 2.82Å; C1625-E1627 VanDerWaalsContact O-N 3.16Å; E1627-D2147 PolarHBondContact OE2-N 3.49Å; E1627-S2148 PolarHBondContact OE2-N 3Å
1628	S	41.4	Very low	65.5	Low	12 Å²	12	24 Å²	24	8%	0.084	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-163.3	20.9	178.7	41.7	0	0	0	0	118.4	S1626 S2148 H2149	S1626-S1628 VanDerWaalsContact C-N 3.3Å; S1626-S1628 PolarHBondContact O-N 2.73Å; S1628-S2148 WeakPolarHBondContact OG-CB 3.2Å; S1628-H2149 WeakPolarHBondContact CB-ND1 3.3Å; S1628-H2149 PolarHBondContact O-ND1 3.02Å; S1628-H2149 WeakPolarHBondContact OG-CA 3.46Å; S1628-H2149 PolarHBondContact OG-CD2 2.84Å; S1628-H2149 PolarHBondContact OG-CE1 2.9Å; S1628-H2149 PolarHBondContact OG-N 2.91Å; S1628-H2149 PolarHBondContact OG-ND1 2.93Å; S1628-H2149 PolarHBondContact OG-NE2 3.5Å
1629	G	46	Very low	65.3	Low	15 Å²	15	25.1 Å²	25.1	16%	0.155	13%	0.13	C	C	.	.			trans	76.8	25	152.4	0	0	0	0	0	122.7	H1763	G1629-H1763 VanDerWaalsContact O-CB 3.23Å; G1629-H1763 WeakPolarHBondContact O-CB 3.22Å
1630	L	54.1	Low	64.5	Low	37 Å²	37	25.2 Å²	25.2	19%	0.194	13%	0.13	C	C	.	.	S	Bend	trans	-84.3	-142	163.6	-70.7	156.2	0	0	0	111.3	I1761 H1763 H2149 M2150	L1630-I1761 HydrophobicContact CD2-CG2 4.49Å; L1630-H1763 WeakPolarHBondContact CD2-CD2 3.22Å; L1630-H2149 HydrophobicContact CB-CB 4.07Å; L1630-H2149 HydrophobicContact CD1-CB 3.94Å; L1630-H2149 HydrophobicContact CG-CB 4.3Å; L1630-M2150 HydrophobicContact CB-CE 3.33Å; L1630-M2150 HydrophobicContact CB-CG 3.44Å; L1630-M2150 VanDerWaalsContact CB-CG 3.44Å; L1630-M2150 HydrophobicContact CB-SD 4.11Å; L1630-M2150 HydrophobicContact CD1-CE 4.05Å; L1630-M2150 HydrophobicContact CG-CE 4.23Å; L1630-M2150 WeakPolarHBondContact O-CA 3.33Å
1631	V	62.4	Low	63.7	Low	49 Å²	49	25 Å²	25	30%	0.297	13%	0.13	S	C	.	.			trans	-142.4	107	-178.9	165.8	0	0	0	0	112.1	R1633 L1668 K1670 M2150	V1631-R1633 PolarHBondContact O-N 3.23Å; V1631-L1668 HydrophobicContact CB-CD2 4.12Å; V1631-L1668 HydrophobicContact CG1-CD1 3.62Å; V1631-L1668 HydrophobicContact CG1-CD2 3.25Å; V1631-L1668 HydrophobicContact CG1-CG 4.09Å; V1631-L1668 VanDerWaalsContact O-CD2 3.31Å; V1631-L1668 WeakPolarHBondContact O-CD2 3.4Å; V1631-K1670 HydrophobicContact CB-CG 4.48Å; V1631-K1670 HydrophobicContact CG1-CD 4.3Å; V1631-K1670 VanDerWaalsContact CG1-CE 3.45Å; V1631-K1670 HydrophobicContact CG1-CG 3.96Å; V1631-K1670 HydrophobicContact CG2-CD 4.48Å; V1631-K1670 HydrophobicContact CG2-CG 4.17Å; V1631-M2150 WeakPolarHBondContact O-CE 3.37Å
1632	C	67.4	Low	62.6	Low	4 Å²	4	27.7 Å²	27.7	3%	0.027	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	83.3	-157	-118.2	0	0	0	0	117.6	C1625 L1668 I1669 M2150	C1625-C1632 HydrophobicContact CB-CB 3.93Å; C1625-C1632 WeakPolarHBondContact CB-SG 3.36Å; C1625-C1632 WeakPolarHBondContact SG-CB 3.25Å; C1625-C1632 CovalentContact SG-SG 2.07Å; C1625-C1632 PolarHBondContact SG-SG 2.75Å; C1632-L1668 VanDerWaalsContact O-CA 3.25Å; C1632-L1668 WeakPolarHBondContact O-CA 3.22Å; C1632-L1668 WeakPolarHBondContact O-CD2 3.33Å; C1632-I1669 HydrophobicContact CB-CB 3.54Å; C1632-I1669 HydrophobicContact CB-CD1 4.25Å; C1632-I1669 HydrophobicContact CB-CG1 4.28Å; C1632-I1669 HydrophobicContact CB-CG2 4.14Å; C1632-I1669 PolarHBondContact N-O 3.23Å; C1632-I1669 PolarHBondContact O-N 3.06Å; C1632-M2150 WeakPolarHBondContact CA-SD 3.45Å; C1632-M2150 HydrophobicContact CB-CB 3.32Å; C1632-M2150 HydrophobicContact CB-CG 3.92Å; C1632-M2150 HydrophobicContact CB-SD 3.7Å; C1632-M2150 PolarHBondContact N-SD 3.08Å; C1632-M2150 WeakPolarHBondContact SG-CB 3.48Å; C1632-M2150 VanDerWaalsContact SG-SD 3.6Å
1633	R	72.1	Confident	61.7	Low	89 Å²	89	31.1 Å²	31.1	34%	0.336	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129	-156.9	-149.3	151.6	173.3	-148.5	-24.3	114	V1631 V1667 L1668 Y2339 L2340	V1631-R1633 PolarHBondContact O-N 3.23Å; R1633-V1667 CarbonylContact C-O 3.09Å; R1633-V1667 WeakPolarHBondContact CA-O 3.45Å; R1633-L1668 HydrophobicContact CB-CD2 3.72Å; R1633-L1668 HydrophobicContact CB-CG 3.92Å; R1633-L1668 HydrophobicContact CG-CD1 4.01Å; R1633-L1668 HydrophobicContact CG-CD2 4Å; R1633-L1668 HydrophobicContact CG-CG 3.66Å; R1633-Y2339 HydrophobicContact CB-CD1 3.83Å; R1633-Y2339 HydrophobicContact CB-CD2 3.8Å; R1633-Y2339 HydrophobicContact CB-CE1 3.9Å; R1633-Y2339 HydrophobicContact CB-CE2 3.88Å; R1633-Y2339 HydrophobicContact CB-CG 3.77Å; R1633-Y2339 VanDerWaalsContact CD-CD2 3.45Å; R1633-Y2339 VanDerWaalsContact CG-C 3.47Å; R1633-Y2339 VanDerWaalsContact CG-CB 3.42Å; R1633-Y2339 HydrophobicContact CG-CD1 3.79Å; R1633-Y2339 HydrophobicContact CG-CD2 3.58Å; R1633-Y2339 HydrophobicContact CG-CE1 4.37Å; R1633-Y2339 HydrophobicContact CG-CE2 4.19Å; R1633-Y2339 HydrophobicContact CG-CG 3.33Å; R1633-Y2339 VanDerWaalsContact NE-CB 3.35Å; R1633-Y2339 PolarHBondContact NE-O 3.45Å; R1633-Y2339 PolarHBondContact NH2-O 3.49Å; R1633-Y2339 VanDerWaalsContact O-CE1 3.28Å; R1633-Y2339 WeakPolarHBondContact O-CE1 3.33Å; R1633-L2340 VanDerWaalsContact CG-N 3.29Å; R1633-L2340 VanDerWaalsContact CZ-CD1 3.42Å
1634	V	72.9	Confident	60.7	Low	8 Å²	8	31.3 Å²	31.3	5%	0.048	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	-179.3	-173.7	-177.4	0	0	0	0	108.4	I1593 L1611 V1667 L2340	I1593-V1634 HydrophobicContact CG2-CG1 3.58Å; L1611-V1634 HydrophobicContact CB-CG1 4.22Å; L1611-V1634 HydrophobicContact CB-CG2 4.33Å; L1611-V1634 HydrophobicContact CD2-CB 4.41Å; L1611-V1634 HydrophobicContact CD2-CG1 3.73Å; V1634-V1667 CarbonylContact C-O 3.54Å; V1634-V1667 HydrophobicContact CB-CB 3.78Å; V1634-V1667 HydrophobicContact CB-CG1 3.98Å; V1634-V1667 HydrophobicContact CG1-CB 4.23Å; V1634-V1667 HydrophobicContact CG1-CG1 4.48Å; V1634-V1667 PolarHBondContact N-O 3.01Å; V1634-V1667 CarbonylContact O-C 3.56Å; V1634-V1667 VanDerWaalsContact O-CA 3.29Å; V1634-V1667 WeakPolarHBondContact O-CA 3.25Å; V1634-V1667 PolarHBondContact O-N 3.38Å; V1634-L2340 PolarHBondContact O-N 2.89Å
1635	T	72.7	Confident	59.5	Low	11 Å²	11	37.6 Å²	37.6	7%	0.067	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	160.4	175.3	16.7	0	0	0	0	112.6	I1593 L1594 D1666	I1593-T1635 WeakPolarHBondContact CA-O 3.04Å; I1593-T1635 WeakPolarHBondContact CG2-O 3.47Å; L1594-T1635 WeakPolarHBondContact CB-OG1 3.24Å; L1594-T1635 PolarHBondContact N-O 2.96Å; L1594-T1635 PolarHBondContact O-N 2.84Å; L1594-T1635 VanDerWaalsContact O-N 3.14Å; L1594-T1635 PolarHBondContact O-OG1 2.85Å; T1635-D1666 WeakPolarHBondContact CG2-OD1 3.09Å
1636	L	75.6	Confident	58.5	Low	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	155.6	-175.8	-157.6	81.5	0	0	0	112.1	L1577 Y1591 K1592 I1593 V1613 L1619 I1638 L1665 V1667	L1577-L1636 HydrophobicContact CD1-CD2 3.41Å; L1577-L1636 VanDerWaalsContact CD1-CD2 3.41Å; Y1591-L1636 HydrophobicContact CD1-CD1 4.26Å; Y1591-L1636 HydrophobicContact CD1-CG 4.19Å; Y1591-L1636 HydrophobicContact CE1-CD1 3.42Å; Y1591-L1636 VanDerWaalsContact CE1-CD1 3.42Å; Y1591-L1636 HydrophobicContact CE1-CD2 3.56Å; Y1591-L1636 HydrophobicContact CE1-CG 3.31Å; Y1591-L1636 WeakPolarHBondContact OH-CD2 3.26Å; K1592-L1636 WeakPolarHBondContact O-CA 3.49Å; K1592-L1636 WeakPolarHBondContact O-CD1 3.43Å; I1593-L1636 HydrophobicContact CG1-CD1 4.28Å; V1613-L1636 HydrophobicContact CG1-CD1 3.98Å; V1613-L1636 HydrophobicContact CG2-CD1 3.89Å; L1619-L1636 HydrophobicContact CD1-CD1 3.8Å; L1619-L1636 HydrophobicContact CD1-CD2 3.7Å; L1619-L1636 HydrophobicContact CD1-CG 4.36Å; L1619-L1636 HydrophobicContact CD2-CB 4.49Å; L1619-L1636 HydrophobicContact CD2-CD1 4.05Å; L1619-L1636 HydrophobicContact CD2-CD2 3.6Å; L1619-L1636 HydrophobicContact CD2-CG 4.25Å; L1619-L1636 HydrophobicContact CG-CD2 4.37Å; L1636-I1638 HydrophobicContact CD2-CD1 4.31Å; L1636-I1638 HydrophobicContact CD2-CG1 4.4Å; L1636-L1665 VanDerWaalsContact CA-O 3.27Å; L1636-L1665 WeakPolarHBondContact CA-O 3.28Å; L1636-L1665 HydrophobicContact CB-CB 3.88Å; L1636-L1665 WeakPolarHBondContact CB-O 3.43Å; L1636-L1665 HydrophobicContact CD2-CB 3.82Å; L1636-L1665 HydrophobicContact CD2-CD1 4.2Å; L1636-L1665 HydrophobicContact CG-CB 4.44Å; L1636-L1665 PolarHBondContact N-O 3.22Å; L1636-L1665 PolarHBondContact O-N 3.41Å; L1636-V1667 HydrophobicContact CB-CG2 3.73Å
1637	Q	76.2	Confident	57.6	Low	36 Å²	36	49.6 Å²	49.6	17%	0.168	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	120.4	-173.8	177	-172.9	10.4	0	0	113	Y1591 K1592 L1594 Q1639 T1662 I1664	Y1591-Q1637 WeakPolarHBondContact CA-O 3.36Å; Y1591-Q1637 WeakPolarHBondContact CD1-O 3.36Å; K1592-Q1637 HydrophobicContact CB-CB 4.26Å; K1592-Q1637 PolarHBondContact N-O 2.94Å; K1592-Q1637 PolarHBondContact O-N 3.07Å; L1594-Q1637 HydrophobicContact CD1-CB 4.2Å; Q1637-Q1639 HydrophobicContact CG-CG 3.81Å; Q1637-T1662 HydrophobicContact CG-CG2 4.36Å; Q1637-I1664 HydrophobicContact CG-CG1 4.32Å
1638	I	75.1	Confident	56.7	Low	1 Å²	1	51.6 Å²	51.6	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	108.5	-170.2	-50.6	-171.3	0	0	0	110.9	L1555 L1557 L1577 Y1591 L1636 T1662 L1663 L1665 S2293 P2294 I2295	L1555-I1638 HydrophobicContact CD2-CG2 3.75Å; L1557-I1638 HydrophobicContact CD2-CD1 4.31Å; L1577-I1638 HydrophobicContact CB-CD1 4.05Å; L1577-I1638 HydrophobicContact CD1-CD1 4.03Å; Y1591-I1638 HydrophobicContact CE1-CG1 4.34Å; L1636-I1638 HydrophobicContact CD2-CD1 4.31Å; L1636-I1638 HydrophobicContact CD2-CG1 4.4Å; I1638-T1662 CarbonylContact O-C 3.36Å; I1638-T1662 WeakPolarHBondContact O-CA 3.41Å; I1638-L1663 HydrophobicContact CB-CB 4.16Å; I1638-L1663 WeakPolarHBondContact CB-O 3.38Å; I1638-L1663 HydrophobicContact CD1-CD2 4.29Å; I1638-L1663 WeakPolarHBondContact CG1-O 3.24Å; I1638-L1663 PolarHBondContact N-O 3.02Å; I1638-L1663 PolarHBondContact O-N 3.2Å; I1638-L1665 HydrophobicContact CD1-CB 4.3Å; I1638-L1665 HydrophobicContact CD1-CD1 3.26Å; I1638-L1665 HydrophobicContact CD1-CG 3.6Å; I1638-L1665 HydrophobicContact CG1-CD1 4.3Å; I1638-L1665 HydrophobicContact CG1-CG 4.18Å; I1638-S2293 CarbonylContact C-O 3.52Å; I1638-S2293 WeakPolarHBondContact CA-O 3.13Å; I1638-S2293 WeakPolarHBondContact CB-O 3.45Å; I1638-S2293 WeakPolarHBondContact CG2-O 3.44Å; I1638-P2294 VanDerWaalsContact CA-O 3.32Å; I1638-P2294 WeakPolarHBondContact CA-O 3.41Å; I1638-P2294 WeakPolarHBondContact CG1-O 3.41Å; I1638-I2295 HydrophobicContact CD1-CG2 4.13Å; I1638-I2295 HydrophobicContact CG2-CG2 3.62Å
1639	Q	71.5	Confident	56.1	Low	23 Å²	23	55 Å²	55	11%	0.107	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	33.7	-155.4	-50.6	179.7	-135.5	0	0	120.8	Q1590 Q1637 M1641 I1660 Q1661 T1662 D2292 S2293	Q1590-Q1639 HydrophobicContact CB-CB 4.16Å; Q1590-Q1639 WeakPolarHBondContact O-CG 3.15Å; Q1590-Q1639 PolarHBondContact O-N 2.86Å; Q1637-Q1639 HydrophobicContact CG-CG 3.81Å; Q1639-M1641 HydrophobicContact CB-CE 3.7Å; Q1639-M1641 VanDerWaalsContact O-CE 3.23Å; Q1639-M1641 WeakPolarHBondContact O-CE 3.32Å; Q1639-M1641 WeakPolarHBondContact O-CG 3.48Å; Q1639-I1660 VanDerWaalsContact O-CG2 3.31Å; Q1639-I1660 WeakPolarHBondContact O-CG2 3.19Å; Q1639-Q1661 CarbonylContact C-O 3.54Å; Q1639-T1662 HydrophobicContact CG-CG2 4.4Å; Q1639-D2292 CarbonylContact C-O 3.56Å; Q1639-S2293 PolarHBondContact N-O 3.17Å
1640	S	62.7	Low	55.5	Low	1 Å²	1	59.4 Å²	59.4	1%	0.007	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	131.6	-158.8	-162.3	0	0	0	0	118.6	I1588 I1660 Q1661 S2293	I1588-S1640 WeakPolarHBondContact O-CA 3.45Å; I1588-S1640 PolarHBondContact O-OG 2.76Å; I1588-S1640 VanDerWaalsContact O-OG 3.08Å; S1640-I1660 CarbonylContact O-C 3.5Å; S1640-I1660 WeakPolarHBondContact O-CA 3.35Å; S1640-Q1661 PolarHBondContact N-O 2.75Å; S1640-Q1661 PolarHBondContact O-N 2.85Å; S1640-S2293 WeakPolarHBondContact CA-OG 3.49Å; S1640-S2293 VanDerWaalsContact CB-CB 3.43Å; S1640-S2293 WeakPolarHBondContact CB-OG 3.22Å; S1640-S2293 PolarHBondContact OG-OG 2.96Å; S1640-S2293 VanDerWaalsContact OG-OG 3.13Å
1641	M	61.3	Low	54.6	Low	13 Å²	13	61.8 Å²	61.8	6%	0.064	34%	0.342	C	S	.	.			trans	-137.4	110.8	-173	-24.4	178.4	-177.5	0	0	112.7	I1588 Q1590 Q1639 N1643 I1660 D2292 N2324	I1588-M1641 VanDerWaalsContact CG1-O 3.23Å; I1588-M1641 WeakPolarHBondContact CG1-O 3.31Å; Q1590-M1641 HydrophobicContact CB-CE 4.24Å; Q1639-M1641 HydrophobicContact CB-CE 3.7Å; Q1639-M1641 VanDerWaalsContact O-CE 3.23Å; Q1639-M1641 WeakPolarHBondContact O-CE 3.32Å; Q1639-M1641 WeakPolarHBondContact O-CG 3.48Å; M1641-N1643 PolarHBondContact O-N 3.46Å; M1641-I1660 HydrophobicContact CB-CD1 4.41Å; M1641-I1660 HydrophobicContact CB-CG1 3.92Å; M1641-I1660 HydrophobicContact CE-CD1 4.13Å; M1641-I1660 HydrophobicContact CE-CG2 4.44Å; M1641-I1660 HydrophobicContact CG-CB 4.44Å; M1641-I1660 HydrophobicContact CG-CD1 3.9Å; M1641-I1660 HydrophobicContact CG-CG1 3.73Å; M1641-I1660 HydrophobicContact CG-CG2 4.18Å; M1641-I1660 HydrophobicContact SD-CD1 3.57Å; M1641-I1660 VanDerWaalsContact SD-CD1 3.57Å; M1641-I1660 HydrophobicContact SD-CG1 4.12Å; M1641-D2292 WeakPolarHBondContact CA-OD2 3.26Å; M1641-D2292 HydrophobicContact CB-CB 4.41Å; M1641-D2292 VanDerWaalsContact CB-CG 3.4Å; M1641-D2292 WeakPolarHBondContact CB-OD2 3.34Å; M1641-D2292 HydrophobicContact CE-CB 4.26Å; M1641-D2292 WeakPolarHBondContact CE-O 3.31Å; M1641-D2292 HydrophobicContact CG-CB 3.9Å; M1641-D2292 VanDerWaalsContact CG-CG 3.41Å; M1641-D2292 VanDerWaalsContact CG-OD2 3.31Å; M1641-D2292 WeakPolarHBondContact CG-OD2 3.41Å; M1641-D2292 PolarHBondContact N-OD2 3.3Å; M1641-D2292 HydrophobicContact SD-CB 4Å; M1641-N2324 HydrophobicContact CE-CB 4.08Å; M1641-N2324 HydrophobicContact SD-CB 3.93Å; M1641-N2324 PolarHBondContact SD-ND2 3.41Å
1642	P	51.5	Low	53	Low	55 Å²	55	64.7 Å²	64.7	36%	0.357	36%	0.36	S	S	.	.			trans	-59.7	125.6	-176.9	21.4	-31.5	0	0	0	114	G1644 L1659	P1642-G1644 PolarHBondContact O-N 2.84Å; P1642-L1659 WeakPolarHBondContact CD-O 3.36Å; P1642-L1659 HydrophobicContact CG-CB 3.56Å; P1642-L1659 HydrophobicContact CG-CD1 3.89Å; P1642-L1659 HydrophobicContact CG-CG 4.2Å
1643	N	47	Very low	51.4	Low	87 Å²	87	69.3 Å²	69.3	47%	0.465	38%	0.381	S	S	.	.			trans	-59.1	112.1	-171.2	-159.5	-14.2	0	0	0	111.7	D1586 I1588 M1641 N1645	D1586-N1643 HydrophobicContact CB-CB 4.38Å; D1586-N1643 WeakPolarHBondContact O-CB 3.25Å; D1586-N1643 PolarHBondContact O-N 3.43Å; I1588-N1643 HydrophobicContact CD1-CB 3.56Å; I1588-N1643 HydrophobicContact CG1-CB 4.19Å; M1641-N1643 PolarHBondContact O-N 3.46Å; N1643-N1645 PolarHBondContact O-N 2.88Å
1644	G	44.5	Very low	49.6	Very low	65 Å²	65	70.7 Å²	70.7	67%	0.67	40%	0.395	S	S	*	.			trans	-77.1	107.4	-161.9	0	0	0	0	0	115.1	P1642	P1642-G1644 PolarHBondContact O-N 2.84Å
1645	N	36.3	Very low	47.9	Very low	140 Å²	140	74 Å²	74	75%	0.749	41%	0.409	S	S	*	.			trans	-151.2	142.6	159.5	-111.3	-51.1	0	0	0	114.1	N1643	N1643-N1645 PolarHBondContact O-N 2.88Å
1646	L	39	Very low	46.3	Very low	151 Å²	151	80.1 Å²	80.1	79%	0.791	44%	0.441	S	S	*	.			trans	50.5	66	173.1	-70.2	81.1	0	0	0	115.1
1647	V	31.2	Very low	44.6	Very low	128 Å²	128	85.5 Å²	85.5	78%	0.776	47%	0.47	S	S	*	.				48	92.7	70.6	-171.6	0	0	0	0	113.3
1648	N	29.2	Very low	43.1	Very low	158 Å²	158	87.3 Å²	87.3	85%	0.845	49%	0.486	S	S	*	.			trans	-164.8	110.1	145.4	-110.9	-47.8	0	0	0	115.2
1649	S	30.3	Very low	41.8	Very low	84 Å²	84	91.6 Å²	91.6	59%	0.587	51%	0.509	S	S	*	.	S	Bend	trans	70.5	137	170.6	105	0	0	0	0	116.1
1650	K	32.7	Very low	40.7	Very low	108 Å²	108	92.2 Å²	92.2	47%	0.47	51%	0.512	S	S	.	.	S	Bend	cis	-156.7	23.5	-3.7	-144.3	-162.1	173.7	178.8	0	115.1	N2433	K1650-N2433 PolarHBondContact NZ-OD1 3.19Å
1651	Y	34.8	Very low	40.3	Very low	87 Å²	87	94.9 Å²	94.9	34%	0.341	53%	0.525	S	S	.	.			trans	-135.3	145.5	-173.6	-57.8	-116.3	0	0	0	107.8	F1655 I2456 S2457 P2458 R2459	Y1651-F1655 WeakPolarHBondContact O-CE2 3.42Å; Y1651-I2456 HydrophobicContact CD1-CG2 4.16Å; Y1651-I2456 HydrophobicContact CG-CG2 4.41Å; Y1651-S2457 WeakPolarHBondContact CB-O 3.26Å; Y1651-S2457 WeakPolarHBondContact CD1-O 3.42Å; Y1651-P2458 PolarHBondContact OH-O 3.23Å; Y1651-R2459 HydrophobicContact CE2-CB 4.04Å; Y1651-R2459 HydrophobicContact CE2-CG 3.64Å
1652	T	29.3	Very low	40.1	Very low	110 Å²	110	97.4 Å²	97.4	68%	0.675	54%	0.541	S	S	*	.			trans	-151.6	81.4	-159.9	51.3	0	0	0	0	110.6	I2456	T1652-I2456 VanDerWaalsContact N-CG2 3.33Å
1653	H	33.7	Very low	40.7	Very low	100 Å²	100	95.1 Å²	95.1	46%	0.463	53%	0.526	S	S	.	.	S	Bend	trans	-131.9	92	168	-119	-118.2	0	0	0	109.1	F1655 Q2454 R2455 I2456	H1653-F1655 VanDerWaalsContact C-N 3.34Å; H1653-F1655 PolarHBondContact O-N 2.98Å; H1653-F1655 VanDerWaalsContact O-N 3.15Å; H1653-Q2454 PolarHBondContact CE1-O 3.45Å; H1653-R2455 PolarHBondContact CD2-O 3.22Å; H1653-R2455 PolarHBondContact CE1-O 2.83Å; H1653-R2455 VanDerWaalsContact CE1-O 3.32Å; H1653-R2455 PolarHBondContact ND1-O 2.93Å; H1653-R2455 PolarHBondContact NE2-O 2.92Å; H1653-R2455 VanDerWaalsContact NE2-O 3.1Å; H1653-I2456 HydrophobicContact CB-CB 4.36Å
1654	N	34.3	Very low	41.7	Very low	118 Å²	118	94.5 Å²	94.5	63%	0.631	52%	0.521	S	S	*	.			trans	35.7	55.5	-179.4	-66.1	12.9	0	0	0	115	D1656 N1657 S1658	N1654-D1656 PolarHBondContact O-N 2.89Å; N1654-N1657 CarbonylContact O-C 3.58Å; N1654-N1657 PolarHBondContact O-N 3.06Å; N1654-S1658 WeakPolarHBondContact O-CB 3.44Å; N1654-S1658 PolarHBondContact O-N 3.48Å
1655	F	38.2	Very low	43	Very low	79 Å²	79	91.4 Å²	91.4	35%	0.346	49%	0.49	S	S	.	.	H	α-helix	trans	-57.4	-30.6	172	-82.1	-84.5	0	0	0	112	Y1651 H1653 N1657 S1658 L1659	Y1651-F1655 WeakPolarHBondContact O-CE2 3.42Å; H1653-F1655 VanDerWaalsContact C-N 3.34Å; H1653-F1655 PolarHBondContact O-N 2.98Å; H1653-F1655 VanDerWaalsContact O-N 3.15Å; F1655-N1657 PolarHBondContact O-N 3Å; F1655-S1658 WeakPolarHBondContact CA-OG 3.41Å; F1655-S1658 WeakPolarHBondContact CD1-OG 3.09Å; F1655-S1658 PolarHBondContact O-N 2.96Å; F1655-S1658 VanDerWaalsContact O-N 3.13Å; F1655-L1659 HydrophobicContact CD1-CD1 4.15Å; F1655-L1659 HydrophobicContact CD1-CG 4.43Å; F1655-L1659 PolarHBondContact O-N 3.39Å
1656	D	38.2	Very low	44.9	Very low	138 Å²	138	86 Å²	86	74%	0.738	46%	0.461	S	S	*	.	H	α-helix	trans	-49.9	-25.5	168.9	-43.6	-4.4	0	0	0	113.7	N1654 I1660	N1654-D1656 PolarHBondContact O-N 2.89Å; D1656-I1660 WeakPolarHBondContact O-CD1 3.44Å; D1656-I1660 WeakPolarHBondContact O-CG1 3.21Å
1657	N	40	Very low	46.6	Very low	113 Å²	113	78.8 Å²	78.8	60%	0.604	42%	0.423	S	S	*	.	H	α-helix	trans	-116.4	-23.4	170.3	-85.6	9.2	0	0	0	113.6	N1654 F1655 L1659 I1660	N1654-N1657 CarbonylContact O-C 3.58Å; N1654-N1657 PolarHBondContact O-N 3.06Å; F1655-N1657 PolarHBondContact O-N 3Å; N1657-L1659 PolarHBondContact O-N 3.22Å; N1657-I1660 VanDerWaalsContact O-CB 3.29Å; N1657-I1660 WeakPolarHBondContact O-CB 3.46Å; N1657-I1660 PolarHBondContact O-N 2.82Å; N1657-I1660 VanDerWaalsContact O-N 3.13Å
1658	S	45	Very low	49	Very low	74 Å²	74	72.7 Å²	72.7	52%	0.517	39%	0.386	S	S	.	.	H	α-helix	trans	-80.5	-17.2	-171.2	89	0	0	0	0	114.2	N1654 F1655	N1654-S1658 WeakPolarHBondContact O-CB 3.44Å; N1654-S1658 PolarHBondContact O-N 3.48Å; F1655-S1658 WeakPolarHBondContact CA-OG 3.41Å; F1655-S1658 WeakPolarHBondContact CD1-OG 3.09Å; F1655-S1658 PolarHBondContact O-N 2.96Å; F1655-S1658 VanDerWaalsContact O-N 3.13Å
1659	L	46.4	Very low	51.3	Low	92 Å²	92	65.2 Å²	65.2	48%	0.482	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	1.5	166.9	-73.4	163.9	0	0	0	112	P1642 F1655 N1657 Q1661	P1642-L1659 WeakPolarHBondContact CD-O 3.36Å; P1642-L1659 HydrophobicContact CG-CB 3.56Å; P1642-L1659 HydrophobicContact CG-CD1 3.89Å; P1642-L1659 HydrophobicContact CG-CG 4.2Å; F1655-L1659 HydrophobicContact CD1-CD1 4.15Å; F1655-L1659 HydrophobicContact CD1-CG 4.43Å; F1655-L1659 PolarHBondContact O-N 3.39Å; N1657-L1659 PolarHBondContact O-N 3.22Å; L1659-Q1661 PolarHBondContact O-N 3.2Å
1660	I	49.1	Very low	53.3	Low	35 Å²	35	61.6 Å²	61.6	18%	0.179	32%	0.32	C	S	.	.			trans	-72.9	93.6	172.2	-61.5	-169.3	0	0	0	108.8	Q1639 S1640 M1641 D1656 N1657 T1662	Q1639-I1660 VanDerWaalsContact O-CG2 3.31Å; Q1639-I1660 WeakPolarHBondContact O-CG2 3.19Å; S1640-I1660 CarbonylContact O-C 3.5Å; S1640-I1660 WeakPolarHBondContact O-CA 3.35Å; M1641-I1660 HydrophobicContact CB-CD1 4.41Å; M1641-I1660 HydrophobicContact CB-CG1 3.92Å; M1641-I1660 HydrophobicContact CE-CD1 4.13Å; M1641-I1660 HydrophobicContact CE-CG2 4.44Å; M1641-I1660 HydrophobicContact CG-CB 4.44Å; M1641-I1660 HydrophobicContact CG-CD1 3.9Å; M1641-I1660 HydrophobicContact CG-CG1 3.73Å; M1641-I1660 HydrophobicContact CG-CG2 4.18Å; M1641-I1660 HydrophobicContact SD-CD1 3.57Å; M1641-I1660 VanDerWaalsContact SD-CD1 3.57Å; M1641-I1660 HydrophobicContact SD-CG1 4.12Å; D1656-I1660 WeakPolarHBondContact O-CD1 3.44Å; D1656-I1660 WeakPolarHBondContact O-CG1 3.21Å; N1657-I1660 VanDerWaalsContact O-CB 3.29Å; N1657-I1660 WeakPolarHBondContact O-CB 3.46Å; N1657-I1660 PolarHBondContact O-N 2.82Å; N1657-I1660 VanDerWaalsContact O-N 3.13Å; I1660-T1662 VanDerWaalsContact C-N 3.32Å; I1660-T1662 VanDerWaalsContact CG2-OG1 3.28Å; I1660-T1662 WeakPolarHBondContact CG2-OG1 2.9Å; I1660-T1662 PolarHBondContact O-N 2.79Å
1661	Q	53.9	Low	55.1	Low	58 Å²	58	57.2 Å²	57.2	27%	0.271	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	87.8	171.8	-56.6	-172.6	-41.4	0	0	107.9	S1553 L1555 Q1639 S1640 L1659	S1553-Q1661 PolarHBondContact O-NE2 2.81Å; L1555-Q1661 HydrophobicContact CB-CB 3.56Å; L1555-Q1661 HydrophobicContact CB-CG 4.41Å; L1555-Q1661 HydrophobicContact CD2-CB 4.31Å; L1555-Q1661 WeakPolarHBondContact CD2-O 3.46Å; L1555-Q1661 HydrophobicContact CG-CB 4.41Å; Q1639-Q1661 CarbonylContact C-O 3.54Å; S1640-Q1661 PolarHBondContact N-O 2.75Å; S1640-Q1661 PolarHBondContact O-N 2.85Å; L1659-Q1661 PolarHBondContact O-N 3.2Å
1662	T	57	Low	56.7	Low	65 Å²	65	53.2 Å²	53.2	40%	0.399	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	122.8	173.4	-60.1	0	0	0	0	111.4	Q1637 I1638 Q1639 I1660 I1664	Q1637-T1662 HydrophobicContact CG-CG2 4.36Å; I1638-T1662 CarbonylContact O-C 3.36Å; I1638-T1662 WeakPolarHBondContact O-CA 3.41Å; Q1639-T1662 HydrophobicContact CG-CG2 4.4Å; I1660-T1662 VanDerWaalsContact C-N 3.32Å; I1660-T1662 VanDerWaalsContact CG2-OG1 3.28Å; I1660-T1662 WeakPolarHBondContact CG2-OG1 2.9Å; I1660-T1662 PolarHBondContact O-N 2.79Å; T1662-I1664 HydrophobicContact CG2-CG1 4.07Å
1663	L	64.7	Low	58.4	Low	7 Å²	7	48.9 Å²	48.9	4%	0.037	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	100.2	170.8	175	68.4	0	0	0	108.6	L1555 L1557 E1563 I1638 L1665	L1555-L1663 HydrophobicContact CD2-CB 3.86Å; L1555-L1663 WeakPolarHBondContact O-CD2 3.31Å; L1557-L1663 HydrophobicContact CD1-CD2 4.27Å; L1557-L1663 HydrophobicContact CD2-CD2 3.2Å; L1557-L1663 HydrophobicContact CG-CD2 3.66Å; E1563-L1663 HydrophobicContact CG-CD1 3.76Å; I1638-L1663 HydrophobicContact CB-CB 4.16Å; I1638-L1663 WeakPolarHBondContact CB-O 3.38Å; I1638-L1663 HydrophobicContact CD1-CD2 4.29Å; I1638-L1663 WeakPolarHBondContact CG1-O 3.24Å; I1638-L1663 PolarHBondContact N-O 3.02Å; I1638-L1663 PolarHBondContact O-N 3.2Å; L1663-L1665 HydrophobicContact CD1-CD2 3.81Å; L1663-L1665 HydrophobicContact CD2-CD1 4.37Å; L1663-L1665 HydrophobicContact CD2-CD2 3.88Å; L1663-L1665 HydrophobicContact CD2-CG 4.12Å; L1663-L1665 HydrophobicContact CG-CD2 3.6Å; L1663-L1665 HydrophobicContact CG-CG 3.9Å
1664	I	68.4	Low	59	Low	74 Å²	74	47.8 Å²	47.8	38%	0.379	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	135.5	169	-66.9	-180	0	0	0	108	Q1565 Q1637 T1662	Q1565-I1664 PolarHBondContact OE1-O 2.85Å; Q1565-I1664 VanDerWaalsContact OE1-O 3.14Å; Q1637-I1664 HydrophobicContact CG-CG1 4.32Å; T1662-I1664 HydrophobicContact CG2-CG1 4.07Å
1665	L	72.5	Confident	59.8	Low	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	93	-169.2	-86	-147.5	0	0	0	107.6	L1557 P1564 I1567 L1577 L1636 I1638 L1663 V1667	L1557-L1665 HydrophobicContact CD1-CD1 3.5Å; L1557-L1665 VanDerWaalsContact CD1-CD1 3.5Å; L1557-L1665 HydrophobicContact CD1-CD2 4.16Å; L1557-L1665 HydrophobicContact CD1-CG 4.49Å; L1557-L1665 HydrophobicContact CD2-CD1 4.27Å; L1557-L1665 HydrophobicContact CG-CD1 4.43Å; P1564-L1665 WeakPolarHBondContact O-CD2 3.18Å; I1567-L1665 HydrophobicContact CD1-CB 3.49Å; I1567-L1665 VanDerWaalsContact CD1-CB 3.49Å; I1567-L1665 HydrophobicContact CD1-CD1 3.74Å; I1567-L1665 HydrophobicContact CD1-CD2 3.96Å; I1567-L1665 HydrophobicContact CD1-CG 3.92Å; I1567-L1665 HydrophobicContact CG1-CD2 4.3Å; L1577-L1665 HydrophobicContact CB-CD1 4.11Å; L1577-L1665 HydrophobicContact CD1-CD1 3.83Å; L1577-L1665 HydrophobicContact CD2-CD1 3.5Å; L1577-L1665 HydrophobicContact CG-CD1 3.95Å; L1636-L1665 VanDerWaalsContact CA-O 3.27Å; L1636-L1665 WeakPolarHBondContact CA-O 3.28Å; L1636-L1665 HydrophobicContact CB-CB 3.88Å; L1636-L1665 WeakPolarHBondContact CB-O 3.43Å; L1636-L1665 HydrophobicContact CD2-CB 3.82Å; L1636-L1665 HydrophobicContact CD2-CD1 4.2Å; L1636-L1665 HydrophobicContact CG-CB 4.44Å; L1636-L1665 PolarHBondContact N-O 3.22Å; L1636-L1665 PolarHBondContact O-N 3.41Å; I1638-L1665 HydrophobicContact CD1-CB 4.3Å; I1638-L1665 HydrophobicContact CD1-CD1 3.26Å; I1638-L1665 HydrophobicContact CD1-CG 3.6Å; I1638-L1665 HydrophobicContact CG1-CD1 4.3Å; I1638-L1665 HydrophobicContact CG1-CG 4.18Å; L1663-L1665 HydrophobicContact CD1-CD2 3.81Å; L1663-L1665 HydrophobicContact CD2-CD1 4.37Å; L1663-L1665 HydrophobicContact CD2-CD2 3.88Å; L1663-L1665 HydrophobicContact CD2-CG 4.12Å; L1663-L1665 HydrophobicContact CG-CD2 3.6Å; L1663-L1665 HydrophobicContact CG-CG 3.9Å; L1665-V1667 WeakPolarHBondContact O-CG2 3.47Å
1666	D	74.4	Confident	60.2	Low	26 Å²	26	44.1 Å²	44.1	14%	0.139	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.4	-175.4	-162.2	23	0	0	0	109.3	Q1565 Q1566 I1567 T1635 L2340 L2341	Q1565-D1666 WeakPolarHBondContact O-CB 3.43Å; Q1565-D1666 PolarHBondContact O-N 2.87Å; Q1566-D1666 HydrophobicContact CG-CB 4.06Å; Q1566-D1666 PolarHBondContact NE2-OD2 2.86Å; I1567-D1666 WeakPolarHBondContact CD1-O 3.43Å; I1567-D1666 WeakPolarHBondContact CG1-O 3.09Å; T1635-D1666 WeakPolarHBondContact CG2-OD1 3.09Å; D1666-L2340 CarbonylContact C-O 3.41Å; D1666-L2340 VanDerWaalsContact CA-O 3.3Å; D1666-L2340 WeakPolarHBondContact CA-O 3.39Å; D1666-L2340 WeakPolarHBondContact CB-O 3.26Å; D1666-L2340 CarbonylContact O-C 3.52Å; D1666-L2340 PolarHBondContact OD1-N 3.33Å; D1666-L2340 WeakPolarHBondContact OD2-CA 3.16Å; D1666-L2340 WeakPolarHBondContact OD2-CB 3.43Å; D1666-L2340 PolarHBondContact OD2-N 3.08Å; D1666-L2341 CarbonylContact O-C 3.57Å; D1666-L2341 VanDerWaalsContact O-C 3.27Å
1667	V	76.1	Confident	60.6	Low	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.5	-168.3	-172.6	0	0	0	0	118	I1567 L1611 L1619 R1633 V1634 L1636 L1665 L2340 L2341 N2342	I1567-V1667 HydrophobicContact CD1-CG2 4.43Å; L1611-V1667 HydrophobicContact CD1-CG1 3.51Å; L1611-V1667 HydrophobicContact CD2-CB 4.2Å; L1611-V1667 HydrophobicContact CD2-CG1 3.58Å; L1611-V1667 HydrophobicContact CD2-CG2 4.19Å; L1611-V1667 HydrophobicContact CG-CG1 4.1Å; L1619-V1667 HydrophobicContact CD2-CB 4.46Å; L1619-V1667 HydrophobicContact CD2-CG1 4.06Å; L1619-V1667 HydrophobicContact CD2-CG2 3.49Å; L1619-V1667 VanDerWaalsContact CD2-CG2 3.49Å; R1633-V1667 CarbonylContact C-O 3.09Å; R1633-V1667 WeakPolarHBondContact CA-O 3.45Å; V1634-V1667 CarbonylContact C-O 3.54Å; V1634-V1667 HydrophobicContact CB-CB 3.78Å; V1634-V1667 HydrophobicContact CB-CG1 3.98Å; V1634-V1667 HydrophobicContact CG1-CB 4.23Å; V1634-V1667 HydrophobicContact CG1-CG1 4.48Å; V1634-V1667 PolarHBondContact N-O 3.01Å; V1634-V1667 CarbonylContact O-C 3.56Å; V1634-V1667 VanDerWaalsContact O-CA 3.29Å; V1634-V1667 WeakPolarHBondContact O-CA 3.25Å; V1634-V1667 PolarHBondContact O-N 3.38Å; L1636-V1667 HydrophobicContact CB-CG2 3.73Å; L1665-V1667 WeakPolarHBondContact O-CG2 3.47Å; V1667-L2340 PolarHBondContact N-O 2.8Å; V1667-L2340 CarbonylContact O-C 3.54Å; V1667-L2340 VanDerWaalsContact O-C 3.26Å; V1667-L2340 WeakPolarHBondContact O-CA 3.34Å; V1667-L2340 PolarHBondContact O-N 3.01Å; V1667-L2341 PolarHBondContact O-N 2.86Å; V1667-N2342 HydrophobicContact CB-CB 4.27Å; V1667-N2342 HydrophobicContact CG1-CB 3.53Å; V1667-N2342 HydrophobicContact CG2-CB 4.09Å
1668	L	80.6	Confident	60.7	Low	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	146.1	-169.8	-96.6	165.2	0	0	0	113.8	L1569 V1631 C1632 R1633 L2340 L2341 N2342	L1569-L1668 CarbonylContact C-O 3.52Å; V1631-L1668 HydrophobicContact CB-CD2 4.12Å; V1631-L1668 HydrophobicContact CG1-CD1 3.62Å; V1631-L1668 HydrophobicContact CG1-CD2 3.25Å; V1631-L1668 HydrophobicContact CG1-CG 4.09Å; V1631-L1668 VanDerWaalsContact O-CD2 3.31Å; V1631-L1668 WeakPolarHBondContact O-CD2 3.4Å; C1632-L1668 VanDerWaalsContact O-CA 3.25Å; C1632-L1668 WeakPolarHBondContact O-CA 3.22Å; C1632-L1668 WeakPolarHBondContact O-CD2 3.33Å; R1633-L1668 HydrophobicContact CB-CD2 3.72Å; R1633-L1668 HydrophobicContact CB-CG 3.92Å; R1633-L1668 HydrophobicContact CG-CD1 4.01Å; R1633-L1668 HydrophobicContact CG-CD2 4Å; R1633-L1668 HydrophobicContact CG-CG 3.66Å; L1668-L2340 HydrophobicContact CD1-CB 4.04Å; L1668-L2340 HydrophobicContact CD1-CD2 3.51Å; L1668-L2340 HydrophobicContact CD1-CG 3.58Å; L1668-L2341 VanDerWaalsContact CA-CA 3.44Å; L1668-L2341 VanDerWaalsContact CA-N 3.31Å; L1668-L2341 HydrophobicContact CB-CB 4.16Å; L1668-L2341 HydrophobicContact CB-CD2 3.57Å; L1668-L2341 HydrophobicContact CB-CG 3.91Å; L1668-L2341 HydrophobicContact CD1-CD2 3.92Å; L1668-L2341 HydrophobicContact CD1-CG 4.06Å; L1668-L2341 HydrophobicContact CG-CD2 4.39Å; L1668-L2341 CarbonylContact O-C 3.49Å; L1668-N2342 CarbonylContact O-C 3.47Å; L1668-N2342 PolarHBondContact O-N 2.88Å
1669	I	76.9	Confident	60.7	Low	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	122.2	-176.7	-58.8	170.7	0	0	0	105	L1569 P1571 F1610 L1611 A1621 C1625 C1632 M2150	L1569-I1669 CarbonylContact O-C 3.57Å; L1569-I1669 VanDerWaalsContact O-C 3.31Å; L1569-I1669 WeakPolarHBondContact O-CA 3.4Å; P1571-I1669 HydrophobicContact CB-CG2 4.38Å; P1571-I1669 HydrophobicContact CG-CG2 3.31Å; F1610-I1669 HydrophobicContact CB-CD1 4.32Å; F1610-I1669 VanDerWaalsContact O-CD1 3.28Å; F1610-I1669 WeakPolarHBondContact O-CD1 3.16Å; L1611-I1669 HydrophobicContact CD1-CD1 4.42Å; A1621-I1669 HydrophobicContact CB-CB 4.45Å; A1621-I1669 HydrophobicContact CB-CD1 3.43Å; A1621-I1669 VanDerWaalsContact CB-CD1 3.43Å; A1621-I1669 HydrophobicContact CB-CG1 3.5Å; A1621-I1669 HydrophobicContact CB-CG2 4.17Å; C1625-I1669 HydrophobicContact CB-CG2 3.7Å; C1632-I1669 HydrophobicContact CB-CB 3.54Å; C1632-I1669 HydrophobicContact CB-CD1 4.25Å; C1632-I1669 HydrophobicContact CB-CG1 4.28Å; C1632-I1669 HydrophobicContact CB-CG2 4.14Å; C1632-I1669 PolarHBondContact N-O 3.23Å; C1632-I1669 PolarHBondContact O-N 3.06Å; I1669-M2150 CarbonylContact C-O 3.55Å
1670	K	73.6	Confident	60.7	Low	9 Å²	9	34.5 Å²	34.5	4%	0.039	18%	0.181	C	C	.	.			trans	-149.7	150.2	-165.1	-82.6	-155.9	171.8	-161.5	0	111.8	L1569 S1570 V1631 D1710 E1711 F1716 S2151 L2341	L1569-K1670 WeakPolarHBondContact O-CB 3.39Å; L1569-K1670 PolarHBondContact O-N 3.17Å; S1570-K1670 WeakPolarHBondContact CB-O 3.2Å; V1631-K1670 HydrophobicContact CB-CG 4.48Å; V1631-K1670 HydrophobicContact CG1-CD 4.3Å; V1631-K1670 VanDerWaalsContact CG1-CE 3.45Å; V1631-K1670 HydrophobicContact CG1-CG 3.96Å; V1631-K1670 HydrophobicContact CG2-CD 4.48Å; V1631-K1670 HydrophobicContact CG2-CG 4.17Å; K1670-D1710 HydrophobicContact CD-CB 3.84Å; K1670-D1710 WeakPolarHBondContact CD-OD2 3.39Å; K1670-D1710 IonicContact NZ-OD2 2.65Å; K1670-D1710 PolarHBondContact NZ-OD2 2.9Å; K1670-E1711 WeakPolarHBondContact CE-OE1 3.49Å; K1670-E1711 IonicContact NZ-OE1 3.04Å; K1670-E1711 PolarHBondContact NZ-OE1 2.9Å; K1670-F1716 HydrophobicContact CB-CE1 4.26Å; K1670-F1716 HydrophobicContact CB-CZ 3.83Å; K1670-F1716 WeakPolarHBondContact O-CE1 3.23Å; K1670-F1716 WeakPolarHBondContact O-CZ 3.05Å; K1670-S2151 CarbonylContact C-O 3.56Å; K1670-S2151 WeakPolarHBondContact CA-OG 3.47Å; K1670-L2341 HydrophobicContact CD-CD2 4.28Å; K1670-L2341 HydrophobicContact CG-CD2 4.49Å
1671	V	70.5	Confident	60.4	Low	16 Å²	16	36.6 Å²	36.6	10%	0.097	20%	0.199	C	C	.	.			trans	-77.8	136.4	169.1	-107.3	0	0	0	0	110.8	R1673 F1723 S2151 T2152	V1671-R1673 PolarHBondContact O-N 3.02Å; V1671-F1723 HydrophobicContact CG1-CE2 3.71Å; V1671-F1723 HydrophobicContact CG1-CZ 4.44Å; V1671-S2151 PolarHBondContact N-OG 2.91Å; V1671-T2152 HydrophobicContact CG1-CG2 4.04Å; V1671-T2152 VanDerWaalsContact CG1-OG1 3.24Å; V1671-T2152 WeakPolarHBondContact CG1-OG1 3.4Å
1672	P	67	Low	59.8	Low	3 Å²	3	35.4 Å²	35.4	2%	0.019	19%	0.194	C	C	.	.			trans	-63.1	122.4	159.9	-15.6	25.9	0	0	0	110.5	Y1708 H1709 F1716 V1719 R1958	P1672-Y1708 HydrophobicContact CB-CD1 4.49Å; P1672-H1709 CarbonylContact C-O 3.4Å; P1672-F1716 VanDerWaalsContact CA-CE2 3.42Å; P1672-F1716 HydrophobicContact CB-CD2 3.98Å; P1672-F1716 HydrophobicContact CB-CE2 3.77Å; P1672-F1716 HydrophobicContact CB-CG 4.43Å; P1672-F1716 HydrophobicContact CB-CZ 4.1Å; P1672-F1716 HydrophobicContact CG-CD1 3.76Å; P1672-F1716 HydrophobicContact CG-CD2 4Å; P1672-F1716 HydrophobicContact CG-CE1 3.68Å; P1672-F1716 HydrophobicContact CG-CE2 3.84Å; P1672-F1716 HydrophobicContact CG-CG 3.99Å; P1672-F1716 HydrophobicContact CG-CZ 3.73Å; P1672-F1716 VanDerWaalsContact N-CZ 3.29Å; P1672-V1719 HydrophobicContact CG-CG1 4.37Å; P1672-V1719 HydrophobicContact CG-CG2 4.07Å; P1672-R1958 VanDerWaalsContact O-CZ 3.25Å; P1672-R1958 PolarHBondContact O-NE 3.32Å; P1672-R1958 PolarHBondContact O-NH2 3.2Å
1673	R	65.5	Low	59.1	Low	19 Å²	19	38.8 Å²	38.8	7%	0.072	22%	0.215	C	C	.	.			trans	-93	-32.8	-177.3	-58.7	-59.7	-159.5	173	-1.5	111.5	V1671 H1709 E1711 A1764 F1766	V1671-R1673 PolarHBondContact O-N 3.02Å; R1673-H1709 PolarHBondContact N-O 2.84Å; R1673-E1711 HydrophobicContact CG-CB 3.96Å; R1673-E1711 WeakPolarHBondContact CG-OE2 3.49Å; R1673-E1711 IonicContact CZ-OE2 2.69Å; R1673-E1711 IonicContact NE-OE2 3.92Å; R1673-E1711 PolarHBondContact NE-OE2 2.8Å; R1673-E1711 IonicContact NH2-OE2 3.19Å; R1673-E1711 PolarHBondContact NH2-OE2 2.9Å; R1673-A1764 PolarHBondContact NH1-O 2.86Å; R1673-A1764 PolarHBondContact NH2-O 2.93Å; R1673-F1766 WeakPolarHBondContact CD-O 2.88Å; R1673-F1766 HydrophobicContact CG-CB 4.4Å; R1673-F1766 PolarHBondContact NH1-O 3.48Å
1674	Y	47.2	Very low	58.1	Low	76 Å²	76	42 Å²	42	30%	0.298	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	-177.2	177.7	76	-89.9	0	0	0	112.8	H1709 D1710 G1713	Y1674-H1709 HydrophobicContact CD1-CB 3.81Å; Y1674-H1709 HydrophobicContact CD2-CB 3.92Å; Y1674-H1709 HydrophobicContact CE1-CB 3.65Å; Y1674-H1709 HydrophobicContact CE2-CB 3.74Å; Y1674-H1709 AromaticContact CE2-CG 3.91Å; Y1674-H1709 HydrophobicContact CG-CB 3.97Å; Y1674-H1709 PolarHBondContact N-O 2.75Å; Y1674-H1709 VanDerWaalsContact N-O 3.12Å; Y1674-H1709 PolarHBondContact O-N 2.86Å; Y1674-D1710 WeakPolarHBondContact CD1-O 3.16Å; Y1674-D1710 VanDerWaalsContact CE1-O 3.3Å; Y1674-D1710 WeakPolarHBondContact CE1-O 3.48Å; Y1674-G1713 WeakPolarHBondContact OH-CA 3.42Å
1675	M	50.6	Low	56.9	Low	23 Å²	23	43.6 Å²	43.6	11%	0.113	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	151.7	-177.4	56.7	176.5	-172.3	0	0	109.8	F1677 S1707 Y1708 L1726 T1738 F1740	M1675-F1677 HydrophobicContact CB-CE2 4.35Å; M1675-F1677 HydrophobicContact CE-CE2 3.71Å; M1675-F1677 HydrophobicContact CE-CZ 3.95Å; M1675-F1677 HydrophobicContact CG-CE2 3.75Å; M1675-F1677 HydrophobicContact CG-CZ 4.24Å; M1675-F1677 HydrophobicContact SD-CE2 3.6Å; M1675-F1677 HydrophobicContact SD-CZ 3.56Å; M1675-F1677 VanDerWaalsContact SD-CZ 3.56Å; M1675-S1707 CarbonylContact C-O 3.51Å; M1675-S1707 VanDerWaalsContact CA-O 3.24Å; M1675-S1707 WeakPolarHBondContact CA-O 3.49Å; M1675-Y1708 HydrophobicContact CB-CE1 4.45Å; M1675-L1726 HydrophobicContact CE-CD1 4.35Å; M1675-L1726 HydrophobicContact CE-CD2 4.37Å; M1675-L1726 HydrophobicContact SD-CD1 3.32Å; M1675-L1726 WeakPolarHBondContact SD-CD1 3.19Å; M1675-L1726 HydrophobicContact SD-CD2 4.12Å; M1675-L1726 HydrophobicContact SD-CG 4.43Å; M1675-T1738 VanDerWaalsContact CE-CB 3.41Å; M1675-T1738 HydrophobicContact CE-CG2 4.1Å; M1675-T1738 WeakPolarHBondContact CE-OG1 3.33Å; M1675-F1740 HydrophobicContact CE-CD2 3.68Å; M1675-F1740 HydrophobicContact CE-CE2 3.34Å; M1675-F1740 HydrophobicContact CE-CZ 4.36Å; M1675-F1740 HydrophobicContact CG-CE2 4.12Å; M1675-F1740 HydrophobicContact CG-CZ 4.33Å; M1675-F1740 HydrophobicContact SD-CD2 4.24Å; M1675-F1740 HydrophobicContact SD-CE2 3.69Å; M1675-F1740 HydrophobicContact SD-CZ 4.19Å
1676	M	46.7	Very low	55.5	Low	98 Å²	98	51.2 Å²	51.2	48%	0.483	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148.2	179.1	-162	-179.7	-159.5	0	0	109.9	I1706 S1707 H1709	M1676-I1706 CarbonylContact O-C 3.6Å; M1676-I1706 WeakPolarHBondContact O-CA 3.37Å; M1676-S1707 PolarHBondContact N-O 3.45Å; M1676-S1707 PolarHBondContact O-N 3.01Å; M1676-H1709 WeakPolarHBondContact CB-NE2 3.15Å; M1676-H1709 VanDerWaalsContact SD-CE1 3.51Å
1677	F	46.4	Very low	53.9	Low	54 Å²	54	52.9 Å²	52.9	24%	0.237	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.3	-177.8	-63.3	-95.7	0	0	0	107.4	M1675 I1704 I1706 A1728 F1736 T1738	M1675-F1677 HydrophobicContact CB-CE2 4.35Å; M1675-F1677 HydrophobicContact CE-CE2 3.71Å; M1675-F1677 HydrophobicContact CE-CZ 3.95Å; M1675-F1677 HydrophobicContact CG-CE2 3.75Å; M1675-F1677 HydrophobicContact CG-CZ 4.24Å; M1675-F1677 HydrophobicContact SD-CE2 3.6Å; M1675-F1677 HydrophobicContact SD-CZ 3.56Å; M1675-F1677 VanDerWaalsContact SD-CZ 3.56Å; F1677-I1704 HydrophobicContact CB-CD1 4.44Å; F1677-I1704 HydrophobicContact CB-CG2 3.76Å; F1677-I1704 HydrophobicContact CD1-CG2 3.76Å; F1677-I1704 HydrophobicContact CG-CG2 4.26Å; F1677-I1706 HydrophobicContact CD1-CD1 4.4Å; F1677-I1706 HydrophobicContact CD1-CG1 3.85Å; F1677-I1706 HydrophobicContact CE1-CB 4.42Å; F1677-I1706 HydrophobicContact CE1-CD1 3.72Å; F1677-I1706 HydrophobicContact CE1-CG1 3.63Å; F1677-I1706 HydrophobicContact CE1-CG2 4.11Å; F1677-I1706 HydrophobicContact CZ-CD1 4.5Å; F1677-I1706 HydrophobicContact CZ-CG2 4.23Å; F1677-A1728 HydrophobicContact CE1-CB 4.16Å; F1677-F1736 HydrophobicContact CD1-CD1 4.42Å; F1677-T1738 HydrophobicContact CD1-CG2 4.49Å; F1677-T1738 HydrophobicContact CD2-CG2 4.39Å; F1677-T1738 HydrophobicContact CE1-CG2 3.74Å; F1677-T1738 HydrophobicContact CE2-CG2 3.64Å; F1677-T1738 HydrophobicContact CZ-CG2 3.27Å
1678	S	42.8	Very low	52.2	Low	45 Å²	45	55.6 Å²	55.6	32%	0.315	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.9	-170.7	57.3	0	0	0	0	112.1	I1704 K1705	S1678-I1704 WeakPolarHBondContact O-CA 3.2Å; S1678-K1705 PolarHBondContact N-O 2.73Å; S1678-K1705 PolarHBondContact O-N 3.2Å; S1678-K1705 PolarHBondContact OG-O 3.35Å
1679	V	43.7	Very low	50	Low	65 Å²	65	65.5 Å²	65.5	39%	0.394	34%	0.341	S	S	.	.			trans	-102.8	123.5	-169.1	178.8	0	0	0	0	110.8	Y1702 N1703 I1704	V1679-Y1702 HydrophobicContact CG1-CD1 3.67Å; V1679-Y1702 HydrophobicContact CG1-CG 4.35Å; V1679-N1703 WeakPolarHBondContact CA-O 3.41Å; V1679-I1704 HydrophobicContact CG2-CD1 3.66Å; V1679-I1704 HydrophobicContact CG2-CG1 3.8Å
1680	P	47.6	Very low	48	Very low	50 Å²	50	73 Å²	73	33%	0.325	38%	0.38	S	S	.	.			trans	-73	166.7	168.7	-19.5	35	0	0	0	114.2	N1703	P1680-N1703 WeakPolarHBondContact CD-O 2.99Å; P1680-N1703 HydrophobicContact CG-CB 4.32Å
1681	S	41.5	Very low	46.1	Very low	79 Å²	79	76.6 Å²	76.6	55%	0.552	41%	0.407	S	S	*	.			trans	-42.8	140.4	173.3	40.2	0	0	0	0	115.7	R1490	R1490-S1681 CarbonylContact O-C 3Å; R1490-S1681 WeakPolarHBondContact O-CA 3.21Å; R1490-S1681 WeakPolarHBondContact O-CB 3.41Å
1682	I	42.5	Very low	44.4	Very low	33 Å²	33	83.4 Å²	83.4	17%	0.169	44%	0.435	C	S	.	.			trans	-108	131.9	-172.7	-58.1	162.2	0	0	0	110.3	R1490 F1491 G1492 I1684 L1696 Y1702	R1490-I1682 PolarHBondContact O-N 2.8Å; F1491-I1682 CarbonylContact C-O 3.14Å; F1491-I1682 HydrophobicContact CD1-CD1 4.1Å; G1492-I1682 PolarHBondContact N-O 2.03Å; I1682-I1684 HydrophobicContact CG2-CG1 4.37Å; I1682-L1696 HydrophobicContact CD1-CD2 3.44Å; I1682-L1696 VanDerWaalsContact CD1-CD2 3.44Å; I1682-Y1702 HydrophobicContact CD1-CD1 4.17Å; I1682-Y1702 HydrophobicContact CD1-CE1 3.63Å; I1682-Y1702 HydrophobicContact CG1-CE1 4.45Å
1683	T	42.8	Very low	43	Very low	136 Å²	136	86.4 Å²	86.4	83%	0.834	45%	0.453	S	S	*	.			trans	-115	110	178	52.4	0	0	0	0	111.3
1684	I	42.5	Very low	41.6	Very low	75 Å²	75	92.3 Å²	92.3	39%	0.385	49%	0.491	S	S	.	.			trans	-87.2	137	-179.8	-55.4	174.8	0	0	0	110.2	I1682 V1693	I1682-I1684 HydrophobicContact CG2-CG1 4.37Å; I1684-V1693 HydrophobicContact CD1-CG1 4.5Å
1685	P	44	Very low	41.1	Very low	108 Å²	108	90.4 Å²	90.4	70%	0.701	49%	0.494	S	S	*	.			trans	-61.4	142.2	175.8	-23.7	35.1	0	0	0	113.8	N1687	P1685-N1687 PolarHBondContact O-N 2.77Å
1686	Q	42.8	Very low	40.5	Very low	159 Å²	159	92 Å²	92	74%	0.743	50%	0.503	S	S	*	.	S	Bend	trans	-86	13.6	-160.7	-64.2	-170.3	-17	0	0	117.6
1687	N	41.7	Very low	40.1	Very low	61 Å²	61	90.1 Å²	90.1	33%	0.326	50%	0.498	S	S	.	.			trans	-97.5	-29.5	-165.6	-82	-18.9	0	0	0	117.4	P1685 R1689 L2486 R2487	P1685-N1687 PolarHBondContact O-N 2.77Å; N1687-R1689 PolarHBondContact O-N 2.92Å; N1687-L2486 VanDerWaalsContact ND2-C 3.32Å; N1687-L2486 WeakPolarHBondContact ND2-CB 3.23Å; N1687-L2486 PolarHBondContact ND2-O 3.39Å; N1687-R2487 PolarHBondContact O-NE 2.87Å
1688	E	38.3	Very low	39.6	Very low	58 Å²	58	94 Å²	94	27%	0.271	53%	0.525	S	S	.	.			trans	-81.6	73.1	175.2	-75	86.2	-127.7	0	0	112.9	L1690	E1688-L1690 PolarHBondContact O-N 2.81Å
1689	R	35.7	Very low	39.1	Very low	209 Å²	209	93.6 Å²	93.6	79%	0.789	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	42.4	176.1	-68.6	-170.8	172.3	-161.7	-2.4	115	N1687	N1687-R1689 PolarHBondContact O-N 2.92Å
1690	L	34.9	Very low	38.6	Very low	158 Å²	158	91.3 Å²	91.3	83%	0.827	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	-5.6	-176.7	-102.6	165.3	0	0	0	116.8	E1688	E1688-L1690 PolarHBondContact O-N 2.81Å
1691	S	33.1	Very low	38	Very low	84 Å²	84	95.4 Å²	95.4	59%	0.587	55%	0.545	S	S	*	.			trans	-122.4	125.7	169	51.5	0	0	0	0	110.2	V1693	S1691-V1693 PolarHBondContact O-N 2.9Å
1692	K	35.8	Very low	38.2	Very low	159 Å²	159	94.5 Å²	94.5	69%	0.691	53%	0.53	S	S	*	.			trans	-72.5	111.4	165.4	-82.8	-169.4	169.1	-169.3	0	107.4	D1496 V1694	D1496-K1692 WeakPolarHBondContact OD2-CE 3.39Å; D1496-K1692 IonicContact OD2-NZ 3.53Å; D1496-K1692 PolarHBondContact OD2-NZ 3.03Å; K1692-V1694 VanDerWaalsContact O-CG2 3.27Å; K1692-V1694 WeakPolarHBondContact O-CG2 3.05Å; K1692-V1694 PolarHBondContact O-N 2.94Å; K1692-V1694 VanDerWaalsContact O-N 3.09Å
1693	V	36.5	Very low	38.2	Very low	65 Å²	65	98.4 Å²	98.4	39%	0.394	55%	0.551	S	S	.	*			trans	-68.2	105.5	177.7	175.6	0	0	0	0	109	I1684 S1691 G1695	I1684-V1693 HydrophobicContact CD1-CG1 4.5Å; S1691-V1693 PolarHBondContact O-N 2.9Å; V1693-G1695 VanDerWaalsContact C-N 3.31Å; V1693-G1695 WeakPolarHBondContact CG1-O 2.83Å; V1693-G1695 PolarHBondContact O-N 2.74Å
1694	V	36.5	Very low	38.3	Very low	143 Å²	143	93.9 Å²	93.9	87%	0.867	52%	0.521	S	S	*	.			trans	-81.6	-8.5	-173.8	-168.1	0	0	0	0	112.6	K1692	K1692-V1694 VanDerWaalsContact O-CG2 3.27Å; K1692-V1694 WeakPolarHBondContact O-CG2 3.05Å; K1692-V1694 PolarHBondContact O-N 2.94Å; K1692-V1694 VanDerWaalsContact O-N 3.09Å
1695	G	36	Very low	38.7	Very low	36 Å²	36	96.5 Å²	96.5	37%	0.371	53%	0.53	S	S	.	.	S	Bend	trans	-170.4	179	-179.1	0	0	0	0	0	113.4	V1693	V1693-G1695 VanDerWaalsContact C-N 3.31Å; V1693-G1695 WeakPolarHBondContact CG1-O 2.83Å; V1693-G1695 PolarHBondContact O-N 2.74Å
1696	L	39.6	Very low	39.2	Very low	58 Å²	58	94.1 Å²	94.1	30%	0.304	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-69	133.5	-177.2	-69.7	160.3	0	0	0	111.9	F1491 I1682 L1812	F1491-L1696 HydrophobicContact CB-CD2 4.32Å; F1491-L1696 HydrophobicContact CD1-CD2 4.03Å; I1682-L1696 HydrophobicContact CD1-CD2 3.44Å; I1682-L1696 VanDerWaalsContact CD1-CD2 3.44Å; L1696-L1812 HydrophobicContact CD1-CD1 4.14Å; L1696-L1812 HydrophobicContact CD1-CD2 3.79Å; L1696-L1812 HydrophobicContact CD1-CG 4.45Å
1697	P	36.9	Very low	40	Very low	58 Å²	58	87.1 Å²	87.1	38%	0.377	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-78	133.4	-179.8	30.6	-34.2	0	0	0	112.6	Y1702	P1697-Y1702 PolarHBondContact O-OH 2.84Å
1698	V	36.2	Very low	41.3	Very low	134 Å²	134	84.7 Å²	84.7	81%	0.812	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	147.7	168.1	-175.1	0	0	0	0	109.2	G1700 D1734	V1698-G1700 VanDerWaalsContact C-N 3.34Å; V1698-G1700 PolarHBondContact O-N 2.72Å; V1698-D1734 VanDerWaalsContact CG1-OD2 3.32Å; V1698-D1734 WeakPolarHBondContact CG1-OD2 3.15Å
1699	G	32	Very low	42.5	Very low	37 Å²	37	82.2 Å²	82.2	38%	0.381	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	5.8	-178.5	0	0	0	0	0	116	D1734	G1699-D1734 WeakPolarHBondContact CA-OD2 3.46Å; G1699-D1734 PolarHBondContact N-OD2 2.98Å
1700	G	34.5	Very low	43.8	Very low	17 Å²	17	72.2 Å²	72.2	18%	0.175	42%	0.416	C	S	.	.			trans	-68.9	149.5	-180	0	0	0	0	0	113.8	V1698 Y1702	V1698-G1700 VanDerWaalsContact C-N 3.34Å; V1698-G1700 PolarHBondContact O-N 2.72Å; G1700-Y1702 VanDerWaalsContact C-N 3.26Å; G1700-Y1702 WeakPolarHBondContact O-CD2 3.43Å; G1700-Y1702 WeakPolarHBondContact O-CE2 3.07Å; G1700-Y1702 PolarHBondContact O-N 3.15Å
1701	P	35.3	Very low	44.6	Very low	136 Å²	136	68 Å²	68	88%	0.883	39%	0.393	S	S	*	.			trans	-74	76.4	177.7	30.6	-35.5	0	0	0	111.8	N1703	P1701-N1703 PolarHBondContact O-N 2.81Å
1702	Y	44.7	Very low	45.8	Very low	61 Å²	61	68.2 Å²	68.2	24%	0.239	39%	0.387	C	S	.	.			trans	-69	98	177.7	-61.4	-66.5	0	0	0	111.2	V1679 I1682 P1697 G1700 I1704	V1679-Y1702 HydrophobicContact CG1-CD1 3.67Å; V1679-Y1702 HydrophobicContact CG1-CG 4.35Å; I1682-Y1702 HydrophobicContact CD1-CD1 4.17Å; I1682-Y1702 HydrophobicContact CD1-CE1 3.63Å; I1682-Y1702 HydrophobicContact CG1-CE1 4.45Å; P1697-Y1702 PolarHBondContact O-OH 2.84Å; G1700-Y1702 VanDerWaalsContact C-N 3.26Å; G1700-Y1702 WeakPolarHBondContact O-CD2 3.43Å; G1700-Y1702 WeakPolarHBondContact O-CE2 3.07Å; G1700-Y1702 PolarHBondContact O-N 3.15Å; Y1702-I1704 PolarHBondContact O-N 3.24Å
1703	N	42.2	Very low	46.4	Very low	115 Å²	115	61.8 Å²	61.8	62%	0.615	37%	0.365	S	S	*	.			trans	-56	134.4	165.3	-171.5	-6.9	0	0	0	108.4	V1679 P1680 P1701	V1679-N1703 WeakPolarHBondContact CA-O 3.41Å; P1680-N1703 WeakPolarHBondContact CD-O 2.99Å; P1680-N1703 HydrophobicContact CG-CB 4.32Å; P1701-N1703 PolarHBondContact O-N 2.81Å
1704	I	45.2	Very low	47.7	Very low	41 Å²	41	61.2 Å²	61.2	21%	0.21	36%	0.356	C	S	.	.			trans	-131.1	125.4	-176.8	-74.7	-146.3	0	0	0	112.9	F1677 S1678 V1679 Y1702 F1736	F1677-I1704 HydrophobicContact CB-CD1 4.44Å; F1677-I1704 HydrophobicContact CB-CG2 3.76Å; F1677-I1704 HydrophobicContact CD1-CG2 3.76Å; F1677-I1704 HydrophobicContact CG-CG2 4.26Å; S1678-I1704 WeakPolarHBondContact O-CA 3.2Å; V1679-I1704 HydrophobicContact CG2-CD1 3.66Å; V1679-I1704 HydrophobicContact CG2-CG1 3.8Å; Y1702-I1704 PolarHBondContact O-N 3.24Å; I1704-F1736 HydrophobicContact CB-CD1 4.46Å; I1704-F1736 HydrophobicContact CB-CE1 3.6Å; I1704-F1736 HydrophobicContact CB-CZ 3.69Å; I1704-F1736 HydrophobicContact CD1-CD1 4.11Å; I1704-F1736 HydrophobicContact CD1-CD2 3.77Å; I1704-F1736 HydrophobicContact CD1-CE1 3.76Å; I1704-F1736 HydrophobicContact CD1-CE2 3.4Å; I1704-F1736 VanDerWaalsContact CD1-CE2 3.4Å; I1704-F1736 HydrophobicContact CD1-CG 4.12Å; I1704-F1736 HydrophobicContact CD1-CZ 3.39Å; I1704-F1736 HydrophobicContact CG1-CE1 3.82Å; I1704-F1736 HydrophobicContact CG1-CE2 3.9Å; I1704-F1736 HydrophobicContact CG1-CZ 3.4Å; I1704-F1736 VanDerWaalsContact CG1-CZ 3.4Å; I1704-F1736 HydrophobicContact CG2-CD1 4.2Å; I1704-F1736 HydrophobicContact CG2-CE1 3.79Å; I1704-F1736 HydrophobicContact CG2-CZ 4.3Å
1705	K	50.2	Low	49.2	Very low	130 Å²	130	55.6 Å²	55.6	57%	0.565	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.5	179.5	177.2	-179.7	-175.3	174.8	0	109.7	S1678	S1678-K1705 PolarHBondContact N-O 2.73Å; S1678-K1705 PolarHBondContact O-N 3.2Å; S1678-K1705 PolarHBondContact OG-O 3.35Å
1706	I	54.8	Low	51.2	Low	57 Å²	57	54.1 Å²	54.1	29%	0.292	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	134	175.9	-46.9	-178.9	0	0	0	109.7	M1676 F1677 Y1708 A1728	M1676-I1706 CarbonylContact O-C 3.6Å; M1676-I1706 WeakPolarHBondContact O-CA 3.37Å; F1677-I1706 HydrophobicContact CD1-CD1 4.4Å; F1677-I1706 HydrophobicContact CD1-CG1 3.85Å; F1677-I1706 HydrophobicContact CE1-CB 4.42Å; F1677-I1706 HydrophobicContact CE1-CD1 3.72Å; F1677-I1706 HydrophobicContact CE1-CG1 3.63Å; F1677-I1706 HydrophobicContact CE1-CG2 4.11Å; F1677-I1706 HydrophobicContact CZ-CD1 4.5Å; F1677-I1706 HydrophobicContact CZ-CG2 4.23Å; I1706-Y1708 HydrophobicContact CG2-CE2 4.2Å; I1706-A1728 HydrophobicContact CD1-CB 4.13Å
1707	S	60.5	Low	52.9	Low	13 Å²	13	52.4 Å²	52.4	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	158.8	170	48.5	0	0	0	0	111.7	M1675 M1676 H1709	M1675-S1707 CarbonylContact C-O 3.51Å; M1675-S1707 VanDerWaalsContact CA-O 3.24Å; M1675-S1707 WeakPolarHBondContact CA-O 3.49Å; M1676-S1707 PolarHBondContact N-O 3.45Å; M1676-S1707 PolarHBondContact O-N 3.01Å; S1707-H1709 WeakPolarHBondContact CB-NE2 3.4Å; S1707-H1709 PolarHBondContact O-CD2 2.84Å; S1707-H1709 PolarHBondContact OG-NE2 2.77Å
1708	Y	67.5	Low	54.6	Low	10 Å²	10	49.8 Å²	49.8	4%	0.039	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	139.9	-176	-67.6	-84.1	0	0	0	110.3	P1672 M1675 I1706 V1715 F1716 V1719 Y1724 S1957	P1672-Y1708 HydrophobicContact CB-CD1 4.49Å; M1675-Y1708 HydrophobicContact CB-CE1 4.45Å; I1706-Y1708 HydrophobicContact CG2-CE2 4.2Å; Y1708-V1715 CarbonylContact O-C 3.51Å; Y1708-V1715 WeakPolarHBondContact O-CA 3.46Å; Y1708-F1716 WeakPolarHBondContact O-CD2 3.35Å; Y1708-F1716 PolarHBondContact O-N 3.49Å; Y1708-V1719 VanDerWaalsContact CB-CG2 3.47Å; Y1708-V1719 HydrophobicContact CD1-CG1 4.17Å; Y1708-V1719 HydrophobicContact CD1-CG2 4.46Å; Y1708-V1719 HydrophobicContact CD2-CB 4Å; Y1708-V1719 HydrophobicContact CD2-CG1 4.19Å; Y1708-V1719 HydrophobicContact CD2-CG2 3.81Å; Y1708-V1719 HydrophobicContact CG-CB 4.11Å; Y1708-V1719 HydrophobicContact CG-CG1 3.99Å; Y1708-V1719 HydrophobicContact CG-CG2 3.61Å; Y1708-Y1724 AromaticContact CD2-CD1 3.98Å; Y1708-Y1724 HydrophobicContact CD2-CD1 3.98Å; Y1708-Y1724 AromaticContact CD2-CE1 3.65Å; Y1708-Y1724 HydrophobicContact CD2-CE1 3.65Å; Y1708-Y1724 HydrophobicContact CE1-CD1 4.21Å; Y1708-Y1724 AromaticContact CE2-CD1 3.26Å; Y1708-Y1724 HydrophobicContact CE2-CD1 3.26Å; Y1708-Y1724 AromaticContact CE2-CE1 3.21Å; Y1708-Y1724 HydrophobicContact CE2-CE1 3.21Å; Y1708-Y1724 AromaticContact CZ-CD1 3.4Å; Y1708-Y1724 AromaticContact CZ-CE1 3.89Å; Y1708-S1957 WeakPolarHBondContact CE1-O 3.31Å; Y1708-S1957 VanDerWaalsContact CZ-O 3.3Å; Y1708-S1957 WeakPolarHBondContact OH-CA 3.26Å; Y1708-S1957 WeakPolarHBondContact OH-CB 3.43Å; Y1708-S1957 PolarHBondContact OH-O 3.11Å
1709	H	64.1	Low	56.2	Low	5 Å²	5	43.4 Å²	43.4	2%	0.023	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143.9	-165.9	-64.1	-111.7	0	0	0	112.3	P1672 R1673 Y1674 M1676 S1707 G1713 R1714 V1715	P1672-H1709 CarbonylContact C-O 3.4Å; R1673-H1709 PolarHBondContact N-O 2.84Å; Y1674-H1709 HydrophobicContact CD1-CB 3.81Å; Y1674-H1709 HydrophobicContact CD2-CB 3.92Å; Y1674-H1709 HydrophobicContact CE1-CB 3.65Å; Y1674-H1709 HydrophobicContact CE2-CB 3.74Å; Y1674-H1709 AromaticContact CE2-CG 3.91Å; Y1674-H1709 HydrophobicContact CG-CB 3.97Å; Y1674-H1709 PolarHBondContact N-O 2.75Å; Y1674-H1709 VanDerWaalsContact N-O 3.12Å; Y1674-H1709 PolarHBondContact O-N 2.86Å; M1676-H1709 WeakPolarHBondContact CB-NE2 3.15Å; M1676-H1709 VanDerWaalsContact SD-CE1 3.51Å; S1707-H1709 WeakPolarHBondContact CB-NE2 3.4Å; S1707-H1709 PolarHBondContact O-CD2 2.84Å; S1707-H1709 PolarHBondContact OG-NE2 2.77Å; H1709-G1713 PolarHBondContact ND1-O 2.89Å; H1709-R1714 VanDerWaalsContact CA-O 3.31Å; H1709-R1714 WeakPolarHBondContact CA-O 3.33Å; H1709-V1715 WeakPolarHBondContact CE1-CG2 3.26Å
1710	D	62.7	Low	57.9	Low	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.223	C	C	.	.			trans	-80	-178.5	174.7	72.3	-13.7	0	0	0	111.4	K1670 Y1674 L1712 G1713 R1714 F1716	K1670-D1710 HydrophobicContact CD-CB 3.84Å; K1670-D1710 WeakPolarHBondContact CD-OD2 3.39Å; K1670-D1710 IonicContact NZ-OD2 2.65Å; K1670-D1710 PolarHBondContact NZ-OD2 2.9Å; Y1674-D1710 WeakPolarHBondContact CD1-O 3.16Å; Y1674-D1710 VanDerWaalsContact CE1-O 3.3Å; Y1674-D1710 WeakPolarHBondContact CE1-O 3.48Å; D1710-L1712 PolarHBondContact O-N 2.7Å; D1710-L1712 WeakPolarHBondContact OD1-CA 3.01Å; D1710-L1712 WeakPolarHBondContact OD1-CB 3.06Å; D1710-L1712 PolarHBondContact OD1-N 3.19Å; D1710-G1713 PolarHBondContact O-N 3.31Å; D1710-G1713 PolarHBondContact OD1-N 2.86Å; D1710-G1713 VanDerWaalsContact OD1-N 3.12Å; D1710-R1714 PolarHBondContact N-O 3.28Å; D1710-R1714 WeakPolarHBondContact OD1-CB 3.36Å; D1710-R1714 PolarHBondContact OD1-N 2.97Å; D1710-R1714 IonicContact OD1-NE 2.71Å; D1710-R1714 IonicContact OD2-CZ 2.84Å; D1710-R1714 IonicContact OD2-NE 3.21Å; D1710-R1714 PolarHBondContact OD2-NE 2.93Å; D1710-R1714 VanDerWaalsContact OD2-NE 3.1Å; D1710-R1714 IonicContact OD2-NH2 3.21Å; D1710-R1714 PolarHBondContact OD2-NH2 2.93Å; D1710-F1716 HydrophobicContact CB-CE2 3.69Å; D1710-F1716 HydrophobicContact CB-CZ 4.19Å
1711	E	53.4	Low	59.1	Low	70 Å²	70	41.8 Å²	41.8	33%	0.327	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-6.2	174.8	57.2	-78.3	129.7	0	0	114.1	K1670 R1673	K1670-E1711 WeakPolarHBondContact CE-OE1 3.49Å; K1670-E1711 IonicContact NZ-OE1 3.04Å; K1670-E1711 PolarHBondContact NZ-OE1 2.9Å; R1673-E1711 HydrophobicContact CG-CB 3.96Å; R1673-E1711 WeakPolarHBondContact CG-OE2 3.49Å; R1673-E1711 IonicContact CZ-OE2 2.69Å; R1673-E1711 IonicContact NE-OE2 3.92Å; R1673-E1711 PolarHBondContact NE-OE2 2.8Å; R1673-E1711 IonicContact NH2-OE2 3.19Å; R1673-E1711 PolarHBondContact NH2-OE2 2.9Å
1712	L	57.8	Low	60	Low	88 Å²	88	36.2 Å²	36.2	46%	0.461	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	5.7	175.5	-54.8	179.7	0	0	0	112.6	D1710 R1714 I1804	D1710-L1712 PolarHBondContact O-N 2.7Å; D1710-L1712 WeakPolarHBondContact OD1-CA 3.01Å; D1710-L1712 WeakPolarHBondContact OD1-CB 3.06Å; D1710-L1712 PolarHBondContact OD1-N 3.19Å; L1712-R1714 HydrophobicContact CB-CG 4.12Å; L1712-I1804 HydrophobicContact CD1-CD1 4.1Å; L1712-I1804 HydrophobicContact CD2-CD1 4.07Å
1713	G	48.7	Very low	60.6	Low	24 Å²	24	34.6 Å²	34.6	25%	0.247	18%	0.177	C	C	.	.			trans	76.6	18.6	175.7	0	0	0	0	0	115.7	Y1674 H1709 D1710	Y1674-G1713 WeakPolarHBondContact OH-CA 3.42Å; H1709-G1713 PolarHBondContact ND1-O 2.89Å; D1710-G1713 PolarHBondContact O-N 3.31Å; D1710-G1713 PolarHBondContact OD1-N 2.86Å; D1710-G1713 VanDerWaalsContact OD1-N 3.12Å
1714	R	62.9	Low	61	Low	52 Å²	52	29.7 Å²	29.7	20%	0.196	15%	0.15	C	C	.	.			trans	-97.8	135.1	-172.5	-54.8	178.5	-58.5	156.7	8.3	109.7	I1568 H1709 D1710 L1712 F1716	I1568-R1714 HydrophobicContact CB-CB 4.47Å; I1568-R1714 HydrophobicContact CD1-CB 3.86Å; I1568-R1714 HydrophobicContact CG1-CB 4.37Å; I1568-R1714 HydrophobicContact CG2-CB 3.43Å; I1568-R1714 VanDerWaalsContact CG2-CB 3.43Å; H1709-R1714 VanDerWaalsContact CA-O 3.31Å; H1709-R1714 WeakPolarHBondContact CA-O 3.33Å; D1710-R1714 PolarHBondContact N-O 3.28Å; D1710-R1714 WeakPolarHBondContact OD1-CB 3.36Å; D1710-R1714 PolarHBondContact OD1-N 2.97Å; D1710-R1714 IonicContact OD1-NE 2.71Å; D1710-R1714 IonicContact OD2-CZ 2.84Å; D1710-R1714 IonicContact OD2-NE 3.21Å; D1710-R1714 PolarHBondContact OD2-NE 2.93Å; D1710-R1714 VanDerWaalsContact OD2-NE 3.1Å; D1710-R1714 IonicContact OD2-NH2 3.21Å; D1710-R1714 PolarHBondContact OD2-NH2 2.93Å; L1712-R1714 HydrophobicContact CB-CG 4.12Å; R1714-F1716 PolarHBondContact O-N 2.77Å
1715	V	68.7	Low	60.8	Low	25 Å²	25	30.8 Å²	30.8	15%	0.152	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-76.2	113.7	-169.8	-175.3	0	0	0	0	113.1	I1568 Y1708 H1709 D1717	I1568-V1715 WeakPolarHBondContact CB-O 3.42Å; I1568-V1715 WeakPolarHBondContact CD1-O 3.33Å; Y1708-V1715 CarbonylContact O-C 3.51Å; Y1708-V1715 WeakPolarHBondContact O-CA 3.46Å; H1709-V1715 WeakPolarHBondContact CE1-CG2 3.26Å; V1715-D1717 PolarHBondContact O-N 2.68Å
1716	F	77.3	Confident	60.2	Low	6 Å²	6	24.9 Å²	24.9	3%	0.026	13%	0.126	C	C	.	.			trans	-48.5	110.9	162.6	-76.7	-103.9	0	0	0	111.1	I1568 L1569 K1670 P1672 Y1708 D1710 R1714 A1718 V1719	I1568-F1716 WeakPolarHBondContact O-CA 3.13Å; I1568-F1716 WeakPolarHBondContact O-CD1 3.24Å; I1568-F1716 WeakPolarHBondContact O-CD2 3.01Å; I1568-F1716 WeakPolarHBondContact O-CE1 3.43Å; I1568-F1716 WeakPolarHBondContact O-CG 3.45Å; L1569-F1716 VanDerWaalsContact C-CE1 3.41Å; L1569-F1716 VanDerWaalsContact CA-CD1 3.47Å; L1569-F1716 HydrophobicContact CD2-CB 3.8Å; L1569-F1716 HydrophobicContact CD2-CD1 3.86Å; L1569-F1716 HydrophobicContact CD2-CG 4.28Å; K1670-F1716 HydrophobicContact CB-CE1 4.26Å; K1670-F1716 HydrophobicContact CB-CZ 3.83Å; K1670-F1716 WeakPolarHBondContact O-CE1 3.23Å; K1670-F1716 WeakPolarHBondContact O-CZ 3.05Å; P1672-F1716 VanDerWaalsContact CA-CE2 3.42Å; P1672-F1716 HydrophobicContact CB-CD2 3.98Å; P1672-F1716 HydrophobicContact CB-CE2 3.77Å; P1672-F1716 HydrophobicContact CB-CG 4.43Å; P1672-F1716 HydrophobicContact CB-CZ 4.1Å; P1672-F1716 HydrophobicContact CG-CD1 3.76Å; P1672-F1716 HydrophobicContact CG-CD2 4Å; P1672-F1716 HydrophobicContact CG-CE1 3.68Å; P1672-F1716 HydrophobicContact CG-CE2 3.84Å; P1672-F1716 HydrophobicContact CG-CG 3.99Å; P1672-F1716 HydrophobicContact CG-CZ 3.73Å; P1672-F1716 VanDerWaalsContact N-CZ 3.29Å; Y1708-F1716 WeakPolarHBondContact O-CD2 3.35Å; Y1708-F1716 PolarHBondContact O-N 3.49Å; D1710-F1716 HydrophobicContact CB-CE2 3.69Å; D1710-F1716 HydrophobicContact CB-CZ 4.19Å; R1714-F1716 PolarHBondContact O-N 2.77Å; F1716-A1718 WeakPolarHBondContact CB-O 3.36Å; F1716-A1718 PolarHBondContact O-N 2.98Å; F1716-V1719 HydrophobicContact CB-CG2 3.39Å; F1716-V1719 HydrophobicContact CD1-CG2 4.03Å; F1716-V1719 HydrophobicContact CG-CG2 3.87Å
1717	D	76	Confident	59.3	Low	22 Å²	22	28 Å²	28	12%	0.118	14%	0.138	C	C	.	.	S	Bend	trans	-68.8	-2.2	-172.7	-62.1	-68.1	0	0	0	114.3	P1560 R1562 I1567 I1568 L1569 L1575 V1715	P1560-D1717 HydrophobicContact CB-CB 3.75Å; P1560-D1717 HydrophobicContact CG-CB 3.86Å; R1562-D1717 WeakPolarHBondContact CD-OD1 3.42Å; R1562-D1717 IonicContact CZ-OD1 3.36Å; R1562-D1717 IonicContact NE-OD1 3.64Å; R1562-D1717 IonicContact NH1-OD1 2.82Å; R1562-D1717 PolarHBondContact NH1-OD1 2.86Å; I1567-D1717 WeakPolarHBondContact CA-OD2 3.4Å; I1568-D1717 PolarHBondContact N-OD2 2.97Å; L1569-D1717 HydrophobicContact CD1-CB 4.08Å; L1569-D1717 VanDerWaalsContact CD2-N 3.26Å; L1575-D1717 HydrophobicContact CD1-CB 3.5Å; L1575-D1717 VanDerWaalsContact CD1-O 3.28Å; L1575-D1717 WeakPolarHBondContact CD1-O 3.3Å; L1575-D1717 HydrophobicContact CD2-CB 4.44Å; V1715-D1717 PolarHBondContact O-N 2.68Å
1718	A	71.4	Confident	58.1	Low	3 Å²	3	29.5 Å²	29.5	3%	0.025	15%	0.15	C	C	.	.	S	Bend	trans	-167.5	163.2	168.1	0	0	0	0	0	108.7	L1569 Q1574 L1575 F1716 F2343 L2348	L1569-A1718 WeakPolarHBondContact CD2-O 3.42Å; Q1574-A1718 WeakPolarHBondContact O-CB 3.45Å; L1575-A1718 HydrophobicContact CD1-CB 3.61Å; F1716-A1718 WeakPolarHBondContact CB-O 3.36Å; F1716-A1718 PolarHBondContact O-N 2.98Å; A1718-F2343 VanDerWaalsContact C-CZ 3.47Å; A1718-F2343 HydrophobicContact CB-CD1 3.35Å; A1718-F2343 HydrophobicContact CB-CE1 3.31Å; A1718-F2343 WeakPolarHBondContact O-CE1 3.44Å; A1718-F2343 VanDerWaalsContact O-CZ 3.22Å; A1718-F2343 WeakPolarHBondContact O-CZ 3.04Å; A1718-L2348 HydrophobicContact CB-CB 4.14Å; A1718-L2348 HydrophobicContact CB-CD1 3.43Å; A1718-L2348 VanDerWaalsContact CB-CD1 3.43Å; A1718-L2348 HydrophobicContact CB-CD2 3.57Å; A1718-L2348 HydrophobicContact CB-CG 3.78Å
1719	V	69.8	Low	56.4	Low	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.			trans	-137.1	-166.7	-179.7	163.7	0	0	0	0	112.5	S1573 P1672 Y1708 F1716 Y1724 F2343 L2348	S1573-V1719 WeakPolarHBondContact CB-O 3.15Å; P1672-V1719 HydrophobicContact CG-CG1 4.37Å; P1672-V1719 HydrophobicContact CG-CG2 4.07Å; Y1708-V1719 VanDerWaalsContact CB-CG2 3.47Å; Y1708-V1719 HydrophobicContact CD1-CG1 4.17Å; Y1708-V1719 HydrophobicContact CD1-CG2 4.46Å; Y1708-V1719 HydrophobicContact CD2-CB 4Å; Y1708-V1719 HydrophobicContact CD2-CG1 4.19Å; Y1708-V1719 HydrophobicContact CD2-CG2 3.81Å; Y1708-V1719 HydrophobicContact CG-CB 4.11Å; Y1708-V1719 HydrophobicContact CG-CG1 3.99Å; Y1708-V1719 HydrophobicContact CG-CG2 3.61Å; F1716-V1719 HydrophobicContact CB-CG2 3.39Å; F1716-V1719 HydrophobicContact CD1-CG2 4.03Å; F1716-V1719 HydrophobicContact CG-CG2 3.87Å; V1719-Y1724 VanDerWaalsContact C-CD2 3.43Å; V1719-Y1724 HydrophobicContact CB-CD1 4Å; V1719-Y1724 HydrophobicContact CB-CD2 3.87Å; V1719-Y1724 HydrophobicContact CB-CE1 3.56Å; V1719-Y1724 HydrophobicContact CB-CE2 3.44Å; V1719-Y1724 VanDerWaalsContact CB-CE2 3.44Å; V1719-Y1724 HydrophobicContact CB-CG 4.17Å; V1719-Y1724 HydrophobicContact CG1-CD1 3.76Å; V1719-Y1724 HydrophobicContact CG1-CD2 3.64Å; V1719-Y1724 HydrophobicContact CG1-CE1 3.89Å; V1719-Y1724 HydrophobicContact CG1-CE2 3.79Å; V1719-Y1724 HydrophobicContact CG1-CG 3.66Å; V1719-Y1724 PolarHBondContact N-OH 2.84Å; V1719-Y1724 WeakPolarHBondContact O-CE2 3.39Å; V1719-F2343 WeakPolarHBondContact O-CE1 3.35Å; V1719-F2343 VanDerWaalsContact O-CZ 3.31Å; V1719-F2343 WeakPolarHBondContact O-CZ 3.09Å; V1719-L2348 WeakPolarHBondContact O-CA 3.49Å; V1719-L2348 PolarHBondContact O-N 2.88Å; V1719-L2348 VanDerWaalsContact O-N 3.08Å
1720	S	68.4	Low	54.9	Low	1 Å²	1	33.5 Å²	33.5	1%	0.007	17%	0.174	C	C	.	.			trans	-66.9	-151.7	-170	-164.1	0	0	0	0	118.1	D1722 F1723 Y1724 S2153 H2347 L2348	S1720-D1722 PolarHBondContact OG-N 3.2Å; S1720-F1723 VanDerWaalsContact CB-CB 3.41Å; S1720-F1723 WeakPolarHBondContact OG-CB 3.09Å; S1720-F1723 PolarHBondContact OG-N 3.4Å; S1720-Y1724 VanDerWaalsContact N-CE2 3.27Å; S1720-Y1724 WeakPolarHBondContact O-CD2 3.22Å; S1720-Y1724 VanDerWaalsContact O-CE2 3.26Å; S1720-Y1724 WeakPolarHBondContact O-CE2 2.99Å; S1720-S2153 VanDerWaalsContact CB-OG 3.25Å; S1720-S2153 WeakPolarHBondContact CB-OG 2.99Å; S1720-S2153 WeakPolarHBondContact OG-CB 3.44Å; S1720-S2153 PolarHBondContact OG-OG 2.79Å; S1720-H2347 CarbonylContact O-C 3.43Å; S1720-H2347 WeakPolarHBondContact O-CA 3.45Å; S1720-H2347 VanDerWaalsContact O-CB 3.3Å; S1720-H2347 WeakPolarHBondContact O-CB 3.36Å; S1720-H2347 PolarHBondContact OG-CD2 2.94Å; S1720-H2347 VanDerWaalsContact OG-CD2 3.31Å; S1720-L2348 PolarHBondContact O-N 3.07Å; S1720-L2348 VanDerWaalsContact O-N 3.16Å
1721	N	59.2	Low	53.3	Low	18 Å²	18	34 Å²	34	10%	0.096	18%	0.176	C	C	.	.	S	Bend	trans	-122.7	-49	138.3	-68.1	-41.6	0	0	0	107.6	F1723 Y1724 R1725 K2154 H2347 A2350	N1721-F1723 PolarHBondContact O-N 2.92Å; N1721-Y1724 VanDerWaalsContact C-N 3.32Å; N1721-Y1724 CarbonylContact O-C 3.56Å; N1721-Y1724 WeakPolarHBondContact O-CA 3.39Å; N1721-Y1724 PolarHBondContact O-N 2.78Å; N1721-R1725 PolarHBondContact O-N 2.78Å; N1721-K2154 HydrophobicContact CB-CB 3.55Å; N1721-K2154 HydrophobicContact CB-CG 3.79Å; N1721-K2154 VanDerWaalsContact ND2-CG 3.32Å; N1721-K2154 WeakPolarHBondContact ND2-CG 3.48Å; N1721-H2347 PolarHBondContact N-CD2 3.29Å; N1721-H2347 VanDerWaalsContact N-CD2 3.27Å; N1721-H2347 WeakPolarHBondContact OD1-CA 3.45Å; N1721-H2347 PolarHBondContact OD1-O 3.05Å; N1721-A2350 VanDerWaalsContact CG-CB 3.49Å; N1721-A2350 VanDerWaalsContact ND2-CB 3.26Å; N1721-A2350 WeakPolarHBondContact ND2-CB 3.37Å; N1721-A2350 VanDerWaalsContact OD1-CA 3.26Å; N1721-A2350 WeakPolarHBondContact OD1-CA 3.1Å; N1721-A2350 WeakPolarHBondContact OD1-CB 3.36Å; N1721-A2350 PolarHBondContact OD1-O 2.93Å
1722	D	55.5	Low	52.1	Low	20 Å²	20	32.7 Å²	32.7	11%	0.107	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-39.5	-175.4	-61.5	-19.1	0	0	0	108.8	S1720 Y1724 R1725 F1744 S1959 K2154	S1720-D1722 PolarHBondContact OG-N 3.2Å; D1722-Y1724 CarbonylContact O-C 3.59Å; D1722-Y1724 PolarHBondContact O-N 2.99Å; D1722-R1725 WeakPolarHBondContact O-CG 3.45Å; D1722-R1725 PolarHBondContact O-N 2.9Å; D1722-R1725 IonicContact OD1-CZ 3.81Å; D1722-R1725 IonicContact OD1-NE 2.64Å; D1722-R1725 PolarHBondContact OD1-NE 3.32Å; D1722-R1725 IonicContact OD1-NH2 3.86Å; D1722-R1725 PolarHBondContact OD1-NH2 2.72Å; D1722-R1725 IonicContact OD2-NH2 3.11Å; D1722-F1744 HydrophobicContact CB-CD2 4.46Å; D1722-F1744 HydrophobicContact CB-CE2 3.44Å; D1722-F1744 VanDerWaalsContact CB-CE2 3.44Å; D1722-F1744 HydrophobicContact CB-CZ 3.93Å; D1722-S1959 WeakPolarHBondContact O-CA 3.25Å; D1722-S1959 WeakPolarHBondContact O-CB 3.26Å; D1722-S1959 PolarHBondContact O-N 2.85Å; D1722-K2154 VanDerWaalsContact OD2-CD 3.28Å; D1722-K2154 WeakPolarHBondContact OD2-CD 3.45Å; D1722-K2154 WeakPolarHBondContact OD2-CE 3.29Å; D1722-K2154 IonicContact OD2-NZ 3.41Å; D1722-K2154 PolarHBondContact OD2-NZ 3.4Å
1723	F	55.7	Low	50.7	Low	26 Å²	26	29 Å²	29	11%	0.114	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	5.6	171.8	-110.1	-11.4	0	0	0	112.8	V1671 S1720 N1721 F1744 R1958 T2152	V1671-F1723 HydrophobicContact CG1-CE2 3.71Å; V1671-F1723 HydrophobicContact CG1-CZ 4.44Å; S1720-F1723 VanDerWaalsContact CB-CB 3.41Å; S1720-F1723 WeakPolarHBondContact OG-CB 3.09Å; S1720-F1723 PolarHBondContact OG-N 3.4Å; N1721-F1723 PolarHBondContact O-N 2.92Å; F1723-F1744 HydrophobicContact CB-CD2 4.19Å; F1723-F1744 HydrophobicContact CB-CE2 3.58Å; F1723-F1744 HydrophobicContact CB-CZ 3.94Å; F1723-F1744 HydrophobicContact CD1-CB 4.42Å; F1723-F1744 AromaticContact CD1-CD2 3.35Å; F1723-F1744 HydrophobicContact CD1-CD2 3.35Å; F1723-F1744 AromaticContact CD1-CE2 3.71Å; F1723-F1744 HydrophobicContact CD1-CE2 3.71Å; F1723-F1744 AromaticContact CD1-CG 3.96Å; F1723-F1744 HydrophobicContact CD1-CG 3.96Å; F1723-F1744 AromaticContact CD2-CD1 3.94Å; F1723-F1744 HydrophobicContact CD2-CD1 3.94Å; F1723-F1744 AromaticContact CD2-CD2 3.84Å; F1723-F1744 HydrophobicContact CD2-CD2 3.84Å; F1723-F1744 AromaticContact CD2-CE1 3.89Å; F1723-F1744 HydrophobicContact CD2-CE1 3.89Å; F1723-F1744 AromaticContact CD2-CE2 3.78Å; F1723-F1744 HydrophobicContact CD2-CE2 3.78Å; F1723-F1744 AromaticContact CD2-CG 3.93Å; F1723-F1744 HydrophobicContact CD2-CG 3.93Å; F1723-F1744 AromaticContact CD2-CZ 3.82Å; F1723-F1744 HydrophobicContact CD2-CZ 3.82Å; F1723-F1744 HydrophobicContact CE1-CB 3.74Å; F1723-F1744 AromaticContact CE1-CD2 3.57Å; F1723-F1744 HydrophobicContact CE1-CD2 3.57Å; F1723-F1744 HydrophobicContact CE1-CE2 4.33Å; F1723-F1744 AromaticContact CE1-CG 3.73Å; F1723-F1744 HydrophobicContact CE1-CG 3.73Å; F1723-F1744 HydrophobicContact CE2-CB 4.14Å; F1723-F1744 AromaticContact CE2-CD1 3.76Å; F1723-F1744 HydrophobicContact CE2-CD1 3.76Å; F1723-F1744 HydrophobicContact CE2-CD2 4.03Å; F1723-F1744 HydrophobicContact CE2-CE1 4.16Å; F1723-F1744 HydrophobicContact CE2-CE2 4.4Å; F1723-F1744 AromaticContact CE2-CG 3.71Å; F1723-F1744 HydrophobicContact CE2-CG 3.71Å; F1723-F1744 HydrophobicContact CE2-CZ 4.47Å; F1723-F1744 HydrophobicContact CG-CD1 4.45Å; F1723-F1744 AromaticContact CG-CD2 3.51Å; F1723-F1744 HydrophobicContact CG-CD2 3.51Å; F1723-F1744 HydrophobicContact CG-CE1 4.36Å; F1723-F1744 AromaticContact CG-CE2 3.4Å; F1723-F1744 HydrophobicContact CG-CE2 3.4Å; F1723-F1744 HydrophobicContact CG-CG 4.07Å; F1723-F1744 AromaticContact CG-CZ 3.86Å; F1723-F1744 HydrophobicContact CG-CZ 3.86Å; F1723-F1744 HydrophobicContact CZ-CB 3.58Å; F1723-F1744 HydrophobicContact CZ-CD1 4.12Å; F1723-F1744 AromaticContact CZ-CD2 3.91Å; F1723-F1744 HydrophobicContact CZ-CD2 3.91Å; F1723-F1744 AromaticContact CZ-CG 3.61Å; F1723-F1744 HydrophobicContact CZ-CG 3.61Å; F1723-F1744 VanDerWaalsContact N-CE2 3.33Å; F1723-R1958 HydrophobicContact CD1-CG 3.71Å; F1723-R1958 HydrophobicContact CE1-CG 4.23Å; F1723-R1958 VanDerWaalsContact CG-NH2 3.27Å; F1723-R1958 VanDerWaalsContact CZ-NH2 3.34Å; F1723-R1958 PolarHBondContact O-NH1 2.97Å; F1723-T2152 HydrophobicContact CD2-CG2 4.37Å; F1723-T2152 HydrophobicContact CE2-CG2 3.92Å
1724	Y	51.4	Low	49.7	Very low	12 Å²	12	30.7 Å²	30.7	5%	0.047	15%	0.153	C	C	.	.	S	Bend	trans	-107.2	68.8	144.6	-61	-90.8	0	0	0	110.6	Y1708 V1719 S1720 N1721 D1722 P1956 S1957 L2348 M2351	Y1708-Y1724 AromaticContact CD2-CD1 3.98Å; Y1708-Y1724 HydrophobicContact CD2-CD1 3.98Å; Y1708-Y1724 AromaticContact CD2-CE1 3.65Å; Y1708-Y1724 HydrophobicContact CD2-CE1 3.65Å; Y1708-Y1724 HydrophobicContact CE1-CD1 4.21Å; Y1708-Y1724 AromaticContact CE2-CD1 3.26Å; Y1708-Y1724 HydrophobicContact CE2-CD1 3.26Å; Y1708-Y1724 AromaticContact CE2-CE1 3.21Å; Y1708-Y1724 HydrophobicContact CE2-CE1 3.21Å; Y1708-Y1724 AromaticContact CZ-CD1 3.4Å; Y1708-Y1724 AromaticContact CZ-CE1 3.89Å; V1719-Y1724 VanDerWaalsContact C-CD2 3.43Å; V1719-Y1724 HydrophobicContact CB-CD1 4Å; V1719-Y1724 HydrophobicContact CB-CD2 3.87Å; V1719-Y1724 HydrophobicContact CB-CE1 3.56Å; V1719-Y1724 HydrophobicContact CB-CE2 3.44Å; V1719-Y1724 VanDerWaalsContact CB-CE2 3.44Å; V1719-Y1724 HydrophobicContact CB-CG 4.17Å; V1719-Y1724 HydrophobicContact CG1-CD1 3.76Å; V1719-Y1724 HydrophobicContact CG1-CD2 3.64Å; V1719-Y1724 HydrophobicContact CG1-CE1 3.89Å; V1719-Y1724 HydrophobicContact CG1-CE2 3.79Å; V1719-Y1724 HydrophobicContact CG1-CG 3.66Å; V1719-Y1724 PolarHBondContact N-OH 2.84Å; V1719-Y1724 WeakPolarHBondContact O-CE2 3.39Å; S1720-Y1724 VanDerWaalsContact N-CE2 3.27Å; S1720-Y1724 WeakPolarHBondContact O-CD2 3.22Å; S1720-Y1724 VanDerWaalsContact O-CE2 3.26Å; S1720-Y1724 WeakPolarHBondContact O-CE2 2.99Å; N1721-Y1724 VanDerWaalsContact C-N 3.32Å; N1721-Y1724 CarbonylContact O-C 3.56Å; N1721-Y1724 WeakPolarHBondContact O-CA 3.39Å; N1721-Y1724 PolarHBondContact O-N 2.78Å; D1722-Y1724 CarbonylContact O-C 3.59Å; D1722-Y1724 PolarHBondContact O-N 2.99Å; Y1724-P1956 CarbonylContact C-O 3.31Å; Y1724-P1956 WeakPolarHBondContact CB-O 3.31Å; Y1724-P1956 CarbonylContact O-C 3.59Å; Y1724-P1956 WeakPolarHBondContact O-CA 3.37Å; Y1724-P1956 WeakPolarHBondContact O-CB 3.5Å; Y1724-P1956 WeakPolarHBondContact O-CD 3.38Å; Y1724-P1956 VanDerWaalsContact O-CG 3.25Å; Y1724-P1956 WeakPolarHBondContact O-CG 3.23Å; Y1724-S1957 VanDerWaalsContact CA-CA 3.43Å; Y1724-S1957 VanDerWaalsContact CA-O 3.25Å; Y1724-S1957 WeakPolarHBondContact CA-O 3.27Å; Y1724-S1957 PolarHBondContact O-N 3.17Å; Y1724-L2348 WeakPolarHBondContact OH-CD1 3.4Å; Y1724-M2351 HydrophobicContact CD1-CB 4.48Å; Y1724-M2351 HydrophobicContact CD1-CG 3.61Å; Y1724-M2351 HydrophobicContact CD1-SD 3.21Å; Y1724-M2351 WeakPolarHBondContact CD1-SD 3.09Å; Y1724-M2351 HydrophobicContact CD2-CB 3.67Å; Y1724-M2351 HydrophobicContact CD2-CG 3.31Å; Y1724-M2351 HydrophobicContact CD2-SD 4.12Å; Y1724-M2351 HydrophobicContact CE1-CB 4.05Å; Y1724-M2351 HydrophobicContact CE1-CE 3.88Å; Y1724-M2351 HydrophobicContact CE1-CG 3.59Å; Y1724-M2351 HydrophobicContact CE1-SD 3.12Å; Y1724-M2351 WeakPolarHBondContact CE1-SD 3.15Å; Y1724-M2351 HydrophobicContact CE2-CB 3.14Å; Y1724-M2351 HydrophobicContact CE2-CG 3.29Å; Y1724-M2351 HydrophobicContact CE2-SD 4.06Å; Y1724-M2351 HydrophobicContact CG-CB 4.32Å; Y1724-M2351 HydrophobicContact CG-CG 3.48Å; Y1724-M2351 VanDerWaalsContact CG-CG 3.48Å; Y1724-M2351 HydrophobicContact CG-SD 3.74Å; Y1724-M2351 VanDerWaalsContact CZ-CG 3.42Å; Y1724-M2351 VanDerWaalsContact CZ-SD 3.56Å
1725	R	40.8	Very low	48.1	Very low	64 Å²	64	31.1 Å²	31.1	24%	0.242	16%	0.159	C	C	.	.			trans	-126.6	91.5	160.1	-30.8	-141	-158.9	105	5.8	120.7	N1721 D1722 I1741 D1743 P1956 S1957 R1958 S1959 E1960	N1721-R1725 PolarHBondContact O-N 2.78Å; D1722-R1725 WeakPolarHBondContact O-CG 3.45Å; D1722-R1725 PolarHBondContact O-N 2.9Å; D1722-R1725 IonicContact OD1-CZ 3.81Å; D1722-R1725 IonicContact OD1-NE 2.64Å; D1722-R1725 PolarHBondContact OD1-NE 3.32Å; D1722-R1725 IonicContact OD1-NH2 3.86Å; D1722-R1725 PolarHBondContact OD1-NH2 2.72Å; D1722-R1725 IonicContact OD2-NH2 3.11Å; R1725-I1741 WeakPolarHBondContact O-CD1 3.45Å; R1725-I1741 WeakPolarHBondContact O-CG1 2.95Å; R1725-D1743 IonicContact CZ-OD2 2.82Å; R1725-D1743 VanDerWaalsContact CZ-OD2 3.27Å; R1725-D1743 IonicContact NH1-OD2 2.78Å; R1725-D1743 PolarHBondContact NH1-OD2 2.82Å; R1725-D1743 IonicContact NH2-OD2 3.7Å; R1725-D1743 PolarHBondContact NH2-OD2 2.78Å; R1725-P1956 HydrophobicContact CB-CB 3.52Å; R1725-P1956 HydrophobicContact CG-CB 3.69Å; R1725-P1956 HydrophobicContact CG-CG 4.25Å; R1725-S1957 VanDerWaalsContact C-N 3.34Å; R1725-S1957 VanDerWaalsContact N-N 3.16Å; R1725-R1958 CarbonylContact O-C 3.6Å; R1725-R1958 WeakPolarHBondContact O-CA 3.31Å; R1725-R1958 PolarHBondContact O-N 2.87Å; R1725-R1958 VanDerWaalsContact O-N 3.16Å; R1725-R1958 VanDerWaalsContact O-O 3.09Å; R1725-S1959 VanDerWaalsContact C-N 3.31Å; R1725-S1959 PolarHBondContact O-N 3.05Å; R1725-E1960 PolarHBondContact NH1-O 3.07Å
1726	L	38.1	Very low	46.3	Very low	6 Å²	6	32.9 Å²	32.9	3%	0.031	17%	0.165	C	C	.	.			trans	-146.7	161.7	-170	-120.1	140.1	0	0	0	104	M1675 H1739 F1740 S1957 R1958	M1675-L1726 HydrophobicContact CE-CD1 4.35Å; M1675-L1726 HydrophobicContact CE-CD2 4.37Å; M1675-L1726 HydrophobicContact SD-CD1 3.32Å; M1675-L1726 WeakPolarHBondContact SD-CD1 3.19Å; M1675-L1726 HydrophobicContact SD-CD2 4.12Å; M1675-L1726 HydrophobicContact SD-CG 4.43Å; L1726-H1739 WeakPolarHBondContact CA-O 3.21Å; L1726-H1739 VanDerWaalsContact CD2-O 3.27Å; L1726-H1739 WeakPolarHBondContact CD2-O 3.33Å; L1726-H1739 VanDerWaalsContact CG-C 3.49Å; L1726-H1739 WeakPolarHBondContact CG-O 3.48Å; L1726-F1740 HydrophobicContact CD1-CD1 4.44Å; L1726-F1740 HydrophobicContact CD1-CD2 4.31Å; L1726-F1740 HydrophobicContact CD1-CG 4.29Å; L1726-S1957 VanDerWaalsContact CB-C 3.46Å; L1726-S1957 WeakPolarHBondContact CB-OG 3.15Å; L1726-S1957 PolarHBondContact O-N 3.19Å; L1726-S1957 PolarHBondContact O-OG 3.45Å; L1726-R1958 HydrophobicContact CD1-CB 3.62Å; L1726-R1958 HydrophobicContact CG-CB 4.43Å
1727	K	36.2	Very low	44	Very low	124 Å²	124	33.5 Å²	33.5	54%	0.539	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.2	153.8	-68.9	-178.2	176.2	-177.6	0	108.6	S1729 H1739	K1727-S1729 PolarHBondContact O-N 3.33Å; K1727-H1739 PolarHBondContact N-O 2.8Å; K1727-H1739 PolarHBondContact O-N 3.3Å
1728	A	34.5	Very low	41.9	Very low	43 Å²	43	34.6 Å²	34.6	36%	0.355	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	102.7	158.5	0	0	0	0	0	106.8	F1677 I1706 S1737	F1677-A1728 HydrophobicContact CE1-CB 4.16Å; I1706-A1728 HydrophobicContact CD1-CB 4.13Å; A1728-S1737 CarbonylContact C-O 2.9Å; A1728-S1737 VanDerWaalsContact CA-O 3.31Å; A1728-S1737 WeakPolarHBondContact CA-O 3.42Å
1729	S	32.9	Very low	39.9	Very low	22 Å²	22	37.4 Å²	37.4	15%	0.154	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	120.6	162.9	22	0	0	0	0	107.1	K1727 S1737	K1727-S1729 PolarHBondContact O-N 3.33Å; S1729-S1737 PolarHBondContact N-O 2.67Å; S1729-S1737 WeakPolarHBondContact O-CA 3.1Å; S1729-S1737 WeakPolarHBondContact O-CB 3.04Å; S1729-S1737 PolarHBondContact O-N 2.64Å; S1729-S1737 VanDerWaalsContact O-O 3.04Å; S1729-S1737 WeakPolarHBondContact OG-CB 3.1Å; S1729-S1737 PolarHBondContact OG-OG 3.24Å
1730	L	30.8	Very low	38.2	Very low	78 Å²	78	39.4 Å²	39.4	41%	0.408	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	147.8	156.8	-137.6	79.8	0	0	0	107.7	F1736 Y1923	L1730-F1736 HydrophobicContact CD1-CE1 3.68Å; L1730-F1736 HydrophobicContact CD1-CE2 3.88Å; L1730-F1736 HydrophobicContact CD1-CZ 3.29Å; L1730-Y1923 WeakPolarHBondContact O-CE1 3.3Å; L1730-Y1923 PolarHBondContact O-OH 2.95Å
1731	H	29	Very low	36.5	Very low	11 Å²	11	41.6 Å²	41.6	5%	0.051	21%	0.21	C	C	.	.			trans	-118.9	150.5	164.9	-147.1	-93.8	0	0	0	108.6	S1733 L1735 S1827 I1918 Y1923	H1731-S1733 WeakPolarHBondContact CB-OG 3.46Å; H1731-S1733 PolarHBondContact ND1-OG 2.74Å; H1731-S1733 PolarHBondContact O-N 2.99Å; H1731-L1735 WeakPolarHBondContact CB-O 3.38Å; H1731-L1735 PolarHBondContact N-O 3.33Å; H1731-S1827 PolarHBondContact CE1-O 2.85Å; H1731-S1827 PolarHBondContact ND1-OG 3.46Å; H1731-I1918 WeakPolarHBondContact ND1-CD1 3.45Å; H1731-Y1923 AromaticContact CD2-CZ 3.93Å; H1731-Y1923 PolarHBondContact CD2-OH 3.43Å
1732	R	28.8	Very low	35	Very low	42 Å²	42	47.2 Å²	47.2	16%	0.158	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-21.3	-179.4	-118	166.8	-165.6	127.8	2.9	112.9	D1734 I1829 I1918 P1919 L1920 L1922 Y1923	R1732-D1734 VanDerWaalsContact C-N 3.33Å; R1732-D1734 PolarHBondContact O-N 3.03Å; R1732-I1829 HydrophobicContact CB-CG1 4.32Å; R1732-I1918 VanDerWaalsContact C-CG2 3.47Å; R1732-I1918 HydrophobicContact CB-CB 4.16Å; R1732-I1918 HydrophobicContact CB-CD1 3.85Å; R1732-I1918 HydrophobicContact CB-CG2 3.83Å; R1732-I1918 WeakPolarHBondContact O-CG2 3.36Å; R1732-P1919 VanDerWaalsContact CD-O 3.26Å; R1732-P1919 WeakPolarHBondContact CD-O 3.26Å; R1732-L1920 PolarHBondContact NE-O 2.84Å; R1732-L1920 PolarHBondContact NH2-O 2.79Å; R1732-L1922 HydrophobicContact CB-CB 4.42Å; R1732-L1922 HydrophobicContact CG-CB 3.84Å; R1732-L1922 VanDerWaalsContact O-CB 3.31Å; R1732-L1922 WeakPolarHBondContact O-CB 3.11Å; R1732-Y1923 HydrophobicContact CB-CD2 3.49Å; R1732-Y1923 VanDerWaalsContact CB-CD2 3.49Å; R1732-Y1923 HydrophobicContact CB-CE2 3.98Å; R1732-Y1923 HydrophobicContact CB-CG 4.26Å; R1732-Y1923 HydrophobicContact CG-CD2 3.35Å; R1732-Y1923 HydrophobicContact CG-CE2 4.32Å; R1732-Y1923 HydrophobicContact CG-CG 3.82Å
1733	S	28.2	Very low	33.7	Very low	9 Å²	9	48.9 Å²	48.9	6%	0.063	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	4.9	-167.1	9.9	0	0	0	0	116	H1731 L1735 S1827 I1918	H1731-S1733 WeakPolarHBondContact CB-OG 3.46Å; H1731-S1733 PolarHBondContact ND1-OG 2.74Å; H1731-S1733 PolarHBondContact O-N 2.99Å; S1733-L1735 PolarHBondContact O-N 2.85Å; S1733-S1827 WeakPolarHBondContact CB-OG 3.33Å; S1733-S1827 PolarHBondContact OG-OG 2.04Å; S1733-I1918 VanDerWaalsContact CB-CD1 3.44Å; S1733-I1918 WeakPolarHBondContact OG-CD1 3.41Å
1734	D	28	Very low	32.5	Very low	60 Å²	60	49.8 Å²	49.8	32%	0.321	24%	0.242	S	C	.	.	S	Bend	trans	57.4	12.6	-156.2	-57.4	-27.2	0	0	0	113.7	V1698 G1699 R1732	V1698-D1734 VanDerWaalsContact CG1-OD2 3.32Å; V1698-D1734 WeakPolarHBondContact CG1-OD2 3.15Å; G1699-D1734 WeakPolarHBondContact CA-OD2 3.46Å; G1699-D1734 PolarHBondContact N-OD2 2.98Å; R1732-D1734 VanDerWaalsContact C-N 3.33Å; R1732-D1734 PolarHBondContact O-N 3.03Å
1735	L	28.9	Very low	31.4	Very low	62 Å²	62	54.5 Å²	54.5	33%	0.325	27%	0.267	S	S	.	.			trans	-95.4	138	177.2	-69.4	172.2	0	0	0	110.6	H1731 S1733	H1731-L1735 WeakPolarHBondContact CB-O 3.38Å; H1731-L1735 PolarHBondContact N-O 3.33Å; S1733-L1735 PolarHBondContact O-N 2.85Å
1736	F	31.9	Very low	30.9	Very low	62 Å²	62	58.1 Å²	58.1	27%	0.272	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	113.8	177.4	-86.9	-108	0	0	0	110.7	F1677 I1704 L1730	F1677-F1736 HydrophobicContact CD1-CD1 4.42Å; I1704-F1736 HydrophobicContact CB-CD1 4.46Å; I1704-F1736 HydrophobicContact CB-CE1 3.6Å; I1704-F1736 HydrophobicContact CB-CZ 3.69Å; I1704-F1736 HydrophobicContact CD1-CD1 4.11Å; I1704-F1736 HydrophobicContact CD1-CD2 3.77Å; I1704-F1736 HydrophobicContact CD1-CE1 3.76Å; I1704-F1736 HydrophobicContact CD1-CE2 3.4Å; I1704-F1736 VanDerWaalsContact CD1-CE2 3.4Å; I1704-F1736 HydrophobicContact CD1-CG 4.12Å; I1704-F1736 HydrophobicContact CD1-CZ 3.39Å; I1704-F1736 HydrophobicContact CG1-CE1 3.82Å; I1704-F1736 HydrophobicContact CG1-CE2 3.9Å; I1704-F1736 HydrophobicContact CG1-CZ 3.4Å; I1704-F1736 VanDerWaalsContact CG1-CZ 3.4Å; I1704-F1736 HydrophobicContact CG2-CD1 4.2Å; I1704-F1736 HydrophobicContact CG2-CE1 3.79Å; I1704-F1736 HydrophobicContact CG2-CZ 4.3Å; L1730-F1736 HydrophobicContact CD1-CE1 3.68Å; L1730-F1736 HydrophobicContact CD1-CE2 3.88Å; L1730-F1736 HydrophobicContact CD1-CZ 3.29Å
1737	S	29.4	Very low	30.2	Very low	19 Å²	19	66.9 Å²	66.9	13%	0.133	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	138.7	169.1	-178.1	0	0	0	0	110	A1728 S1729	A1728-S1737 CarbonylContact C-O 2.9Å; A1728-S1737 VanDerWaalsContact CA-O 3.31Å; A1728-S1737 WeakPolarHBondContact CA-O 3.42Å; S1729-S1737 PolarHBondContact N-O 2.67Å; S1729-S1737 WeakPolarHBondContact O-CA 3.1Å; S1729-S1737 WeakPolarHBondContact O-CB 3.04Å; S1729-S1737 PolarHBondContact O-N 2.64Å; S1729-S1737 VanDerWaalsContact O-O 3.04Å; S1729-S1737 WeakPolarHBondContact OG-CB 3.1Å; S1729-S1737 PolarHBondContact OG-OG 3.24Å
1738	T	30.8	Very low	29.8	Very low	44 Å²	44	68.9 Å²	68.9	27%	0.27	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	82.2	-166.2	60.1	0	0	0	0	110.6	M1675 F1677 F1740	M1675-T1738 VanDerWaalsContact CE-CB 3.41Å; M1675-T1738 HydrophobicContact CE-CG2 4.1Å; M1675-T1738 WeakPolarHBondContact CE-OG1 3.33Å; F1677-T1738 HydrophobicContact CD1-CG2 4.49Å; F1677-T1738 HydrophobicContact CD2-CG2 4.39Å; F1677-T1738 HydrophobicContact CE1-CG2 3.74Å; F1677-T1738 HydrophobicContact CE2-CG2 3.64Å; F1677-T1738 HydrophobicContact CZ-CG2 3.27Å; T1738-F1740 PolarHBondContact O-N 2.99Å
1739	H	29.7	Very low	29.4	Very low	63 Å²	63	73.3 Å²	73.3	29%	0.292	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	89.7	-178.6	-67.5	-34.4	0	0	0	112.7	L1726 K1727	L1726-H1739 WeakPolarHBondContact CA-O 3.21Å; L1726-H1739 VanDerWaalsContact CD2-O 3.27Å; L1726-H1739 WeakPolarHBondContact CD2-O 3.33Å; L1726-H1739 VanDerWaalsContact CG-C 3.49Å; L1726-H1739 WeakPolarHBondContact CG-O 3.48Å; K1727-H1739 PolarHBondContact N-O 2.8Å; K1727-H1739 PolarHBondContact O-N 3.3Å
1740	F	32.9	Very low	29	Very low	41 Å²	41	81.4 Å²	81.4	18%	0.18	39%	0.392	C	S	.	.			trans	-56.6	168.5	150.6	-91.6	-86.8	0	0	0	111.6	M1675 L1726 T1738 F1768 R1958	M1675-F1740 HydrophobicContact CE-CD2 3.68Å; M1675-F1740 HydrophobicContact CE-CE2 3.34Å; M1675-F1740 HydrophobicContact CE-CZ 4.36Å; M1675-F1740 HydrophobicContact CG-CE2 4.12Å; M1675-F1740 HydrophobicContact CG-CZ 4.33Å; M1675-F1740 HydrophobicContact SD-CD2 4.24Å; M1675-F1740 HydrophobicContact SD-CE2 3.69Å; M1675-F1740 HydrophobicContact SD-CZ 4.19Å; L1726-F1740 HydrophobicContact CD1-CD1 4.44Å; L1726-F1740 HydrophobicContact CD1-CD2 4.31Å; L1726-F1740 HydrophobicContact CD1-CG 4.29Å; T1738-F1740 PolarHBondContact O-N 2.99Å; F1740-F1768 HydrophobicContact CD1-CB 4.36Å; F1740-F1768 HydrophobicContact CD2-CB 4.17Å; F1740-F1768 HydrophobicContact CD2-CD1 4.49Å; F1740-F1768 HydrophobicContact CE1-CB 3.94Å; F1740-F1768 HydrophobicContact CE2-CB 3.72Å; F1740-F1768 AromaticContact CE2-CD1 3.98Å; F1740-F1768 HydrophobicContact CE2-CD1 3.98Å; F1740-F1768 HydrophobicContact CE2-CD2 4.39Å; F1740-F1768 AromaticContact CE2-CG 3.78Å; F1740-F1768 HydrophobicContact CE2-CG 3.78Å; F1740-F1768 HydrophobicContact CG-CB 4.45Å; F1740-F1768 HydrophobicContact CZ-CB 3.61Å; F1740-F1768 HydrophobicContact CZ-CD2 4.24Å; F1740-F1768 AromaticContact CZ-CG 3.9Å; F1740-F1768 HydrophobicContact CZ-CG 3.9Å; F1740-R1958 HydrophobicContact CD1-CB 3.73Å; F1740-R1958 HydrophobicContact CD1-CG 4.01Å; F1740-R1958 HydrophobicContact CE1-CB 3.62Å; F1740-R1958 HydrophobicContact CE1-CG 3.57Å; F1740-R1958 HydrophobicContact CZ-CB 4.49Å
1741	I	33.4	Very low	28.8	Very low	48 Å²	48	83.6 Å²	83.6	25%	0.246	41%	0.411	C	S	.	.			trans	-158.1	-172.1	177.7	-2.1	164.5	0	0	0	106.3	R1725 S1959 E1960 F1962	R1725-I1741 WeakPolarHBondContact O-CD1 3.45Å; R1725-I1741 WeakPolarHBondContact O-CG1 2.95Å; I1741-S1959 CarbonylContact C-O 3.56Å; I1741-S1959 WeakPolarHBondContact CA-O 3.41Å; I1741-S1959 VanDerWaalsContact CB-O 3.28Å; I1741-S1959 WeakPolarHBondContact CB-O 3.33Å; I1741-E1960 HydrophobicContact CB-CB 3.31Å; I1741-E1960 HydrophobicContact CB-CG 4.31Å; I1741-E1960 HydrophobicContact CD1-CB 4.01Å; I1741-E1960 HydrophobicContact CG1-CB 4.23Å; I1741-E1960 HydrophobicContact CG2-CB 3.41Å; I1741-E1960 VanDerWaalsContact CG2-CB 3.41Å; I1741-E1960 HydrophobicContact CG2-CG 3.92Å; I1741-E1960 WeakPolarHBondContact CG2-OE2 3.5Å; I1741-F1962 HydrophobicContact CG2-CE2 4.42Å
1742	R	27.6	Very low	28.6	Very low	136 Å²	136	88.5 Å²	88.5	51%	0.513	44%	0.442	S	S	.	.			trans	-134.4	118.3	168.1	51.1	-81.4	-164.6	-86	0.8	116.4	S1959 E1960 S2064	R1742-S1959 CarbonylContact C-O 3.55Å; R1742-S1959 VanDerWaalsContact C-O 3.31Å; R1742-S1959 WeakPolarHBondContact CA-O 3.43Å; R1742-S1959 PolarHBondContact N-O 2.84Å; R1742-E1960 VanDerWaalsContact C-CA 3.43Å; R1742-E1960 VanDerWaalsContact CD-OE2 3.29Å; R1742-E1960 WeakPolarHBondContact CD-OE2 3.19Å; R1742-E1960 WeakPolarHBondContact CG-OE2 3.21Å; R1742-E1960 IonicContact CZ-OE2 3.36Å; R1742-E1960 PolarHBondContact N-OE2 3.07Å; R1742-E1960 IonicContact NE-OE2 2.7Å; R1742-E1960 VanDerWaalsContact NH1-CD 3.31Å; R1742-E1960 IonicContact NH1-OE1 2.67Å; R1742-E1960 PolarHBondContact NH1-OE1 2.85Å; R1742-E1960 IonicContact NH1-OE2 3.48Å; R1742-E1960 PolarHBondContact NH1-OE2 2.8Å; R1742-E1960 WeakPolarHBondContact O-CA 3.24Å; R1742-E1960 WeakPolarHBondContact O-CB 3.36Å; R1742-E1960 WeakPolarHBondContact O-CG 3.43Å; R1742-S2064 PolarHBondContact NH1-OG 2.98Å
1743	D	29.1	Very low	28.4	Very low	54 Å²	54	92.8 Å²	92.8	29%	0.289	47%	0.468	S	S	.	.			trans	-116.2	-27.3	170.8	-143.6	-14.6	0	0	0	111.7	R1725 S1959 E1960 S1961	R1725-D1743 IonicContact CZ-OD2 2.82Å; R1725-D1743 VanDerWaalsContact CZ-OD2 3.27Å; R1725-D1743 IonicContact NH1-OD2 2.78Å; R1725-D1743 PolarHBondContact NH1-OD2 2.82Å; R1725-D1743 IonicContact NH2-OD2 3.7Å; R1725-D1743 PolarHBondContact NH2-OD2 2.78Å; D1743-S1959 PolarHBondContact N-O 3.38Å; D1743-E1960 VanDerWaalsContact CB-CA 3.49Å; D1743-E1960 VanDerWaalsContact OD2-C 3.25Å; D1743-S1961 VanDerWaalsContact CG-CA 3.46Å; D1743-S1961 WeakPolarHBondContact OD1-CA 3.4Å; D1743-S1961 WeakPolarHBondContact OD1-CB 3.15Å; D1743-S1961 PolarHBondContact OD1-N 3.43Å; D1743-S1961 PolarHBondContact OD2-N 2.88Å
1744	F	29.2	Very low	28.3	Very low	46 Å²	46	98.5 Å²	98.5	20%	0.202	50%	0.498	C	S	.	.			trans	-86.4	130.9	167.6	-72.3	-98.6	0	0	0	107.5	D1722 F1723 T2152	D1722-F1744 HydrophobicContact CB-CD2 4.46Å; D1722-F1744 HydrophobicContact CB-CE2 3.44Å; D1722-F1744 VanDerWaalsContact CB-CE2 3.44Å; D1722-F1744 HydrophobicContact CB-CZ 3.93Å; F1723-F1744 HydrophobicContact CB-CD2 4.19Å; F1723-F1744 HydrophobicContact CB-CE2 3.58Å; F1723-F1744 HydrophobicContact CB-CZ 3.94Å; F1723-F1744 HydrophobicContact CD1-CB 4.42Å; F1723-F1744 AromaticContact CD1-CD2 3.35Å; F1723-F1744 HydrophobicContact CD1-CD2 3.35Å; F1723-F1744 AromaticContact CD1-CE2 3.71Å; F1723-F1744 HydrophobicContact CD1-CE2 3.71Å; F1723-F1744 AromaticContact CD1-CG 3.96Å; F1723-F1744 HydrophobicContact CD1-CG 3.96Å; F1723-F1744 AromaticContact CD2-CD1 3.94Å; F1723-F1744 HydrophobicContact CD2-CD1 3.94Å; F1723-F1744 AromaticContact CD2-CD2 3.84Å; F1723-F1744 HydrophobicContact CD2-CD2 3.84Å; F1723-F1744 AromaticContact CD2-CE1 3.89Å; F1723-F1744 HydrophobicContact CD2-CE1 3.89Å; F1723-F1744 AromaticContact CD2-CE2 3.78Å; F1723-F1744 HydrophobicContact CD2-CE2 3.78Å; F1723-F1744 AromaticContact CD2-CG 3.93Å; F1723-F1744 HydrophobicContact CD2-CG 3.93Å; F1723-F1744 AromaticContact CD2-CZ 3.82Å; F1723-F1744 HydrophobicContact CD2-CZ 3.82Å; F1723-F1744 HydrophobicContact CE1-CB 3.74Å; F1723-F1744 AromaticContact CE1-CD2 3.57Å; F1723-F1744 HydrophobicContact CE1-CD2 3.57Å; F1723-F1744 HydrophobicContact CE1-CE2 4.33Å; F1723-F1744 AromaticContact CE1-CG 3.73Å; F1723-F1744 HydrophobicContact CE1-CG 3.73Å; F1723-F1744 HydrophobicContact CE2-CB 4.14Å; F1723-F1744 AromaticContact CE2-CD1 3.76Å; F1723-F1744 HydrophobicContact CE2-CD1 3.76Å; F1723-F1744 HydrophobicContact CE2-CD2 4.03Å; F1723-F1744 HydrophobicContact CE2-CE1 4.16Å; F1723-F1744 HydrophobicContact CE2-CE2 4.4Å; F1723-F1744 AromaticContact CE2-CG 3.71Å; F1723-F1744 HydrophobicContact CE2-CG 3.71Å; F1723-F1744 HydrophobicContact CE2-CZ 4.47Å; F1723-F1744 HydrophobicContact CG-CD1 4.45Å; F1723-F1744 AromaticContact CG-CD2 3.51Å; F1723-F1744 HydrophobicContact CG-CD2 3.51Å; F1723-F1744 HydrophobicContact CG-CE1 4.36Å; F1723-F1744 AromaticContact CG-CE2 3.4Å; F1723-F1744 HydrophobicContact CG-CE2 3.4Å; F1723-F1744 HydrophobicContact CG-CG 4.07Å; F1723-F1744 AromaticContact CG-CZ 3.86Å; F1723-F1744 HydrophobicContact CG-CZ 3.86Å; F1723-F1744 HydrophobicContact CZ-CB 3.58Å; F1723-F1744 HydrophobicContact CZ-CD1 4.12Å; F1723-F1744 AromaticContact CZ-CD2 3.91Å; F1723-F1744 HydrophobicContact CZ-CD2 3.91Å; F1723-F1744 AromaticContact CZ-CG 3.61Å; F1723-F1744 HydrophobicContact CZ-CG 3.61Å; F1723-F1744 VanDerWaalsContact N-CE2 3.33Å; F1744-T2152 HydrophobicContact CD1-CG2 3.8Å; F1744-T2152 HydrophobicContact CE1-CG2 3.86Å
1745	I	29.2	Very low	28.3	Very low	111 Å²	111	102 Å²	102	57%	0.569	52%	0.515	S	S	*	.			cis	-145	130.1	4.5	-90.1	139.8	0	0	0	109.6	T2152	I1745-T2152 HydrophobicContact CD1-CG2 4.11Å
1746	I	30.2	Very low	28.1	Very low	140 Å²	140	106 Å²	106	72%	0.718	54%	0.536	S	S	*	.			trans	32.7	109.4	143	-46.6	172	0	0	0	118.4	Q1748	I1746-Q1748 HydrophobicContact CG2-CB 4.35Å
1747	E	23.1	Very low	27.9	Very low	189 Å²	189	109 Å²	109	88%	0.883	57%	0.565	S	S	*	*			trans	-93.8	126.3	142.5	-64.6	-178	134.3	0	0	108.9
1748	Q	28.4	Very low	27.8	Very low	167 Å²	167	118.3 Å²	118.3	78%	0.78	60%	0.599	S	S	*	*			trans	-169	124.6	158.9	-113	165.3	47.9	0	0	115.2	I1746	I1746-Q1748 HydrophobicContact CG2-CB 4.35Å
1749	N	26.4	Very low	27.5	Very low	135 Å²	135	123.2 Å²	123.2	72%	0.722	62%	0.624	S	S	*	*			trans	49.5	108.2	144.7	-59	-16.8	0	0	0	123.2
1750	F	23.9	Very low	27.5	Very low	192 Å²	192	124.3 Å²	124.3	84%	0.842	64%	0.636	S	S	*	*				16.4	139.3	124.4	-69.7	-76.2	0	0	0	120.2
1751	P	25.9	Very low	27.1	Very low	125 Å²	125	126.9 Å²	126.9	81%	0.812	65%	0.651	S	S	*	*				-145.9	-177.4	70.5	41.7	-24.1	0	0	0	118.3
1752	V	25.8	Very low	26.6	Very low	113 Å²	113	133.6 Å²	133.6	69%	0.685	67%	0.673	S	S	*	*			trans	-79.1	142.4	-170.9	-164.3	0	0	0	0	113.3
1753	N	24.7	Very low	26.5	Very low	132 Å²	132	131.8 Å²	131.8	71%	0.706	67%	0.671	S	S	*	*			trans	141.8	133.5	133.8	-77.7	-62.6	0	0	0	115.9
1754	N	25.3	Very low	26.3	Very low	130 Å²	130	131.5 Å²	131.5	70%	0.695	68%	0.675	S	S	*	*			trans	66.6	118.8	141	-73.7	-13	0	0	0	123.9
1755	I	27.9	Very low	26	Very low	134 Å²	134	134.3 Å²	134.3	69%	0.687	71%	0.707	S	S	*	*				81.7	101.5	127.2	-61.4	169.4	0	0	0	118.5
1756	N	26.1	Very low	25.7	Very low	144 Å²	144	136.2 Å²	136.2	77%	0.77	71%	0.712	S	S	*	*			trans	49.2	101.8	136.1	-51	-7.6	0	0	0	120.2
1757	S	27.2	Very low	25.4	Very low	126 Å²	126	131.8 Å²	131.8	88%	0.881	70%	0.7	S	S	*	*				178.5	167.4	120.2	44.3	0	0	0	0	114.3
1758	Y	27.4	Very low	25.4	Very low	214 Å²	214	129 Å²	129	84%	0.839	69%	0.686	S	S	*	*			trans	-59	130.7	-168.8	-77.4	-105.2	0	0	0	117.9
1759	N	24.6	Very low	25.2	Very low	148 Å²	148	124.9 Å²	124.9	79%	0.791	68%	0.675	S	S	*	*			trans	60.7	169.7	151.3	-65.9	-16.4	0	0	0	117.3
1760	P	28.3	Very low	25.1	Very low	85 Å²	85	125.9 Å²	125.9	55%	0.552	68%	0.679	S	S	*	*			cis	-128.6	-172.1	-6.4	43.4	-27.5	0	0	0	114.3
1761	I	24.5	Very low	25.1	Very low	96 Å²	96	122.4 Å²	122.4	49%	0.492	67%	0.665	S	S	.	*			trans	38.8	118.6	145.1	-62	155.5	0	0	0	119.9	L1630 H1763	L1630-I1761 HydrophobicContact CD2-CG2 4.49Å; I1761-H1763 WeakPolarHBondContact CG2-CD2 3.42Å
1762	R	24.7	Very low	25	Very low	189 Å²	189	120.2 Å²	120.2	71%	0.713	65%	0.653	S	S	*	*			trans	-134.8	141.8	141.2	-73.7	-164.8	172.7	-145.9	-5.6	110.2
1763	H	24.7	Very low	24.9	Very low	98 Å²	98	121.3 Å²	121.3	45%	0.454	65%	0.654	S	S	.	*			trans	-114.4	142.2	-165.8	-88.9	-87.2	0	0	0	114.9	G1629 L1630 I1761	G1629-H1763 VanDerWaalsContact O-CB 3.23Å; G1629-H1763 WeakPolarHBondContact O-CB 3.22Å; L1630-H1763 WeakPolarHBondContact CD2-CD2 3.22Å; I1761-H1763 WeakPolarHBondContact CG2-CD2 3.42Å
1764	A	24	Very low	25	Very low	47 Å²	47	119.8 Å²	119.8	39%	0.388	65%	0.652	S	S	.	*			trans	46.2	82	136.2	0	0	0	0	0	119.1	R1673 F1766	R1673-A1764 PolarHBondContact NH1-O 2.86Å; R1673-A1764 PolarHBondContact NH2-O 2.93Å; A1764-F1766 VanDerWaalsContact C-N 3.29Å; A1764-F1766 HydrophobicContact CB-CD2 4.42Å; A1764-F1766 PolarHBondContact O-N 2.84Å
1765	A	24.3	Very low	25	Very low	106 Å²	106	123.5 Å²	123.5	88%	0.876	66%	0.662	S	S	*	*			trans	-85.4	60.1	155.1	0	0	0	0	0	111.9	G1767	A1765-G1767 PolarHBondContact O-N 2.8Å
1766	F	22.1	Very low	24.9	Very low	151 Å²	151	119 Å²	119	66%	0.662	64%	0.642	S	S	*	*			trans	-61.6	120.5	158.6	-88.7	-97.5	0	0	0	108.2	R1673 A1764	R1673-F1766 WeakPolarHBondContact CD-O 2.88Å; R1673-F1766 HydrophobicContact CG-CB 4.4Å; R1673-F1766 PolarHBondContact NH1-O 3.48Å; A1764-F1766 VanDerWaalsContact C-N 3.29Å; A1764-F1766 HydrophobicContact CB-CD2 4.42Å; A1764-F1766 PolarHBondContact O-N 2.84Å
1767	G	23.7	Very low	24.8	Very low	46 Å²	46	121 Å²	121	47%	0.474	64%	0.644	S	S	.	*			trans	-164.8	148.7	174.5	0	0	0	0	0	108.6	A1765 S1769	A1765-G1767 PolarHBondContact O-N 2.8Å; G1767-S1769 PolarHBondContact O-N 3.23Å
1768	F	23.3	Very low	24.8	Very low	131 Å²	131	120 Å²	120	58%	0.575	64%	0.637	S	S	*	*			trans	-67.7	96	-179	-100	-109.2	0	0	0	110.7	F1740	F1740-F1768 HydrophobicContact CD1-CB 4.36Å; F1740-F1768 HydrophobicContact CD2-CB 4.17Å; F1740-F1768 HydrophobicContact CD2-CD1 4.49Å; F1740-F1768 HydrophobicContact CE1-CB 3.94Å; F1740-F1768 HydrophobicContact CE2-CB 3.72Å; F1740-F1768 AromaticContact CE2-CD1 3.98Å; F1740-F1768 HydrophobicContact CE2-CD1 3.98Å; F1740-F1768 HydrophobicContact CE2-CD2 4.39Å; F1740-F1768 AromaticContact CE2-CG 3.78Å; F1740-F1768 HydrophobicContact CE2-CG 3.78Å; F1740-F1768 HydrophobicContact CG-CB 4.45Å; F1740-F1768 HydrophobicContact CZ-CB 3.61Å; F1740-F1768 HydrophobicContact CZ-CD2 4.24Å; F1740-F1768 AromaticContact CZ-CG 3.9Å; F1740-F1768 HydrophobicContact CZ-CG 3.9Å
1769	S	24	Very low	24.6	Very low	80 Å²	80	115.3 Å²	115.3	56%	0.559	63%	0.631	S	S	*	*			trans	-113.2	98	-177.9	66.9	0	0	0	0	111.7	G1767 H1771	G1767-S1769 PolarHBondContact O-N 3.23Å; S1769-H1771 VanDerWaalsContact C-N 3.3Å; S1769-H1771 VanDerWaalsContact CB-CD2 3.49Å; S1769-H1771 WeakPolarHBondContact CB-CD2 3.42Å; S1769-H1771 PolarHBondContact O-N 3.39Å
1770	I	24.8	Very low	24.6	Very low	157 Å²	157	115 Å²	115	81%	0.805	63%	0.629	S	S	*	*			trans	-74.3	88.2	165.3	-57.1	173.7	0	0	0	107.1
1771	H	24	Very low	24.4	Very low	118 Å²	118	120 Å²	120	55%	0.546	65%	0.645	S	S	.	*			trans	-102.5	94.6	-179.1	-91.3	-53.6	0	0	0	112.2	S1769 L1773	S1769-H1771 VanDerWaalsContact C-N 3.3Å; S1769-H1771 VanDerWaalsContact CB-CD2 3.49Å; S1769-H1771 WeakPolarHBondContact CB-CD2 3.42Å; S1769-H1771 PolarHBondContact O-N 3.39Å; H1771-L1773 HydrophobicContact CB-CD1 4.16Å; H1771-L1773 HydrophobicContact CB-CG 4.13Å; H1771-L1773 PolarHBondContact O-N 2.99Å
1772	S	23	Very low	24.6	Very low	79 Å²	79	120.7 Å²	120.7	55%	0.552	65%	0.654	S	S	*	*			trans	-73.3	94.5	143.9	41.6	0	0	0	0	108.5	Q2063	S1772-Q2063 PolarHBondContact OG-OE1 3.13Å
1773	L	24.8	Very low	24.5	Very low	136 Å²	136	119.7 Å²	119.7	71%	0.712	66%	0.657	S	S	*	*			trans	-94	131.1	171.8	-83.2	165.6	0	0	0	110.4	H1771	H1771-L1773 HydrophobicContact CB-CD1 4.16Å; H1771-L1773 HydrophobicContact CB-CG 4.13Å; H1771-L1773 PolarHBondContact O-N 2.99Å
1774	P	25.9	Very low	24.5	Very low	101 Å²	101	119.4 Å²	119.4	66%	0.656	66%	0.655	S	S	*	*			trans	-95.3	153.5	-163.9	36.3	-37	0	0	0	115	S1776	P1774-S1776 PolarHBondContact O-N 3.04Å
1775	F	24.8	Very low	24.8	Very low	207 Å²	207	121.7 Å²	121.7	91%	0.908	66%	0.659	S	S	*	*			trans	-76.2	104.2	166.2	-93.7	-90.3	0	0	0	111.8
1776	S	26.4	Very low	24.8	Very low	39 Å²	39	120.5 Å²	120.5	27%	0.273	64%	0.636	S	S	.	*			trans	-169.7	105.2	146.8	51	0	0	0	0	115.5	P1774 S1988 L1989	P1774-S1776 PolarHBondContact O-N 3.04Å; S1776-S1988 WeakPolarHBondContact OG-CA 3.42Å; S1776-S1988 PolarHBondContact OG-N 2.8Å; S1776-L1989 WeakPolarHBondContact O-CD1 3.27Å
1777	K	25	Very low	25	Very low	186 Å²	186	118.3 Å²	118.3	81%	0.809	63%	0.631	S	S	*	*			trans	36.3	110.7	132	-60.8	-179	176.3	-178.8	0	120.5	L1989	K1777-L1989 WeakPolarHBondContact O-CD1 3.42Å
1778	S	26.1	Very low	25.2	Very low	105 Å²	105	119.5 Å²	119.5	73%	0.734	62%	0.624	S	S	*	*				-170.1	130.9	100.6	46.4	0	0	0	0	115.6
1779	T	24.3	Very low	25.4	Very low	117 Å²	117	118.2 Å²	118.2	72%	0.718	62%	0.618	S	S	*	*			trans	55.8	106.8	148.7	51	0	0	0	0	122.7
1780	N	24.4	Very low	25.5	Very low	142 Å²	142	118.9 Å²	118.9	76%	0.759	62%	0.616	S	S	*	*				109.7	114.2	124	-64.2	-3.1	0	0	0	121.1
1781	Q	24.7	Very low	25.4	Very low	188 Å²	188	116.6 Å²	116.6	88%	0.879	61%	0.614	S	S	*	*			trans	74	150.7	153.8	-64.6	-177.8	-20.6	0	0	118.8
1782	V	27.6	Very low	25.5	Very low	111 Å²	111	117.6 Å²	117.6	67%	0.673	62%	0.618	S	S	*	*			trans	70.3	74.2	-157.4	-169.6	0	0	0	0	110.9	F1784	V1782-F1784 HydrophobicContact CG1-CD2 4.2Å; V1782-F1784 HydrophobicContact CG1-CE1 4.36Å; V1782-F1784 HydrophobicContact CG1-CE2 3.69Å; V1782-F1784 HydrophobicContact CG1-CZ 3.75Å
1783	E	23.2	Very low	25.5	Very low	169 Å²	169	124 Å²	124	79%	0.79	63%	0.63	S	S	*	*				44.9	112.4	84.2	-61.2	-164.8	133.6	0	0	112.7
1784	F	25	Very low	25.5	Very low	91 Å²	91	122.5 Å²	122.5	40%	0.399	64%	0.637	S	S	.	*			trans	-175.2	-132.3	147.1	-67.9	-31.4	0	0	0	116.1	G1195 H1196 K1197 V1782	G1195-F1784 CarbonylContact C-O 3.56Å; G1195-F1784 VanDerWaalsContact C-O 3.24Å; H1196-F1784 HydrophobicContact CB-CB 4.24Å; H1196-F1784 HydrophobicContact CB-CD1 3.95Å; H1196-F1784 PolarHBondContact N-O 3.05Å; K1197-F1784 HydrophobicContact CB-CB 3.97Å; K1197-F1784 HydrophobicContact CB-CD1 4.09Å; K1197-F1784 HydrophobicContact CB-CD2 3.87Å; K1197-F1784 HydrophobicContact CB-CE2 4.5Å; K1197-F1784 HydrophobicContact CB-CG 3.68Å; K1197-F1784 HydrophobicContact CD-CD1 3.78Å; K1197-F1784 HydrophobicContact CD-CD2 4.16Å; K1197-F1784 HydrophobicContact CD-CE1 3.65Å; K1197-F1784 HydrophobicContact CD-CE2 4Å; K1197-F1784 HydrophobicContact CD-CG 4.09Å; K1197-F1784 HydrophobicContact CD-CZ 3.78Å; K1197-F1784 VanDerWaalsContact CE-CE1 3.46Å; K1197-F1784 HydrophobicContact CG-CD1 3.81Å; K1197-F1784 HydrophobicContact CG-CD2 4.36Å; K1197-F1784 HydrophobicContact CG-CE1 4.22Å; K1197-F1784 HydrophobicContact CG-CG 3.95Å; K1197-F1784 VanDerWaalsContact NZ-CZ 3.3Å; K1197-F1784 WeakPolarHBondContact O-CB 3.32Å; V1782-F1784 HydrophobicContact CG1-CD2 4.2Å; V1782-F1784 HydrophobicContact CG1-CE1 4.36Å; V1782-F1784 HydrophobicContact CG1-CE2 3.69Å; V1782-F1784 HydrophobicContact CG1-CZ 3.75Å
1785	I	29.3	Very low	25.4	Very low	95 Å²	95	120 Å²	120	49%	0.487	63%	0.625	S	S	.	*			trans	-87.8	169.2	-156.1	-124.8	175.8	0	0	0	119.8	G1195 K1197 E1198	G1195-I1785 WeakPolarHBondContact O-CA 2.97Å; K1197-I1785 VanDerWaalsContact C-CB 3.41Å; K1197-I1785 VanDerWaalsContact N-CB 3.25Å; K1197-I1785 WeakPolarHBondContact O-CB 3.47Å; K1197-I1785 WeakPolarHBondContact O-CG2 3.49Å; K1197-I1785 PolarHBondContact O-N 2.99Å; E1198-I1785 HydrophobicContact CB-CG2 4.31Å
1786	Q	25	Very low	25.4	Very low	82 Å²	82	116.8 Å²	116.8	38%	0.383	62%	0.617	S	S	.	*			cis	85.1	149.5	1.4	-71.6	-156.9	-13.9	0	0	124.4	S1193 G1195	S1193-Q1786 PolarHBondContact O-NE2 3.45Å; S1193-Q1786 PolarHBondContact O-OE1 3.16Å; G1195-Q1786 VanDerWaalsContact O-CB 3.31Å; G1195-Q1786 WeakPolarHBondContact O-CB 3.22Å; G1195-Q1786 VanDerWaalsContact O-CG 3.27Å; G1195-Q1786 WeakPolarHBondContact O-CG 3.33Å
1787	D	26.4	Very low	25.3	Very low	105 Å²	105	122 Å²	122	56%	0.561	63%	0.631	S	S	*	*			trans	41.2	135.7	170.8	-59.7	-1.8	0	0	0	121.1
1788	E	26.2	Very low	25.4	Very low	71 Å²	71	120.1 Å²	120.1	33%	0.332	63%	0.628	S	S	.	*			cis	-158.9	157.7	-23	-100.7	-139.1	156.3	0	0	109.4	S1191	S1191-E1788 WeakPolarHBondContact CB-OE1 3.39Å; S1191-E1788 PolarHBondContact N-OE1 2.88Å; S1191-E1788 PolarHBondContact N-OE2 3.32Å; S1191-E1788 PolarHBondContact OG-OE1 3.36Å
1789	K	28.4	Very low	25.3	Very low	103 Å²	103	117.5 Å²	117.5	45%	0.448	62%	0.618	S	S	.	*			trans	20.3	98.6	152.6	-58.2	169.7	-169.4	133.2	0	118.4	T1189 H1190 S1191	T1189-K1789 HydrophobicContact CG2-CD 4.49Å; H1190-K1789 VanDerWaalsContact C-NZ 3.34Å; H1190-K1789 PolarHBondContact O-NZ 2.93Å; S1191-K1789 PolarHBondContact OG-NZ 2.97Å
1790	N	26.3	Very low	25.4	Very low	95 Å²	95	119.4 Å²	119.4	51%	0.508	62%	0.623	S	S	.	*			trans	-155.8	136.4	149.9	-104.4	-49.2	0	0	0	113.6	H1187	H1187-N1790 WeakPolarHBondContact CB-ND2 3.26Å; H1187-N1790 PolarHBondContact CD2-ND2 2.83Å; H1187-N1790 VanDerWaalsContact CD2-ND2 3.31Å; H1187-N1790 PolarHBondContact CE1-OD1 3.37Å; H1187-N1790 PolarHBondContact ND1-ND2 2.88Å; H1187-N1790 PolarHBondContact ND1-OD1 2.85Å
1791	S	23.6	Very low	25.5	Very low	109 Å²	109	118.1 Å²	118.1	76%	0.762	63%	0.625	S	S	*	*			trans	-121.5	84.6	-178.3	-175.7	0	0	0	0	110.7
1792	H	24.9	Very low	25.6	Very low	138 Å²	138	116.3 Å²	116.3	64%	0.639	62%	0.621	S	S	*	*			trans	-143.3	110.3	-178.4	-76.8	-81.3	0	0	0	116.4
1793	W	23.2	Very low	25.6	Very low	214 Å²	214	119.6 Å²	119.6	81%	0.811	63%	0.626	S	S	*	*			trans	25.3	111.1	141.8	-39.9	77.3	0	0	0	120.3
1794	A	24.3	Very low	25.9	Very low	104 Å²	104	117.7 Å²	117.7	86%	0.86	62%	0.62	S	S	*	*			trans	-128.4	114.2	145.2	0	0	0	0	0	106.8
1795	A	24	Very low	25.8	Very low	48 Å²	48	121.2 Å²	121.2	40%	0.397	64%	0.643	S	S	.	*			cis	68.6	95.7	22.8	0	0	0	0	0	113.3	R1797	A1795-R1797 VanDerWaalsContact C-N 3.28Å; A1795-R1797 PolarHBondContact O-N 2.83Å
1796	L	24.9	Very low	25.5	Very low	141 Å²	141	120.3 Å²	120.3	74%	0.738	66%	0.657	S	S	*	*			trans	-69.2	84.7	176.2	-161.3	165.3	0	0	0	109.3	I1798	L1796-I1798 HydrophobicContact CD2-CD1 4.05Å; L1796-I1798 HydrophobicContact CD2-CG1 3.56Å; L1796-I1798 PolarHBondContact O-N 2.67Å
1797	R	24.6	Very low	25.6	Very low	149 Å²	149	123.7 Å²	123.7	56%	0.562	68%	0.683	S	S	*	*			trans	-79.1	84.1	-171.8	-173.2	-177.3	178.6	-164.5	-3.6	110.5	A1795 G1799	A1795-R1797 VanDerWaalsContact C-N 3.28Å; A1795-R1797 PolarHBondContact O-N 2.83Å; R1797-G1799 PolarHBondContact O-N 2.91Å
1798	I	26.1	Very low	25.5	Very low	145 Å²	145	123.9 Å²	123.9	74%	0.744	69%	0.693	S	S	*	*			trans	-70.8	63.8	161	-48	-176.6	0	0	0	108.7	L1796 L1800	L1796-I1798 HydrophobicContact CD2-CD1 4.05Å; L1796-I1798 HydrophobicContact CD2-CG1 3.56Å; L1796-I1798 PolarHBondContact O-N 2.67Å; I1798-L1800 PolarHBondContact O-N 2.93Å
1799	G	24.7	Very low	25.5	Very low	51 Å²	51	126 Å²	126	53%	0.526	71%	0.712	S	S	.	*			trans	-88	80.4	-177.6	0	0	0	0	0	110.7	R1797 S1801	R1797-G1799 PolarHBondContact O-N 2.91Å; G1799-S1801 PolarHBondContact O-N 2.89Å
1800	L	26.6	Very low	25.4	Very low	157 Å²	157	124.6 Å²	124.6	82%	0.822	72%	0.716	S	S	*	*			trans	-57.9	105.8	167.3	-91.8	159.1	0	0	0	109.2	I1798	I1798-L1800 PolarHBondContact O-N 2.93Å
1801	S	27.1	Very low	25.3	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	73%	0.725	S	S	*	*			trans	-80.6	124.2	-179.5	-172.4	0	0	0	0	109.9	G1799 K1803	G1799-S1801 PolarHBondContact O-N 2.89Å; S1801-K1803 PolarHBondContact O-N 3.49Å
1802	N	25.6	Very low	25.4	Very low	149 Å²	149	130.2 Å²	130.2	80%	0.797	73%	0.725	S	S	*	*			trans	-64.5	105	-173	-67.5	-48	0	0	0	112.9
1803	K	27.4	Very low	25.3	Very low	181 Å²	181	128.1 Å²	128.1	79%	0.787	73%	0.725	S	S	*	*			trans	-171.7	160.6	148.8	-108.7	157.3	-172.5	179.5	0	112.8	S1801	S1801-K1803 PolarHBondContact O-N 3.49Å
1804	I	30.3	Very low	25.4	Very low	128 Å²	128	126.2 Å²	126.2	66%	0.656	73%	0.73	S	S	*	*			trans	77	107.2	-175.5	-50.6	175.7	0	0	0	112.4	L1712	L1712-I1804 HydrophobicContact CD1-CD1 4.1Å; L1712-I1804 HydrophobicContact CD2-CD1 4.07Å
1805	N	23.8	Very low	25.4	Very low	165 Å²	165	126.7 Å²	126.7	88%	0.882	73%	0.725	S	S	*	*			trans	-80.5	160.1	179.6	-54	-21.6	0	0	0	110.6
1806	G	23	Very low	25.5	Very low	76 Å²	76	133.6 Å²	133.6	78%	0.784	74%	0.742	S	S	*	*			trans	-179.7	-90.6	175.7	0	0	0	0	0	113.8
1807	V	26.3	Very low	25.5	Very low	153 Å²	153	131.3 Å²	131.3	93%	0.927	74%	0.738	S	S	*	*			trans	-124.2	131.2	-171.1	-174.1	0	0	0	0	110.6
1808	S	23.2	Very low	25.5	Very low	109 Å²	109	128.2 Å²	128.2	76%	0.762	73%	0.732	S	S	*	*			trans	-111.4	176.1	-176.3	81.6	0	0	0	0	110.1
1809	P	28	Very low	25.6	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	72%	0.724	S	S	*	*				-125	179.8	-123.2	34.1	-14.4	0	0	0	115
1810	S	24.4	Very low	26.1	Very low	75 Å²	75	126.7 Å²	126.7	52%	0.524	72%	0.72	S	S	.	*			trans	-153.7	118.5	158.8	-76.8	0	0	0	0	111.9
1811	Y	24.7	Very low	26.6	Very low	178 Å²	178	124.1 Å²	124.1	70%	0.698	71%	0.706	S	S	*	*			trans	5.3	133.1	158.8	-42.8	-83.9	0	0	0	118.5	W1487	W1487-Y1811 AromaticContact CH2-CD2 3.92Å; W1487-Y1811 HydrophobicContact CH2-CD2 3.92Å; W1487-Y1811 AromaticContact CZ2-CD2 3.96Å; W1487-Y1811 HydrophobicContact CZ2-CD2 3.96Å
1812	L	26.4	Very low	27.1	Very low	144 Å²	144	119 Å²	119	75%	0.754	67%	0.67	S	S	*	*				-134.9	153.2	69.1	-166.4	72.9	0	0	0	113.9	L1696	L1696-L1812 HydrophobicContact CD1-CD1 4.14Å; L1696-L1812 HydrophobicContact CD1-CD2 3.79Å; L1696-L1812 HydrophobicContact CD1-CG 4.45Å
1813	S	23	Very low	27.8	Very low	93 Å²	93	115.6 Å²	115.6	65%	0.65	65%	0.651	S	S	*	*			trans	-147.7	126.2	-178.3	58.9	0	0	0	0	113.9
1814	L	25.1	Very low	28.2	Very low	174 Å²	174	108.7 Å²	108.7	91%	0.911	63%	0.632	S	S	*	*			trans	-141.8	149.7	158.7	-72.5	178.3	0	0	0	109.8
1815	P	25	Very low	28.5	Very low	115 Å²	115	104.6 Å²	104.6	75%	0.747	61%	0.611	S	S	*	*			trans	-125.1	138.4	-152.2	35.6	-18.3	0	0	0	117.8
1816	Y	24.4	Very low	29.5	Very low	192 Å²	192	100.3 Å²	100.3	75%	0.753	59%	0.591	S	S	*	*			trans	55.6	108.4	135.7	-159.6	-88.4	0	0	0	120.9
1817	S	25.7	Very low	30.8	Very low	93 Å²	93	96.7 Å²	96.7	65%	0.65	55%	0.554	S	S	*	*				-162.7	155.7	117.6	59.2	0	0	0	0	113
1818	N	24.7	Very low	32.2	Very low	85 Å²	85	89.5 Å²	89.5	46%	0.455	51%	0.51	S	S	.	.			trans	-46.4	128.7	-168	-50.9	-30.2	0	0	0	116.6
1819	S	28.6	Very low	33.6	Very low	80 Å²	80	85.3 Å²	85.3	56%	0.559	48%	0.479	S	S	*	.			trans	-124.6	157.2	161.2	57.7	0	0	0	0	111.2
1820	L	34.1	Very low	34.9	Very low	84 Å²	84	80.6 Å²	80.6	44%	0.44	45%	0.447	S	S	.	.			trans	-106.7	134.4	172.6	-162.4	93.1	0	0	0	107.7	L1822 I1913	L1820-L1822 PolarHBondContact O-N 2.86Å; L1820-I1913 HydrophobicContact CB-CB 4.35Å; L1820-I1913 HydrophobicContact CB-CD1 3.98Å; L1820-I1913 HydrophobicContact CB-CG1 3.75Å; L1820-I1913 HydrophobicContact CB-CG2 3.95Å; L1820-I1913 HydrophobicContact CD2-CD1 3.65Å; L1820-I1913 HydrophobicContact CD2-CG1 4.21Å; L1820-I1913 HydrophobicContact CG-CD1 4.46Å; L1820-I1913 WeakPolarHBondContact O-CG2 3.26Å
1821	D	37.4	Very low	36	Very low	102 Å²	102	79.4 Å²	79.4	55%	0.545	45%	0.447	S	S	.	.			trans	-78.9	114	-176.8	-166.8	-7	0	0	0	111.4	G1824 L1825	D1821-G1824 WeakPolarHBondContact OD1-CA 3.44Å; D1821-G1824 PolarHBondContact OD1-N 3.42Å; D1821-L1825 PolarHBondContact OD1-N 2.83Å
1822	L	39	Very low	37.4	Very low	7 Å²	7	73.4 Å²	73.4	4%	0.037	43%	0.425	C	S	.	.	B	Isolated β-bridge	trans	-93.7	99.8	179.4	-108.6	168.2	0	0	0	109.6	L1820 G1824 L1825 L1836 P1837 W1852 L1879 I1913 L1915	L1820-L1822 PolarHBondContact O-N 2.86Å; L1822-G1824 PolarHBondContact O-N 2.8Å; L1822-G1824 VanDerWaalsContact O-N 3.17Å; L1822-L1825 PolarHBondContact O-N 3.3Å; L1822-L1825 VanDerWaalsContact O-N 3.12Å; L1822-L1836 HydrophobicContact CD1-CD2 4.31Å; L1822-L1836 HydrophobicContact CD2-CD2 4.5Å; L1822-P1837 HydrophobicContact CD2-CG 3.77Å; L1822-W1852 HydrophobicContact CD1-CH2 4.35Å; L1822-W1852 HydrophobicContact CD1-CZ3 4.08Å; L1822-W1852 HydrophobicContact CD2-CH2 4.09Å; L1822-L1879 HydrophobicContact CD1-CD1 3.28Å; L1822-I1913 HydrophobicContact CD1-CD1 3.8Å; L1822-I1913 HydrophobicContact CD1-CG2 4.35Å; L1822-I1913 HydrophobicContact CG-CD1 4.14Å; L1822-L1915 HydrophobicContact CD1-CD1 4.3Å
1823	L	39.2	Very low	38.8	Very low	78 Å²	78	71.2 Å²	71.2	41%	0.408	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	23.9	178	-66.9	163.9	0	0	0	114.5	M1834	L1823-M1834 HydrophobicContact CB-CE 4.13Å; L1823-M1834 HydrophobicContact CD1-CE 4.07Å
1824	G	35	Very low	40.3	Very low	36 Å²	36	67.2 Å²	67.2	37%	0.371	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	9.2	-179.4	0	0	0	0	0	114.2	D1821 L1822	D1821-G1824 WeakPolarHBondContact OD1-CA 3.44Å; D1821-G1824 PolarHBondContact OD1-N 3.42Å; L1822-G1824 PolarHBondContact O-N 2.8Å; L1822-G1824 VanDerWaalsContact O-N 3.17Å
1825	L	38.3	Very low	41.4	Very low	42 Å²	42	59.2 Å²	59.2	22%	0.22	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-105	98	178	-80.7	160.9	0	0	0	110.1	D1821 L1822 S1827 M1834	D1821-L1825 PolarHBondContact OD1-N 2.83Å; L1822-L1825 PolarHBondContact O-N 3.3Å; L1822-L1825 VanDerWaalsContact O-N 3.12Å; L1825-S1827 PolarHBondContact O-N 3.22Å; L1825-S1827 VanDerWaalsContact O-N 3.16Å; L1825-M1834 HydrophobicContact CB-CE 4.27Å; L1825-M1834 HydrophobicContact CD1-CE 3.48Å; L1825-M1834 VanDerWaalsContact CD1-CE 3.48Å; L1825-M1834 HydrophobicContact CG-CE 4.47Å
1826	T	43.9	Very low	42.9	Very low	76 Å²	76	53.7 Å²	53.7	47%	0.466	30%	0.301	S	S	.	.	S	Bend	trans	-64.9	-11.2	171.8	54.2	0	0	0	0	113.5
1827	S	50.2	Low	43.9	Very low	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	156.1	-173.9	51.6	0	0	0	0	111.3	H1731 S1733 L1825 Q1916	H1731-S1827 PolarHBondContact CE1-O 2.85Å; H1731-S1827 PolarHBondContact ND1-OG 3.46Å; S1733-S1827 WeakPolarHBondContact CB-OG 3.33Å; S1733-S1827 PolarHBondContact OG-OG 2.04Å; L1825-S1827 PolarHBondContact O-N 3.22Å; L1825-S1827 VanDerWaalsContact O-N 3.16Å; S1827-Q1916 CarbonylContact C-O 3.31Å; S1827-Q1916 WeakPolarHBondContact CA-O 3.33Å; S1827-Q1916 WeakPolarHBondContact CB-O 3.44Å
1828	L	56.8	Low	44.7	Very low	1 Å²	1	45.6 Å²	45.6	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	147.4	177.7	-70.3	169.1	0	0	0	110.7	Q1832 I1869 A1871 L1915 Q1916 V1917 I1918	L1828-Q1832 HydrophobicContact CD2-CG 4.31Å; L1828-I1869 HydrophobicContact CD1-CD1 3.74Å; L1828-I1869 HydrophobicContact CD1-CG1 4.05Å; L1828-I1869 HydrophobicContact CD1-CG2 3.94Å; L1828-A1871 HydrophobicContact CB-CB 3.7Å; L1828-A1871 HydrophobicContact CD1-CB 4.35Å; L1828-L1915 HydrophobicContact CD1-CD1 4.17Å; L1828-Q1916 PolarHBondContact N-O 3.37Å; L1828-V1917 HydrophobicContact CB-CG2 4.42Å; L1828-V1917 VanDerWaalsContact O-CA 3.25Å; L1828-V1917 WeakPolarHBondContact O-CA 3.33Å; L1828-I1918 VanDerWaalsContact O-CD1 3.26Å; L1828-I1918 WeakPolarHBondContact O-CD1 3.21Å; L1828-I1918 VanDerWaalsContact O-CG1 3.24Å; L1828-I1918 WeakPolarHBondContact O-CG1 3.44Å; L1828-I1918 PolarHBondContact O-N 2.83Å; L1828-I1918 VanDerWaalsContact O-N 3.08Å
1829	I	51.1	Low	45.7	Very low	22 Å²	22	46.3 Å²	46.3	11%	0.113	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	142.9	172.1	-45.8	158.9	0	0	0	109.7	R1732 G1831 Q1832 A1871 I1918 L1920 Y1923	R1732-I1829 HydrophobicContact CB-CG1 4.32Å; I1829-G1831 PolarHBondContact O-N 2.76Å; I1829-Q1832 HydrophobicContact CB-CB 3.96Å; I1829-Q1832 WeakPolarHBondContact O-CA 3.38Å; I1829-Q1832 WeakPolarHBondContact O-CB 3.35Å; I1829-Q1832 PolarHBondContact O-N 3.15Å; I1829-A1871 WeakPolarHBondContact O-CB 2.89Å; I1829-I1918 HydrophobicContact CG1-CD1 4.48Å; I1829-L1920 HydrophobicContact CG2-CD1 3.9Å; I1829-Y1923 HydrophobicContact CD1-CD2 3.8Å; I1829-Y1923 HydrophobicContact CD1-CE2 3.58Å; I1829-Y1923 HydrophobicContact CG1-CD2 4.27Å; I1829-Y1923 HydrophobicContact CG1-CE2 4.05Å
1830	E	55.5	Low	46	Very low	15 Å²	15	46.6 Å²	46.6	7%	0.07	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-34.6	123.7	154.6	169.3	157.6	139.8	0	0	113.3	N380 N381 Q1832 I1918 P1919 L1920	N380-E1830 WeakPolarHBondContact CA-OE1 3.29Å; N381-E1830 WeakPolarHBondContact ND2-CG 3.18Å; N381-E1830 PolarHBondContact ND2-OE2 2.89Å; E1830-Q1832 PolarHBondContact O-N 3.06Å; E1830-I1918 WeakPolarHBondContact CB-O 3.47Å; E1830-I1918 PolarHBondContact N-O 3.17Å; E1830-P1919 WeakPolarHBondContact OE2-CA 3.36Å; E1830-L1920 HydrophobicContact CG-CB 4.27Å; E1830-L1920 WeakPolarHBondContact O-CD1 3.29Å
1831	G	48.7	Very low	45.8	Very low	51 Å²	51	47.4 Å²	47.4	53%	0.526	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	-9.3	-176.3	0	0	0	0	0	115.3	I1829 A1871	I1829-G1831 PolarHBondContact O-N 2.76Å; G1831-A1871 PolarHBondContact N-O 3.33Å
1832	Q	54.2	Low	45.4	Very low	51 Å²	51	48 Å²	48	24%	0.238	29%	0.286	C	S	.	.			trans	-72.1	134.7	170.4	-171.1	-179.3	4	0	0	110	L1828 I1829 E1830 A1871	L1828-Q1832 HydrophobicContact CD2-CG 4.31Å; I1829-Q1832 HydrophobicContact CB-CB 3.96Å; I1829-Q1832 WeakPolarHBondContact O-CA 3.38Å; I1829-Q1832 WeakPolarHBondContact O-CB 3.35Å; I1829-Q1832 PolarHBondContact O-N 3.15Å; E1830-Q1832 PolarHBondContact O-N 3.06Å; Q1832-A1871 PolarHBondContact O-N 3.01Å
1833	W	54.3	Low	44.9	Very low	99 Å²	99	54.4 Å²	54.4	38%	0.375	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	158.9	169.7	62.2	-87.2	0	0	0	110.5	I1868 I1869 L1870	W1833-I1868 HydrophobicContact CB-CG2 4.17Å; W1833-I1868 HydrophobicContact CE3-CG2 4.41Å; W1833-I1869 WeakPolarHBondContact CA-O 3.05Å; W1833-I1869 WeakPolarHBondContact CB-O 3.39Å; W1833-L1870 HydrophobicContact CB-CD1 4.03Å
1834	M	54.7	Low	44.4	Very low	8 Å²	8	55.7 Å²	55.7	4%	0.039	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	148.2	179	128	-165.9	-68.8	0	0	108.2	L1823 L1825 I1868 I1869	L1823-M1834 HydrophobicContact CB-CE 4.13Å; L1823-M1834 HydrophobicContact CD1-CE 4.07Å; L1825-M1834 HydrophobicContact CB-CE 4.27Å; L1825-M1834 HydrophobicContact CD1-CE 3.48Å; L1825-M1834 VanDerWaalsContact CD1-CE 3.48Å; L1825-M1834 HydrophobicContact CG-CE 4.47Å; M1834-I1868 CarbonylContact O-C 3.45Å; M1834-I1868 WeakPolarHBondContact O-CA 3.26Å; M1834-I1869 HydrophobicContact CB-CG2 3.45Å; M1834-I1869 VanDerWaalsContact CB-CG2 3.45Å; M1834-I1869 HydrophobicContact CG-CG2 3.48Å; M1834-I1869 VanDerWaalsContact CG-CG2 3.48Å; M1834-I1869 PolarHBondContact N-O 3.5Å; M1834-I1869 VanDerWaalsContact N-O 3.12Å; M1834-I1869 WeakPolarHBondContact O-CG2 3.39Å; M1834-I1869 PolarHBondContact O-N 3.37Å; M1834-I1869 HydrophobicContact SD-CG2 3.84Å
1835	C	48.3	Very low	44.1	Very low	6 Å²	6	64.5 Å²	64.5	4%	0.041	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	129.4	165.1	-62.5	0	0	0	0	109.3	Q1867 S2070	C1835-Q1867 CarbonylContact C-O 3.58Å; C1835-Q1867 WeakPolarHBondContact CA-O 3.29Å; C1835-S2070 WeakPolarHBondContact CB-OG 3.46Å; C1835-S2070 PolarHBondContact O-OG 3.25Å
1836	L	56	Low	43.6	Very low	0 Å²	0	66.8 Å²	66.8	0%	0	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-75	147.4	176.1	-71.4	163.7	0	0	0	110	L1822 K1838 W1852 I1862 Q1867 I1869 L1879 S2070	L1822-L1836 HydrophobicContact CD1-CD2 4.31Å; L1822-L1836 HydrophobicContact CD2-CD2 4.5Å; L1836-K1838 PolarHBondContact O-N 2.8Å; L1836-W1852 HydrophobicContact CB-CD2 4.29Å; L1836-W1852 HydrophobicContact CB-CG 4.39Å; L1836-W1852 HydrophobicContact CD1-CB 3.86Å; L1836-W1852 HydrophobicContact CD1-CD2 4.07Å; L1836-W1852 HydrophobicContact CD1-CE3 4.42Å; L1836-W1852 HydrophobicContact CD1-CG 3.83Å; L1836-W1852 HydrophobicContact CD2-CD2 4.18Å; L1836-W1852 HydrophobicContact CD2-CE3 4.02Å; L1836-W1852 HydrophobicContact CD2-CZ3 4.19Å; L1836-W1852 HydrophobicContact CG-CD2 4.42Å; L1836-I1862 HydrophobicContact CD1-CD1 4.43Å; L1836-I1862 HydrophobicContact CD1-CG2 3.53Å; L1836-Q1867 HydrophobicContact CB-CB 4.31Å; L1836-Q1867 PolarHBondContact N-O 3.18Å; L1836-I1869 HydrophobicContact CD1-CB 4.36Å; L1836-I1869 HydrophobicContact CD2-CB 4.38Å; L1836-I1869 HydrophobicContact CD2-CD1 4.3Å; L1836-I1869 HydrophobicContact CG-CB 4.23Å; L1836-L1879 HydrophobicContact CD2-CD1 4.37Å; L1836-S2070 PolarHBondContact O-OG 2.76Å
1837	P	45.7	Very low	42.9	Very low	28 Å²	28	70.9 Å²	70.9	18%	0.182	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-74.8	127.5	-178.5	26.4	-29.6	0	0	0	111.4	L1822 F1839 W1852	L1822-P1837 HydrophobicContact CD2-CG 3.77Å; P1837-F1839 HydrophobicContact CG-CE2 4.2Å; P1837-F1839 HydrophobicContact CG-CZ 4.5Å; P1837-F1839 PolarHBondContact O-N 2.83Å; P1837-F1839 VanDerWaalsContact O-N 3.15Å; P1837-W1852 HydrophobicContact CG-CH2 4.26Å; P1837-W1852 HydrophobicContact CG-CZ2 3.83Å; P1837-W1852 PolarHBondContact O-NE1 2.79Å
1838	K	43.4	Very low	42.3	Very low	86 Å²	86	75.8 Å²	75.8	37%	0.374	43%	0.429	S	S	.	.			trans	-78.2	94.9	167.3	-157.2	-175.1	-117.6	71.4	0	109	L1836 S1840 Q1867 P1981 C1982	L1836-K1838 PolarHBondContact O-N 2.8Å; K1838-S1840 PolarHBondContact O-N 2.79Å; K1838-S1840 VanDerWaalsContact O-N 3.1Å; K1838-Q1867 VanDerWaalsContact NZ-NE2 3.16Å; K1838-P1981 PolarHBondContact NZ-O 3.03Å; K1838-C1982 VanDerWaalsContact CD-O 3.26Å; K1838-C1982 WeakPolarHBondContact CD-O 3.42Å; K1838-C1982 WeakPolarHBondContact CE-O 2.99Å; K1838-C1982 PolarHBondContact NZ-O 2.9Å
1839	F	45.4	Very low	41.7	Very low	101 Å²	101	80.1 Å²	80.1	44%	0.443	45%	0.453	S	S	.	.			trans	-59.5	112.9	171	-74.2	-76.4	0	0	0	109.6	P1837 W1852 F1881	P1837-F1839 HydrophobicContact CG-CE2 4.2Å; P1837-F1839 HydrophobicContact CG-CZ 4.5Å; P1837-F1839 PolarHBondContact O-N 2.83Å; P1837-F1839 VanDerWaalsContact O-N 3.15Å; F1839-W1852 AromaticContact CD2-CZ2 3.94Å; F1839-W1852 HydrophobicContact CD2-CZ2 3.94Å; F1839-W1852 AromaticContact CE2-CH2 3.94Å; F1839-W1852 HydrophobicContact CE2-CH2 3.94Å; F1839-W1852 AromaticContact CE2-CZ2 3.65Å; F1839-W1852 HydrophobicContact CE2-CZ2 3.65Å; F1839-F1881 HydrophobicContact CB-CE1 4.29Å; F1839-F1881 HydrophobicContact CB-CZ 3.91Å; F1839-F1881 AromaticContact CD2-CD1 3.99Å; F1839-F1881 HydrophobicContact CD2-CD1 3.99Å; F1839-F1881 AromaticContact CD2-CE1 3.39Å; F1839-F1881 HydrophobicContact CD2-CE1 3.39Å; F1839-F1881 HydrophobicContact CD2-CE2 4.16Å; F1839-F1881 AromaticContact CD2-CZ 3.51Å; F1839-F1881 HydrophobicContact CD2-CZ 3.51Å; F1839-F1881 HydrophobicContact CE2-CD1 4.09Å; F1839-F1881 AromaticContact CE2-CE1 3.91Å; F1839-F1881 HydrophobicContact CE2-CE1 3.91Å; F1839-F1881 HydrophobicContact CE2-CZ 4.4Å; F1839-F1881 HydrophobicContact CG-CE1 4.02Å; F1839-F1881 HydrophobicContact CG-CZ 4.05Å
1840	S	35.2	Very low	41.5	Very low	85 Å²	85	81.2 Å²	81.2	59%	0.594	46%	0.458	S	S	*	.			trans	-102.3	106.2	-168.2	45	0	0	0	0	112.3	K1838	K1838-S1840 PolarHBondContact O-N 2.79Å; K1838-S1840 VanDerWaalsContact O-N 3.1Å
1841	S	30.2	Very low	41.2	Very low	101 Å²	101	82.2 Å²	82.2	71%	0.706	47%	0.466	S	S	*	.			trans	-74.8	124.3	157.7	45	0	0	0	0	109.1	T1843	S1841-T1843 PolarHBondContact O-N 3.24Å
1842	S	29.1	Very low	41.7	Very low	114 Å²	114	80 Å²	80	80%	0.797	44%	0.441	S	S	*	.	S	Bend	trans	-96	73.9	-163.7	62.2	0	0	0	0	114.6
1843	T	28.7	Very low	41.6	Very low	143 Å²	143	79.9 Å²	79.9	88%	0.877	45%	0.447	S	S	*	.			trans	-156.1	150.5	155.9	32.7	0	0	0	0	110.6	S1841	S1841-T1843 PolarHBondContact O-N 3.24Å
1844	S	28.8	Very low	41.9	Very low	105 Å²	105	75.8 Å²	75.8	73%	0.734	43%	0.433	S	S	*	.			trans	-93.4	126	-174.2	52.1	0	0	0	0	113.8
1845	Y	27.7	Very low	41.9	Very low	221 Å²	221	77.5 Å²	77.5	87%	0.867	44%	0.444	S	S	*	.			trans	173.2	125.5	137.5	-95.4	-66.1	0	0	0	109.9
1846	S	27.1	Very low	42.4	Very low	90 Å²	90	79 Å²	79	63%	0.629	45%	0.452	S	S	*	.	S	Bend	trans	38.1	117.9	164	60.6	0	0	0	0	121.1
1847	D	30.5	Very low	42.6	Very low	162 Å²	162	79.4 Å²	79.4	87%	0.866	45%	0.454	S	S	*	.			trans	48.1	87.4	141.9	-48	-16.2	0	0	0	119.1
1848	L	36.7	Very low	43.1	Very low	102 Å²	102	79.8 Å²	79.8	53%	0.534	46%	0.457	S	S	.	.			trans	-139.7	141.4	159.9	-82	102.7	0	0	0	112.3	N1850 S1886	L1848-N1850 PolarHBondContact O-N 2.88Å; L1848-S1886 WeakPolarHBondContact CD2-OG 3.39Å
1849	D	44.1	Very low	43.9	Very low	93 Å²	93	76.9 Å²	76.9	50%	0.497	45%	0.445	S	S	.	.			trans	-76.5	94	-169.5	-72	-67.3	0	0	0	113.9	T1851 T1884	D1849-T1851 HydrophobicContact CB-CG2 4.13Å; D1849-T1884 VanDerWaalsContact C-OG1 3.23Å; D1849-T1884 WeakPolarHBondContact O-CB 3.46Å; D1849-T1884 WeakPolarHBondContact O-CG2 3.28Å; D1849-T1884 PolarHBondContact O-OG1 3.1Å
1850	N	47.7	Very low	45	Very low	44 Å²	44	72 Å²	72	24%	0.235	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	90.2	159.8	-81.9	-14.8	0	0	0	109.4	L1848 F1881 S1882 L1883 T1884	L1848-N1850 PolarHBondContact O-N 2.88Å; N1850-F1881 HydrophobicContact CB-CE2 4.29Å; N1850-S1882 CarbonylContact C-O 3.49Å; N1850-S1882 WeakPolarHBondContact CA-O 3.3Å; N1850-L1883 WeakPolarHBondContact OD1-CA 3.33Å; N1850-T1884 PolarHBondContact OD1-N 2.95Å; N1850-T1884 PolarHBondContact OD1-O 3.4Å
1851	T	48.5	Very low	46.4	Very low	36 Å²	36	69.9 Å²	69.9	22%	0.221	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.7	-169.5	53.5	0	0	0	0	113.3	D1849 F1881 S1882	D1849-T1851 HydrophobicContact CB-CG2 4.13Å; T1851-F1881 WeakPolarHBondContact O-CA 3.41Å; T1851-S1882 PolarHBondContact N-O 2.8Å; T1851-S1882 PolarHBondContact O-N 3.49Å; T1851-S1882 PolarHBondContact OG1-OG 2.94Å
1852	W	59.2	Low	48.2	Very low	4 Å²	4	65.4 Å²	65.4	2%	0.015	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	131.2	162.4	-69.8	95.4	0	0	0	108.6	L1822 L1836 P1837 F1839 I1862 P1864 L1879 T1880 F1881 I1913	L1822-W1852 HydrophobicContact CD1-CH2 4.35Å; L1822-W1852 HydrophobicContact CD1-CZ3 4.08Å; L1822-W1852 HydrophobicContact CD2-CH2 4.09Å; L1836-W1852 HydrophobicContact CB-CD2 4.29Å; L1836-W1852 HydrophobicContact CB-CG 4.39Å; L1836-W1852 HydrophobicContact CD1-CB 3.86Å; L1836-W1852 HydrophobicContact CD1-CD2 4.07Å; L1836-W1852 HydrophobicContact CD1-CE3 4.42Å; L1836-W1852 HydrophobicContact CD1-CG 3.83Å; L1836-W1852 HydrophobicContact CD2-CD2 4.18Å; L1836-W1852 HydrophobicContact CD2-CE3 4.02Å; L1836-W1852 HydrophobicContact CD2-CZ3 4.19Å; L1836-W1852 HydrophobicContact CG-CD2 4.42Å; P1837-W1852 HydrophobicContact CG-CH2 4.26Å; P1837-W1852 HydrophobicContact CG-CZ2 3.83Å; P1837-W1852 PolarHBondContact O-NE1 2.79Å; F1839-W1852 AromaticContact CD2-CZ2 3.94Å; F1839-W1852 HydrophobicContact CD2-CZ2 3.94Å; F1839-W1852 AromaticContact CE2-CH2 3.94Å; F1839-W1852 HydrophobicContact CE2-CH2 3.94Å; F1839-W1852 AromaticContact CE2-CZ2 3.65Å; F1839-W1852 HydrophobicContact CE2-CZ2 3.65Å; W1852-I1862 HydrophobicContact CB-CD1 4.25Å; W1852-I1862 HydrophobicContact CB-CG2 4.19Å; W1852-P1864 WeakPolarHBondContact O-CB 3.22Å; W1852-L1879 HydrophobicContact CZ3-CD1 4.43Å; W1852-T1880 CarbonylContact C-O 2.8Å; W1852-T1880 WeakPolarHBondContact CA-O 3.47Å; W1852-F1881 HydrophobicContact CD2-CB 4.16Å; W1852-F1881 AromaticContact CD2-CD2 3.86Å; W1852-F1881 HydrophobicContact CD2-CD2 3.86Å; W1852-F1881 HydrophobicContact CD2-CG 4.29Å; W1852-F1881 AromaticContact CE2-CD2 3.67Å; W1852-F1881 HydrophobicContact CE3-CB 3.79Å; W1852-F1881 HydrophobicContact CE3-CD2 4.37Å; W1852-F1881 HydrophobicContact CE3-CG 4.37Å; W1852-F1881 HydrophobicContact CG-CD2 4.18Å; W1852-F1881 HydrophobicContact CH2-CB 4.11Å; W1852-F1881 HydrophobicContact CH2-CG 4.22Å; W1852-F1881 HydrophobicContact CZ2-CB 4.44Å; W1852-F1881 HydrophobicContact CZ2-CD2 4.03Å; W1852-F1881 HydrophobicContact CZ2-CG 4.13Å; W1852-F1881 HydrophobicContact CZ3-CB 3.78Å; W1852-F1881 HydrophobicContact CZ3-CG 4.34Å; W1852-F1881 AromaticContact NE1-CD2 3.89Å; W1852-I1913 HydrophobicContact CH2-CD1 4.34Å; W1852-I1913 HydrophobicContact CZ3-CD1 4.01Å
1853	S	52.8	Low	49.6	Very low	50 Å²	50	60.4 Å²	60.4	35%	0.35	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	149.3	172.3	94.2	0	0	0	0	111.4	T1880	S1853-T1880 PolarHBondContact N-O 2.81Å; S1853-T1880 WeakPolarHBondContact O-CA 3.18Å; S1853-T1880 WeakPolarHBondContact O-CB 3.17Å; S1853-T1880 PolarHBondContact O-N 2.77Å; S1853-T1880 PolarHBondContact O-OG1 2.77Å; S1853-T1880 PolarHBondContact OG-OG1 2.72Å
1854	S	60.9	Low	50.8	Low	12 Å²	12	55.3 Å²	55.3	8%	0.084	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.2	177.1	-176.1	0	0	0	0	111.1	D1856 I1860	S1854-D1856 VanDerWaalsContact C-N 3.26Å; S1854-D1856 VanDerWaalsContact OG-C 3.24Å; S1854-D1856 PolarHBondContact OG-N 3.17Å; S1854-D1856 PolarHBondContact OG-O 3.35Å; S1854-I1860 WeakPolarHBondContact CB-O 3.28Å; S1854-I1860 PolarHBondContact OG-O 3.35Å
1855	V	54.8	Low	51.9	Low	44 Å²	44	55.1 Å²	55.1	27%	0.267	30%	0.295	S	S	.	.	S	Bend	trans	-65.6	-32.4	169.7	175.6	0	0	0	0	110.8	R360 V1878 T1880	R360-V1855 HydrophobicContact CG-CG1 4.37Å; R360-V1855 HydrophobicContact CG-CG2 4.5Å; V1855-V1878 HydrophobicContact CB-CB 4.02Å; V1855-V1878 WeakPolarHBondContact CB-O 3.31Å; V1855-V1878 HydrophobicContact CG2-CB 3.88Å; V1855-V1878 HydrophobicContact CG2-CG1 3.94Å; V1855-V1878 VanDerWaalsContact CG2-O 3.3Å; V1855-V1878 WeakPolarHBondContact CG2-O 3.22Å; V1855-V1878 PolarHBondContact N-O 3Å; V1855-T1880 HydrophobicContact CG2-CG2 3.69Å
1856	D	57.4	Low	53	Low	39 Å²	39	47.9 Å²	47.9	21%	0.209	27%	0.271	C	S	.	.			trans	-129.4	104.9	171.8	-158.5	-40.4	0	0	0	112.3	S1854 S1858 I1859 I1860	S1854-D1856 VanDerWaalsContact C-N 3.26Å; S1854-D1856 VanDerWaalsContact OG-C 3.24Å; S1854-D1856 PolarHBondContact OG-N 3.17Å; S1854-D1856 PolarHBondContact OG-O 3.35Å; D1856-S1858 PolarHBondContact O-N 2.9Å; D1856-S1858 VanDerWaalsContact OD1-CB 3.29Å; D1856-S1858 WeakPolarHBondContact OD1-CB 3.25Å; D1856-S1858 PolarHBondContact OD1-N 2.76Å; D1856-S1858 PolarHBondContact OD1-OG 3.46Å; D1856-I1859 HydrophobicContact CB-CD1 4.22Å; D1856-I1859 HydrophobicContact CB-CG1 4.34Å; D1856-I1860 PolarHBondContact O-N 2.87Å; D1856-I1860 VanDerWaalsContact O-N 3.07Å; D1856-I1860 VanDerWaalsContact O-O 3.06Å
1857	P	60.3	Low	54.3	Low	7 Å²	7	44.2 Å²	44.2	5%	0.045	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-12.4	179.1	33.3	-39.1	0	0	0	113.9	W362 I1860 R1872	W362-P1857 HydrophobicContact CZ2-CG 4.34Å; W362-P1857 VanDerWaalsContact NE1-CB 3.3Å; P1857-I1860 WeakPolarHBondContact CA-O 3.33Å; P1857-R1872 PolarHBondContact O-NH1 3.26Å
1858	S	56.3	Low	55.5	Low	37 Å²	37	38.8 Å²	38.8	26%	0.259	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-42.8	176.2	70.2	0	0	0	0	111.5	D1856 R1872 H1873	D1856-S1858 PolarHBondContact O-N 2.9Å; D1856-S1858 VanDerWaalsContact OD1-CB 3.29Å; D1856-S1858 WeakPolarHBondContact OD1-CB 3.25Å; D1856-S1858 PolarHBondContact OD1-N 2.76Å; D1856-S1858 PolarHBondContact OD1-OG 3.46Å; S1858-R1872 CarbonylContact O-C 3.55Å; S1858-R1872 VanDerWaalsContact O-C 3.29Å; S1858-R1872 WeakPolarHBondContact O-CB 3.47Å; S1858-H1873 PolarHBondContact O-N 3.24Å; S1858-H1873 PolarHBondContact O-ND1 2.59Å
1859	I	60.5	Low	56.9	Low	24 Å²	24	34 Å²	34	12%	0.123	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-48.2	177.5	-53.7	174.5	0	0	0	110	D1856 R1872 H1873 Q1876 V1917	D1856-I1859 HydrophobicContact CB-CD1 4.22Å; D1856-I1859 HydrophobicContact CB-CG1 4.34Å; I1859-R1872 PolarHBondContact O-N 3.04Å; I1859-H1873 VanDerWaalsContact CG2-O 3.32Å; I1859-H1873 WeakPolarHBondContact CG2-O 3.49Å; I1859-H1873 PolarHBondContact O-N 3.45Å; I1859-Q1876 WeakPolarHBondContact CD1-O 3.34Å; I1859-V1917 HydrophobicContact CG2-CB 3.88Å; I1859-V1917 HydrophobicContact CG2-CG2 3.81Å
1860	I	67.7	Low	57.8	Low	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	107	-178.7	-66.2	-176.1	0	0	0	109.1	S1854 D1856 P1857 I1862 I1869 L1879 L1915 V1917	S1854-I1860 WeakPolarHBondContact CB-O 3.28Å; S1854-I1860 PolarHBondContact OG-O 3.35Å; D1856-I1860 PolarHBondContact O-N 2.87Å; D1856-I1860 VanDerWaalsContact O-N 3.07Å; D1856-I1860 VanDerWaalsContact O-O 3.06Å; P1857-I1860 WeakPolarHBondContact CA-O 3.33Å; I1860-I1862 HydrophobicContact CG2-CG1 4.3Å; I1860-I1869 HydrophobicContact CG2-CD1 3.55Å; I1860-I1869 HydrophobicContact CG2-CG1 3.4Å; I1860-L1879 HydrophobicContact CG2-CD2 3.83Å; I1860-L1915 HydrophobicContact CD1-CB 3.63Å; I1860-L1915 HydrophobicContact CD1-CD1 4.17Å; I1860-V1917 HydrophobicContact CD1-CG2 3.84Å; I1860-V1917 HydrophobicContact CG1-CG2 3.45Å; I1860-V1917 VanDerWaalsContact CG1-CG2 3.45Å
1861	W	66.2	Low	58.8	Low	39 Å²	39	29.4 Å²	29.4	15%	0.148	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	147.8	166.4	175.3	87.4	0	0	0	110.1	N449 D1863 I1869 L1870 R1872	N449-W1861 VanDerWaalsContact O-CZ2 3.29Å; N449-W1861 WeakPolarHBondContact O-CZ2 3.41Å; N449-W1861 PolarHBondContact O-NE1 3.06Å; W1861-D1863 HydrophobicContact CE3-CB 4.49Å; W1861-D1863 HydrophobicContact CH2-CB 3.53Å; W1861-D1863 HydrophobicContact CZ2-CB 3.98Å; W1861-D1863 HydrophobicContact CZ3-CB 3.8Å; W1861-I1869 WeakPolarHBondContact O-CA 3.4Å; W1861-L1870 HydrophobicContact CE3-CB 3.7Å; W1861-L1870 HydrophobicContact CE3-CD2 4.35Å; W1861-L1870 HydrophobicContact CZ3-CB 4.35Å; W1861-L1870 PolarHBondContact N-O 3.38Å; W1861-L1870 PolarHBondContact O-N 2.96Å; W1861-R1872 VanDerWaalsContact CB-CD 3.41Å; W1861-R1872 HydrophobicContact CB-CG 4.11Å
1862	I	66.3	Low	59.1	Low	7 Å²	7	28 Å²	28	4%	0.036	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137	171.6	-51.3	177.2	0	0	0	107.3	L1836 W1852 I1860 P1864 I1868 I1869 L1879	L1836-I1862 HydrophobicContact CD1-CD1 4.43Å; L1836-I1862 HydrophobicContact CD1-CG2 3.53Å; W1852-I1862 HydrophobicContact CB-CD1 4.25Å; W1852-I1862 HydrophobicContact CB-CG2 4.19Å; I1860-I1862 HydrophobicContact CG2-CG1 4.3Å; I1862-P1864 HydrophobicContact CG2-CB 4.47Å; I1862-P1864 WeakPolarHBondContact O-CD 3.5Å; I1862-I1868 CarbonylContact C-O 2.73Å; I1862-I1868 WeakPolarHBondContact CA-O 3.27Å; I1862-I1869 HydrophobicContact CG1-CG1 4.48Å; I1862-L1879 HydrophobicContact CD1-CD2 3.29Å; I1862-L1879 HydrophobicContact CG1-CD2 3.95Å
1863	D	59.6	Low	59.1	Low	10 Å²	10	29.7 Å²	29.7	5%	0.053	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	92.4	160.6	-164.4	-42.6	0	0	0	107.1	W1861 L1865 N1866 Q1867 I1868	W1861-D1863 HydrophobicContact CE3-CB 4.49Å; W1861-D1863 HydrophobicContact CH2-CB 3.53Å; W1861-D1863 HydrophobicContact CZ2-CB 3.98Å; W1861-D1863 HydrophobicContact CZ3-CB 3.8Å; D1863-L1865 VanDerWaalsContact C-N 3.29Å; D1863-L1865 PolarHBondContact O-N 2.72Å; D1863-L1865 WeakPolarHBondContact OD1-CB 3.36Å; D1863-N1866 HydrophobicContact CB-CB 4.07Å; D1863-N1866 VanDerWaalsContact CG-ND2 3.25Å; D1863-N1866 PolarHBondContact O-N 3.35Å; D1863-N1866 WeakPolarHBondContact OD1-CB 3.25Å; D1863-N1866 PolarHBondContact OD1-N 2.82Å; D1863-N1866 PolarHBondContact OD1-ND2 2.85Å; D1863-N1866 PolarHBondContact OD2-ND2 3.3Å; D1863-Q1867 WeakPolarHBondContact O-CA 3.5Å; D1863-Q1867 PolarHBondContact O-N 2.66Å; D1863-I1868 HydrophobicContact CB-CB 4.28Å; D1863-I1868 PolarHBondContact N-O 2.92Å; D1863-I1868 PolarHBondContact O-N 2.88Å; D1863-I1868 VanDerWaalsContact O-N 3.14Å
1864	P	53.6	Low	59.7	Low	35 Å²	35	30.6 Å²	30.6	23%	0.227	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-23.2	-176.6	23.5	-29.4	0	0	0	113.2	D451 W1852 I1862 Q1867	D451-P1864 HydrophobicContact CB-CG 3.59Å; D451-P1864 WeakPolarHBondContact OD2-CD 3.42Å; D451-P1864 VanDerWaalsContact OD2-CG 3.24Å; D451-P1864 WeakPolarHBondContact OD2-CG 3.49Å; W1852-P1864 WeakPolarHBondContact O-CB 3.22Å; I1862-P1864 HydrophobicContact CG2-CB 4.47Å; I1862-P1864 WeakPolarHBondContact O-CD 3.5Å; P1864-Q1867 WeakPolarHBondContact O-CG 3.32Å
1865	L	51.4	Low	59.6	Low	102 Å²	102	31.4 Å²	31.4	53%	0.534	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-67.6	160.2	-86.1	167.1	0	0	0	110.3	D451 D1863 Q1867 P1981	D451-L1865 WeakPolarHBondContact OD2-CG 3.26Å; D451-L1865 PolarHBondContact OD2-N 2.94Å; D451-L1865 VanDerWaalsContact OD2-N 3.14Å; D1863-L1865 VanDerWaalsContact C-N 3.29Å; D1863-L1865 PolarHBondContact O-N 2.72Å; D1863-L1865 WeakPolarHBondContact OD1-CB 3.36Å; L1865-Q1867 PolarHBondContact O-N 2.8Å; L1865-P1981 WeakPolarHBondContact O-CB 2.95Å; L1865-P1981 VanDerWaalsContact O-CG 3.23Å; L1865-P1981 WeakPolarHBondContact O-CG 3.3Å
1866	N	50.7	Low	59.9	Low	68 Å²	68	35.4 Å²	35.4	36%	0.364	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-13.2	-174.4	-68.4	-57.7	0	0	0	114.6	D1863 I1868 P1981 C1982	D1863-N1866 HydrophobicContact CB-CB 4.07Å; D1863-N1866 VanDerWaalsContact CG-ND2 3.25Å; D1863-N1866 PolarHBondContact O-N 3.35Å; D1863-N1866 WeakPolarHBondContact OD1-CB 3.25Å; D1863-N1866 PolarHBondContact OD1-N 2.82Å; D1863-N1866 PolarHBondContact OD1-ND2 2.85Å; D1863-N1866 PolarHBondContact OD2-ND2 3.3Å; N1866-I1868 VanDerWaalsContact C-N 3.31Å; N1866-I1868 HydrophobicContact CB-CD1 3.83Å; N1866-I1868 HydrophobicContact CB-CG1 3.98Å; N1866-P1981 VanDerWaalsContact CA-CB 3.49Å; N1866-P1981 HydrophobicContact CB-CB 4.44Å; N1866-C1982 PolarHBondContact O-SG 2.83Å
1867	Q	55.9	Low	59.9	Low	13 Å²	13	33.6 Å²	33.6	6%	0.061	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	47.3	-169.9	-49.5	-164.5	-33.4	0	0	111.4	C1835 L1836 K1838 D1863 P1864 L1865 C1982	C1835-Q1867 CarbonylContact C-O 3.58Å; C1835-Q1867 WeakPolarHBondContact CA-O 3.29Å; L1836-Q1867 HydrophobicContact CB-CB 4.31Å; L1836-Q1867 PolarHBondContact N-O 3.18Å; K1838-Q1867 VanDerWaalsContact NZ-NE2 3.16Å; D1863-Q1867 WeakPolarHBondContact O-CA 3.5Å; D1863-Q1867 PolarHBondContact O-N 2.66Å; P1864-Q1867 WeakPolarHBondContact O-CG 3.32Å; L1865-Q1867 PolarHBondContact O-N 2.8Å; Q1867-C1982 HydrophobicContact CB-CB 3.8Å; Q1867-C1982 HydrophobicContact CG-CB 4.23Å
1868	I	54.6	Low	59.8	Low	49 Å²	49	35.2 Å²	35.2	25%	0.251	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	133.3	176.3	-62.7	173	0	0	0	108.5	W1833 M1834 I1862 D1863 N1866	W1833-I1868 HydrophobicContact CB-CG2 4.17Å; W1833-I1868 HydrophobicContact CE3-CG2 4.41Å; M1834-I1868 CarbonylContact O-C 3.45Å; M1834-I1868 WeakPolarHBondContact O-CA 3.26Å; I1862-I1868 CarbonylContact C-O 2.73Å; I1862-I1868 WeakPolarHBondContact CA-O 3.27Å; D1863-I1868 HydrophobicContact CB-CB 4.28Å; D1863-I1868 PolarHBondContact N-O 2.92Å; D1863-I1868 PolarHBondContact O-N 2.88Å; D1863-I1868 VanDerWaalsContact O-N 3.14Å; N1866-I1868 VanDerWaalsContact C-N 3.31Å; N1866-I1868 HydrophobicContact CB-CD1 3.83Å; N1866-I1868 HydrophobicContact CB-CG1 3.98Å
1869	I	67.1	Low	60.2	Low	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	143.3	164.6	-159.6	164.5	0	0	0	108.7	L1828 W1833 M1834 L1836 I1860 W1861 I1862 L1879 L1915	L1828-I1869 HydrophobicContact CD1-CD1 3.74Å; L1828-I1869 HydrophobicContact CD1-CG1 4.05Å; L1828-I1869 HydrophobicContact CD1-CG2 3.94Å; W1833-I1869 WeakPolarHBondContact CA-O 3.05Å; W1833-I1869 WeakPolarHBondContact CB-O 3.39Å; M1834-I1869 HydrophobicContact CB-CG2 3.45Å; M1834-I1869 VanDerWaalsContact CB-CG2 3.45Å; M1834-I1869 HydrophobicContact CG-CG2 3.48Å; M1834-I1869 VanDerWaalsContact CG-CG2 3.48Å; M1834-I1869 PolarHBondContact N-O 3.5Å; M1834-I1869 VanDerWaalsContact N-O 3.12Å; M1834-I1869 WeakPolarHBondContact O-CG2 3.39Å; M1834-I1869 PolarHBondContact O-N 3.37Å; M1834-I1869 HydrophobicContact SD-CG2 3.84Å; L1836-I1869 HydrophobicContact CD1-CB 4.36Å; L1836-I1869 HydrophobicContact CD2-CB 4.38Å; L1836-I1869 HydrophobicContact CD2-CD1 4.3Å; L1836-I1869 HydrophobicContact CG-CB 4.23Å; I1860-I1869 HydrophobicContact CG2-CD1 3.55Å; I1860-I1869 HydrophobicContact CG2-CG1 3.4Å; W1861-I1869 WeakPolarHBondContact O-CA 3.4Å; I1862-I1869 HydrophobicContact CG1-CG1 4.48Å; I1869-L1879 HydrophobicContact CD1-CD1 3.76Å; I1869-L1879 HydrophobicContact CD1-CD2 3.73Å; I1869-L1879 HydrophobicContact CD1-CG 4.18Å; I1869-L1915 HydrophobicContact CD1-CD1 3.92Å
1870	L	62.6	Low	60	Low	41 Å²	41	32.8 Å²	32.8	22%	0.215	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.1	169.5	-178.7	67.8	0	0	0	108.9	W1833 W1861 R1872	W1833-L1870 HydrophobicContact CB-CD1 4.03Å; W1861-L1870 HydrophobicContact CE3-CB 3.7Å; W1861-L1870 HydrophobicContact CE3-CD2 4.35Å; W1861-L1870 HydrophobicContact CZ3-CB 4.35Å; W1861-L1870 PolarHBondContact N-O 3.38Å; W1861-L1870 PolarHBondContact O-N 2.96Å; L1870-R1872 HydrophobicContact CB-CG 4.5Å; L1870-R1872 HydrophobicContact CD2-CG 3.82Å; L1870-R1872 HydrophobicContact CG-CG 3.95Å; L1870-R1872 PolarHBondContact O-N 3.48Å
1871	A	67.8	Low	59.6	Low	1 Å²	1	33.2 Å²	33.2	1%	0.008	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	113.7	171.8	0	0	0	0	0	109.8	L1828 I1829 G1831 Q1832 V1917	L1828-A1871 HydrophobicContact CB-CB 3.7Å; L1828-A1871 HydrophobicContact CD1-CB 4.35Å; I1829-A1871 WeakPolarHBondContact O-CB 2.89Å; G1831-A1871 PolarHBondContact N-O 3.33Å; Q1832-A1871 PolarHBondContact O-N 3.01Å; A1871-V1917 HydrophobicContact CB-CB 4.35Å; A1871-V1917 HydrophobicContact CB-CG1 3.44Å; A1871-V1917 VanDerWaalsContact CB-CG1 3.44Å; A1871-V1917 HydrophobicContact CB-CG2 3.92Å
1872	R	54.8	Low	58.8	Low	7 Å²	7	32.3 Å²	32.3	3%	0.026	18%	0.182	C	C	.	.			trans	-115.6	-18.3	-165.5	-87.3	-170	68.7	-130	-7.5	115.8	Y319 N381 P1857 S1858 I1859 W1861 L1870	Y319-R1872 HydrophobicContact CE2-CG 4.28Å; Y319-R1872 PolarHBondContact OH-O 2.65Å; N381-R1872 VanDerWaalsContact ND2-C 3.29Å; N381-R1872 PolarHBondContact ND2-O 2.95Å; N381-R1872 PolarHBondContact OD1-O 3.26Å; P1857-R1872 PolarHBondContact O-NH1 3.26Å; S1858-R1872 CarbonylContact O-C 3.55Å; S1858-R1872 VanDerWaalsContact O-C 3.29Å; S1858-R1872 WeakPolarHBondContact O-CB 3.47Å; I1859-R1872 PolarHBondContact O-N 3.04Å; W1861-R1872 VanDerWaalsContact CB-CD 3.41Å; W1861-R1872 HydrophobicContact CB-CG 4.11Å; L1870-R1872 HydrophobicContact CB-CG 4.5Å; L1870-R1872 HydrophobicContact CD2-CG 3.82Å; L1870-R1872 HydrophobicContact CG-CG 3.95Å; L1870-R1872 PolarHBondContact O-N 3.48Å
1873	H	59.7	Low	57.7	Low	39 Å²	39	34.3 Å²	34.3	18%	0.181	19%	0.193	C	C	.	.	S	Bend	trans	-151.4	152	168.5	-75.7	78.1	0	0	0	108.4	Y377 N381 S1858 I1859 V1917	Y377-H1873 AromaticContact CD1-CE1 3.64Å; Y377-H1873 AromaticContact CD1-NE2 3.59Å; Y377-H1873 AromaticContact CE1-CE1 3.15Å; Y377-H1873 WeakPolarHBondContact CE1-CE1 3.37Å; Y377-H1873 AromaticContact CE1-NE2 3.09Å; Y377-H1873 WeakPolarHBondContact CE1-NE2 3.42Å; Y377-H1873 AromaticContact CZ-CE1 3.52Å; Y377-H1873 AromaticContact CZ-NE2 3.86Å; N381-H1873 WeakPolarHBondContact ND2-CA 3.4Å; N381-H1873 PolarHBondContact O-NE2 2.87Å; S1858-H1873 PolarHBondContact O-N 3.24Å; S1858-H1873 PolarHBondContact O-ND1 2.59Å; I1859-H1873 VanDerWaalsContact CG2-O 3.32Å; I1859-H1873 WeakPolarHBondContact CG2-O 3.49Å; I1859-H1873 PolarHBondContact O-N 3.45Å; H1873-V1917 WeakPolarHBondContact O-CB 3.01Å; H1873-V1917 WeakPolarHBondContact O-CG1 3.37Å
1874	S	65.2	Low	56.9	Low	68 Å²	68	35.8 Å²	35.8	48%	0.476	20%	0.202	S	C	.	.	S	Bend	trans	-61.5	141	168.2	57.2	0	0	0	0	111.8	V1917	S1874-V1917 WeakPolarHBondContact CA-O 3.32Å
1875	G	59.7	Low	56	Low	29 Å²	29	36.7 Å²	36.7	30%	0.299	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-168	-177.6	0	0	0	0	0	114.3	Q1916 V1917	G1875-Q1916 CarbonylContact O-C 3.5Å; G1875-Q1916 WeakPolarHBondContact O-CA 3.32Å; G1875-V1917 PolarHBondContact N-O 2.95Å; G1875-V1917 PolarHBondContact O-N 3.39Å
1876	Q	60.5	Low	55.1	Low	129 Å²	129	35 Å²	35	60%	0.603	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	110.3	172.8	-70	-170.7	16	0	0	110.5	I1859 N1914	I1859-Q1876 WeakPolarHBondContact CD1-O 3.34Å; Q1876-N1914 PolarHBondContact OE1-ND2 2.93Å
1877	G	57.4	Low	54.2	Low	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	118.9	175.3	0	0	0	0	0	110.5	L1915	G1877-L1915 PolarHBondContact N-O 3.04Å; G1877-L1915 PolarHBondContact O-N 3.02Å
1878	V	58.9	Low	52.9	Low	41 Å²	41	46.7 Å²	46.7	25%	0.248	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	113.3	174.3	178.7	0	0	0	0	109.4	V1855 L1912 I1913 N1914	V1855-V1878 HydrophobicContact CB-CB 4.02Å; V1855-V1878 WeakPolarHBondContact CB-O 3.31Å; V1855-V1878 HydrophobicContact CG2-CB 3.88Å; V1855-V1878 HydrophobicContact CG2-CG1 3.94Å; V1855-V1878 VanDerWaalsContact CG2-O 3.3Å; V1855-V1878 WeakPolarHBondContact CG2-O 3.22Å; V1855-V1878 PolarHBondContact N-O 3Å; V1878-L1912 HydrophobicContact CG1-CB 4.19Å; V1878-L1912 HydrophobicContact CG1-CD2 4.44Å; V1878-I1913 CarbonylContact C-O 3.2Å; V1878-I1913 WeakPolarHBondContact CA-O 3.3Å; V1878-N1914 HydrophobicContact CG2-CB 4.32Å
1879	L	64	Low	51.6	Low	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	151.7	165.7	-65.5	176.5	0	0	0	111	L1822 L1836 W1852 I1860 I1862 I1869 L1912 I1913 L1915	L1822-L1879 HydrophobicContact CD1-CD1 3.28Å; L1836-L1879 HydrophobicContact CD2-CD1 4.37Å; W1852-L1879 HydrophobicContact CZ3-CD1 4.43Å; I1860-L1879 HydrophobicContact CG2-CD2 3.83Å; I1862-L1879 HydrophobicContact CD1-CD2 3.29Å; I1862-L1879 HydrophobicContact CG1-CD2 3.95Å; I1869-L1879 HydrophobicContact CD1-CD1 3.76Å; I1869-L1879 HydrophobicContact CD1-CD2 3.73Å; I1869-L1879 HydrophobicContact CD1-CG 4.18Å; L1879-L1912 WeakPolarHBondContact O-CA 3.03Å; L1879-I1913 HydrophobicContact CB-CB 4.16Å; L1879-I1913 PolarHBondContact N-O 3.32Å; L1879-I1913 PolarHBondContact O-N 3.28Å; L1879-L1915 HydrophobicContact CD1-CD1 3.45Å; L1879-L1915 VanDerWaalsContact CD1-CD1 3.45Å; L1879-L1915 HydrophobicContact CD1-CG 4.24Å; L1879-L1915 HydrophobicContact CG-CD1 4.06Å
1880	T	55.9	Low	49.6	Very low	11 Å²	11	56.6 Å²	56.6	7%	0.067	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138.3	168.6	71.9	0	0	0	0	108.4	W1852 S1853 V1855 Y1911 L1912	W1852-T1880 CarbonylContact C-O 2.8Å; W1852-T1880 WeakPolarHBondContact CA-O 3.47Å; S1853-T1880 PolarHBondContact N-O 2.81Å; S1853-T1880 WeakPolarHBondContact O-CA 3.18Å; S1853-T1880 WeakPolarHBondContact O-CB 3.17Å; S1853-T1880 PolarHBondContact O-N 2.77Å; S1853-T1880 PolarHBondContact O-OG1 2.77Å; S1853-T1880 PolarHBondContact OG-OG1 2.72Å; V1855-T1880 HydrophobicContact CG2-CG2 3.69Å; T1880-Y1911 VanDerWaalsContact CA-O 3.3Å; T1880-Y1911 WeakPolarHBondContact CA-O 3.25Å; T1880-L1912 HydrophobicContact CG2-CD2 3.63Å
1881	F	59.2	Low	47.9	Very low	8 Å²	8	63.1 Å²	63.1	4%	0.035	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	117.4	170.5	171.4	-121.8	0	0	0	107.9	F1839 N1850 T1851 W1852 L1883 T1910 Y1911	F1839-F1881 HydrophobicContact CB-CE1 4.29Å; F1839-F1881 HydrophobicContact CB-CZ 3.91Å; F1839-F1881 AromaticContact CD2-CD1 3.99Å; F1839-F1881 HydrophobicContact CD2-CD1 3.99Å; F1839-F1881 AromaticContact CD2-CE1 3.39Å; F1839-F1881 HydrophobicContact CD2-CE1 3.39Å; F1839-F1881 HydrophobicContact CD2-CE2 4.16Å; F1839-F1881 AromaticContact CD2-CZ 3.51Å; F1839-F1881 HydrophobicContact CD2-CZ 3.51Å; F1839-F1881 HydrophobicContact CE2-CD1 4.09Å; F1839-F1881 AromaticContact CE2-CE1 3.91Å; F1839-F1881 HydrophobicContact CE2-CE1 3.91Å; F1839-F1881 HydrophobicContact CE2-CZ 4.4Å; F1839-F1881 HydrophobicContact CG-CE1 4.02Å; F1839-F1881 HydrophobicContact CG-CZ 4.05Å; N1850-F1881 HydrophobicContact CB-CE2 4.29Å; T1851-F1881 WeakPolarHBondContact O-CA 3.41Å; W1852-F1881 HydrophobicContact CD2-CB 4.16Å; W1852-F1881 AromaticContact CD2-CD2 3.86Å; W1852-F1881 HydrophobicContact CD2-CD2 3.86Å; W1852-F1881 HydrophobicContact CD2-CG 4.29Å; W1852-F1881 AromaticContact CE2-CD2 3.67Å; W1852-F1881 HydrophobicContact CE3-CB 3.79Å; W1852-F1881 HydrophobicContact CE3-CD2 4.37Å; W1852-F1881 HydrophobicContact CE3-CG 4.37Å; W1852-F1881 HydrophobicContact CG-CD2 4.18Å; W1852-F1881 HydrophobicContact CH2-CB 4.11Å; W1852-F1881 HydrophobicContact CH2-CG 4.22Å; W1852-F1881 HydrophobicContact CZ2-CB 4.44Å; W1852-F1881 HydrophobicContact CZ2-CD2 4.03Å; W1852-F1881 HydrophobicContact CZ2-CG 4.13Å; W1852-F1881 HydrophobicContact CZ3-CB 3.78Å; W1852-F1881 HydrophobicContact CZ3-CG 4.34Å; W1852-F1881 AromaticContact NE1-CD2 3.89Å; F1881-L1883 HydrophobicContact CE1-CB 4.1Å; F1881-L1883 HydrophobicContact CE1-CD1 3.97Å; F1881-L1883 HydrophobicContact CE1-CG 4.03Å; F1881-L1883 HydrophobicContact CZ-CB 4.2Å; F1881-L1883 HydrophobicContact CZ-CD1 4.38Å; F1881-L1883 HydrophobicContact CZ-CG 4Å; F1881-T1910 CarbonylContact O-C 3.46Å; F1881-T1910 WeakPolarHBondContact O-CA 3.24Å; F1881-Y1911 AromaticContact CD1-CD2 3.75Å; F1881-Y1911 HydrophobicContact CD1-CD2 3.75Å; F1881-Y1911 HydrophobicContact CD1-CE2 4.34Å; F1881-Y1911 HydrophobicContact CE1-CD2 4.36Å; F1881-Y1911 PolarHBondContact N-O 2.88Å; F1881-Y1911 PolarHBondContact O-N 3.37Å
1882	S	50.3	Low	45.9	Very low	21 Å²	21	72.3 Å²	72.3	15%	0.147	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.9	176.6	84.3	0	0	0	0	110.6	N1850 T1851	N1850-S1882 CarbonylContact C-O 3.49Å; N1850-S1882 WeakPolarHBondContact CA-O 3.3Å; T1851-S1882 PolarHBondContact N-O 2.8Å; T1851-S1882 PolarHBondContact O-N 3.49Å; T1851-S1882 PolarHBondContact OG1-OG 2.94Å
1883	L	43	Very low	44.7	Very low	48 Å²	48	79 Å²	79	25%	0.251	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	91.8	-169.6	-156.9	176.9	0	0	0	108.4	N1850 F1881 P1908 L1909 Y1911	N1850-L1883 WeakPolarHBondContact OD1-CA 3.33Å; F1881-L1883 HydrophobicContact CE1-CB 4.1Å; F1881-L1883 HydrophobicContact CE1-CD1 3.97Å; F1881-L1883 HydrophobicContact CE1-CG 4.03Å; F1881-L1883 HydrophobicContact CZ-CB 4.2Å; F1881-L1883 HydrophobicContact CZ-CD1 4.38Å; F1881-L1883 HydrophobicContact CZ-CG 4Å; L1883-P1908 WeakPolarHBondContact O-CA 3.44Å; L1883-P1908 WeakPolarHBondContact O-CB 3.14Å; L1883-L1909 HydrophobicContact CB-CB 4.2Å; L1883-L1909 WeakPolarHBondContact CB-O 3.26Å; L1883-L1909 PolarHBondContact N-O 2.72Å; L1883-L1909 PolarHBondContact O-N 2.84Å; L1883-Y1911 HydrophobicContact CD1-CE2 4.18Å
1884	T	43.6	Very low	43.1	Very low	42 Å²	42	85.5 Å²	85.5	26%	0.258	45%	0.448	S	S	.	.			trans	-77.5	142.6	179.5	60.2	0	0	0	0	110.8	D1849 N1850 P1908	D1849-T1884 VanDerWaalsContact C-OG1 3.23Å; D1849-T1884 WeakPolarHBondContact O-CB 3.46Å; D1849-T1884 WeakPolarHBondContact O-CG2 3.28Å; D1849-T1884 PolarHBondContact O-OG1 3.1Å; N1850-T1884 PolarHBondContact OD1-N 2.95Å; N1850-T1884 PolarHBondContact OD1-O 3.4Å; T1884-P1908 HydrophobicContact CG2-CB 4.5Å; T1884-P1908 HydrophobicContact CG2-CG 4.39Å
1885	S	33.6	Very low	41.4	Very low	53 Å²	53	88.6 Å²	88.6	37%	0.371	46%	0.464	S	S	.	.			trans	-129.2	122.7	-174.1	174.9	0	0	0	0	109.7	S1906	S1885-S1906 WeakPolarHBondContact CB-OG 3.46Å; S1885-S1906 PolarHBondContact O-OG 2.99Å; S1885-S1906 VanDerWaalsContact OG-CB 3.26Å; S1885-S1906 WeakPolarHBondContact OG-CB 3.39Å; S1885-S1906 PolarHBondContact OG-OG 3.21Å
1886	S	32.8	Very low	40	Very low	67 Å²	67	93.4 Å²	93.4	47%	0.469	49%	0.487	S	S	.	.			trans	-138.2	135.4	163.3	91.4	0	0	0	0	109.3	L1848	L1848-S1886 WeakPolarHBondContact CD2-OG 3.39Å
1887	V	30.9	Very low	38.3	Very low	129 Å²	129	95.9 Å²	95.9	78%	0.782	50%	0.496	S	S	*	.			trans	-114.2	112.3	174.2	177.7	0	0	0	0	107.4
1888	K	29.2	Very low	36.9	Very low	198 Å²	198	103.6 Å²	103.6	86%	0.861	54%	0.537	S	S	*	.			trans	-109.1	135.2	165.4	-74.3	179.7	178.9	171.8	0	108.4
1889	T	27.3	Very low	35.5	Very low	95 Å²	95	108.7 Å²	108.7	58%	0.583	57%	0.568	S	S	*	*			trans	-83.4	138.7	-173.1	45.5	0	0	0	0	112.7
1890	Y	25	Very low	33.8	Very low	162 Å²	162	114.4 Å²	114.4	64%	0.635	60%	0.604	S	S	*	*				171.5	160	116.1	-107	-87.1	0	0	0	113.4
1891	Q	26.7	Very low	32.5	Very low	177 Å²	177	125 Å²	125	83%	0.827	64%	0.644	S	S	*	*			trans	61.2	96.5	160.2	-69.3	175.8	-15.3	0	0	120.3
1892	Q	26.2	Very low	31.1	Very low	195 Å²	195	128.1 Å²	128.1	91%	0.911	67%	0.667	S	S	*	*				165	51.8	123.1	-88.7	-162.5	-8.4	0	0	114
1893	I	29	Very low	29.9	Very low	147 Å²	147	131.6 Å²	131.6	75%	0.754	68%	0.684	S	S	*	*			trans	-137.3	91.3	155.8	-55.4	-178.4	0	0	0	109.2
1894	E	26.3	Very low	29.3	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	72%	0.715	S	S	*	*			trans	-91.9	111.1	158.9	-66.1	-173.5	117.8	0	0	108.1
1895	T	29.5	Very low	28.5	Very low	133 Å²	133	143.8 Å²	143.8	82%	0.816	74%	0.736	S	S	*	*	S	Bend	trans	172.8	-21.9	156.7	21.2	0	0	0	0	112.8
1896	V	30	Very low	28.4	Very low	129 Å²	129	143.8 Å²	143.8	78%	0.782	74%	0.736	S	S	*	*			trans	-118.5	88.8	-177.7	-171.4	0	0	0	0	110.5
1897	K	26.4	Very low	28.4	Very low	181 Å²	181	146.4 Å²	146.4	79%	0.787	74%	0.741	S	S	*	*			trans	-114.9	104.3	173.7	-77	-176.6	175.2	177.3	0	110
1898	N	26.7	Very low	28.6	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	71%	0.71	S	S	*	*			trans	170.9	72.1	147.5	-91.1	-4.9	0	0	0	112.9
1899	T	30.4	Very low	28.9	Very low	148 Å²	148	136.3 Å²	136.3	91%	0.908	69%	0.693	S	S	*	*			trans	-163.3	141.4	154.7	38.1	0	0	0	0	109.2
1900	T	26.9	Very low	29.3	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	68%	0.68	S	S	*	*			trans	-122.2	116.7	-170	50	0	0	0	0	112.9
1901	Y	29.5	Very low	30	Very low	232 Å²	232	131 Å²	131	91%	0.91	67%	0.667	S	S	*	*			trans	-164.5	117.9	163.8	-92.1	-67.1	0	0	0	111.1
1902	S	29.1	Very low	30.9	Very low	74 Å²	74	126.9 Å²	126.9	52%	0.517	65%	0.65	S	S	.	*			trans	-147.8	124.5	155.5	78.5	0	0	0	0	113.6	E603	E603-S1902 WeakPolarHBondContact OE1-CB 3.46Å; E603-S1902 PolarHBondContact OE1-N 3.21Å; E603-S1902 PolarHBondContact OE1-OG 3.06Å
1903	N	26.8	Very low	32.1	Very low	94 Å²	94	117.7 Å²	117.7	50%	0.503	61%	0.607	S	S	.	*			trans	-170.2	102.4	138.4	-129.9	-42.2	0	0	0	109.9	N602	N602-N1903 VanDerWaalsContact O-CB 3.28Å; N602-N1903 WeakPolarHBondContact O-CB 3.34Å; N602-N1903 PolarHBondContact O-ND2 3.45Å
1904	M	29.1	Very low	33.1	Very low	185 Å²	185	112.6 Å²	112.6	91%	0.911	58%	0.582	S	S	*	*			trans	-123.5	104.8	171.4	-75.1	-163.9	175.9	0	0	109.7	S1906	M1904-S1906 PolarHBondContact O-N 3.29Å
1905	K	28	Very low	34.8	Very low	161 Å²	161	104.4 Å²	104.4	70%	0.7	54%	0.544	S	S	*	.			trans	-72	107.9	163.5	-68	-178.6	-175.9	176	0	107.7	H486	H486-K1905 PolarHBondContact NE2-NZ 3.47Å
1906	S	31.6	Very low	36.3	Very low	53 Å²	53	101.5 Å²	101.5	37%	0.371	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-80.6	124.4	-177.6	40.5	0	0	0	0	111.8	S1885 M1904 P1908	S1885-S1906 WeakPolarHBondContact CB-OG 3.46Å; S1885-S1906 PolarHBondContact O-OG 2.99Å; S1885-S1906 VanDerWaalsContact OG-CB 3.26Å; S1885-S1906 WeakPolarHBondContact OG-CB 3.39Å; S1885-S1906 PolarHBondContact OG-OG 3.21Å; M1904-S1906 PolarHBondContact O-N 3.29Å; S1906-P1908 WeakPolarHBondContact O-CD 3.26Å
1907	E	32.9	Very low	38	Very low	122 Å²	122	95.6 Å²	95.6	57%	0.57	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-78.8	121.1	168.4	-88.6	-163.5	-136.3	0	0	110.4	Q495 L1909	Q495-E1907 HydrophobicContact CG-CB 4.33Å; Q495-E1907 HydrophobicContact CG-CG 4.23Å; Q495-E1907 PolarHBondContact NE2-OE2 3.03Å; E1907-L1909 PolarHBondContact O-N 2.81Å
1908	P	34	Very low	39.2	Very low	19 Å²	19	87.3 Å²	87.3	12%	0.123	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-48.8	121.9	169.3	-27	17	0	0	0	114.7	Q495 L1883 T1884 S1906 T1910	Q495-P1908 HydrophobicContact CG-CB 4.27Å; Q495-P1908 VanDerWaalsContact CG-CD 3.43Å; Q495-P1908 HydrophobicContact CG-CG 3.82Å; Q495-P1908 PolarHBondContact NE2-O 2.91Å; Q495-P1908 PolarHBondContact OE1-O 3.13Å; L1883-P1908 WeakPolarHBondContact O-CA 3.44Å; L1883-P1908 WeakPolarHBondContact O-CB 3.14Å; T1884-P1908 HydrophobicContact CG2-CB 4.5Å; T1884-P1908 HydrophobicContact CG2-CG 4.39Å; S1906-P1908 WeakPolarHBondContact O-CD 3.26Å; P1908-T1910 PolarHBondContact O-N 2.8Å
1909	L	34.8	Very low	40.2	Very low	97 Å²	97	81.6 Å²	81.6	51%	0.508	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	115.8	178.7	-75.3	147.8	0	0	0	108.9	L1883 E1907 Y1911	L1883-L1909 HydrophobicContact CB-CB 4.2Å; L1883-L1909 WeakPolarHBondContact CB-O 3.26Å; L1883-L1909 PolarHBondContact N-O 2.72Å; L1883-L1909 PolarHBondContact O-N 2.84Å; E1907-L1909 PolarHBondContact O-N 2.81Å; L1909-Y1911 HydrophobicContact CB-CD2 4.37Å; L1909-Y1911 HydrophobicContact CB-CE2 3.58Å
1910	T	37	Very low	40.8	Very low	51 Å²	51	78.1 Å²	78.1	31%	0.313	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	109.2	175.6	-52.6	0	0	0	0	109.8	F1881 P1908	F1881-T1910 CarbonylContact O-C 3.46Å; F1881-T1910 WeakPolarHBondContact O-CA 3.24Å; P1908-T1910 PolarHBondContact O-N 2.8Å
1911	Y	40.4	Very low	41.5	Very low	94 Å²	94	80.1 Å²	80.1	37%	0.369	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	145	177	-60	-94.6	0	0	0	110.4	T1880 F1881 L1883 L1909	T1880-Y1911 VanDerWaalsContact CA-O 3.3Å; T1880-Y1911 WeakPolarHBondContact CA-O 3.25Å; F1881-Y1911 AromaticContact CD1-CD2 3.75Å; F1881-Y1911 HydrophobicContact CD1-CD2 3.75Å; F1881-Y1911 HydrophobicContact CD1-CE2 4.34Å; F1881-Y1911 HydrophobicContact CE1-CD2 4.36Å; F1881-Y1911 PolarHBondContact N-O 2.88Å; F1881-Y1911 PolarHBondContact O-N 3.37Å; L1883-Y1911 HydrophobicContact CD1-CE2 4.18Å; L1909-Y1911 HydrophobicContact CB-CD2 4.37Å; L1909-Y1911 HydrophobicContact CB-CE2 3.58Å
1912	L	43.6	Very low	42.1	Very low	91 Å²	91	72 Å²	72	48%	0.476	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	135.2	171.6	-58.2	-179.8	0	0	0	109.1	V1878 L1879 T1880	V1878-L1912 HydrophobicContact CG1-CB 4.19Å; V1878-L1912 HydrophobicContact CG1-CD2 4.44Å; L1879-L1912 WeakPolarHBondContact O-CA 3.03Å; T1880-L1912 HydrophobicContact CG2-CD2 3.63Å
1913	I	52	Low	42.6	Very low	1 Å²	1	71 Å²	71	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	113	-177.6	-47.2	179.1	0	0	0	108.5	L1820 L1822 W1852 V1878 L1879 L1915	L1820-I1913 HydrophobicContact CB-CB 4.35Å; L1820-I1913 HydrophobicContact CB-CD1 3.98Å; L1820-I1913 HydrophobicContact CB-CG1 3.75Å; L1820-I1913 HydrophobicContact CB-CG2 3.95Å; L1820-I1913 HydrophobicContact CD2-CD1 3.65Å; L1820-I1913 HydrophobicContact CD2-CG1 4.21Å; L1820-I1913 HydrophobicContact CG-CD1 4.46Å; L1820-I1913 WeakPolarHBondContact O-CG2 3.26Å; L1822-I1913 HydrophobicContact CD1-CD1 3.8Å; L1822-I1913 HydrophobicContact CD1-CG2 4.35Å; L1822-I1913 HydrophobicContact CG-CD1 4.14Å; W1852-I1913 HydrophobicContact CH2-CD1 4.34Å; W1852-I1913 HydrophobicContact CZ3-CD1 4.01Å; V1878-I1913 CarbonylContact C-O 3.2Å; V1878-I1913 WeakPolarHBondContact CA-O 3.3Å; L1879-I1913 HydrophobicContact CB-CB 4.16Å; L1879-I1913 PolarHBondContact N-O 3.32Å; L1879-I1913 PolarHBondContact O-N 3.28Å; I1913-L1915 HydrophobicContact CG2-CG 4.46Å
1914	N	50.1	Low	42.7	Very low	41 Å²	41	72.4 Å²	72.4	22%	0.219	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.8	175.1	-162.8	9.5	0	0	0	110.1	Q1876 V1878	Q1876-N1914 PolarHBondContact OE1-ND2 2.93Å; V1878-N1914 HydrophobicContact CG2-CB 4.32Å
1915	L	62.2	Low	42.7	Very low	4 Å²	4	67 Å²	67	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.9	175	-73.8	-178	0	0	0	110.1	L1822 L1828 I1860 I1869 G1877 L1879 I1913	L1822-L1915 HydrophobicContact CD1-CD1 4.3Å; L1828-L1915 HydrophobicContact CD1-CD1 4.17Å; I1860-L1915 HydrophobicContact CD1-CB 3.63Å; I1860-L1915 HydrophobicContact CD1-CD1 4.17Å; I1869-L1915 HydrophobicContact CD1-CD1 3.92Å; G1877-L1915 PolarHBondContact N-O 3.04Å; G1877-L1915 PolarHBondContact O-N 3.02Å; L1879-L1915 HydrophobicContact CD1-CD1 3.45Å; L1879-L1915 VanDerWaalsContact CD1-CD1 3.45Å; L1879-L1915 HydrophobicContact CD1-CG 4.24Å; L1879-L1915 HydrophobicContact CG-CD1 4.06Å; I1913-L1915 HydrophobicContact CG2-CG 4.46Å
1916	Q	61.9	Low	42.9	Very low	72 Å²	72	62.5 Å²	62.5	34%	0.336	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	130.5	173.5	-177.9	-179.8	-11.6	0	0	110.2	S1827 L1828 G1875	S1827-Q1916 CarbonylContact C-O 3.31Å; S1827-Q1916 WeakPolarHBondContact CA-O 3.33Å; S1827-Q1916 WeakPolarHBondContact CB-O 3.44Å; L1828-Q1916 PolarHBondContact N-O 3.37Å; G1875-Q1916 CarbonylContact O-C 3.5Å; G1875-Q1916 WeakPolarHBondContact O-CA 3.32Å
1917	V	64.5	Low	42.8	Very low	4 Å²	4	65.3 Å²	65.3	2%	0.024	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	146.1	171.3	-177.5	0	0	0	0	110.5	L1828 I1859 I1860 A1871 H1873 S1874 G1875	L1828-V1917 HydrophobicContact CB-CG2 4.42Å; L1828-V1917 VanDerWaalsContact O-CA 3.25Å; L1828-V1917 WeakPolarHBondContact O-CA 3.33Å; I1859-V1917 HydrophobicContact CG2-CB 3.88Å; I1859-V1917 HydrophobicContact CG2-CG2 3.81Å; I1860-V1917 HydrophobicContact CD1-CG2 3.84Å; I1860-V1917 HydrophobicContact CG1-CG2 3.45Å; I1860-V1917 VanDerWaalsContact CG1-CG2 3.45Å; A1871-V1917 HydrophobicContact CB-CB 4.35Å; A1871-V1917 HydrophobicContact CB-CG1 3.44Å; A1871-V1917 VanDerWaalsContact CB-CG1 3.44Å; A1871-V1917 HydrophobicContact CB-CG2 3.92Å; H1873-V1917 WeakPolarHBondContact O-CB 3.01Å; H1873-V1917 WeakPolarHBondContact O-CG1 3.37Å; S1874-V1917 WeakPolarHBondContact CA-O 3.32Å; G1875-V1917 PolarHBondContact N-O 2.95Å; G1875-V1917 PolarHBondContact O-N 3.39Å
1918	I	52.7	Low	42.7	Very low	7 Å²	7	62.3 Å²	62.3	4%	0.036	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	135.8	-159.7	-33.6	145.4	0	0	0	111.9	H1731 R1732 S1733 L1828 I1829 E1830	H1731-I1918 WeakPolarHBondContact ND1-CD1 3.45Å; R1732-I1918 VanDerWaalsContact C-CG2 3.47Å; R1732-I1918 HydrophobicContact CB-CB 4.16Å; R1732-I1918 HydrophobicContact CB-CD1 3.85Å; R1732-I1918 HydrophobicContact CB-CG2 3.83Å; R1732-I1918 WeakPolarHBondContact O-CG2 3.36Å; S1733-I1918 VanDerWaalsContact CB-CD1 3.44Å; S1733-I1918 WeakPolarHBondContact OG-CD1 3.41Å; L1828-I1918 VanDerWaalsContact O-CD1 3.26Å; L1828-I1918 WeakPolarHBondContact O-CD1 3.21Å; L1828-I1918 VanDerWaalsContact O-CG1 3.24Å; L1828-I1918 WeakPolarHBondContact O-CG1 3.44Å; L1828-I1918 PolarHBondContact O-N 2.83Å; L1828-I1918 VanDerWaalsContact O-N 3.08Å; I1829-I1918 HydrophobicContact CG1-CD1 4.48Å; E1830-I1918 WeakPolarHBondContact CB-O 3.47Å; E1830-I1918 PolarHBondContact N-O 3.17Å
1919	P	47.8	Very low	42.5	Very low	42 Å²	42	63.7 Å²	63.7	27%	0.273	36%	0.357	S	S	.	.			trans	-66.3	155.7	-179.1	28.9	-35.3	0	0	0	113.2	R1732 E1830 E1921 L1922	R1732-P1919 VanDerWaalsContact CD-O 3.26Å; R1732-P1919 WeakPolarHBondContact CD-O 3.26Å; E1830-P1919 WeakPolarHBondContact OE2-CA 3.36Å; P1919-E1921 PolarHBondContact O-N 3.48Å; P1919-L1922 HydrophobicContact CG-CD1 3.87Å
1920	L	43.3	Very low	42.4	Very low	75 Å²	75	60.6 Å²	60.6	39%	0.393	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	4.9	-171.6	-156.6	77.2	0	0	0	114.7	R1732 I1829 E1830	R1732-L1920 PolarHBondContact NE-O 2.84Å; R1732-L1920 PolarHBondContact NH2-O 2.79Å; I1829-L1920 HydrophobicContact CG2-CD1 3.9Å; E1830-L1920 HydrophobicContact CG-CB 4.27Å; E1830-L1920 WeakPolarHBondContact O-CD1 3.29Å
1921	E	41.1	Very low	42.4	Very low	163 Å²	163	60.1 Å²	60.1	76%	0.762	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-21.3	-168.2	-60.1	-173.7	136.2	0	0	114.2	P1919 Y1923	P1919-E1921 PolarHBondContact O-N 3.48Å; E1921-Y1923 PolarHBondContact O-N 3.24Å
1922	L	41.8	Very low	42.4	Very low	62 Å²	62	59 Å²	59	33%	0.325	34%	0.344	S	S	.	.	S	Bend	trans	-93.1	28	-171.7	-60.7	86.6	0	0	0	116.8	R1732 P1919	R1732-L1922 HydrophobicContact CB-CB 4.42Å; R1732-L1922 HydrophobicContact CG-CB 3.84Å; R1732-L1922 VanDerWaalsContact O-CB 3.31Å; R1732-L1922 WeakPolarHBondContact O-CB 3.11Å; P1919-L1922 HydrophobicContact CG-CD1 3.87Å
1923	Y	39	Very low	42.4	Very low	54 Å²	54	55.3 Å²	55.3	21%	0.212	33%	0.325	C	S	.	.			trans	-133.6	107.2	173.7	-105.7	-63.3	0	0	0	110	L1730 H1731 R1732 I1829 E1921	L1730-Y1923 WeakPolarHBondContact O-CE1 3.3Å; L1730-Y1923 PolarHBondContact O-OH 2.95Å; H1731-Y1923 AromaticContact CD2-CZ 3.93Å; H1731-Y1923 PolarHBondContact CD2-OH 3.43Å; R1732-Y1923 HydrophobicContact CB-CD2 3.49Å; R1732-Y1923 VanDerWaalsContact CB-CD2 3.49Å; R1732-Y1923 HydrophobicContact CB-CE2 3.98Å; R1732-Y1923 HydrophobicContact CB-CG 4.26Å; R1732-Y1923 HydrophobicContact CG-CD2 3.35Å; R1732-Y1923 HydrophobicContact CG-CE2 4.32Å; R1732-Y1923 HydrophobicContact CG-CG 3.82Å; I1829-Y1923 HydrophobicContact CD1-CD2 3.8Å; I1829-Y1923 HydrophobicContact CD1-CE2 3.58Å; I1829-Y1923 HydrophobicContact CG1-CD2 4.27Å; I1829-Y1923 HydrophobicContact CG1-CE2 4.05Å; E1921-Y1923 PolarHBondContact O-N 3.24Å
1924	T	29.2	Very low	41.9	Very low	122 Å²	122	60.4 Å²	60.4	75%	0.748	35%	0.347	S	S	*	.			trans	-143.5	28.6	178.3	46.5	0	0	0	0	114.5
1925	S	29.4	Very low	41.6	Very low	73 Å²	73	58.8 Å²	58.8	51%	0.51	34%	0.339	S	S	.	.	S	Bend	trans	-164.5	148.6	163.2	50.9	0	0	0	0	113.9
1926	G	31.9	Very low	40.6	Very low	65 Å²	65	62.6 Å²	62.6	67%	0.67	36%	0.359	S	S	*	.			trans	134.2	-23	152.3	0	0	0	0	0	120.7
1927	I	30.4	Very low	39.6	Very low	112 Å²	112	62.8 Å²	62.8	57%	0.574	37%	0.369	S	S	*	.			trans	-109	114.4	-173.2	-57.3	-179.8	0	0	0	112.1	S1929	I1927-S1929 PolarHBondContact O-N 2.03Å
1928	P	30.2	Very low	38.2	Very low	59 Å²	59	64.3 Å²	64.3	38%	0.383	39%	0.385	S	S	.	.			trans	-77.9	115.6	171	29.6	-32	0	0	0	111.9
1929	S	30	Very low	37.5	Very low	48 Å²	48	72.1 Å²	72.1	34%	0.336	43%	0.427	S	S	.	.			trans	44.7	79.4	148.6	54.1	0	0	0	0	118.2	I1927 F1949	I1927-S1929 PolarHBondContact O-N 2.03Å; S1929-F1949 WeakPolarHBondContact OG-CE1 3.08Å; S1929-F1949 WeakPolarHBondContact OG-CZ 3.46Å
1930	A	32.6	Very low	37	Very low	32 Å²	32	76.6 Å²	76.6	26%	0.264	45%	0.448	S	S	.	.			trans	-126.4	88.8	156.9	0	0	0	0	0	109.5	L1969 F2067	A1930-L1969 HydrophobicContact CB-CD1 4.08Å; A1930-F2067 HydrophobicContact CB-CE1 4.05Å; A1930-F2067 HydrophobicContact CB-CE2 4.23Å; A1930-F2067 HydrophobicContact CB-CZ 3.71Å
1931	S	37.1	Very low	36.9	Very low	42 Å²	42	76.5 Å²	76.5	29%	0.294	45%	0.451	S	S	.	.			trans	-74.7	134.6	179.6	55.8	0	0	0	0	111.7	I1933 I1947	S1931-I1933 PolarHBondContact O-N 2.57Å; S1931-I1947 WeakPolarHBondContact OG-CD1 3.48Å
1932	L	39.6	Very low	36.7	Very low	69 Å²	69	72.6 Å²	72.6	36%	0.361	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	111.6	167.2	-118.8	72.3	0	0	0	109.9	F1934 L1969 Q1971	L1932-F1934 HydrophobicContact CB-CD2 4.28Å; L1932-F1934 HydrophobicContact CB-CE2 3.99Å; L1932-F1934 HydrophobicContact CD2-CE1 4.28Å; L1932-F1934 HydrophobicContact CD2-CE2 3.81Å; L1932-F1934 HydrophobicContact CD2-CZ 3.63Å; L1932-F1934 HydrophobicContact CG-CE2 4.49Å; L1932-F1934 PolarHBondContact O-N 3.1Å; L1932-L1969 HydrophobicContact CD1-CB 4.01Å; L1932-L1969 HydrophobicContact CD1-CD1 3.83Å; L1932-Q1971 VanDerWaalsContact CD2-OE1 3.24Å
1933	I	43.6	Very low	36.6	Very low	15 Å²	15	78.1 Å²	78.1	8%	0.077	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	101	167.2	-56.4	179.7	0	0	0	107.1	S1931 V1935 F1968 L1969 I1970 Q1971 L2103 A2124 T2126	S1931-I1933 PolarHBondContact O-N 2.57Å; I1933-V1935 HydrophobicContact CG2-CG2 4.23Å; I1933-F1968 HydrophobicContact CD1-CB 4.03Å; I1933-F1968 HydrophobicContact CD1-CD1 4.41Å; I1933-L1969 WeakPolarHBondContact CB-O 3.39Å; I1933-L1969 PolarHBondContact N-O 2.63Å; I1933-I1970 HydrophobicContact CB-CG1 4.34Å; I1933-I1970 HydrophobicContact CD1-CG1 4.38Å; I1933-Q1971 PolarHBondContact O-N 2.84Å; I1933-L2103 HydrophobicContact CD1-CD2 4.06Å; I1933-A2124 HydrophobicContact CG2-CB 3.72Å; I1933-T2126 HydrophobicContact CD1-CG2 3.86Å
1934	F	41.8	Very low	36.7	Very low	107 Å²	107	77.9 Å²	77.9	47%	0.469	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134.1	170.1	-77.4	-83.7	0	0	0	110.5	L1932 L1942	L1932-F1934 HydrophobicContact CB-CD2 4.28Å; L1932-F1934 HydrophobicContact CB-CE2 3.99Å; L1932-F1934 HydrophobicContact CD2-CE1 4.28Å; L1932-F1934 HydrophobicContact CD2-CE2 3.81Å; L1932-F1934 HydrophobicContact CD2-CZ 3.63Å; L1932-F1934 HydrophobicContact CG-CE2 4.49Å; L1932-F1934 PolarHBondContact O-N 3.1Å; F1934-L1942 HydrophobicContact CB-CD2 4.36Å
1935	V	44.1	Very low	37	Very low	8 Å²	8	80.5 Å²	80.5	5%	0.048	47%	0.469	C	S	.	.			trans	-119.1	58.5	-169.3	172.3	0	0	0	0	110.6	I1933 S1937 I1970 Q1971 L1972 P1973 L2105 I2123 A2124	I1933-V1935 HydrophobicContact CG2-CG2 4.23Å; V1935-S1937 PolarHBondContact O-N 2.95Å; V1935-I1970 HydrophobicContact CG2-CG2 4.05Å; V1935-Q1971 PolarHBondContact N-O 2.95Å; V1935-L1972 HydrophobicContact CB-CD2 4.38Å; V1935-L1972 HydrophobicContact CG1-CD2 3.72Å; V1935-P1973 WeakPolarHBondContact O-CD 3.29Å; V1935-P1973 WeakPolarHBondContact O-CG 3.44Å; V1935-L2105 HydrophobicContact CG1-CD2 4.42Å; V1935-L2105 HydrophobicContact CG2-CD2 3.88Å; V1935-I2123 HydrophobicContact CB-CG2 4.39Å; V1935-I2123 HydrophobicContact CG1-CG2 3.13Å; V1935-A2124 HydrophobicContact CG2-CB 4.12Å
1936	D	40.9	Very low	37.4	Very low	84 Å²	84	80.3 Å²	80.3	45%	0.449	47%	0.468	S	S	.	.			trans	-60.1	132.1	-174.9	-166.1	23.1	0	0	0	112.1	G1938 L1942 K1975	D1936-G1938 PolarHBondContact O-N 3.28Å; D1936-L1942 HydrophobicContact CB-CD1 4.35Å; D1936-K1975 IonicContact OD1-NZ 3.6Å; D1936-K1975 PolarHBondContact OD1-NZ 3.47Å; D1936-K1975 IonicContact OD2-NZ 3.96Å
1937	S	40.8	Very low	37.8	Very low	76 Å²	76	78.9 Å²	78.9	53%	0.531	44%	0.444	S	S	.	.	S	Bend	trans	-81	23	-168	76.1	0	0	0	0	113.5	V1935 K1975	V1935-S1937 PolarHBondContact O-N 2.95Å; S1937-K1975 WeakPolarHBondContact OG-CD 3.48Å
1938	G	35.3	Very low	37.7	Very low	36 Å²	36	78.9 Å²	78.9	37%	0.371	44%	0.444	S	S	.	.	S	Bend	trans	-133.3	83.7	-167.4	0	0	0	0	0	113.8	D1936 N1940	D1936-G1938 PolarHBondContact O-N 3.28Å; G1938-N1940 PolarHBondContact O-N 2.99Å
1939	N	37.9	Very low	38	Very low	171 Å²	171	78 Å²	78	91%	0.914	43%	0.434	S	S	*	.	S	Bend	trans	52.8	-14	163.4	-72.1	-3.5	0	0	0	120.7
1940	N	37.6	Very low	37.9	Very low	135 Å²	135	77.6 Å²	77.6	72%	0.722	43%	0.431	S	S	*	.			trans	-106	111.6	-179	-70.4	-24.6	0	0	0	110.2	G1938 L1942	G1938-N1940 PolarHBondContact O-N 2.99Å; N1940-L1942 PolarHBondContact O-N 3.1Å; N1940-L1942 VanDerWaalsContact O-N 3.1Å
1941	V	40.7	Very low	37.8	Very low	74 Å²	74	80.6 Å²	80.6	45%	0.448	44%	0.441	S	S	.	.			trans	-67.2	108.7	173.7	179.8	0	0	0	0	108.8	Q1943 L2122	V1941-Q1943 PolarHBondContact O-N 3.27Å; V1941-L2122 HydrophobicContact CG1-CD2 4.21Å
1942	L	37.5	Very low	37.4	Very low	80 Å²	80	79.9 Å²	79.9	42%	0.419	44%	0.44	S	S	.	.			trans	-63.9	107.3	172.9	-87.9	87	0	0	0	109.7	F1934 D1936 N1940 S1944	F1934-L1942 HydrophobicContact CB-CD2 4.36Å; D1936-L1942 HydrophobicContact CB-CD1 4.35Å; N1940-L1942 PolarHBondContact O-N 3.1Å; N1940-L1942 VanDerWaalsContact O-N 3.1Å; L1942-S1944 PolarHBondContact O-N 3.41Å
1943	Q	39.3	Very low	36.9	Very low	178 Å²	178	81.2 Å²	81.2	83%	0.832	45%	0.451	S	S	*	.	B	Isolated β-bridge	trans	-76.9	114.4	160.8	-69.2	-175.9	-18.7	0	0	107.9	V1941	V1941-Q1943 PolarHBondContact O-N 3.27Å
1944	S	41.2	Very low	36.1	Very low	49 Å²	49	82.4 Å²	82.4	34%	0.343	46%	0.458	S	S	.	.			trans	-92.7	145.6	170.2	49.3	0	0	0	0	110.4	L1942 Q2125 T2126	L1942-S1944 PolarHBondContact O-N 3.41Å; S1944-Q2125 PolarHBondContact OG-O 3.04Å; S1944-Q2125 VanDerWaalsContact OG-O 3.05Å; S1944-T2126 WeakPolarHBondContact OG-CA 3.48Å; S1944-T2126 WeakPolarHBondContact OG-CB 3.37Å; S1944-T2126 PolarHBondContact OG-OG1 2.83Å
1945	E	35.1	Very low	35.4	Very low	178 Å²	178	77.8 Å²	77.8	83%	0.832	44%	0.437	S	S	*	.			trans	-61	156.2	-174.7	-61.6	-173.8	140.3	0	0	112.8	I1947	E1945-I1947 WeakPolarHBondContact O-CG1 3.44Å; E1945-I1947 PolarHBondContact O-N 3.36Å
1946	S	38.2	Very low	34.6	Very low	69 Å²	69	78.2 Å²	78.2	48%	0.483	44%	0.44	S	S	.	.			trans	-72	112.4	-174.9	56.1	0	0	0	0	112.3	S2127	S1946-S2127 CarbonylContact C-O 3.24Å; S1946-S2127 WeakPolarHBondContact CA-O 3.36Å
1947	I	39.5	Very low	34	Very low	35 Å²	35	74.7 Å²	74.7	18%	0.179	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	121.3	-173.3	-48.3	176.4	0	0	0	110.3	S1931 E1945 F1949 S2127 L2128 L2129	S1931-I1947 WeakPolarHBondContact OG-CD1 3.48Å; E1945-I1947 WeakPolarHBondContact O-CG1 3.44Å; E1945-I1947 PolarHBondContact O-N 3.36Å; I1947-F1949 HydrophobicContact CG2-CD2 3.84Å; I1947-F1949 HydrophobicContact CG2-CE2 3.7Å; I1947-S2127 PolarHBondContact N-O 3.01Å; I1947-L2128 HydrophobicContact CB-CD2 4.01Å; I1947-L2128 HydrophobicContact CG2-CD2 4.44Å; I1947-L2128 VanDerWaalsContact O-CA 3.3Å; I1947-L2128 WeakPolarHBondContact O-CA 3.42Å; I1947-L2129 PolarHBondContact O-N 3.46Å
1948	I	28.8	Very low	33.4	Very low	111 Å²	111	71.4 Å²	71.4	57%	0.569	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	125.4	177.1	-57.1	174.5	0	0	0	109.1	L2131	I1948-L2131 HydrophobicContact CG2-CD1 3.83Å; I1948-L2131 HydrophobicContact CG2-CG 4.32Å
1949	F	37	Very low	33	Very low	40 Å²	40	69.9 Å²	69.9	18%	0.175	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.1	179.2	-99.2	-100.6	0	0	0	111.9	S1929 I1947 I1951 L1966 L2128 L2129 L2131	S1929-F1949 WeakPolarHBondContact OG-CE1 3.08Å; S1929-F1949 WeakPolarHBondContact OG-CZ 3.46Å; I1947-F1949 HydrophobicContact CG2-CD2 3.84Å; I1947-F1949 HydrophobicContact CG2-CE2 3.7Å; F1949-I1951 PolarHBondContact O-N 3.09Å; F1949-L1966 HydrophobicContact CD1-CD2 4.07Å; F1949-L1966 HydrophobicContact CE1-CD2 3.51Å; F1949-L1966 HydrophobicContact CE2-CD2 4.34Å; F1949-L1966 HydrophobicContact CZ-CD2 3.65Å; F1949-L2128 HydrophobicContact CD2-CD2 3.38Å; F1949-L2128 HydrophobicContact CE2-CD2 3.43Å; F1949-L2128 VanDerWaalsContact CE2-CD2 3.43Å; F1949-L2128 HydrophobicContact CG-CD2 4.45Å; F1949-L2129 PolarHBondContact N-O 2.82Å; F1949-L2131 PolarHBondContact O-N 3.07Å
1950	P	26.4	Very low	32.5	Very low	40 Å²	40	62.2 Å²	62.2	26%	0.26	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	114.3	165.2	30	-30.8	0	0	0	109.4	G1952	P1950-G1952 PolarHBondContact O-N 2.83Å
1951	I	31.9	Very low	31.9	Very low	96 Å²	96	59 Å²	59	49%	0.492	33%	0.328	S	S	.	.			trans	-81.3	89.4	179.5	-57.6	180	0	0	0	108.9	F1949 P2130	F1949-I1951 PolarHBondContact O-N 3.09Å; I1951-P2130 HydrophobicContact CD1-CB 3.74Å
1952	G	28.6	Very low	31.3	Very low	26 Å²	26	59.4 Å²	59.4	27%	0.268	32%	0.324	S	S	.	.			trans	-140.8	155.4	176.8	0	0	0	0	0	111.7	P1950	P1950-G1952 PolarHBondContact O-N 2.83Å
1953	V	28.4	Very low	31	Very low	97 Å²	97	58.9 Å²	58.9	59%	0.588	32%	0.321	S	S	*	.			trans	-115.3	115.4	-171	-176.8	0	0	0	0	108.5	I2354 F2357	V1953-I2354 VanDerWaalsContact C-CG2 3.47Å; V1953-I2354 HydrophobicContact CG1-CG2 4.25Å; V1953-I2354 WeakPolarHBondContact O-CG2 3.46Å; V1953-F2357 WeakPolarHBondContact O-CB 3.46Å; V1953-F2357 WeakPolarHBondContact O-CD2 3.49Å; V1953-F2357 WeakPolarHBondContact O-CG 3.23Å
1954	D	26.4	Very low	30.7	Very low	40 Å²	40	55.2 Å²	55.2	21%	0.214	32%	0.316	C	S	.	.			trans	-114.2	147.3	-159.9	-98.3	21.2	0	0	0	115.2	I2354 F2357 I2358 I2361	D1954-I2354 CarbonylContact C-O 3.54Å; D1954-I2354 WeakPolarHBondContact O-CG2 3.3Å; D1954-F2357 WeakPolarHBondContact OD1-CB 3.19Å; D1954-I2358 HydrophobicContact CB-CD1 4.34Å; D1954-I2358 HydrophobicContact CB-CG1 3.56Å; D1954-I2358 VanDerWaalsContact CG-CG1 3.41Å; D1954-I2358 PolarHBondContact OD1-N 3.03Å; D1954-I2358 VanDerWaalsContact OD1-N 3.17Å; D1954-I2358 WeakPolarHBondContact OD2-CA 3.33Å; D1954-I2358 VanDerWaalsContact OD2-CG1 3.24Å; D1954-I2358 WeakPolarHBondContact OD2-CG1 3.42Å; D1954-I2361 VanDerWaalsContact CG-CD1 3.47Å; D1954-I2361 VanDerWaalsContact OD1-CD1 3.24Å; D1954-I2361 WeakPolarHBondContact OD1-CD1 3.41Å; D1954-I2361 VanDerWaalsContact OD1-CG1 3.32Å; D1954-I2361 WeakPolarHBondContact OD1-CG1 3.43Å; D1954-I2361 VanDerWaalsContact OD2-CB 3.3Å; D1954-I2361 WeakPolarHBondContact OD2-CB 3.33Å
1955	R	27.5	Very low	30.6	Very low	11 Å²	11	54.5 Å²	54.5	4%	0.042	31%	0.308	C	S	.	.			trans	-55.7	129.2	-154.9	-167.9	121.3	-83.9	162.5	-6.9	112.5	A2350 M2351 I2352 I2354 T2355 I2358	R1955-A2350 VanDerWaalsContact CZ-O 3.24Å; R1955-A2350 PolarHBondContact NE-O 3.46Å; R1955-A2350 VanDerWaalsContact NE-O 3.1Å; R1955-A2350 PolarHBondContact NH2-O 3.18Å; R1955-M2351 VanDerWaalsContact CD-CG 3.47Å; R1955-M2351 WeakPolarHBondContact CD-SD 3.47Å; R1955-M2351 HydrophobicContact CG-CG 3.96Å; R1955-M2351 HydrophobicContact CG-SD 3.73Å; R1955-M2351 PolarHBondContact NH1-O 3.16Å; R1955-M2351 VanDerWaalsContact NH2-N 3.17Å; R1955-I2352 PolarHBondContact NH1-O 3.34Å; R1955-I2354 VanDerWaalsContact CA-CG2 3.48Å; R1955-I2354 VanDerWaalsContact CA-O 3.3Å; R1955-I2354 WeakPolarHBondContact CA-O 3.41Å; R1955-I2354 HydrophobicContact CB-CB 4.32Å; R1955-I2354 HydrophobicContact CB-CG2 4.48Å; R1955-I2354 WeakPolarHBondContact CB-O 3.25Å; R1955-I2354 VanDerWaalsContact CZ-CA 3.4Å; R1955-I2354 PolarHBondContact N-O 3.09Å; R1955-I2354 VanDerWaalsContact NE-C 3.33Å; R1955-I2354 VanDerWaalsContact NE-CB 3.35Å; R1955-I2354 VanDerWaalsContact NH2-CA 3.29Å; R1955-T2355 HydrophobicContact CB-CG2 3.33Å; R1955-T2355 VanDerWaalsContact CD-CG2 3.41Å; R1955-T2355 VanDerWaalsContact CD-OG1 3.29Å; R1955-T2355 WeakPolarHBondContact CD-OG1 3.43Å; R1955-T2355 HydrophobicContact CG-CG2 3.65Å; R1955-T2355 PolarHBondContact NH1-OG1 3.41Å; R1955-I2358 HydrophobicContact CB-CD1 3.67Å; R1955-I2358 HydrophobicContact CB-CG1 4.16Å; R1955-I2358 VanDerWaalsContact N-CG1 3.33Å
1956	P	28.1	Very low	31.2	Very low	17 Å²	17	48.9 Å²	48.9	11%	0.11	28%	0.283	C	S	.	.			trans	-97.2	164.4	-178.8	21.7	5.3	0	0	0	106.1	Y1724 R1725 I2354	Y1724-P1956 CarbonylContact C-O 3.31Å; Y1724-P1956 WeakPolarHBondContact CB-O 3.31Å; Y1724-P1956 CarbonylContact O-C 3.59Å; Y1724-P1956 WeakPolarHBondContact O-CA 3.37Å; Y1724-P1956 WeakPolarHBondContact O-CB 3.5Å; Y1724-P1956 WeakPolarHBondContact O-CD 3.38Å; Y1724-P1956 VanDerWaalsContact O-CG 3.25Å; Y1724-P1956 WeakPolarHBondContact O-CG 3.23Å; R1725-P1956 HydrophobicContact CB-CB 3.52Å; R1725-P1956 HydrophobicContact CG-CB 3.69Å; R1725-P1956 HydrophobicContact CG-CG 4.25Å; P1956-I2354 HydrophobicContact CG-CD1 3.99Å; P1956-I2354 HydrophobicContact CG-CG2 4.35Å
1957	S	27.7	Very low	31.9	Very low	10 Å²	10	48.2 Å²	48.2	7%	0.07	27%	0.27	C	S	.	.	S	Bend	trans	-133.1	-20.4	173.8	17.8	0	0	0	0	123.1	Y1708 Y1724 R1725 L1726	Y1708-S1957 WeakPolarHBondContact CE1-O 3.31Å; Y1708-S1957 VanDerWaalsContact CZ-O 3.3Å; Y1708-S1957 WeakPolarHBondContact OH-CA 3.26Å; Y1708-S1957 WeakPolarHBondContact OH-CB 3.43Å; Y1708-S1957 PolarHBondContact OH-O 3.11Å; Y1724-S1957 VanDerWaalsContact CA-CA 3.43Å; Y1724-S1957 VanDerWaalsContact CA-O 3.25Å; Y1724-S1957 WeakPolarHBondContact CA-O 3.27Å; Y1724-S1957 PolarHBondContact O-N 3.17Å; R1725-S1957 VanDerWaalsContact C-N 3.34Å; R1725-S1957 VanDerWaalsContact N-N 3.16Å; L1726-S1957 VanDerWaalsContact CB-C 3.46Å; L1726-S1957 WeakPolarHBondContact CB-OG 3.15Å; L1726-S1957 PolarHBondContact O-N 3.19Å; L1726-S1957 PolarHBondContact O-OG 3.45Å
1958	R	27.4	Very low	32.7	Very low	6 Å²	6	46.6 Å²	46.6	2%	0.023	26%	0.262	C	S	.	.	S	Bend	trans	-160.9	84.2	151.8	-153	141.2	-177.3	74.1	12.6	120.1	P1672 F1723 R1725 L1726 F1740	P1672-R1958 VanDerWaalsContact O-CZ 3.25Å; P1672-R1958 PolarHBondContact O-NE 3.32Å; P1672-R1958 PolarHBondContact O-NH2 3.2Å; F1723-R1958 HydrophobicContact CD1-CG 3.71Å; F1723-R1958 HydrophobicContact CE1-CG 4.23Å; F1723-R1958 VanDerWaalsContact CG-NH2 3.27Å; F1723-R1958 VanDerWaalsContact CZ-NH2 3.34Å; F1723-R1958 PolarHBondContact O-NH1 2.97Å; R1725-R1958 CarbonylContact O-C 3.6Å; R1725-R1958 WeakPolarHBondContact O-CA 3.31Å; R1725-R1958 PolarHBondContact O-N 2.87Å; R1725-R1958 VanDerWaalsContact O-N 3.16Å; R1725-R1958 VanDerWaalsContact O-O 3.09Å; L1726-R1958 HydrophobicContact CD1-CB 3.62Å; L1726-R1958 HydrophobicContact CG-CB 4.43Å; F1740-R1958 HydrophobicContact CD1-CB 3.73Å; F1740-R1958 HydrophobicContact CD1-CG 4.01Å; F1740-R1958 HydrophobicContact CE1-CB 3.62Å; F1740-R1958 HydrophobicContact CE1-CG 3.57Å; F1740-R1958 HydrophobicContact CZ-CB 4.49Å
1959	S	27.3	Very low	34	Very low	4 Å²	4	41.7 Å²	41.7	3%	0.028	24%	0.237	C	C	.	.			trans	52.4	120.5	164.9	64	0	0	0	0	125.2	D1722 R1725 I1741 R1742 D1743	D1722-S1959 WeakPolarHBondContact O-CA 3.25Å; D1722-S1959 WeakPolarHBondContact O-CB 3.26Å; D1722-S1959 PolarHBondContact O-N 2.85Å; R1725-S1959 VanDerWaalsContact C-N 3.31Å; R1725-S1959 PolarHBondContact O-N 3.05Å; I1741-S1959 CarbonylContact C-O 3.56Å; I1741-S1959 WeakPolarHBondContact CA-O 3.41Å; I1741-S1959 VanDerWaalsContact CB-O 3.28Å; I1741-S1959 WeakPolarHBondContact CB-O 3.33Å; R1742-S1959 CarbonylContact C-O 3.55Å; R1742-S1959 VanDerWaalsContact C-O 3.31Å; R1742-S1959 WeakPolarHBondContact CA-O 3.43Å; R1742-S1959 PolarHBondContact N-O 2.84Å; D1743-S1959 PolarHBondContact N-O 3.38Å
1960	E	27.2	Very low	34.8	Very low	10 Å²	10	40 Å²	40	5%	0.047	23%	0.229	C	C	.	.			trans	-154.6	151.9	139	-179.1	149.9	121.8	0	0	114.2	R1725 I1741 R1742 D1743 F1962 S2064	R1725-E1960 PolarHBondContact NH1-O 3.07Å; I1741-E1960 HydrophobicContact CB-CB 3.31Å; I1741-E1960 HydrophobicContact CB-CG 4.31Å; I1741-E1960 HydrophobicContact CD1-CB 4.01Å; I1741-E1960 HydrophobicContact CG1-CB 4.23Å; I1741-E1960 HydrophobicContact CG2-CB 3.41Å; I1741-E1960 VanDerWaalsContact CG2-CB 3.41Å; I1741-E1960 HydrophobicContact CG2-CG 3.92Å; I1741-E1960 WeakPolarHBondContact CG2-OE2 3.5Å; R1742-E1960 VanDerWaalsContact C-CA 3.43Å; R1742-E1960 VanDerWaalsContact CD-OE2 3.29Å; R1742-E1960 WeakPolarHBondContact CD-OE2 3.19Å; R1742-E1960 WeakPolarHBondContact CG-OE2 3.21Å; R1742-E1960 IonicContact CZ-OE2 3.36Å; R1742-E1960 PolarHBondContact N-OE2 3.07Å; R1742-E1960 IonicContact NE-OE2 2.7Å; R1742-E1960 VanDerWaalsContact NH1-CD 3.31Å; R1742-E1960 IonicContact NH1-OE1 2.67Å; R1742-E1960 PolarHBondContact NH1-OE1 2.85Å; R1742-E1960 IonicContact NH1-OE2 3.48Å; R1742-E1960 PolarHBondContact NH1-OE2 2.8Å; R1742-E1960 WeakPolarHBondContact O-CA 3.24Å; R1742-E1960 WeakPolarHBondContact O-CB 3.36Å; R1742-E1960 WeakPolarHBondContact O-CG 3.43Å; D1743-E1960 VanDerWaalsContact CB-CA 3.49Å; D1743-E1960 VanDerWaalsContact OD2-C 3.25Å; E1960-F1962 HydrophobicContact CB-CD2 4.16Å; E1960-F1962 HydrophobicContact CB-CE2 4.01Å; E1960-F1962 HydrophobicContact CG-CD2 3.95Å; E1960-F1962 HydrophobicContact CG-CE2 3.49Å; E1960-F1962 VanDerWaalsContact CG-CE2 3.49Å; E1960-F1962 HydrophobicContact CG-CZ 3.81Å; E1960-F1962 PolarHBondContact O-N 2.91Å; E1960-F1962 VanDerWaalsContact OE1-CE2 3.28Å; E1960-F1962 WeakPolarHBondContact OE1-CE2 3.3Å; E1960-F1962 WeakPolarHBondContact OE1-CZ 3.29Å; E1960-S2064 PolarHBondContact OE1-OG 2.92Å
1961	S	25.9	Very low	36	Very low	68 Å²	68	40 Å²	40	48%	0.476	23%	0.226	S	C	.	.			trans	-64.6	46.9	-173.2	53.5	0	0	0	0	115.4	D1743 L1963	D1743-S1961 VanDerWaalsContact CG-CA 3.46Å; D1743-S1961 WeakPolarHBondContact OD1-CA 3.4Å; D1743-S1961 WeakPolarHBondContact OD1-CB 3.15Å; D1743-S1961 PolarHBondContact OD1-N 3.43Å; D1743-S1961 PolarHBondContact OD2-N 2.88Å; S1961-L1963 PolarHBondContact O-N 2.97Å
1962	F	27.7	Very low	36.7	Very low	82 Å²	82	36.7 Å²	36.7	36%	0.36	21%	0.209	S	C	.	.			trans	-94.8	97.7	171.1	-61.3	-51.7	0	0	0	110.7	I1741 E1960 I1965 R1967	I1741-F1962 HydrophobicContact CG2-CE2 4.42Å; E1960-F1962 HydrophobicContact CB-CD2 4.16Å; E1960-F1962 HydrophobicContact CB-CE2 4.01Å; E1960-F1962 HydrophobicContact CG-CD2 3.95Å; E1960-F1962 HydrophobicContact CG-CE2 3.49Å; E1960-F1962 VanDerWaalsContact CG-CE2 3.49Å; E1960-F1962 HydrophobicContact CG-CZ 3.81Å; E1960-F1962 PolarHBondContact O-N 2.91Å; E1960-F1962 VanDerWaalsContact OE1-CE2 3.28Å; E1960-F1962 WeakPolarHBondContact OE1-CE2 3.3Å; E1960-F1962 WeakPolarHBondContact OE1-CZ 3.29Å; F1962-I1965 HydrophobicContact CB-CD1 4.49Å; F1962-I1965 HydrophobicContact CD1-CD1 4.01Å; F1962-R1967 VanDerWaalsContact CE2-NH2 3.33Å
1963	L	31.3	Very low	37.3	Very low	69 Å²	69	37.9 Å²	37.9	36%	0.361	21%	0.212	S	C	.	.			trans	-37.7	160.5	145.7	-65.9	116.1	0	0	0	110.8	S1961 I1965	S1961-L1963 PolarHBondContact O-N 2.97Å; L1963-I1965 VanDerWaalsContact C-N 3.3Å; L1963-I1965 HydrophobicContact CB-CD1 4.05Å; L1963-I1965 HydrophobicContact CB-CG1 4.25Å; L1963-I1965 VanDerWaalsContact O-CB 3.23Å; L1963-I1965 WeakPolarHBondContact O-CB 3.26Å; L1963-I1965 VanDerWaalsContact O-CG1 3.23Å; L1963-I1965 WeakPolarHBondContact O-CG1 3.44Å; L1963-I1965 PolarHBondContact O-N 2.84Å
1964	S	33.9	Very low	37.7	Very low	102 Å²	102	40.4 Å²	40.4	71%	0.713	22%	0.22	S	C	*	.	S	Bend	trans	-58	88.2	176.9	31.9	0	0	0	0	112.2
1965	I	38.9	Very low	37.8	Very low	34 Å²	34	44.3 Å²	44.3	17%	0.174	24%	0.235	C	C	.	.			trans	-117.1	110.6	-166.4	-81.7	164.1	0	0	0	109.8	F1962 L1963 R1967 V2077 I2078 K2079	F1962-I1965 HydrophobicContact CB-CD1 4.49Å; F1962-I1965 HydrophobicContact CD1-CD1 4.01Å; L1963-I1965 VanDerWaalsContact C-N 3.3Å; L1963-I1965 HydrophobicContact CB-CD1 4.05Å; L1963-I1965 HydrophobicContact CB-CG1 4.25Å; L1963-I1965 VanDerWaalsContact O-CB 3.23Å; L1963-I1965 WeakPolarHBondContact O-CB 3.26Å; L1963-I1965 VanDerWaalsContact O-CG1 3.23Å; L1963-I1965 WeakPolarHBondContact O-CG1 3.44Å; L1963-I1965 PolarHBondContact O-N 2.84Å; I1965-R1967 HydrophobicContact CG2-CG 3.62Å; I1965-V2077 HydrophobicContact CB-CG1 4.45Å; I1965-V2077 HydrophobicContact CG1-CG1 4.3Å; I1965-V2077 HydrophobicContact CG2-CG1 3.39Å; I1965-I2078 WeakPolarHBondContact CA-O 3.26Å; I1965-K2079 HydrophobicContact CD1-CG 3.88Å; I1965-K2079 HydrophobicContact CG1-CG 3.73Å
1966	L	47.4	Very low	37.8	Very low	60 Å²	60	52.5 Å²	52.5	31%	0.314	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	135.2	169.7	-100.1	148.2	0	0	0	108.6	F1949 F1968 I2078	F1949-L1966 HydrophobicContact CD1-CD2 4.07Å; F1949-L1966 HydrophobicContact CE1-CD2 3.51Å; F1949-L1966 HydrophobicContact CE2-CD2 4.34Å; F1949-L1966 HydrophobicContact CZ-CD2 3.65Å; L1966-F1968 HydrophobicContact CB-CE2 4.31Å; L1966-F1968 HydrophobicContact CD2-CE2 4.11Å; L1966-F1968 HydrophobicContact CD2-CZ 4.1Å; L1966-I2078 HydrophobicContact CB-CB 3.67Å; L1966-I2078 HydrophobicContact CB-CD1 3.98Å; L1966-I2078 HydrophobicContact CB-CG1 4.14Å; L1966-I2078 HydrophobicContact CB-CG2 4.09Å; L1966-I2078 PolarHBondContact N-O 2.73Å; L1966-I2078 PolarHBondContact O-N 2.79Å
1967	R	52.4	Low	37.9	Very low	54 Å²	54	56.8 Å²	56.8	20%	0.204	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128	-174.2	-59.6	-179.4	-176.3	-150.9	14	111.3	F1962 I1965 C2076	F1962-R1967 VanDerWaalsContact CE2-NH2 3.33Å; I1965-R1967 HydrophobicContact CG2-CG 3.62Å; R1967-C2076 WeakPolarHBondContact CA-O 3.5Å
1968	F	56.3	Low	37.7	Very low	2 Å²	2	62.6 Å²	62.6	1%	0.009	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.2	175	-66.2	-90.3	0	0	0	109.5	I1933 L1966 I1970 Q2075 C2076 I2078 L2103 T2126 L2128	I1933-F1968 HydrophobicContact CD1-CB 4.03Å; I1933-F1968 HydrophobicContact CD1-CD1 4.41Å; L1966-F1968 HydrophobicContact CB-CE2 4.31Å; L1966-F1968 HydrophobicContact CD2-CE2 4.11Å; L1966-F1968 HydrophobicContact CD2-CZ 4.1Å; F1968-I1970 PolarHBondContact O-N 3.07Å; F1968-Q2075 CarbonylContact O-C 3.59Å; F1968-Q2075 WeakPolarHBondContact O-CA 3.32Å; F1968-C2076 HydrophobicContact CB-CB 4.31Å; F1968-C2076 PolarHBondContact N-O 2.8Å; F1968-C2076 PolarHBondContact O-N 3.11Å; F1968-I2078 HydrophobicContact CD2-CD1 4.11Å; F1968-I2078 HydrophobicContact CD2-CG1 4.47Å; F1968-I2078 HydrophobicContact CE2-CD1 3.59Å; F1968-I2078 HydrophobicContact CE2-CG1 4.34Å; F1968-L2103 HydrophobicContact CB-CD2 3.63Å; F1968-L2103 HydrophobicContact CD1-CD2 4.09Å; F1968-L2103 HydrophobicContact CD2-CD1 4.18Å; F1968-L2103 HydrophobicContact CD2-CD2 3.78Å; F1968-L2103 HydrophobicContact CE2-CD1 4.48Å; F1968-L2103 HydrophobicContact CG-CD2 3.52Å; F1968-T2126 HydrophobicContact CD1-CG2 4.22Å; F1968-T2126 HydrophobicContact CE1-CG2 4.4Å; F1968-L2128 HydrophobicContact CE1-CD1 4.05Å; F1968-L2128 HydrophobicContact CE1-CD2 3.89Å; F1968-L2128 HydrophobicContact CE1-CG 4.37Å; F1968-L2128 HydrophobicContact CE2-CD1 4.2Å; F1968-L2128 HydrophobicContact CZ-CD1 3.47Å; F1968-L2128 VanDerWaalsContact CZ-CD1 3.47Å; F1968-L2128 HydrophobicContact CZ-CD2 3.68Å; F1968-L2128 HydrophobicContact CZ-CG 4.12Å
1969	L	56.3	Low	37.8	Very low	8 Å²	8	69.7 Å²	69.7	4%	0.042	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	124.8	-179.8	-63.8	173.2	0	0	0	109.3	A1930 L1932 I1933 L2061 F2067	A1930-L1969 HydrophobicContact CB-CD1 4.08Å; L1932-L1969 HydrophobicContact CD1-CB 4.01Å; L1932-L1969 HydrophobicContact CD1-CD1 3.83Å; I1933-L1969 WeakPolarHBondContact CB-O 3.39Å; I1933-L1969 PolarHBondContact N-O 2.63Å; L1969-L2061 HydrophobicContact CD2-CD1 4.24Å; L1969-L2061 HydrophobicContact CD2-CD2 3.87Å; L1969-F2067 HydrophobicContact CD1-CB 3.99Å; L1969-F2067 HydrophobicContact CD1-CD1 3.73Å; L1969-F2067 HydrophobicContact CD1-CD2 4.46Å; L1969-F2067 HydrophobicContact CD1-CE1 4.28Å; L1969-F2067 HydrophobicContact CD1-CG 3.82Å; L1969-F2067 HydrophobicContact CD2-CB 3.83Å; L1969-F2067 HydrophobicContact CD2-CD2 4.48Å; L1969-F2067 HydrophobicContact CD2-CG 4.2Å
1970	I	53.8	Low	37.7	Very low	3 Å²	3	74.9 Å²	74.9	2%	0.015	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	113.9	-177.5	-68.4	164.4	0	0	0	107.7	I1933 V1935 F1968 L1972 L2058 W2074 C2076 L2105	I1933-I1970 HydrophobicContact CB-CG1 4.34Å; I1933-I1970 HydrophobicContact CD1-CG1 4.38Å; V1935-I1970 HydrophobicContact CG2-CG2 4.05Å; F1968-I1970 PolarHBondContact O-N 3.07Å; I1970-L1972 HydrophobicContact CG2-CG 4.2Å; I1970-L2058 HydrophobicContact CD1-CD1 3.63Å; I1970-W2074 HydrophobicContact CB-CB 4.45Å; I1970-W2074 WeakPolarHBondContact CB-O 3.4Å; I1970-W2074 PolarHBondContact N-O 2.84Å; I1970-W2074 PolarHBondContact O-N 2.82Å; I1970-C2076 HydrophobicContact CD1-CB 3.62Å; I1970-L2105 HydrophobicContact CD1-CD1 4.15Å; I1970-L2105 HydrophobicContact CD1-CD2 4.48Å; I1970-L2105 HydrophobicContact CG2-CD2 3.63Å
1971	Q	50.6	Low	37.7	Very low	40 Å²	40	76.2 Å²	76.2	19%	0.187	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	98.8	175.4	-176.2	168.3	-19.8	0	0	109.4	L1932 I1933 V1935 P1973	L1932-Q1971 VanDerWaalsContact CD2-OE1 3.24Å; I1933-Q1971 PolarHBondContact O-N 2.84Å; V1935-Q1971 PolarHBondContact N-O 2.95Å; Q1971-P1973 WeakPolarHBondContact O-CD 3.47Å
1972	L	47.6	Very low	37.8	Very low	28 Å²	28	74 Å²	74	15%	0.147	39%	0.394	C	S	.	.			trans	-76.6	115.9	172.8	-72.2	161.8	0	0	0	109.9	V1935 I1970 I1974 F1998 W2074 L2105	V1935-L1972 HydrophobicContact CB-CD2 4.38Å; V1935-L1972 HydrophobicContact CG1-CD2 3.72Å; I1970-L1972 HydrophobicContact CG2-CG 4.2Å; L1972-I1974 PolarHBondContact O-N 3.19Å; L1972-F1998 HydrophobicContact CD1-CD2 3.6Å; L1972-F1998 HydrophobicContact CD1-CE2 3.55Å; L1972-F1998 HydrophobicContact CD1-CZ 4.4Å; L1972-F1998 HydrophobicContact CD2-CD2 4.17Å; L1972-F1998 HydrophobicContact CD2-CE1 4.24Å; L1972-F1998 HydrophobicContact CD2-CE2 3.81Å; L1972-F1998 HydrophobicContact CD2-CZ 3.84Å; L1972-F1998 HydrophobicContact CG-CE2 4.32Å; L1972-W2074 HydrophobicContact CD1-CG 4.45Å; L1972-L2105 HydrophobicContact CD2-CD2 4.4Å
1973	P	41.6	Very low	37.9	Very low	50 Å²	50	72.2 Å²	72.2	33%	0.325	39%	0.391	S	S	.	.			trans	-77.4	122.5	170.4	30.6	-29.2	0	0	0	109.7	V1935 Q1971 K1975	V1935-P1973 WeakPolarHBondContact O-CD 3.29Å; V1935-P1973 WeakPolarHBondContact O-CG 3.44Å; Q1971-P1973 WeakPolarHBondContact O-CD 3.47Å; P1973-K1975 PolarHBondContact O-N 2.7Å
1974	I	35.8	Very low	37.8	Very low	150 Å²	150	75.9 Å²	75.9	77%	0.769	40%	0.404	S	S	*	.			trans	-81.1	105.3	171.7	-56.9	173.3	0	0	0	107	L1972	L1972-I1974 PolarHBondContact O-N 3.19Å
1975	K	29.8	Very low	37.4	Very low	122 Å²	122	76.9 Å²	76.9	53%	0.53	41%	0.406	S	S	.	.			trans	-118.8	147.6	174.8	-99.7	171.4	177.4	170	0	109.5	D1936 S1937 P1973	D1936-K1975 IonicContact OD1-NZ 3.6Å; D1936-K1975 PolarHBondContact OD1-NZ 3.47Å; D1936-K1975 IonicContact OD2-NZ 3.96Å; S1937-K1975 WeakPolarHBondContact OG-CD 3.48Å; P1973-K1975 PolarHBondContact O-N 2.7Å
1976	E	27.2	Very low	36.8	Very low	183 Å²	183	80.1 Å²	80.1	86%	0.855	43%	0.43	S	S	*	.	S	Bend	trans	75.1	123.1	-179.7	-52.4	-168.4	160.9	0	0	116.6
1977	S	29.8	Very low	35.8	Very low	108 Å²	108	79.7 Å²	79.7	76%	0.755	44%	0.44	S	S	*	.	S	Bend	trans	55.2	109.3	167.9	65.4	0	0	0	0	120.4
1978	N	24.4	Very low	34.6	Very low	132 Å²	132	80.9 Å²	80.9	71%	0.706	46%	0.456	S	S	*	.	S	Bend	cis	-150.5	146.6	-24.4	-97.2	-13.5	0	0	0	105.7	I1980	N1978-I1980 PolarHBondContact O-N 3.1Å
1979	D	27.9	Very low	33.4	Very low	155 Å²	155	85.5 Å²	85.5	83%	0.829	48%	0.481	S	S	*	.			trans	53.1	47.2	165	-49.2	-32	0	0	0	117.7
1980	I	26.7	Very low	32.2	Very low	113 Å²	113	92.6 Å²	92.6	58%	0.579	52%	0.518	S	S	*	.			trans	-123	105.2	171.7	-57.6	-179.4	0	0	0	112.4	N1978 S1983	N1978-I1980 PolarHBondContact O-N 3.1Å; I1980-S1983 VanDerWaalsContact CG2-CB 3.43Å; I1980-S1983 WeakPolarHBondContact CG2-OG 3.3Å
1981	P	26.2	Very low	30.8	Very low	38 Å²	38	96.7 Å²	96.7	25%	0.247	54%	0.543	C	S	.	.			trans	-108.5	135.8	166.4	4.8	17.4	0	0	0	113.2	K1838 L1865 N1866	K1838-P1981 PolarHBondContact NZ-O 3.03Å; L1865-P1981 WeakPolarHBondContact O-CB 2.95Å; L1865-P1981 VanDerWaalsContact O-CG 3.23Å; L1865-P1981 WeakPolarHBondContact O-CG 3.3Å; N1866-P1981 VanDerWaalsContact CA-CB 3.49Å; N1866-P1981 HydrophobicContact CB-CB 4.44Å
1982	C	29.1	Very low	29.9	Very low	21 Å²	21	102 Å²	102	14%	0.142	57%	0.566	C	S	.	*	S	Bend	trans	41.1	87.7	179.3	-68.6	0	0	0	0	115.1	K1838 N1866 Q1867	K1838-C1982 VanDerWaalsContact CD-O 3.26Å; K1838-C1982 WeakPolarHBondContact CD-O 3.42Å; K1838-C1982 WeakPolarHBondContact CE-O 2.99Å; K1838-C1982 PolarHBondContact NZ-O 2.9Å; N1866-C1982 PolarHBondContact O-SG 2.83Å; Q1867-C1982 HydrophobicContact CB-CB 3.8Å; Q1867-C1982 HydrophobicContact CG-CB 4.23Å
1983	S	28.7	Very low	29.1	Very low	45 Å²	45	108.6 Å²	108.6	32%	0.315	60%	0.595	S	S	.	*			trans	-164.7	141.1	-162.7	138.6	0	0	0	0	110.4	I1980	I1980-S1983 VanDerWaalsContact CG2-CB 3.43Å; I1980-S1983 WeakPolarHBondContact CG2-OG 3.3Å
1984	K	29.2	Very low	28.7	Very low	146 Å²	146	112.4 Å²	112.4	64%	0.635	61%	0.613	S	S	*	*			cis	-154.6	169.1	1	-93.4	163.5	-160.4	90.7	0	108.2
1985	T	25.7	Very low	28.6	Very low	122 Å²	122	114 Å²	114	75%	0.748	62%	0.615	S	S	*	*			trans	52.7	126	165	50.2	0	0	0	0	119.4
1986	P	26.6	Very low	29.1	Very low	103 Å²	103	109.9 Å²	109.9	67%	0.669	60%	0.603	S	S	*	*			trans	-138.1	119.3	130.2	34.3	-20.2	0	0	0	113
1987	G	26.4	Very low	30.1	Very low	51 Å²	51	103.7 Å²	103.7	53%	0.526	58%	0.579	S	S	.	*			trans	-172.5	138.9	173.4	0	0	0	0	0	110.3
1988	S	26.5	Very low	31.7	Very low	79 Å²	79	100.7 Å²	100.7	55%	0.552	55%	0.553	S	S	*	*	S	Bend	trans	64.8	93.1	-159.8	-161	0	0	0	0	110.9	S1776	S1776-S1988 WeakPolarHBondContact OG-CA 3.42Å; S1776-S1988 PolarHBondContact OG-N 2.8Å
1989	L	31.6	Very low	33.7	Very low	99 Å²	99	100.4 Å²	100.4	52%	0.518	55%	0.545	S	S	.	.				64.8	129.5	90	-70.9	167.1	0	0	0	113.3	S1776 K1777	S1776-L1989 WeakPolarHBondContact O-CD1 3.27Å; K1777-L1989 WeakPolarHBondContact O-CD1 3.42Å
1990	L	30.1	Very low	35.6	Very low	157 Å²	157	93.3 Å²	93.3	82%	0.822	51%	0.507	S	S	*	.	S	Bend	trans	75.4	132.9	174.6	-51.7	133.5	0	0	0	115.4
1991	T	26.2	Very low	37.6	Very low	88 Å²	88	91.9 Å²	91.9	54%	0.54	50%	0.498	S	S	.	.			trans	47.2	87.9	161.2	56.1	0	0	0	0	118.4	E1993	T1991-E1993 PolarHBondContact O-N 3.23Å
1992	F	30.2	Very low	39.6	Very low	152 Å²	152	90.2 Å²	90.2	67%	0.667	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-67.8	-2.7	163.8	-102.6	-87.5	0	0	0	114.1	N1994 P2060	F1992-N1994 VanDerWaalsContact C-N 3.31Å; F1992-N1994 PolarHBondContact O-N 3.24Å; F1992-P2060 HydrophobicContact CD1-CG 4.27Å; F1992-P2060 HydrophobicContact CE1-CG 4.2Å
1993	E	32.3	Very low	41.2	Very low	166 Å²	166	92.4 Å²	92.4	78%	0.776	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-73	-14.6	-167.2	-61.4	178.9	116.5	0	0	114.7	T1991	T1991-E1993 PolarHBondContact O-N 3.23Å
1994	N	32.3	Very low	42.6	Very low	130 Å²	130	90.9 Å²	90.9	70%	0.695	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-92.3	-0.2	-169.9	-73.4	-39.5	0	0	0	116	F1992	F1992-N1994 VanDerWaalsContact C-N 3.31Å; F1992-N1994 PolarHBondContact O-N 3.24Å
1995	F	33.4	Very low	43.7	Very low	184 Å²	184	87.6 Å²	87.6	81%	0.807	47%	0.471	S	S	*	.	S	Bend	trans	-122.2	7.5	-171.5	-79.9	-79.5	0	0	0	116.1	P1997	F1995-P1997 WeakPolarHBondContact O-CD 3.21Å
1996	A	41.1	Very low	45.1	Very low	35 Å²	35	87 Å²	87	29%	0.289	46%	0.462	S	S	.	.			trans	-116.6	95.5	-176.3	0	0	0	0	0	112.9	F1998 W2074	A1996-F1998 PolarHBondContact O-N 2.84Å; A1996-W2074 HydrophobicContact CB-CH2 3.72Å; A1996-W2074 HydrophobicContact CB-CZ2 4.3Å; A1996-W2074 HydrophobicContact CB-CZ3 4.09Å
1997	P	48.7	Very low	45.9	Very low	53 Å²	53	84.6 Å²	84.6	34%	0.344	44%	0.444	S	S	.	.			trans	-78.1	28.8	176	34.8	-36.9	0	0	0	112.9	F1995 K2107 T2108	F1995-P1997 WeakPolarHBondContact O-CD 3.21Å; P1997-K2107 WeakPolarHBondContact O-CA 3.49Å; P1997-T2108 PolarHBondContact O-N 2.81Å; P1997-T2108 PolarHBondContact O-OG1 3.42Å
1998	F	62	Low	46.3	Very low	46 Å²	46	89 Å²	89	20%	0.202	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	128.4	-169.6	-55.9	-60	0	0	0	110.4	L1972 A1996 L2058 L2105 V2106 K2107 I2123	L1972-F1998 HydrophobicContact CD1-CD2 3.6Å; L1972-F1998 HydrophobicContact CD1-CE2 3.55Å; L1972-F1998 HydrophobicContact CD1-CZ 4.4Å; L1972-F1998 HydrophobicContact CD2-CD2 4.17Å; L1972-F1998 HydrophobicContact CD2-CE1 4.24Å; L1972-F1998 HydrophobicContact CD2-CE2 3.81Å; L1972-F1998 HydrophobicContact CD2-CZ 3.84Å; L1972-F1998 HydrophobicContact CG-CE2 4.32Å; A1996-F1998 PolarHBondContact O-N 2.84Å; F1998-L2058 HydrophobicContact CB-CD2 3.91Å; F1998-L2058 WeakPolarHBondContact O-CD2 3.28Å; F1998-L2105 HydrophobicContact CB-CD1 4.16Å; F1998-V2106 WeakPolarHBondContact CA-O 3.49Å; F1998-K2107 HydrophobicContact CD1-CG 4.39Å; F1998-K2107 HydrophobicContact CE1-CG 4.19Å; F1998-I2123 HydrophobicContact CD1-CD1 3.33Å; F1998-I2123 HydrophobicContact CE1-CD1 3.54Å
1999	K	65.8	Low	46.5	Very low	125 Å²	125	93.6 Å²	93.6	54%	0.543	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.2	171.4	-72	-173.2	178	179.6	0	110.2	V2106 T2108	K1999-V2106 PolarHBondContact N-O 3.31Å; K1999-V2106 PolarHBondContact O-N 3.32Å; K1999-T2108 HydrophobicContact CB-CG2 4.47Å; K1999-T2108 HydrophobicContact CD-CG2 3.8Å; K1999-T2108 HydrophobicContact CG-CG2 3.87Å
2000	C	68.6	Low	46.5	Very low	6 Å²	6	95.9 Å²	95.9	4%	0.041	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	141.3	163.3	-172	0	0	0	0	109.9	T2056 L2058 C2076 Q2104	C2000-T2056 PolarHBondContact O-OG1 3.02Å; C2000-T2056 VanDerWaalsContact O-OG1 3.13Å; C2000-L2058 HydrophobicContact CB-CD1 4.26Å; C2000-C2076 HydrophobicContact CB-CB 3.66Å; C2000-C2076 WeakPolarHBondContact CB-SG 3.32Å; C2000-C2076 WeakPolarHBondContact SG-CB 3.18Å; C2000-C2076 CovalentContact SG-SG 2.02Å; C2000-C2076 PolarHBondContact SG-SG 2.85Å; C2000-Q2104 CarbonylContact C-O 3.17Å; C2000-Q2104 WeakPolarHBondContact CA-O 3.38Å
2001	Q	69.2	Low	46.3	Very low	83 Å²	83	96.5 Å²	96.5	39%	0.388	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.8	176.7	-63.7	-177.7	-51.2	0	0	109.8	L2103 Q2104	Q2001-L2103 WeakPolarHBondContact O-CA 3.1Å; Q2001-Q2104 PolarHBondContact N-O 3.03Å; Q2001-Q2104 PolarHBondContact O-N 3.32Å
2002	I	67.5	Low	46.4	Very low	4 Å²	4	99.6 Å²	99.6	2%	0.021	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	145.6	163.6	-69.9	153.6	0	0	0	108	L2004 Q2051 I2054 T2056 I2078 M2101 I2102 L2103	I2002-L2004 HydrophobicContact CG2-CG 4.28Å; I2002-Q2051 WeakPolarHBondContact O-CG 2.85Å; I2002-Q2051 PolarHBondContact O-NE2 3.49Å; I2002-I2054 HydrophobicContact CD1-CB 4.22Å; I2002-I2054 HydrophobicContact CD1-CG2 3.4Å; I2002-I2054 VanDerWaalsContact CD1-CG2 3.4Å; I2002-T2056 HydrophobicContact CB-CG2 4.27Å; I2002-T2056 HydrophobicContact CD1-CG2 3.32Å; I2002-T2056 HydrophobicContact CG1-CG2 3.51Å; I2002-I2078 HydrophobicContact CD1-CD1 3.84Å; I2002-I2078 HydrophobicContact CD1-CG1 4.07Å; I2002-I2078 HydrophobicContact CD1-CG2 4.05Å; I2002-I2078 HydrophobicContact CG1-CD1 4.15Å; I2002-M2101 HydrophobicContact CD1-CE 3.57Å; I2002-M2101 HydrophobicContact CG1-CE 4Å; I2002-M2101 HydrophobicContact CG2-CE 4.03Å; I2002-M2101 HydrophobicContact CG2-CG 3.95Å; I2002-I2102 CarbonylContact C-O 3.15Å; I2002-I2102 VanDerWaalsContact CA-O 3.26Å; I2002-I2102 WeakPolarHBondContact CA-O 3.27Å; I2002-L2103 HydrophobicContact CG1-CD1 3.94Å
2003	Q	63.4	Low	46.2	Very low	66 Å²	66	98.6 Å²	98.6	31%	0.308	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.4	165.9	-175.7	-177.5	11.8	0	0	108.5	F2048 I2102	Q2003-F2048 HydrophobicContact CG-CE1 3.65Å; Q2003-F2048 HydrophobicContact CG-CZ 4.27Å; Q2003-I2102 HydrophobicContact CB-CB 4.19Å; Q2003-I2102 PolarHBondContact N-O 3.06Å; Q2003-I2102 WeakPolarHBondContact O-CA 3.31Å; Q2003-I2102 WeakPolarHBondContact O-CB 3.19Å; Q2003-I2102 PolarHBondContact O-N 3.33Å
2004	L	57.2	Low	45.9	Very low	14 Å²	14	101.1 Å²	101.1	7%	0.073	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	113.1	179.1	-77	158	0	0	0	110.1	I2002 F2048 L2050 T2099 M2101	I2002-L2004 HydrophobicContact CG2-CG 4.28Å; L2004-F2048 WeakPolarHBondContact O-CE1 3.27Å; L2004-F2048 WeakPolarHBondContact O-CZ 3.36Å; L2004-L2050 HydrophobicContact CD1-CB 3.35Å; L2004-L2050 HydrophobicContact CD1-CD1 4Å; L2004-L2050 HydrophobicContact CD1-CG 4.3Å; L2004-T2099 HydrophobicContact CD2-CG2 4.13Å; L2004-M2101 HydrophobicContact CD2-CB 3.82Å; L2004-M2101 HydrophobicContact CD2-CG 4.02Å
2005	Q	53.4	Low	45.7	Very low	77 Å²	77	101.8 Å²	101.8	36%	0.36	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.9	175.9	176.4	174	-20.8	0	0	110.1	D2007 R2100 I2102	Q2005-D2007 PolarHBondContact NE2-OD1 2.9Å; Q2005-R2100 HydrophobicContact CB-CB 4.25Å; Q2005-R2100 PolarHBondContact N-O 2.76Å; Q2005-R2100 PolarHBondContact O-N 2.88Å; Q2005-I2102 HydrophobicContact CB-CD1 3.85Å; Q2005-I2102 HydrophobicContact CB-CG1 4.41Å
2006	I	53.8	Low	45.4	Very low	109 Å²	109	103.7 Å²	103.7	56%	0.559	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.4	169.4	-56.5	175.1	0	0	0	105.4	D2008 T2099	I2006-D2008 PolarHBondContact O-N 2.78Å; I2006-T2099 HydrophobicContact CG1-CG2 4.05Å
2007	D	44.5	Very low	44.7	Very low	53 Å²	53	112 Å²	112	28%	0.283	53%	0.525	S	S	.	.			trans	-74.7	114.5	179	-73.5	-6.9	0	0	0	109.9	Q2005 E2009 R2100	Q2005-D2007 PolarHBondContact NE2-OD1 2.9Å; D2007-E2009 PolarHBondContact O-N 2.79Å; D2007-R2100 IonicContact OD1-CZ 2.99Å; D2007-R2100 IonicContact OD1-NH1 3.69Å; D2007-R2100 PolarHBondContact OD1-NH1 3.23Å; D2007-R2100 IonicContact OD2-CZ 2.69Å; D2007-R2100 IonicContact OD2-NH1 3.64Å; D2007-R2100 PolarHBondContact OD2-NH1 2.81Å; D2007-R2100 IonicContact OD2-NH2 3.83Å; D2007-R2100 PolarHBondContact OD2-NH2 2.9Å
2008	D	34.6	Very low	43.6	Very low	143 Å²	143	115.7 Å²	115.7	77%	0.765	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	16.3	-167.9	-87.8	-42.1	0	0	0	116.2	I2006	I2006-D2008 PolarHBondContact O-N 2.78Å
2009	E	31	Very low	42.1	Very low	175 Å²	175	116.4 Å²	116.4	82%	0.818	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	3.7	-179.1	-78.8	-159.9	147.8	0	0	115.5	D2007 H2011	D2007-E2009 PolarHBondContact O-N 2.79Å; E2009-H2011 VanDerWaalsContact C-N 3.26Å; E2009-H2011 PolarHBondContact O-N 3.01Å
2010	F	30.9	Very low	40.3	Very low	148 Å²	148	113.9 Å²	113.9	65%	0.649	56%	0.555	S	S	*	*			trans	-82.9	67.5	172.6	-111.9	-29.5	0	0	0	113	I2012 K2098	F2010-I2012 PolarHBondContact O-N 2.86Å; F2010-K2098 HydrophobicContact CD2-CD 3.54Å; F2010-K2098 HydrophobicContact CD2-CG 4.26Å; F2010-K2098 HydrophobicContact CE2-CD 3.6Å; F2010-K2098 HydrophobicContact CE2-CG 4.07Å; F2010-K2098 HydrophobicContact CG-CD 4.49Å
2011	H	26.8	Very low	38.6	Very low	170 Å²	170	118.5 Å²	118.5	79%	0.787	58%	0.578	S	S	*	*			trans	-64.3	115.4	154.4	-81.1	-81.5	0	0	0	109.5	E2009	E2009-H2011 VanDerWaalsContact C-N 3.26Å; E2009-H2011 PolarHBondContact O-N 3.01Å
2012	I	27.2	Very low	37	Very low	152 Å²	152	115.7 Å²	115.7	78%	0.779	57%	0.567	S	S	*	*			trans	-170.2	113.3	142.3	-96.1	148.7	0	0	0	109.7	F2010	F2010-I2012 PolarHBondContact O-N 2.86Å
2013	D	25.8	Very low	35.3	Very low	131 Å²	131	121.5 Å²	121.5	70%	0.701	60%	0.599	S	S	*	*			trans	37.8	103.9	154.4	-57.3	-12.2	0	0	0	121.7	N2015	D2013-N2015 PolarHBondContact O-N 3.41Å
2014	F	27.4	Very low	34.1	Very low	220 Å²	220	121.4 Å²	121.4	97%	0.965	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-42.7	8.9	169.6	-71.4	-96.4	0	0	0	120
2015	N	27.4	Very low	33.3	Very low	143 Å²	143	121.4 Å²	121.4	77%	0.765	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-9.3	-171.4	-85	-32.5	0	0	0	116.1	D2013 R2017	D2013-N2015 PolarHBondContact O-N 3.41Å; N2015-R2017 VanDerWaalsContact C-N 3.28Å; N2015-R2017 PolarHBondContact O-N 3.3Å
2016	Y	26.6	Very low	32.4	Very low	224 Å²	224	119.9 Å²	119.9	88%	0.878	59%	0.593	S	S	*	*			trans	-78	77.8	173.8	-96.1	-87.4	0	0	0	111.6
2017	R	26.5	Very low	31.3	Very low	209 Å²	209	120.2 Å²	120.2	79%	0.789	59%	0.592	S	S	*	*			trans	-61.8	155.1	178.6	-80	-173.7	170.2	-166.2	-3.3	113.6	N2015 S2019	N2015-R2017 VanDerWaalsContact C-N 3.28Å; N2015-R2017 PolarHBondContact O-N 3.3Å; R2017-S2019 VanDerWaalsContact C-N 3.25Å; R2017-S2019 PolarHBondContact O-N 2.97Å; R2017-S2019 PolarHBondContact O-OG 2.88Å
2018	S	26.3	Very low	30.9	Very low	132 Å²	132	121.1 Å²	121.1	92%	0.923	60%	0.596	S	S	*	*	S	Bend	trans	-66.2	66.5	169.9	40	0	0	0	0	113.3
2019	S	30.2	Very low	30.9	Very low	60 Å²	60	118.4 Å²	118.4	42%	0.42	58%	0.581	S	S	.	*			trans	-133.8	14.5	-175.2	59.5	0	0	0	0	115.3	R2017 S2274	R2017-S2019 VanDerWaalsContact C-N 3.25Å; R2017-S2019 PolarHBondContact O-N 2.97Å; R2017-S2019 PolarHBondContact O-OG 2.88Å; S2019-S2274 PolarHBondContact O-OG 2.83Å
2020	L	28.9	Very low	31.1	Very low	73 Å²	73	115.7 Å²	115.7	38%	0.382	57%	0.572	S	S	.	*	S	Bend	trans	-100.1	-12.6	-173.4	-114.1	164.6	0	0	0	114.8	P2177	L2020-P2177 HydrophobicContact CD2-CB 4.4Å
2021	L	33	Very low	31.1	Very low	102 Å²	102	116 Å²	116	53%	0.534	57%	0.569	S	S	.	*	S	Bend	trans	-116.8	120	166.5	-77.7	162.9	0	0	0	107.4	F2025	L2021-F2025 HydrophobicContact CD2-CD1 3.7Å; L2021-F2025 HydrophobicContact CD2-CE1 3.9Å
2022	P	34	Very low	31.4	Very low	24 Å²	24	113.1 Å²	113.1	16%	0.156	56%	0.556	C	S	.	*			trans	-67.3	152.3	-178.1	-22.3	33.3	0	0	0	113.4	W2024 F2025 S2026 I2275	P2022-W2024 VanDerWaalsContact C-N 3.28Å; P2022-W2024 VanDerWaalsContact CB-CD1 3.42Å; P2022-W2024 HydrophobicContact CB-CD2 4.45Å; P2022-W2024 HydrophobicContact CB-CG 4.1Å; P2022-W2024 PolarHBondContact O-N 2.91Å; P2022-F2025 HydrophobicContact CB-CB 4.3Å; P2022-F2025 HydrophobicContact CG-CB 4.42Å; P2022-F2025 CarbonylContact O-C 3.47Å; P2022-F2025 WeakPolarHBondContact O-CA 3.41Å; P2022-F2025 WeakPolarHBondContact O-CB 3.19Å; P2022-F2025 PolarHBondContact O-N 3.01Å; P2022-S2026 PolarHBondContact O-N 3.48Å; P2022-I2275 HydrophobicContact CB-CD1 4.15Å; P2022-I2275 HydrophobicContact CG-CD1 3.44Å; P2022-I2275 VanDerWaalsContact CG-CD1 3.44Å; P2022-I2275 HydrophobicContact CG-CG1 3.46Å; P2022-I2275 VanDerWaalsContact CG-CG1 3.46Å
2023	N	31.6	Very low	31.4	Very low	127 Å²	127	112.7 Å²	112.7	68%	0.679	55%	0.55	S	S	*	*	H	α-helix	trans	-58.9	-37.5	175.9	-65	-4.3	0	0	0	112.5	F2025 S2026 H2027	N2023-F2025 PolarHBondContact O-N 2.85Å; N2023-S2026 WeakPolarHBondContact CA-OG 3.27Å; N2023-S2026 PolarHBondContact O-N 3.47Å; N2023-S2026 PolarHBondContact O-OG 3.4Å; N2023-H2027 PolarHBondContact O-CD2 2.91Å; N2023-H2027 PolarHBondContact O-N 2.77Å
2024	W	39.8	Very low	31.5	Very low	63 Å²	63	113 Å²	113	24%	0.239	55%	0.552	C	S	.	*	H	α-helix	trans	-63.1	-28.9	174	70.8	-101.3	0	0	0	112.7	P2022 L2028 I2263 I2275 L2281	P2022-W2024 VanDerWaalsContact C-N 3.28Å; P2022-W2024 VanDerWaalsContact CB-CD1 3.42Å; P2022-W2024 HydrophobicContact CB-CD2 4.45Å; P2022-W2024 HydrophobicContact CB-CG 4.1Å; P2022-W2024 PolarHBondContact O-N 2.91Å; W2024-L2028 HydrophobicContact CE3-CD1 3.8Å; W2024-L2028 HydrophobicContact CZ3-CD1 3.81Å; W2024-L2028 WeakPolarHBondContact O-CB 3.48Å; W2024-L2028 PolarHBondContact O-N 3.26Å; W2024-L2028 VanDerWaalsContact O-N 3.13Å; W2024-I2263 HydrophobicContact CG-CD1 4.19Å; W2024-I2275 HydrophobicContact CZ2-CD1 4.16Å; W2024-L2281 HydrophobicContact CH2-CD1 4.32Å
2025	F	40.3	Very low	31.5	Very low	14 Å²	14	110.4 Å²	110.4	6%	0.061	54%	0.543	C	S	.	.	H	α-helix	trans	-83	-28.7	178.3	-164.7	-92.3	0	0	0	112.4	L2021 P2022 N2023 L2029 L2137 F2174	L2021-F2025 HydrophobicContact CD2-CD1 3.7Å; L2021-F2025 HydrophobicContact CD2-CE1 3.9Å; P2022-F2025 HydrophobicContact CB-CB 4.3Å; P2022-F2025 HydrophobicContact CG-CB 4.42Å; P2022-F2025 CarbonylContact O-C 3.47Å; P2022-F2025 WeakPolarHBondContact O-CA 3.41Å; P2022-F2025 WeakPolarHBondContact O-CB 3.19Å; P2022-F2025 PolarHBondContact O-N 3.01Å; N2023-F2025 PolarHBondContact O-N 2.85Å; F2025-L2029 HydrophobicContact CD1-CD1 3.96Å; F2025-L2029 HydrophobicContact CE1-CD1 3.71Å; F2025-L2029 PolarHBondContact O-N 2.88Å; F2025-L2137 HydrophobicContact CE1-CD1 4.23Å; F2025-L2137 HydrophobicContact CE2-CD1 3.87Å; F2025-L2137 HydrophobicContact CZ-CD1 3.44Å; F2025-L2137 VanDerWaalsContact CZ-CD1 3.44Å; F2025-F2174 HydrophobicContact CD1-CZ 4.38Å; F2025-F2174 HydrophobicContact CD2-CD2 4.28Å; F2025-F2174 AromaticContact CD2-CE2 3.78Å; F2025-F2174 HydrophobicContact CD2-CE2 3.78Å; F2025-F2174 HydrophobicContact CD2-CZ 4.26Å; F2025-F2174 HydrophobicContact CE1-CE1 4.05Å; F2025-F2174 HydrophobicContact CE1-CE2 4.17Å; F2025-F2174 AromaticContact CE1-CZ 3.67Å; F2025-F2174 HydrophobicContact CE1-CZ 3.67Å; F2025-F2174 HydrophobicContact CE2-CD1 4.29Å; F2025-F2174 AromaticContact CE2-CD2 3.42Å; F2025-F2174 HydrophobicContact CE2-CD2 3.42Å; F2025-F2174 VanDerWaalsContact CE2-CD2 3.42Å; F2025-F2174 HydrophobicContact CE2-CE1 4.11Å; F2025-F2174 AromaticContact CE2-CE2 3.18Å; F2025-F2174 HydrophobicContact CE2-CE2 3.18Å; F2025-F2174 AromaticContact CE2-CG 3.96Å; F2025-F2174 HydrophobicContact CE2-CG 3.96Å; F2025-F2174 AromaticContact CE2-CZ 3.55Å; F2025-F2174 HydrophobicContact CE2-CZ 3.55Å; F2025-F2174 HydrophobicContact CG-CE2 4.49Å; F2025-F2174 AromaticContact CZ-CD1 3.83Å; F2025-F2174 HydrophobicContact CZ-CD1 3.83Å; F2025-F2174 AromaticContact CZ-CD2 3.8Å; F2025-F2174 HydrophobicContact CZ-CD2 3.8Å; F2025-F2174 AromaticContact CZ-CE1 3.45Å; F2025-F2174 HydrophobicContact CZ-CE1 3.45Å; F2025-F2174 VanDerWaalsContact CZ-CE1 3.45Å; F2025-F2174 AromaticContact CZ-CE2 3.4Å; F2025-F2174 HydrophobicContact CZ-CE2 3.4Å; F2025-F2174 VanDerWaalsContact CZ-CE2 3.4Å; F2025-F2174 AromaticContact CZ-CG 3.98Å; F2025-F2174 HydrophobicContact CZ-CG 3.98Å; F2025-F2174 AromaticContact CZ-CZ 3.2Å; F2025-F2174 HydrophobicContact CZ-CZ 3.2Å
2026	S	33.5	Very low	31.5	Very low	46 Å²	46	108.9 Å²	108.9	32%	0.322	54%	0.539	S	S	.	.	H	α-helix	trans	-71.7	-39.6	167.9	59.2	0	0	0	0	111.7	P2022 N2023 L2028 L2029 L2030	P2022-S2026 PolarHBondContact O-N 3.48Å; N2023-S2026 WeakPolarHBondContact CA-OG 3.27Å; N2023-S2026 PolarHBondContact O-N 3.47Å; N2023-S2026 PolarHBondContact O-OG 3.4Å; S2026-L2028 VanDerWaalsContact C-N 3.3Å; S2026-L2028 PolarHBondContact O-N 3.35Å; S2026-L2029 CarbonylContact O-C 3.59Å; S2026-L2029 WeakPolarHBondContact O-CA 3.31Å; S2026-L2029 WeakPolarHBondContact O-CB 3.48Å; S2026-L2029 PolarHBondContact O-N 2.9Å; S2026-L2030 WeakPolarHBondContact O-CB 3.36Å; S2026-L2030 WeakPolarHBondContact O-CD1 3.23Å; S2026-L2030 VanDerWaalsContact O-CG 3.25Å; S2026-L2030 WeakPolarHBondContact O-CG 3.47Å; S2026-L2030 PolarHBondContact O-N 2.76Å
2027	H	31.3	Very low	31.6	Very low	116 Å²	116	102.4 Å²	102.4	54%	0.537	52%	0.518	S	S	.	.	H	α-helix	trans	-57.1	-43.2	170.2	-69.2	-57	0	0	0	111.8	N2023 L2029 L2030 W2031	N2023-H2027 PolarHBondContact O-CD2 2.91Å; N2023-H2027 PolarHBondContact O-N 2.77Å; H2027-L2029 PolarHBondContact O-N 3.36Å; H2027-L2029 VanDerWaalsContact O-N 3.14Å; H2027-L2030 PolarHBondContact O-N 2.89Å; H2027-L2030 VanDerWaalsContact O-N 3.09Å; H2027-W2031 PolarHBondContact O-N 2.52Å
2028	L	35.1	Very low	31.6	Very low	71 Å²	71	100.8 Å²	100.8	37%	0.372	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.2	174.5	-120.2	147.2	0	0	0	114.7	W2024 S2026 L2137 W2252	W2024-L2028 HydrophobicContact CE3-CD1 3.8Å; W2024-L2028 HydrophobicContact CZ3-CD1 3.81Å; W2024-L2028 WeakPolarHBondContact O-CB 3.48Å; W2024-L2028 PolarHBondContact O-N 3.26Å; W2024-L2028 VanDerWaalsContact O-N 3.13Å; S2026-L2028 VanDerWaalsContact C-N 3.3Å; S2026-L2028 PolarHBondContact O-N 3.35Å; L2028-L2137 HydrophobicContact CD2-CD2 4.43Å; L2028-W2252 HydrophobicContact CD1-CH2 4.25Å; L2028-W2252 HydrophobicContact CD2-CH2 4.06Å; L2028-W2252 HydrophobicContact CG-CH2 4.1Å
2029	L	36.1	Very low	31.7	Very low	87 Å²	87	98.9 Å²	98.9	46%	0.455	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-3.1	176.1	-99	159.2	0	0	0	113.5	F2025 S2026 H2027	F2025-L2029 HydrophobicContact CD1-CD1 3.96Å; F2025-L2029 HydrophobicContact CE1-CD1 3.71Å; F2025-L2029 PolarHBondContact O-N 2.88Å; S2026-L2029 CarbonylContact O-C 3.59Å; S2026-L2029 WeakPolarHBondContact O-CA 3.31Å; S2026-L2029 WeakPolarHBondContact O-CB 3.48Å; S2026-L2029 PolarHBondContact O-N 2.9Å; H2027-L2029 PolarHBondContact O-N 3.36Å; H2027-L2029 VanDerWaalsContact O-N 3.14Å
2030	L	33.6	Very low	31.8	Very low	118 Å²	118	99 Å²	99	62%	0.618	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	-13.2	-169.9	-73.7	169.2	0	0	0	114.8	S2026 H2027 E2032	S2026-L2030 WeakPolarHBondContact O-CB 3.36Å; S2026-L2030 WeakPolarHBondContact O-CD1 3.23Å; S2026-L2030 VanDerWaalsContact O-CG 3.25Å; S2026-L2030 WeakPolarHBondContact O-CG 3.47Å; S2026-L2030 PolarHBondContact O-N 2.76Å; H2027-L2030 PolarHBondContact O-N 2.89Å; H2027-L2030 VanDerWaalsContact O-N 3.09Å; L2030-E2032 VanDerWaalsContact C-N 3.27Å; L2030-E2032 PolarHBondContact O-N 2.92Å
2031	W	32.6	Very low	31.8	Very low	153 Å²	153	102.9 Å²	102.9	58%	0.58	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	17.7	-158.3	-159.5	21.2	0	0	0	117.2	H2027 W2252 I2255	H2027-W2031 PolarHBondContact O-N 2.52Å; W2031-W2252 HydrophobicContact CE3-CZ2 4.42Å; W2031-W2252 HydrophobicContact CZ3-CZ2 4.08Å; W2031-W2252 AromaticContact CZ3-NE1 3.92Å; W2031-I2255 HydrophobicContact CH2-CD1 3.94Å
2032	E	31.7	Very low	31.7	Very low	110 Å²	110	106 Å²	106	51%	0.514	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	20.1	-174.4	-117.1	-173	145.3	0	0	117.8	L2030 N2087	L2030-E2032 VanDerWaalsContact C-N 3.27Å; L2030-E2032 PolarHBondContact O-N 2.92Å; E2032-N2087 HydrophobicContact CB-CB 3.9Å; E2032-N2087 HydrophobicContact CG-CB 3.89Å; E2032-N2087 VanDerWaalsContact OE1-CG 3.27Å; E2032-N2087 PolarHBondContact OE1-ND2 3.06Å
2033	H	27.3	Very low	31.5	Very low	144 Å²	144	110.4 Å²	110.4	67%	0.667	56%	0.556	S	S	*	*	S	Bend	trans	-169.7	137.1	131.8	-108.1	67.4	0	0	0	112.7
2034	N	29.2	Very low	31.4	Very low	137 Å²	137	113.3 Å²	113.3	73%	0.733	57%	0.565	S	S	*	*			trans	-66.2	162	167.5	-70.5	-9.5	0	0	0	110.6
2035	E	26.6	Very low	31	Very low	165 Å²	165	114.9 Å²	114.9	77%	0.771	59%	0.586	S	S	*	*	S	Bend	cis	-152	-0.5	21.6	-151.9	160.9	-115.1	0	0	114.8
2036	T	26.3	Very low	30.6	Very low	111 Å²	111	117.1 Å²	117.1	68%	0.681	61%	0.606	S	S	*	*	S	Bend	trans	-104.6	-10.3	-156.1	51.9	0	0	0	0	117.6	S2039	T2036-S2039 PolarHBondContact O-OG 3.5Å
2037	I	29.4	Very low	30.4	Very low	89 Å²	89	123.2 Å²	123.2	46%	0.456	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-91.7	-10.9	-163.4	-59.7	-174.9	0	0	0	114.6	S2039 I2040	I2037-S2039 PolarHBondContact O-N 3.44Å; I2037-S2039 VanDerWaalsContact O-N 3.16Å; I2037-I2040 HydrophobicContact CB-CD1 4.45Å; I2037-I2040 HydrophobicContact CG1-CD1 4.23Å; I2037-I2040 HydrophobicContact CG2-CB 4.44Å; I2037-I2040 HydrophobicContact CG2-CD1 4.37Å; I2037-I2040 PolarHBondContact O-N 2.81Å; I2037-I2040 VanDerWaalsContact O-N 3.11Å
2038	E	27.3	Very low	30.4	Very low	175 Å²	175	122.2 Å²	122.2	82%	0.818	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-55.2	-35.7	174.3	-69.1	-167.1	133.9	0	0	112.7	I2040	E2038-I2040 VanDerWaalsContact C-N 3.26Å; E2038-I2040 PolarHBondContact O-N 3.41Å
2039	S	28.6	Very low	30.2	Very low	92 Å²	92	120.2 Å²	120.2	64%	0.643	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-71.6	-9.7	-178.9	66.8	0	0	0	0	115.8	T2036 I2037	T2036-S2039 PolarHBondContact O-OG 3.5Å; I2037-S2039 PolarHBondContact O-N 3.44Å; I2037-S2039 VanDerWaalsContact O-N 3.16Å
2040	I	30.5	Very low	30.5	Very low	62 Å²	62	119.3 Å²	119.3	32%	0.318	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-96	-20.4	-167.2	-67.1	171.2	0	0	0	112.6	I2037 E2038 Y2053	I2037-I2040 HydrophobicContact CB-CD1 4.45Å; I2037-I2040 HydrophobicContact CG1-CD1 4.23Å; I2037-I2040 HydrophobicContact CG2-CB 4.44Å; I2037-I2040 HydrophobicContact CG2-CD1 4.37Å; I2037-I2040 PolarHBondContact O-N 2.81Å; I2037-I2040 VanDerWaalsContact O-N 3.11Å; E2038-I2040 VanDerWaalsContact C-N 3.26Å; E2038-I2040 PolarHBondContact O-N 3.41Å; I2040-Y2053 HydrophobicContact CD1-CE1 3.82Å; I2040-Y2053 WeakPolarHBondContact CD1-OH 3.5Å; I2040-Y2053 WeakPolarHBondContact CG1-OH 3.44Å; I2040-Y2053 HydrophobicContact CG2-CE1 4.44Å; I2040-Y2053 HydrophobicContact CG2-CE2 3.91Å; I2040-Y2053 WeakPolarHBondContact CG2-OH 3.23Å
2041	L	30.6	Very low	30.9	Very low	154 Å²	154	117.7 Å²	117.7	81%	0.806	60%	0.598	S	S	*	*	S	Bend	trans	-90.1	-11.1	-172	-76.3	160.7	0	0	0	114.9
2042	E	31	Very low	31.2	Very low	168 Å²	168	120 Å²	120	79%	0.785	61%	0.606	S	S	*	*	S	Bend	trans	-103.7	-17.5	-170.8	-64.3	-160.6	133.5	0	0	116.5
2043	L	29	Very low	31.7	Very low	117 Å²	117	119.1 Å²	119.1	61%	0.613	60%	0.599	S	S	*	*			trans	-93.2	118.5	-171.8	-99.5	75	0	0	0	114.7	S2045 A2046	L2043-S2045 PolarHBondContact O-N 3.01Å; L2043-A2046 WeakPolarHBondContact O-CB 3.2Å; L2043-A2046 PolarHBondContact O-N 3.44Å
2044	E	29.9	Very low	32.6	Very low	188 Å²	188	113.4 Å²	113.4	88%	0.879	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-59.2	-11.3	-177.4	-60.9	-177.2	113.6	0	0	115.8	A2046	E2044-A2046 PolarHBondContact O-N 3.01Å
2045	S	30.8	Very low	33.5	Very low	96 Å²	96	110 Å²	110	67%	0.671	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-63	-3.4	165.4	52.6	0	0	0	0	113.8	L2043 K2047	L2043-S2045 PolarHBondContact O-N 3.01Å; S2045-K2047 PolarHBondContact O-N 3.05Å
2046	A	33	Very low	35.1	Very low	60 Å²	60	104.3 Å²	104.3	50%	0.496	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-55.7	-11.5	177.6	0	0	0	0	0	116	L2043 E2044 F2048 S2049	L2043-A2046 WeakPolarHBondContact O-CB 3.2Å; L2043-A2046 PolarHBondContact O-N 3.44Å; E2044-A2046 PolarHBondContact O-N 3.01Å; A2046-F2048 PolarHBondContact O-N 2.82Å; A2046-S2049 PolarHBondContact O-N 3.24Å
2047	K	29.5	Very low	36.8	Very low	174 Å²	174	103.6 Å²	103.6	76%	0.757	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-52	-18.9	-178.8	-90.8	-161.2	170.9	-161.6	0	116.3	S2045	S2045-K2047 PolarHBondContact O-N 3.05Å
2048	F	29.6	Very low	38.5	Very low	96 Å²	96	100.7 Å²	100.7	42%	0.421	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-130.8	7.4	166.5	-91.1	-83.4	0	0	0	114	Q2003 L2004 A2046 L2050 Q2051	Q2003-F2048 HydrophobicContact CG-CE1 3.65Å; Q2003-F2048 HydrophobicContact CG-CZ 4.27Å; L2004-F2048 WeakPolarHBondContact O-CE1 3.27Å; L2004-F2048 WeakPolarHBondContact O-CZ 3.36Å; A2046-F2048 PolarHBondContact O-N 2.82Å; F2048-L2050 PolarHBondContact O-N 2.85Å; F2048-Q2051 WeakPolarHBondContact O-CB 3.27Å; F2048-Q2051 PolarHBondContact O-N 3.07Å; F2048-Q2051 VanDerWaalsContact O-N 3.1Å
2049	S	32.6	Very low	39.9	Very low	29 Å²	29	93.9 Å²	93.9	20%	0.203	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-14.5	-162.9	-161.6	0	0	0	0	116	A2046 Q2051 R2052 Y2053	A2046-S2049 PolarHBondContact O-N 3.24Å; S2049-Q2051 PolarHBondContact O-N 3.35Å; S2049-Q2051 VanDerWaalsContact O-N 3.14Å; S2049-R2052 WeakPolarHBondContact O-CB 3.12Å; S2049-R2052 PolarHBondContact O-N 3.5Å; S2049-Y2053 VanDerWaalsContact O-CD2 3.31Å; S2049-Y2053 WeakPolarHBondContact O-CD2 3.41Å; S2049-Y2053 WeakPolarHBondContact O-CE2 2.97Å
2050	L	40.4	Very low	40.8	Very low	68 Å²	68	92 Å²	92	36%	0.356	46%	0.462	S	S	.	.	H	α-helix	trans	-55.7	-29.2	167.5	-94	163.7	0	0	0	112	L2004 F2048 R2052 Y2053 I2054 L2093 L2095	L2004-L2050 HydrophobicContact CD1-CB 3.35Å; L2004-L2050 HydrophobicContact CD1-CD1 4Å; L2004-L2050 HydrophobicContact CD1-CG 4.3Å; F2048-L2050 PolarHBondContact O-N 2.85Å; L2050-R2052 PolarHBondContact O-N 3.46Å; L2050-R2052 VanDerWaalsContact O-N 3.15Å; L2050-Y2053 PolarHBondContact O-N 3.13Å; L2050-Y2053 VanDerWaalsContact O-N 3.17Å; L2050-I2054 HydrophobicContact CD2-CD1 4.49Å; L2050-I2054 WeakPolarHBondContact O-CG1 3.48Å; L2050-L2093 HydrophobicContact CD2-CD2 4.07Å; L2050-L2095 HydrophobicContact CD1-CD2 4.17Å
2051	Q	43	Very low	41.7	Very low	83 Å²	83	89.8 Å²	89.8	39%	0.388	45%	0.451	S	S	.	.	H	α-helix	trans	-62.6	-12.8	174.8	-158.7	-179.3	15.5	0	0	113.8	I2002 F2048 S2049	I2002-Q2051 WeakPolarHBondContact O-CG 2.85Å; I2002-Q2051 PolarHBondContact O-NE2 3.49Å; F2048-Q2051 WeakPolarHBondContact O-CB 3.27Å; F2048-Q2051 PolarHBondContact O-N 3.07Å; F2048-Q2051 VanDerWaalsContact O-N 3.1Å; S2049-Q2051 PolarHBondContact O-N 3.35Å; S2049-Q2051 VanDerWaalsContact O-N 3.14Å
2052	R	38.5	Very low	42.3	Very low	201 Å²	201	84.7 Å²	84.7	76%	0.758	43%	0.428	S	S	*	.	H	α-helix	trans	-89.7	-27.3	173.2	-78.4	-176.8	165.7	-177.8	-3.6	114.3	S2049 L2050	S2049-R2052 WeakPolarHBondContact O-CB 3.12Å; S2049-R2052 PolarHBondContact O-N 3.5Å; L2050-R2052 PolarHBondContact O-N 3.46Å; L2050-R2052 VanDerWaalsContact O-N 3.15Å
2053	Y	42.2	Very low	42.7	Very low	92 Å²	92	82.8 Å²	82.8	36%	0.361	42%	0.419	S	S	.	.	H	α-helix	trans	-97.3	-0.4	-174.2	-57.3	-71.3	0	0	0	113.2	I2040 S2049 L2050	I2040-Y2053 HydrophobicContact CD1-CE1 3.82Å; I2040-Y2053 WeakPolarHBondContact CD1-OH 3.5Å; I2040-Y2053 WeakPolarHBondContact CG1-OH 3.44Å; I2040-Y2053 HydrophobicContact CG2-CE1 4.44Å; I2040-Y2053 HydrophobicContact CG2-CE2 3.91Å; I2040-Y2053 WeakPolarHBondContact CG2-OH 3.23Å; S2049-Y2053 VanDerWaalsContact O-CD2 3.31Å; S2049-Y2053 WeakPolarHBondContact O-CD2 3.41Å; S2049-Y2053 WeakPolarHBondContact O-CE2 2.97Å; L2050-Y2053 PolarHBondContact O-N 3.13Å; L2050-Y2053 VanDerWaalsContact O-N 3.17Å
2054	I	46.8	Very low	42.9	Very low	25 Å²	25	79 Å²	79	13%	0.128	40%	0.403	C	S	.	.	S	Bend	trans	-117.9	103.6	178.9	-57.4	171.5	0	0	0	107.1	I2002 L2050 T2056 I2078 M2101	I2002-I2054 HydrophobicContact CD1-CB 4.22Å; I2002-I2054 HydrophobicContact CD1-CG2 3.4Å; I2002-I2054 VanDerWaalsContact CD1-CG2 3.4Å; L2050-I2054 HydrophobicContact CD2-CD1 4.49Å; L2050-I2054 WeakPolarHBondContact O-CG1 3.48Å; I2054-T2056 PolarHBondContact O-N 3.09Å; I2054-I2078 HydrophobicContact CG2-CG2 3.3Å; I2054-M2101 HydrophobicContact CD1-CE 4.41Å
2055	T	48.2	Very low	43.2	Very low	64 Å²	64	70.6 Å²	70.6	39%	0.393	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	105.2	-177.6	36.9	0	0	0	0	110.5	Q2057 K2079	T2055-Q2057 PolarHBondContact O-N 3.21Å; T2055-K2079 PolarHBondContact N-O 2.61Å; T2055-K2079 PolarHBondContact O-N 3.12Å; T2055-K2079 VanDerWaalsContact OG1-CB 3.27Å; T2055-K2079 WeakPolarHBondContact OG1-CB 3.5Å; T2055-K2079 PolarHBondContact OG1-O 3.06Å; T2055-K2079 VanDerWaalsContact OG1-O 3.07Å
2056	T	60.6	Low	43.1	Very low	46 Å²	46	69.7 Å²	69.7	28%	0.282	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	104.2	170.5	48.5	0	0	0	0	110.8	C2000 I2002 I2054 V2077	C2000-T2056 PolarHBondContact O-OG1 3.02Å; C2000-T2056 VanDerWaalsContact O-OG1 3.13Å; I2002-T2056 HydrophobicContact CB-CG2 4.27Å; I2002-T2056 HydrophobicContact CD1-CG2 3.32Å; I2002-T2056 HydrophobicContact CG1-CG2 3.51Å; I2054-T2056 PolarHBondContact O-N 3.09Å; T2056-V2077 WeakPolarHBondContact CA-O 3.07Å
2057	Q	60.7	Low	43.3	Very low	97 Å²	97	70.5 Å²	70.5	45%	0.453	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.4	173.9	-164.6	170.4	2.7	0	0	109.1	T2055 E2059 V2077	T2055-Q2057 PolarHBondContact O-N 3.21Å; Q2057-E2059 HydrophobicContact CB-CG 4.07Å; Q2057-E2059 HydrophobicContact CG-CG 3.7Å; Q2057-E2059 PolarHBondContact O-N 3.09Å; Q2057-E2059 PolarHBondContact OE1-OE1 3.08Å; Q2057-V2077 PolarHBondContact N-O 3.47Å; Q2057-V2077 WeakPolarHBondContact O-CA 3.48Å; Q2057-V2077 WeakPolarHBondContact O-CB 3.37Å; Q2057-V2077 PolarHBondContact O-N 3.5Å
2058	L	65.2	Low	43.8	Very low	27 Å²	27	64.6 Å²	64.6	14%	0.141	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	106.1	167.3	-168.4	78.8	0	0	0	107.1	I1970 F1998 C2000 W2074 C2076 L2105	I1970-L2058 HydrophobicContact CD1-CD1 3.63Å; F1998-L2058 HydrophobicContact CB-CD2 3.91Å; F1998-L2058 WeakPolarHBondContact O-CD2 3.28Å; C2000-L2058 HydrophobicContact CB-CD1 4.26Å; L2058-W2074 HydrophobicContact CD1-CB 3.96Å; L2058-W2074 HydrophobicContact CD2-CB 4.39Å; L2058-W2074 HydrophobicContact CD2-CD2 4.03Å; L2058-W2074 HydrophobicContact CD2-CE3 3.81Å; L2058-W2074 HydrophobicContact CD2-CG 4.3Å; L2058-W2074 HydrophobicContact CD2-CZ3 4.44Å; L2058-W2074 HydrophobicContact CG-CB 4.06Å; L2058-W2074 HydrophobicContact CG-CD2 4.23Å; L2058-W2074 HydrophobicContact CG-CE3 3.77Å; L2058-W2074 HydrophobicContact CG-CG 4.39Å; L2058-C2076 HydrophobicContact CD1-CB 4.28Å; L2058-L2105 HydrophobicContact CD1-CD1 4.26Å
2059	E	56.8	Low	44.3	Very low	32 Å²	32	61.5 Å²	61.5	15%	0.15	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	143.8	-177.7	-59.2	174.8	-171.1	0	0	110.7	Q2057 W2074 Q2075 V2077 K2079	Q2057-E2059 HydrophobicContact CB-CG 4.07Å; Q2057-E2059 HydrophobicContact CG-CG 3.7Å; Q2057-E2059 PolarHBondContact O-N 3.09Å; Q2057-E2059 PolarHBondContact OE1-OE1 3.08Å; E2059-W2074 CarbonylContact O-C 3.58Å; E2059-W2074 WeakPolarHBondContact O-CA 3.43Å; E2059-Q2075 HydrophobicContact CB-CG 4.02Å; E2059-Q2075 PolarHBondContact N-O 3.35Å; E2059-Q2075 WeakPolarHBondContact O-CG 3.45Å; E2059-Q2075 PolarHBondContact O-N 2.82Å; E2059-Q2075 PolarHBondContact OE2-NE2 3.01Å; E2059-V2077 HydrophobicContact CB-CG2 3.81Å; E2059-V2077 VanDerWaalsContact CD-CG2 3.4Å; E2059-V2077 HydrophobicContact CG-CB 4.14Å; E2059-V2077 HydrophobicContact CG-CG2 3.7Å; E2059-V2077 WeakPolarHBondContact OE2-CG2 3.44Å; E2059-K2079 WeakPolarHBondContact OE1-CE 3.11Å; E2059-K2079 IonicContact OE1-NZ 3.45Å; E2059-K2079 PolarHBondContact OE1-NZ 3.46Å
2060	P	49	Very low	44.7	Very low	53 Å²	53	61.8 Å²	61.8	34%	0.344	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	147.2	159.1	30.9	-33.9	0	0	0	108.9	F1992	F1992-P2060 HydrophobicContact CD1-CG 4.27Å; F1992-P2060 HydrophobicContact CE1-CG 4.2Å
2061	L	48.8	Very low	44.7	Very low	16 Å²	16	60 Å²	60	8%	0.084	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-66.3	142.1	171.2	-79.7	79.3	0	0	0	110	L1969 F2067 H2068 Q2073 Q2075	L1969-L2061 HydrophobicContact CD2-CD1 4.24Å; L1969-L2061 HydrophobicContact CD2-CD2 3.87Å; L2061-F2067 VanDerWaalsContact CD2-C 3.43Å; L2061-F2067 HydrophobicContact CD2-CB 3.59Å; L2061-F2067 WeakPolarHBondContact CD2-O 3.22Å; L2061-H2068 HydrophobicContact CB-CB 4.17Å; L2061-H2068 PolarHBondContact O-CD2 3.42Å; L2061-Q2073 HydrophobicContact CD1-CB 3.95Å; L2061-Q2073 VanDerWaalsContact CD1-O 3.25Å; L2061-Q2073 WeakPolarHBondContact CD1-O 3.5Å; L2061-Q2075 HydrophobicContact CD1-CB 3.8Å; L2061-Q2075 HydrophobicContact CD1-CG 3.79Å; L2061-Q2075 HydrophobicContact CG-CB 4.32Å; L2061-Q2075 HydrophobicContact CG-CG 4.02Å
2062	S	42.2	Very low	44.7	Very low	46 Å²	46	60.1 Å²	60.1	32%	0.322	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-75.8	155.8	170.8	61.5	0	0	0	0	111.2	S2064 S2065 H2068	S2062-S2064 PolarHBondContact O-N 3.26Å; S2062-S2064 VanDerWaalsContact O-N 3.12Å; S2062-S2064 PolarHBondContact OG-OG 3.03Å; S2062-S2065 WeakPolarHBondContact O-CB 3.16Å; S2062-S2065 PolarHBondContact O-N 3.07Å; S2062-S2065 PolarHBondContact OG-N 3.48Å; S2062-H2068 WeakPolarHBondContact O-CB 3.46Å; S2062-H2068 PolarHBondContact O-CD2 2.8Å
2063	Q	39.4	Very low	45.3	Very low	129 Å²	129	51.5 Å²	51.5	60%	0.603	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.2	168.9	-71	-176.6	-4.2	0	0	113.2	S1772 S2065	S1772-Q2063 PolarHBondContact OG-OE1 3.13Å; Q2063-S2065 VanDerWaalsContact C-N 3.35Å
2064	S	33.6	Very low	46.1	Very low	38 Å²	38	48.9 Å²	48.9	27%	0.266	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.2	170.8	61.2	0	0	0	0	114	R1742 E1960 S2062	R1742-S2064 PolarHBondContact NH1-OG 2.98Å; E1960-S2064 PolarHBondContact OE1-OG 2.92Å; S2062-S2064 PolarHBondContact O-N 3.26Å; S2062-S2064 VanDerWaalsContact O-N 3.12Å; S2062-S2064 PolarHBondContact OG-OG 3.03Å
2065	S	35.9	Very low	46.7	Very low	11 Å²	11	47.9 Å²	47.9	8%	0.077	27%	0.267	C	S	.	.	S	Bend	trans	-86.8	129.5	-176.8	-169.3	0	0	0	0	111.6	S2062 Q2063 F2067 H2068	S2062-S2065 WeakPolarHBondContact O-CB 3.16Å; S2062-S2065 PolarHBondContact O-N 3.07Å; S2062-S2065 PolarHBondContact OG-N 3.48Å; Q2063-S2065 VanDerWaalsContact C-N 3.35Å; S2065-F2067 PolarHBondContact O-N 2.76Å; S2065-H2068 WeakPolarHBondContact O-CB 3.01Å; S2065-H2068 PolarHBondContact O-N 3.17Å; S2065-H2068 VanDerWaalsContact O-N 3.09Å
2066	P	29.2	Very low	47.4	Very low	76 Å²	76	44.9 Å²	44.9	49%	0.494	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-15.3	177.4	-30.2	37.5	0	0	0	116.2
2067	F	37.3	Very low	47.3	Very low	77 Å²	77	42.7 Å²	42.7	34%	0.338	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	8.2	-175.3	-53.7	-78.7	0	0	0	113.3	A1930 L1969 L2061 S2065 T2069 Q2073	A1930-F2067 HydrophobicContact CB-CE1 4.05Å; A1930-F2067 HydrophobicContact CB-CE2 4.23Å; A1930-F2067 HydrophobicContact CB-CZ 3.71Å; L1969-F2067 HydrophobicContact CD1-CB 3.99Å; L1969-F2067 HydrophobicContact CD1-CD1 3.73Å; L1969-F2067 HydrophobicContact CD1-CD2 4.46Å; L1969-F2067 HydrophobicContact CD1-CE1 4.28Å; L1969-F2067 HydrophobicContact CD1-CG 3.82Å; L1969-F2067 HydrophobicContact CD2-CB 3.83Å; L1969-F2067 HydrophobicContact CD2-CD2 4.48Å; L1969-F2067 HydrophobicContact CD2-CG 4.2Å; L2061-F2067 VanDerWaalsContact CD2-C 3.43Å; L2061-F2067 HydrophobicContact CD2-CB 3.59Å; L2061-F2067 WeakPolarHBondContact CD2-O 3.22Å; S2065-F2067 PolarHBondContact O-N 2.76Å; F2067-T2069 PolarHBondContact O-N 2.86Å; F2067-Q2073 PolarHBondContact O-OE1 2.84Å
2068	H	39.6	Very low	47.1	Very low	51 Å²	51	38.5 Å²	38.5	24%	0.236	22%	0.216	C	C	.	.			trans	-77.9	101.8	-177.1	171.8	-70.3	0	0	0	112.2	L2061 S2062 S2065	L2061-H2068 HydrophobicContact CB-CB 4.17Å; L2061-H2068 PolarHBondContact O-CD2 3.42Å; S2062-H2068 WeakPolarHBondContact O-CB 3.46Å; S2062-H2068 PolarHBondContact O-CD2 2.8Å; S2065-H2068 WeakPolarHBondContact O-CB 3.01Å; S2065-H2068 PolarHBondContact O-N 3.17Å; S2065-H2068 VanDerWaalsContact O-N 3.09Å
2069	T	40.1	Very low	46.3	Very low	30 Å²	30	39.7 Å²	39.7	18%	0.184	22%	0.22	C	C	.	.			trans	-93.2	168	164.5	75.9	0	0	0	0	111.1	F2067 S2071 Q2073	F2067-T2069 PolarHBondContact O-N 2.86Å; T2069-S2071 PolarHBondContact O-N 2.68Å; T2069-S2071 PolarHBondContact OG1-N 2.92Å; T2069-S2071 PolarHBondContact OG1-OG 2.88Å; T2069-Q2073 PolarHBondContact OG1-OE1 2.88Å
2070	S	41.5	Very low	45.5	Very low	35 Å²	35	38.8 Å²	38.8	25%	0.245	22%	0.217	C	C	.	.	S	Bend	trans	-79.5	8.6	176.5	61.2	0	0	0	0	115.1	C1835 L1836	C1835-S2070 WeakPolarHBondContact CB-OG 3.46Å; C1835-S2070 PolarHBondContact O-OG 3.25Å; L1836-S2070 PolarHBondContact O-OG 2.76Å
2071	S	40.1	Very low	45	Very low	32 Å²	32	37.8 Å²	37.8	22%	0.224	21%	0.211	C	C	.	.	S	Bend	trans	-88.2	150	160.7	69.2	0	0	0	0	109.8	T2069 Q2073	T2069-S2071 PolarHBondContact O-N 2.68Å; T2069-S2071 PolarHBondContact OG1-N 2.92Å; T2069-S2071 PolarHBondContact OG1-OG 2.88Å; S2071-Q2073 PolarHBondContact O-N 2.78Å
2072	T	42.6	Very low	44.3	Very low	84 Å²	84	42.1 Å²	42.1	52%	0.515	24%	0.238	S	C	.	.			trans	-73.4	74.2	-175.6	52.7	0	0	0	0	112.3	W2074	T2072-W2074 VanDerWaalsContact O-CD1 3.25Å
2073	Q	52.2	Low	43.8	Very low	21 Å²	21	45.6 Å²	45.6	10%	0.098	26%	0.257	C	S	.	.			trans	-76.8	131.2	172.4	-70.3	166	-49.5	0	0	109.7	L2061 F2067 T2069 S2071	L2061-Q2073 HydrophobicContact CD1-CB 3.95Å; L2061-Q2073 VanDerWaalsContact CD1-O 3.25Å; L2061-Q2073 WeakPolarHBondContact CD1-O 3.5Å; F2067-Q2073 PolarHBondContact O-OE1 2.84Å; T2069-Q2073 PolarHBondContact OG1-OE1 2.88Å; S2071-Q2073 PolarHBondContact O-N 2.78Å
2074	W	57.7	Low	43.9	Very low	36 Å²	36	44.3 Å²	44.3	14%	0.136	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	143.6	172.7	-62.5	76.1	0	0	0	108.1	I1970 L1972 A1996 L2058 E2059 T2072	I1970-W2074 HydrophobicContact CB-CB 4.45Å; I1970-W2074 WeakPolarHBondContact CB-O 3.4Å; I1970-W2074 PolarHBondContact N-O 2.84Å; I1970-W2074 PolarHBondContact O-N 2.82Å; L1972-W2074 HydrophobicContact CD1-CG 4.45Å; A1996-W2074 HydrophobicContact CB-CH2 3.72Å; A1996-W2074 HydrophobicContact CB-CZ2 4.3Å; A1996-W2074 HydrophobicContact CB-CZ3 4.09Å; L2058-W2074 HydrophobicContact CD1-CB 3.96Å; L2058-W2074 HydrophobicContact CD2-CB 4.39Å; L2058-W2074 HydrophobicContact CD2-CD2 4.03Å; L2058-W2074 HydrophobicContact CD2-CE3 3.81Å; L2058-W2074 HydrophobicContact CD2-CG 4.3Å; L2058-W2074 HydrophobicContact CD2-CZ3 4.44Å; L2058-W2074 HydrophobicContact CG-CB 4.06Å; L2058-W2074 HydrophobicContact CG-CD2 4.23Å; L2058-W2074 HydrophobicContact CG-CE3 3.77Å; L2058-W2074 HydrophobicContact CG-CG 4.39Å; E2059-W2074 CarbonylContact O-C 3.58Å; E2059-W2074 WeakPolarHBondContact O-CA 3.43Å; T2072-W2074 VanDerWaalsContact O-CD1 3.25Å
2075	Q	59.5	Low	43.6	Very low	5 Å²	5	47.1 Å²	47.1	2%	0.023	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.7	165.7	45.6	175.3	30.5	0	0	106.8	F1968 E2059 L2061 V2077	F1968-Q2075 CarbonylContact O-C 3.59Å; F1968-Q2075 WeakPolarHBondContact O-CA 3.32Å; E2059-Q2075 HydrophobicContact CB-CG 4.02Å; E2059-Q2075 PolarHBondContact N-O 3.35Å; E2059-Q2075 WeakPolarHBondContact O-CG 3.45Å; E2059-Q2075 PolarHBondContact O-N 2.82Å; E2059-Q2075 PolarHBondContact OE2-NE2 3.01Å; L2061-Q2075 HydrophobicContact CD1-CB 3.8Å; L2061-Q2075 HydrophobicContact CD1-CG 3.79Å; L2061-Q2075 HydrophobicContact CG-CB 4.32Å; L2061-Q2075 HydrophobicContact CG-CG 4.02Å; Q2075-V2077 HydrophobicContact CB-CG2 3.89Å; Q2075-V2077 HydrophobicContact CG-CG2 3.45Å; Q2075-V2077 VanDerWaalsContact CG-CG2 3.45Å; Q2075-V2077 WeakPolarHBondContact O-CG2 3.46Å; Q2075-V2077 PolarHBondContact O-N 2.8Å
2076	C	63.3	Low	43.3	Very low	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	115	158.5	175.6	0	0	0	0	107.7	R1967 F1968 I1970 C2000 L2058 L2103	R1967-C2076 WeakPolarHBondContact CA-O 3.5Å; F1968-C2076 HydrophobicContact CB-CB 4.31Å; F1968-C2076 PolarHBondContact N-O 2.8Å; F1968-C2076 PolarHBondContact O-N 3.11Å; I1970-C2076 HydrophobicContact CD1-CB 3.62Å; C2000-C2076 HydrophobicContact CB-CB 3.66Å; C2000-C2076 WeakPolarHBondContact CB-SG 3.32Å; C2000-C2076 WeakPolarHBondContact SG-CB 3.18Å; C2000-C2076 CovalentContact SG-SG 2.02Å; C2000-C2076 PolarHBondContact SG-SG 2.85Å; L2058-C2076 HydrophobicContact CD1-CB 4.28Å; C2076-L2103 HydrophobicContact CB-CD2 4.21Å
2077	V	59.2	Low	43.2	Very low	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.7	-173.1	-169.1	0	0	0	0	108.4	I1965 T2056 Q2057 E2059 Q2075 K2079	I1965-V2077 HydrophobicContact CB-CG1 4.45Å; I1965-V2077 HydrophobicContact CG1-CG1 4.3Å; I1965-V2077 HydrophobicContact CG2-CG1 3.39Å; T2056-V2077 WeakPolarHBondContact CA-O 3.07Å; Q2057-V2077 PolarHBondContact N-O 3.47Å; Q2057-V2077 WeakPolarHBondContact O-CA 3.48Å; Q2057-V2077 WeakPolarHBondContact O-CB 3.37Å; Q2057-V2077 PolarHBondContact O-N 3.5Å; E2059-V2077 HydrophobicContact CB-CG2 3.81Å; E2059-V2077 VanDerWaalsContact CD-CG2 3.4Å; E2059-V2077 HydrophobicContact CG-CB 4.14Å; E2059-V2077 HydrophobicContact CG-CG2 3.7Å; E2059-V2077 WeakPolarHBondContact OE2-CG2 3.44Å; Q2075-V2077 HydrophobicContact CB-CG2 3.89Å; Q2075-V2077 HydrophobicContact CG-CG2 3.45Å; Q2075-V2077 VanDerWaalsContact CG-CG2 3.45Å; Q2075-V2077 WeakPolarHBondContact O-CG2 3.46Å; Q2075-V2077 PolarHBondContact O-N 2.8Å; V2077-K2079 HydrophobicContact CG1-CD 4.4Å; V2077-K2079 HydrophobicContact CG1-CG 3.98Å; V2077-K2079 PolarHBondContact O-N 2.84Å
2078	I	57.1	Low	42.8	Very low	10 Å²	10	52.4 Å²	52.4	5%	0.051	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	96.8	175.5	-60.4	-170.6	0	0	0	106.1	I1965 L1966 F1968 I2002 I2054 M2101 L2103	I1965-I2078 WeakPolarHBondContact CA-O 3.26Å; L1966-I2078 HydrophobicContact CB-CB 3.67Å; L1966-I2078 HydrophobicContact CB-CD1 3.98Å; L1966-I2078 HydrophobicContact CB-CG1 4.14Å; L1966-I2078 HydrophobicContact CB-CG2 4.09Å; L1966-I2078 PolarHBondContact N-O 2.73Å; L1966-I2078 PolarHBondContact O-N 2.79Å; F1968-I2078 HydrophobicContact CD2-CD1 4.11Å; F1968-I2078 HydrophobicContact CD2-CG1 4.47Å; F1968-I2078 HydrophobicContact CE2-CD1 3.59Å; F1968-I2078 HydrophobicContact CE2-CG1 4.34Å; I2002-I2078 HydrophobicContact CD1-CD1 3.84Å; I2002-I2078 HydrophobicContact CD1-CG1 4.07Å; I2002-I2078 HydrophobicContact CD1-CG2 4.05Å; I2002-I2078 HydrophobicContact CG1-CD1 4.15Å; I2054-I2078 HydrophobicContact CG2-CG2 3.3Å; I2078-M2101 HydrophobicContact CD1-CE 3.88Å; I2078-M2101 HydrophobicContact CG2-CE 4.36Å; I2078-L2103 HydrophobicContact CD1-CD1 3.91Å; I2078-L2103 HydrophobicContact CG1-CD1 4.37Å
2079	K	46.4	Very low	42.2	Very low	51 Å²	51	56.9 Å²	56.9	22%	0.222	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	148.7	179.4	-88.9	167.6	164.6	166.7	0	111.7	I1965 T2055 E2059 V2077	I1965-K2079 HydrophobicContact CD1-CG 3.88Å; I1965-K2079 HydrophobicContact CG1-CG 3.73Å; T2055-K2079 PolarHBondContact N-O 2.61Å; T2055-K2079 PolarHBondContact O-N 3.12Å; T2055-K2079 VanDerWaalsContact OG1-CB 3.27Å; T2055-K2079 WeakPolarHBondContact OG1-CB 3.5Å; T2055-K2079 PolarHBondContact OG1-O 3.06Å; T2055-K2079 VanDerWaalsContact OG1-O 3.07Å; E2059-K2079 WeakPolarHBondContact OE1-CE 3.11Å; E2059-K2079 IonicContact OE1-NZ 3.45Å; E2059-K2079 PolarHBondContact OE1-NZ 3.46Å; V2077-K2079 HydrophobicContact CG1-CD 4.4Å; V2077-K2079 HydrophobicContact CG1-CG 3.98Å; V2077-K2079 PolarHBondContact O-N 2.84Å
2080	S	41.5	Very low	41.7	Very low	14 Å²	14	57.4 Å²	57.4	10%	0.098	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-79.1	150.5	152.2	41.6	0	0	0	0	109.9
2081	P	37.8	Very low	41	Very low	32 Å²	32	60.1 Å²	60.1	21%	0.208	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-65.3	143.6	179.8	27.1	-34.7	0	0	0	111.6	T2083 W2084	P2081-T2083 PolarHBondContact O-N 3.21Å; P2081-T2083 VanDerWaalsContact O-N 3.15Å; P2081-W2084 HydrophobicContact CG-CD2 4.38Å; P2081-W2084 HydrophobicContact CG-CH2 4.42Å; P2081-W2084 HydrophobicContact CG-CZ2 4.01Å
2082	T	33.5	Very low	40.6	Very low	107 Å²	107	61.9 Å²	61.9	66%	0.656	35%	0.351	S	S	*	.	S	Bend	trans	-71.2	-6.8	-174.3	45.9	0	0	0	0	114.7	W2084	T2082-W2084 PolarHBondContact O-N 2.93Å; T2082-W2084 VanDerWaalsContact O-N 3.17Å
2083	T	32.9	Very low	40.2	Very low	118 Å²	118	62.5 Å²	62.5	72%	0.724	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	22.2	-176.1	56.2	0	0	0	0	114.3	P2081	P2081-T2083 PolarHBondContact O-N 3.21Å; P2081-T2083 VanDerWaalsContact O-N 3.15Å
2084	W	40	Very low	39.4	Very low	102 Å²	102	67.9 Å²	67.9	39%	0.386	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	16.3	179.3	-67.6	-17.2	0	0	0	113.2	P2081 T2082 L2086 I2091	P2081-W2084 HydrophobicContact CG-CD2 4.38Å; P2081-W2084 HydrophobicContact CG-CH2 4.42Å; P2081-W2084 HydrophobicContact CG-CZ2 4.01Å; T2082-W2084 PolarHBondContact O-N 2.93Å; T2082-W2084 VanDerWaalsContact O-N 3.17Å; W2084-L2086 PolarHBondContact O-N 3.1Å; W2084-I2091 HydrophobicContact CD2-CD1 4Å; W2084-I2091 HydrophobicContact CE3-CD1 3.85Å; W2084-I2091 HydrophobicContact CH2-CD1 3.72Å; W2084-I2091 HydrophobicContact CZ2-CD1 3.86Å; W2084-I2091 HydrophobicContact CZ3-CD1 3.71Å
2085	S	29.2	Very low	38.6	Very low	97 Å²	97	68.3 Å²	68.3	68%	0.678	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	92.8	-174	58.5	0	0	0	0	113.6
2086	L	28.2	Very low	37.7	Very low	145 Å²	145	75.1 Å²	75.1	76%	0.759	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-172.4	-48.6	140.7	-105.5	155.3	0	0	0	111.9	W2084	W2084-L2086 PolarHBondContact O-N 3.1Å
2087	N	28	Very low	36.5	Very low	68 Å²	68	80.7 Å²	80.7	36%	0.364	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	7.1	-163.6	-66.8	-1.7	0	0	0	116.4	E2032	E2032-N2087 HydrophobicContact CB-CB 3.9Å; E2032-N2087 HydrophobicContact CG-CB 3.89Å; E2032-N2087 VanDerWaalsContact OE1-CG 3.27Å; E2032-N2087 PolarHBondContact OE1-ND2 3.06Å
2088	V	28.6	Very low	35.7	Very low	63 Å²	63	85.1 Å²	85.1	38%	0.382	48%	0.479	S	S	.	.			trans	-128.3	81.7	-166.1	-166.7	0	0	0	0	115.1	A2090 I2091	V2088-A2090 HydrophobicContact CG1-CB 4.03Å; V2088-A2090 PolarHBondContact O-N 3.23Å; V2088-I2091 HydrophobicContact CG1-CD1 4.46Å; V2088-I2091 HydrophobicContact CG1-CG1 4.2Å
2089	D	26.7	Very low	35.2	Very low	144 Å²	144	85.2 Å²	85.2	77%	0.77	48%	0.48	S	S	*	.			trans	-79	10.7	166	-103.9	-13.7	0	0	0	113
2090	A	28.9	Very low	35.6	Very low	42 Å²	42	87.1 Å²	87.1	35%	0.347	49%	0.486	S	S	.	.			trans	-98.4	-0.3	-158	0	0	0	0	0	116.5	V2088 R2135	V2088-A2090 HydrophobicContact CG1-CB 4.03Å; V2088-A2090 PolarHBondContact O-N 3.23Å; A2090-R2135 VanDerWaalsContact C-NH1 3.32Å; A2090-R2135 PolarHBondContact O-NH1 2.95Å
2091	I	28.3	Very low	36.6	Very low	92 Å²	92	87.4 Å²	87.4	47%	0.472	49%	0.485	S	S	.	.			trans	-87.6	124.6	-173.2	-60	174.7	0	0	0	112.2	W2084 V2088	W2084-I2091 HydrophobicContact CD2-CD1 4Å; W2084-I2091 HydrophobicContact CE3-CD1 3.85Å; W2084-I2091 HydrophobicContact CH2-CD1 3.72Å; W2084-I2091 HydrophobicContact CZ2-CD1 3.86Å; W2084-I2091 HydrophobicContact CZ3-CD1 3.71Å; V2088-I2091 HydrophobicContact CG1-CD1 4.46Å; V2088-I2091 HydrophobicContact CG1-CG1 4.2Å
2092	S	31.9	Very low	38	Very low	68 Å²	68	86.1 Å²	86.1	48%	0.476	48%	0.477	S	S	.	.			trans	-129.3	118.3	173.8	55.6	0	0	0	0	111.4	T2094	S2092-T2094 PolarHBondContact O-N 3.14Å
2093	L	34.1	Very low	39.7	Very low	97 Å²	97	81.2 Å²	81.2	51%	0.508	45%	0.447	S	S	.	.			trans	-71.1	95.7	-178.6	-86.6	162.8	0	0	0	112.4	L2050 L2095	L2050-L2093 HydrophobicContact CD2-CD2 4.07Å; L2093-L2095 PolarHBondContact O-N 2.84Å; L2093-L2095 VanDerWaalsContact O-N 3.07Å
2094	T	34.3	Very low	41.7	Very low	135 Å²	135	77 Å²	77	83%	0.828	42%	0.419	S	S	*	.			trans	-78.5	81.9	169.7	50.5	0	0	0	0	111	S2092	S2092-T2094 PolarHBondContact O-N 3.14Å
2095	L	42.5	Very low	43.3	Very low	45 Å²	45	72.4 Å²	72.4	24%	0.236	40%	0.402	C	S	.	.			trans	-73.5	147.4	170.8	-70.5	164.6	0	0	0	110.9	L2050 L2093 T2099 P2130	L2050-L2095 HydrophobicContact CD1-CD2 4.17Å; L2093-L2095 PolarHBondContact O-N 2.84Å; L2093-L2095 VanDerWaalsContact O-N 3.07Å; L2095-T2099 HydrophobicContact CD2-CG2 4.39Å; L2095-P2130 HydrophobicContact CB-CB 4.32Å; L2095-P2130 HydrophobicContact CB-CG 3.64Å; L2095-P2130 HydrophobicContact CD1-CB 4.03Å; L2095-P2130 HydrophobicContact CD1-CG 3.8Å; L2095-P2130 HydrophobicContact CG-CG 4.36Å
2096	M	39.6	Very low	45.2	Very low	148 Å²	148	68.5 Å²	68.5	73%	0.729	37%	0.374	S	S	*	.			trans	-66.1	148	176.6	-75.5	-84	-174.5	0	0	111	K2098 T2099	M2096-K2098 PolarHBondContact O-N 2.92Å; M2096-T2099 WeakPolarHBondContact CA-OG1 2.98Å; M2096-T2099 WeakPolarHBondContact CB-OG1 3.39Å; M2096-T2099 PolarHBondContact N-OG1 2.85Å; M2096-T2099 PolarHBondContact O-N 3.25Å; M2096-T2099 PolarHBondContact O-OG1 2.96Å
2097	P	38.3	Very low	46.8	Very low	116 Å²	116	65.3 Å²	65.3	75%	0.753	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	10.7	-176	28.7	-36.3	0	0	0	115.8
2098	K	41.7	Very low	48.1	Very low	93 Å²	93	63.8 Å²	63.8	40%	0.404	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	8.2	167.3	-80.3	-161.4	-175.5	167.3	0	113.8	F2010 M2096 R2100	F2010-K2098 HydrophobicContact CD2-CD 3.54Å; F2010-K2098 HydrophobicContact CD2-CG 4.26Å; F2010-K2098 HydrophobicContact CE2-CD 3.6Å; F2010-K2098 HydrophobicContact CE2-CG 4.07Å; F2010-K2098 HydrophobicContact CG-CD 4.49Å; M2096-K2098 PolarHBondContact O-N 2.92Å; K2098-R2100 PolarHBondContact O-N 2.81Å
2099	T	47.4	Very low	49.1	Very low	12 Å²	12	67.6 Å²	67.6	7%	0.074	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	115	176.9	-17.7	0	0	0	0	109.5	L2004 I2006 L2095 M2096 P2130	L2004-T2099 HydrophobicContact CD2-CG2 4.13Å; I2006-T2099 HydrophobicContact CG1-CG2 4.05Å; L2095-T2099 HydrophobicContact CD2-CG2 4.39Å; M2096-T2099 WeakPolarHBondContact CA-OG1 2.98Å; M2096-T2099 WeakPolarHBondContact CB-OG1 3.39Å; M2096-T2099 PolarHBondContact N-OG1 2.85Å; M2096-T2099 PolarHBondContact O-N 3.25Å; M2096-T2099 PolarHBondContact O-OG1 2.96Å; T2099-P2130 WeakPolarHBondContact O-CD 3.17Å
2100	R	53.9	Low	49.8	Very low	92 Å²	92	67.2 Å²	67.2	35%	0.347	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.1	167.5	-73.6	-176.6	176.1	133.3	6	109.3	Q2005 D2007 K2098 L2129	Q2005-R2100 HydrophobicContact CB-CB 4.25Å; Q2005-R2100 PolarHBondContact N-O 2.76Å; Q2005-R2100 PolarHBondContact O-N 2.88Å; D2007-R2100 IonicContact OD1-CZ 2.99Å; D2007-R2100 IonicContact OD1-NH1 3.69Å; D2007-R2100 PolarHBondContact OD1-NH1 3.23Å; D2007-R2100 IonicContact OD2-CZ 2.69Å; D2007-R2100 IonicContact OD2-NH1 3.64Å; D2007-R2100 PolarHBondContact OD2-NH1 2.81Å; D2007-R2100 IonicContact OD2-NH2 3.83Å; D2007-R2100 PolarHBondContact OD2-NH2 2.9Å; K2098-R2100 PolarHBondContact O-N 2.81Å; R2100-L2129 HydrophobicContact CG-CD1 4.42Å
2101	M	62.1	Low	50.1	Low	19 Å²	19	70.1 Å²	70.1	9%	0.094	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	104.2	174.8	179.4	-178.8	-171	0	0	108.4	I2002 L2004 I2054 I2078 S2127 L2128	I2002-M2101 HydrophobicContact CD1-CE 3.57Å; I2002-M2101 HydrophobicContact CG1-CE 4Å; I2002-M2101 HydrophobicContact CG2-CE 4.03Å; I2002-M2101 HydrophobicContact CG2-CG 3.95Å; L2004-M2101 HydrophobicContact CD2-CB 3.82Å; L2004-M2101 HydrophobicContact CD2-CG 4.02Å; I2054-M2101 HydrophobicContact CD1-CE 4.41Å; I2078-M2101 HydrophobicContact CD1-CE 3.88Å; I2078-M2101 HydrophobicContact CG2-CE 4.36Å; M2101-S2127 CarbonylContact O-C 3.48Å; M2101-L2128 HydrophobicContact CB-CB 4.09Å; M2101-L2128 HydrophobicContact CB-CD1 4.5Å; M2101-L2128 HydrophobicContact CG-CD1 4.22Å; M2101-L2128 PolarHBondContact N-O 3Å; M2101-L2128 WeakPolarHBondContact O-CB 3.32Å; M2101-L2128 PolarHBondContact O-N 2.85Å; M2101-L2128 HydrophobicContact SD-CD1 4.4Å
2102	I	68.5	Low	50.2	Low	6 Å²	6	69.1 Å²	69.1	3%	0.031	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	142	179.6	-51.6	173.7	0	0	0	108.4	I2002 Q2003 Q2005 Q2104 Q2125 T2126	I2002-I2102 CarbonylContact C-O 3.15Å; I2002-I2102 VanDerWaalsContact CA-O 3.26Å; I2002-I2102 WeakPolarHBondContact CA-O 3.27Å; Q2003-I2102 HydrophobicContact CB-CB 4.19Å; Q2003-I2102 PolarHBondContact N-O 3.06Å; Q2003-I2102 WeakPolarHBondContact O-CA 3.31Å; Q2003-I2102 WeakPolarHBondContact O-CB 3.19Å; Q2003-I2102 PolarHBondContact O-N 3.33Å; Q2005-I2102 HydrophobicContact CB-CD1 3.85Å; Q2005-I2102 HydrophobicContact CB-CG1 4.41Å; I2102-Q2104 HydrophobicContact CG2-CG 4.09Å; I2102-Q2125 VanDerWaalsContact CG2-CD 3.49Å; I2102-Q2125 HydrophobicContact CG2-CG 3.47Å; I2102-Q2125 VanDerWaalsContact CG2-CG 3.47Å; I2102-T2126 WeakPolarHBondContact CA-O 3.12Å; I2102-T2126 WeakPolarHBondContact CG2-O 3.46Å
2103	L	69.5	Low	50	Low	4 Å²	4	73.2 Å²	73.2	2%	0.021	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134.5	168.1	-161.6	89.3	0	0	0	109.2	I1933 F1968 Q2001 I2002 C2076 I2078 Q2125 T2126	I1933-L2103 HydrophobicContact CD1-CD2 4.06Å; F1968-L2103 HydrophobicContact CB-CD2 3.63Å; F1968-L2103 HydrophobicContact CD1-CD2 4.09Å; F1968-L2103 HydrophobicContact CD2-CD1 4.18Å; F1968-L2103 HydrophobicContact CD2-CD2 3.78Å; F1968-L2103 HydrophobicContact CE2-CD1 4.48Å; F1968-L2103 HydrophobicContact CG-CD2 3.52Å; Q2001-L2103 WeakPolarHBondContact O-CA 3.1Å; I2002-L2103 HydrophobicContact CG1-CD1 3.94Å; C2076-L2103 HydrophobicContact CB-CD2 4.21Å; I2078-L2103 HydrophobicContact CD1-CD1 3.91Å; I2078-L2103 HydrophobicContact CG1-CD1 4.37Å; L2103-Q2125 VanDerWaalsContact O-CA 3.3Å; L2103-Q2125 WeakPolarHBondContact O-CA 3.45Å; L2103-T2126 HydrophobicContact CB-CG2 3.66Å; L2103-T2126 HydrophobicContact CD2-CG2 4.17Å; L2103-T2126 PolarHBondContact N-O 3.09Å; L2103-T2126 PolarHBondContact O-N 3.06Å
2104	Q	74.1	Confident	49.8	Very low	29 Å²	29	76.4 Å²	76.4	14%	0.136	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.5	-177.9	-74.2	167.8	-22.6	0	0	110.8	C2000 Q2001 I2102 V2106 L2122 Q2125	C2000-Q2104 CarbonylContact C-O 3.17Å; C2000-Q2104 WeakPolarHBondContact CA-O 3.38Å; Q2001-Q2104 PolarHBondContact N-O 3.03Å; Q2001-Q2104 PolarHBondContact O-N 3.32Å; I2102-Q2104 HydrophobicContact CG2-CG 4.09Å; Q2104-V2106 HydrophobicContact CB-CG2 4.32Å; Q2104-L2122 HydrophobicContact CB-CD1 3.85Å; Q2104-L2122 HydrophobicContact CG-CD1 3.82Å; Q2104-Q2125 HydrophobicContact CG-CG 4.07Å
2105	L	72.7	Confident	49.6	Very low	6 Å²	6	77.8 Å²	77.8	3%	0.031	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.8	169.4	-173.9	64.5	0	0	0	108.7	V1935 I1970 L1972 F1998 L2058 I2123 A2124	V1935-L2105 HydrophobicContact CG1-CD2 4.42Å; V1935-L2105 HydrophobicContact CG2-CD2 3.88Å; I1970-L2105 HydrophobicContact CD1-CD1 4.15Å; I1970-L2105 HydrophobicContact CD1-CD2 4.48Å; I1970-L2105 HydrophobicContact CG2-CD2 3.63Å; L1972-L2105 HydrophobicContact CD2-CD2 4.4Å; F1998-L2105 HydrophobicContact CB-CD1 4.16Å; L2058-L2105 HydrophobicContact CD1-CD1 4.26Å; L2105-I2123 HydrophobicContact CB-CB 4.44Å; L2105-I2123 HydrophobicContact CD2-CB 4.42Å; L2105-I2123 HydrophobicContact CD2-CG2 4.2Å; L2105-I2123 HydrophobicContact CG-CB 4.32Å; L2105-I2123 HydrophobicContact CG-CD1 4.27Å; L2105-I2123 WeakPolarHBondContact O-CB 3.04Å; L2105-I2123 PolarHBondContact O-N 3.1Å; L2105-A2124 HydrophobicContact CB-CB 4.31Å; L2105-A2124 PolarHBondContact N-O 3.06Å
2106	V	70.1	Confident	48.9	Very low	14 Å²	14	84.9 Å²	84.9	9%	0.085	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.2	-169.5	-175.2	0	0	0	0	110.8	F1998 K1999 Q2104 L2122	F1998-V2106 WeakPolarHBondContact CA-O 3.49Å; K1999-V2106 PolarHBondContact N-O 3.31Å; K1999-V2106 PolarHBondContact O-N 3.32Å; Q2104-V2106 HydrophobicContact CB-CG2 4.32Å; V2106-L2122 HydrophobicContact CG2-CD1 4.29Å
2107	K	61.2	Low	48.3	Very low	79 Å²	79	80.7 Å²	80.7	34%	0.343	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	132.1	176.3	-153.7	179.6	-178.9	-173.4	0	110.7	P1997 F1998 S2121 I2123	P1997-K2107 WeakPolarHBondContact O-CA 3.49Å; F1998-K2107 HydrophobicContact CD1-CG 4.39Å; F1998-K2107 HydrophobicContact CE1-CG 4.19Å; K2107-S2121 WeakPolarHBondContact CB-OG 3.2Å; K2107-S2121 PolarHBondContact N-O 3.08Å; K2107-I2123 HydrophobicContact CB-CD1 3.77Å; K2107-I2123 HydrophobicContact CB-CG1 4.18Å; K2107-I2123 HydrophobicContact CG-CD1 4.33Å
2108	T	55.4	Low	48.1	Very low	36 Å²	36	84.3 Å²	84.3	22%	0.221	46%	0.456	C	S	.	.			trans	-113	112.4	171.2	53.2	0	0	0	0	110	P1997 K1999	P1997-T2108 PolarHBondContact O-N 2.81Å; P1997-T2108 PolarHBondContact O-OG1 3.42Å; K1999-T2108 HydrophobicContact CB-CG2 4.47Å; K1999-T2108 HydrophobicContact CD-CG2 3.8Å; K1999-T2108 HydrophobicContact CG-CG2 3.87Å
2109	H	49	Very low	47.8	Very low	142 Å²	142	86.9 Å²	86.9	66%	0.657	47%	0.474	S	S	*	.			trans	-70.3	128.6	169.6	-87.8	-109.3	0	0	0	109.9
2110	V	42.8	Very low	47.8	Very low	136 Å²	136	90.3 Å²	90.3	82%	0.824	50%	0.499	S	S	*	.			trans	-118.4	82.3	177	-174.6	0	0	0	0	108.6
2111	S	34.9	Very low	47.9	Very low	104 Å²	104	88.6 Å²	88.6	73%	0.727	50%	0.501	S	S	*	.			trans	-106.9	134.7	164.4	48.8	0	0	0	0	108.5
2112	G	29.5	Very low	47.6	Very low	70 Å²	70	90.9 Å²	90.9	72%	0.722	51%	0.513	S	S	*	.	S	Bend	trans	-69.8	136.6	-173.1	0	0	0	0	0	113.7
2113	N	27.7	Very low	47.3	Very low	155 Å²	155	92.2 Å²	92.2	83%	0.829	52%	0.52	S	S	*	.	S	Bend	trans	72.5	139.3	168.4	-55.8	-24.5	0	0	0	118.1
2114	I	31	Very low	46.8	Very low	164 Å²	164	92.2 Å²	92.2	84%	0.841	52%	0.52	S	S	*	.			trans	81.4	140.8	163.8	-58.3	159.3	0	0	0	116.4
2115	E	28.8	Very low	46.3	Very low	164 Å²	164	93.3 Å²	93.3	77%	0.766	53%	0.526	S	S	*	.			trans	-57	165.2	-172	-54.7	166	155.2	0	0	115.9
2116	Q	28.1	Very low	45.7	Very low	193 Å²	193	93.1 Å²	93.1	90%	0.902	53%	0.525	S	S	*	.			trans	72.1	143.9	-178.9	-46.3	169.6	24.7	0	0	112.6
2117	G	28.5	Very low	45	Very low	61 Å²	61	93.7 Å²	93.7	63%	0.629	53%	0.529	S	S	*	.			cis	161.2	123.6	-1.4	0	0	0	0	0	108.8
2118	E	32.7	Very low	44.6	Very low	191 Å²	191	90.3 Å²	90.3	89%	0.893	52%	0.515	S	S	*	.			trans	65.4	174.6	-178.6	-51.7	-173.7	144.1	0	0	115.7
2119	N	36.8	Very low	44	Very low	148 Å²	148	91.5 Å²	91.5	79%	0.791	52%	0.52	S	S	*	.			trans	73.1	36.5	176.9	-56.3	-44.5	0	0	0	119.6	S2121	N2119-S2121 PolarHBondContact O-N 2.9Å
2120	S	45.6	Very low	43.7	Very low	83 Å²	83	86 Å²	86	58%	0.58	50%	0.496	S	S	*	.			trans	-80.4	106.5	156.6	58.2	0	0	0	0	110.7	L2122	S2120-L2122 PolarHBondContact O-N 2.85Å
2121	S	55.9	Low	43.4	Very low	56 Å²	56	83.9 Å²	83.9	39%	0.392	48%	0.48	S	S	.	.			trans	-73.4	127.1	-176.9	59.6	0	0	0	0	112.5	K2107 N2119	K2107-S2121 WeakPolarHBondContact CB-OG 3.2Å; K2107-S2121 PolarHBondContact N-O 3.08Å; N2119-S2121 PolarHBondContact O-N 2.9Å
2122	L	57.6	Low	43.2	Very low	67 Å²	67	85.1 Å²	85.1	35%	0.351	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	134.3	162.8	-178.7	71.2	0	0	0	108.9	V1941 Q2104 V2106 S2120	V1941-L2122 HydrophobicContact CG1-CD2 4.21Å; Q2104-L2122 HydrophobicContact CB-CD1 3.85Å; Q2104-L2122 HydrophobicContact CG-CD1 3.82Å; V2106-L2122 HydrophobicContact CG2-CD1 4.29Å; S2120-L2122 PolarHBondContact O-N 2.85Å
2123	I	61.5	Low	43.5	Very low	34 Å²	34	84.9 Å²	84.9	17%	0.174	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-45.9	-174.9	-61.1	163.1	0	0	0	111.2	V1935 F1998 L2105 K2107	V1935-I2123 HydrophobicContact CB-CG2 4.39Å; V1935-I2123 HydrophobicContact CG1-CG2 3.13Å; F1998-I2123 HydrophobicContact CD1-CD1 3.33Å; F1998-I2123 HydrophobicContact CE1-CD1 3.54Å; L2105-I2123 HydrophobicContact CB-CB 4.44Å; L2105-I2123 HydrophobicContact CD2-CB 4.42Å; L2105-I2123 HydrophobicContact CD2-CG2 4.2Å; L2105-I2123 HydrophobicContact CG-CB 4.32Å; L2105-I2123 HydrophobicContact CG-CD1 4.27Å; L2105-I2123 WeakPolarHBondContact O-CB 3.04Å; L2105-I2123 PolarHBondContact O-N 3.1Å; K2107-I2123 HydrophobicContact CB-CD1 3.77Å; K2107-I2123 HydrophobicContact CB-CG1 4.18Å; K2107-I2123 HydrophobicContact CG-CD1 4.33Å
2124	A	59.3	Low	43.7	Very low	4 Å²	4	79.3 Å²	79.3	3%	0.033	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.6	179.1	0	0	0	0	0	110.9	I1933 V1935 L2105	I1933-A2124 HydrophobicContact CG2-CB 3.72Å; V1935-A2124 HydrophobicContact CG2-CB 4.12Å; L2105-A2124 HydrophobicContact CB-CB 4.31Å; L2105-A2124 PolarHBondContact N-O 3.06Å
2125	Q	64.3	Low	43.8	Very low	53 Å²	53	77.2 Å²	77.2	25%	0.248	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	141	178.2	-173.6	170.1	-55.2	0	0	111.7	S1944 I2102 L2103 Q2104	S1944-Q2125 PolarHBondContact OG-O 3.04Å; S1944-Q2125 VanDerWaalsContact OG-O 3.05Å; I2102-Q2125 VanDerWaalsContact CG2-CD 3.49Å; I2102-Q2125 HydrophobicContact CG2-CG 3.47Å; I2102-Q2125 VanDerWaalsContact CG2-CG 3.47Å; L2103-Q2125 VanDerWaalsContact O-CA 3.3Å; L2103-Q2125 WeakPolarHBondContact O-CA 3.45Å; Q2104-Q2125 HydrophobicContact CG-CG 4.07Å
2126	T	58.8	Low	44	Very low	2 Å²	2	71.2 Å²	71.2	1%	0.012	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	167.9	168.6	-166.4	0	0	0	0	110.8	I1933 S1944 F1968 I2102 L2103	I1933-T2126 HydrophobicContact CD1-CG2 3.86Å; S1944-T2126 WeakPolarHBondContact OG-CA 3.48Å; S1944-T2126 WeakPolarHBondContact OG-CB 3.37Å; S1944-T2126 PolarHBondContact OG-OG1 2.83Å; F1968-T2126 HydrophobicContact CD1-CG2 4.22Å; F1968-T2126 HydrophobicContact CE1-CG2 4.4Å; I2102-T2126 WeakPolarHBondContact CA-O 3.12Å; I2102-T2126 WeakPolarHBondContact CG2-O 3.46Å; L2103-T2126 HydrophobicContact CB-CG2 3.66Å; L2103-T2126 HydrophobicContact CD2-CG2 4.17Å; L2103-T2126 PolarHBondContact N-O 3.09Å; L2103-T2126 PolarHBondContact O-N 3.06Å
2127	S	54.9	Low	44.4	Very low	25 Å²	25	64.9 Å²	64.9	18%	0.175	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	147.9	-178	66.5	0	0	0	0	112.6	S1946 I1947 M2101	S1946-S2127 CarbonylContact C-O 3.24Å; S1946-S2127 WeakPolarHBondContact CA-O 3.36Å; I1947-S2127 PolarHBondContact N-O 3.01Å; M2101-S2127 CarbonylContact O-C 3.48Å
2128	L	53	Low	45	Very low	9 Å²	9	63.9 Å²	63.9	5%	0.047	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	142.4	-169.3	-64.9	144.5	0	0	0	111.6	I1947 F1949 F1968 M2101	I1947-L2128 HydrophobicContact CB-CD2 4.01Å; I1947-L2128 HydrophobicContact CG2-CD2 4.44Å; I1947-L2128 VanDerWaalsContact O-CA 3.3Å; I1947-L2128 WeakPolarHBondContact O-CA 3.42Å; F1949-L2128 HydrophobicContact CD2-CD2 3.38Å; F1949-L2128 HydrophobicContact CE2-CD2 3.43Å; F1949-L2128 VanDerWaalsContact CE2-CD2 3.43Å; F1949-L2128 HydrophobicContact CG-CD2 4.45Å; F1968-L2128 HydrophobicContact CE1-CD1 4.05Å; F1968-L2128 HydrophobicContact CE1-CD2 3.89Å; F1968-L2128 HydrophobicContact CE1-CG 4.37Å; F1968-L2128 HydrophobicContact CE2-CD1 4.2Å; F1968-L2128 HydrophobicContact CZ-CD1 3.47Å; F1968-L2128 VanDerWaalsContact CZ-CD1 3.47Å; F1968-L2128 HydrophobicContact CZ-CD2 3.68Å; F1968-L2128 HydrophobicContact CZ-CG 4.12Å; M2101-L2128 HydrophobicContact CB-CB 4.09Å; M2101-L2128 HydrophobicContact CB-CD1 4.5Å; M2101-L2128 HydrophobicContact CG-CD1 4.22Å; M2101-L2128 PolarHBondContact N-O 3Å; M2101-L2128 WeakPolarHBondContact O-CB 3.32Å; M2101-L2128 PolarHBondContact O-N 2.85Å; M2101-L2128 HydrophobicContact SD-CD1 4.4Å
2129	L	43.1	Very low	45.1	Very low	61 Å²	61	57 Å²	57	32%	0.319	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.5	170.9	-81	90.5	0	0	0	111.9	I1947 F1949 R2100	I1947-L2129 PolarHBondContact O-N 3.46Å; F1949-L2129 PolarHBondContact N-O 2.82Å; R2100-L2129 HydrophobicContact CG-CD1 4.42Å
2130	P	42.7	Very low	45.1	Very low	25 Å²	25	54.5 Å²	54.5	16%	0.162	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	152.1	-178.8	36.9	-35.1	0	0	0	114.2	I1951 L2095 T2099	I1951-P2130 HydrophobicContact CD1-CB 3.74Å; L2095-P2130 HydrophobicContact CB-CB 4.32Å; L2095-P2130 HydrophobicContact CB-CG 3.64Å; L2095-P2130 HydrophobicContact CD1-CB 4.03Å; L2095-P2130 HydrophobicContact CD1-CG 3.8Å; L2095-P2130 HydrophobicContact CG-CG 4.36Å; T2099-P2130 WeakPolarHBondContact O-CD 3.17Å
2131	L	36.4	Very low	44.5	Very low	92 Å²	92	52.3 Å²	52.3	48%	0.482	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.8	177.7	-68.4	169.2	0	0	0	113	I1948 F1949	I1948-L2131 HydrophobicContact CG2-CD1 3.83Å; I1948-L2131 HydrophobicContact CG2-CG 4.32Å; F1949-L2131 PolarHBondContact O-N 3.07Å
2132	P	31.8	Very low	43.5	Very low	131 Å²	131	53.4 Å²	53.4	85%	0.851	31%	0.314	S	S	*	.			trans	-89.2	152.1	-174.3	34.8	-36	0	0	0	115.3
2133	G	34.7	Very low	42.3	Very low	65 Å²	65	56.6 Å²	56.6	67%	0.67	33%	0.325	S	S	*	.			trans	-146.7	175.5	-177.3	0	0	0	0	0	115.3
2134	I	32	Very low	40.9	Very low	38 Å²	38	57.8 Å²	57.8	20%	0.195	33%	0.331	C	S	.	.			trans	-103	142.4	-165	-47.5	177.4	0	0	0	112	P2176 T2179 I2312	I2134-P2176 HydrophobicContact CG2-CG 3.9Å; I2134-T2179 HydrophobicContact CD1-CG2 3.79Å; I2134-T2179 HydrophobicContact CG1-CG2 4.44Å; I2134-T2179 HydrophobicContact CG2-CG2 4.42Å; I2134-I2312 HydrophobicContact CB-CD1 4.35Å; I2134-I2312 HydrophobicContact CG2-CD1 3.92Å
2135	R	32.5	Very low	39.8	Very low	119 Å²	119	65.4 Å²	65.4	45%	0.449	37%	0.366	S	S	.	.			trans	-135.2	150.4	166.8	-81	-179.7	161.2	-167.2	-8.4	111.4	A2090 P2176	A2090-R2135 VanDerWaalsContact C-NH1 3.32Å; A2090-R2135 PolarHBondContact O-NH1 2.95Å; R2135-P2176 VanDerWaalsContact O-CD 3.28Å; R2135-P2176 WeakPolarHBondContact O-CD 3.49Å; R2135-P2176 WeakPolarHBondContact O-CG 3.37Å
2136	I	34.4	Very low	38.3	Very low	39 Å²	39	69 Å²	69	20%	0.2	38%	0.383	C	S	.	.			trans	-119.2	144.6	177.5	-63.6	-173.2	0	0	0	109	I2173 L2303 I2312 I2314	I2136-I2173 HydrophobicContact CD1-CG2 4.27Å; I2136-I2173 HydrophobicContact CG2-CG2 3.68Å; I2136-L2303 HydrophobicContact CD1-CD1 3.88Å; I2136-L2303 HydrophobicContact CD1-CD2 4.24Å; I2136-L2303 HydrophobicContact CD1-CG 4.46Å; I2136-I2312 HydrophobicContact CD1-CB 4.06Å; I2136-I2312 HydrophobicContact CD1-CD1 3.82Å; I2136-I2312 HydrophobicContact CD1-CG2 3.82Å; I2136-I2312 HydrophobicContact CG1-CD1 4.02Å; I2136-I2312 HydrophobicContact CG1-CG2 4.28Å; I2136-I2314 HydrophobicContact CG2-CD1 4.17Å
2137	L	36.2	Very low	37	Very low	59 Å²	59	73.1 Å²	73.1	31%	0.309	41%	0.405	S	S	.	.			trans	-115.8	138.4	-179	-122.3	156.5	0	0	0	110.7	F2025 L2028 F2174	F2025-L2137 HydrophobicContact CE1-CD1 4.23Å; F2025-L2137 HydrophobicContact CE2-CD1 3.87Å; F2025-L2137 HydrophobicContact CZ-CD1 3.44Å; F2025-L2137 VanDerWaalsContact CZ-CD1 3.44Å; L2028-L2137 HydrophobicContact CD2-CD2 4.43Å; L2137-F2174 HydrophobicContact CB-CB 4.01Å
2138	I	41.4	Very low	35.8	Very low	40 Å²	40	73.6 Å²	73.6	21%	0.205	41%	0.408	C	S	.	.			trans	-139.4	146.4	-176.1	-54.4	152	0	0	0	107.4	Y2157 I2314	I2138-Y2157 HydrophobicContact CD1-CD2 4.44Å; I2138-Y2157 HydrophobicContact CD1-CE2 3.95Å; I2138-I2314 HydrophobicContact CD1-CB 4.36Å; I2138-I2314 HydrophobicContact CD1-CD1 3.96Å; I2138-I2314 HydrophobicContact CD1-CG1 3.97Å; I2138-I2314 HydrophobicContact CD1-CG2 3.66Å; I2138-I2314 HydrophobicContact CG1-CD1 4.15Å; I2138-I2314 HydrophobicContact CG1-CG2 4.42Å
2139	P	35	Very low	34.7	Very low	47 Å²	47	74.5 Å²	74.5	31%	0.305	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-58.8	154.8	175.2	-25.9	36.4	0	0	0	114.7
2140	P	35.1	Very low	34.1	Very low	96 Å²	96	73.3 Å²	73.3	62%	0.623	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-73.5	162.4	-162.9	27.8	-36.1	0	0	0	116.5
2141	A	33	Very low	33.4	Very low	36 Å²	36	72.3 Å²	72.3	30%	0.298	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-94.5	134.1	174.5	0	0	0	0	0	112.3	S2156 Y2157	A2141-S2156 VanDerWaalsContact CB-O 3.31Å; A2141-S2156 WeakPolarHBondContact CB-O 3.35Å; A2141-Y2157 HydrophobicContact CB-CD1 3.72Å; A2141-Y2157 HydrophobicContact CB-CE1 4.25Å
2142	V	36.6	Very low	33	Very low	80 Å²	80	68 Å²	68	49%	0.485	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-86.8	125.6	168.7	-173.8	0	0	0	0	109.7
2143	K	31.5	Very low	33.1	Very low	134 Å²	134	61.9 Å²	61.9	58%	0.583	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-91.4	159.2	173.9	-79.7	-177.1	171.6	-179.2	0	112.2	D2155	K2143-D2155 WeakPolarHBondContact CE-OD1 3.4Å; K2143-D2155 IonicContact NZ-OD1 2.61Å; K2143-D2155 PolarHBondContact NZ-OD1 3Å; K2143-D2155 IonicContact NZ-OD2 3.05Å
2144	L	33.1	Very low	33	Very low	58 Å²	58	61 Å²	61	30%	0.304	31%	0.314	S	S	.	.			trans	-114	153.2	167	-96.1	90.9	0	0	0	110	N1622	N1622-L2144 WeakPolarHBondContact ND2-CB 3.44Å
2145	Q	35.7	Very low	33	Very low	164 Å²	164	60.8 Å²	60.8	77%	0.766	31%	0.314	S	S	*	.			trans	-136.7	152.7	-169.7	-177.6	178.6	-6.4	0	0	111.6	K1624	K1624-Q2145 VanDerWaalsContact CE-C 3.42Å; K1624-Q2145 WeakPolarHBondContact CE-O 3.4Å; K1624-Q2145 PolarHBondContact NZ-O 2.93Å
2146	E	33.3	Very low	32.9	Very low	129 Å²	129	55.5 Å²	55.5	60%	0.603	30%	0.295	S	S	*	.			trans	101.5	129.6	172.5	-57.8	176.4	141.9	0	0	119.1	K1624	K1624-E2146 WeakPolarHBondContact CB-O 3.46Å; K1624-E2146 WeakPolarHBondContact CD-O 3.36Å; K1624-E2146 WeakPolarHBondContact CE-O 3.11Å; K1624-E2146 WeakPolarHBondContact CG-O 3.43Å; K1624-E2146 PolarHBondContact NZ-O 2.82Å
2147	D	30.8	Very low	33.2	Very low	89 Å²	89	57 Å²	57	48%	0.476	30%	0.299	S	S	.	.			trans	87.8	80.2	152.7	-73	16.3	0	0	0	120.3	K1624 E1627	K1624-D2147 CarbonylContact C-O 3.51Å; K1624-D2147 CarbonylContact O-C 3.57Å; K1624-D2147 VanDerWaalsContact O-C 3.24Å; E1627-D2147 PolarHBondContact OE2-N 3.49Å
2148	S	29.3	Very low	33.3	Very low	34 Å²	34	56.3 Å²	56.3	24%	0.238	29%	0.294	C	S	.	.				48.7	136.9	121.5	104.5	0	0	0	0	123.3	K1624 E1627 S1628	K1624-S2148 WeakPolarHBondContact O-CA 3.36Å; K1624-S2148 PolarHBondContact O-N 2.82Å; E1627-S2148 PolarHBondContact OE2-N 3Å; S1628-S2148 WeakPolarHBondContact OG-CB 3.2Å
2149	H	30.3	Very low	33.4	Very low	28 Å²	28	55 Å²	55	13%	0.13	29%	0.287	C	S	.	.			trans	68.1	136.5	-178.4	-61.8	-86.6	0	0	0	115.5	C1625 S1628 L1630	C1625-H2149 VanDerWaalsContact C-C 3.5Å; C1625-H2149 CarbonylContact C-O 3.59Å; C1625-H2149 VanDerWaalsContact C-O 3.31Å; C1625-H2149 WeakPolarHBondContact CA-O 3.43Å; C1625-H2149 WeakPolarHBondContact CB-O 3.36Å; C1625-H2149 CarbonylContact O-C 3.53Å; C1625-H2149 WeakPolarHBondContact O-CA 3.43Å; S1628-H2149 WeakPolarHBondContact CB-ND1 3.3Å; S1628-H2149 PolarHBondContact O-ND1 3.02Å; S1628-H2149 WeakPolarHBondContact OG-CA 3.46Å; S1628-H2149 PolarHBondContact OG-CD2 2.84Å; S1628-H2149 PolarHBondContact OG-CE1 2.9Å; S1628-H2149 PolarHBondContact OG-N 2.91Å; S1628-H2149 PolarHBondContact OG-ND1 2.93Å; S1628-H2149 PolarHBondContact OG-NE2 3.5Å; L1630-H2149 HydrophobicContact CB-CB 4.07Å; L1630-H2149 HydrophobicContact CD1-CB 3.94Å; L1630-H2149 HydrophobicContact CG-CB 4.3Å
2150	M	29.7	Very low	33.6	Very low	36 Å²	36	54.9 Å²	54.9	18%	0.177	28%	0.28	C	S	.	.	S	Bend	trans	95.4	26.1	168.9	-31.3	177.3	140	0	0	122.6	C1625 L1630 V1631 C1632 I1669	C1625-M2150 HydrophobicContact CB-CB 3.97Å; C1625-M2150 CarbonylContact O-C 3.58Å; C1625-M2150 WeakPolarHBondContact O-CA 3.38Å; C1625-M2150 PolarHBondContact O-N 2.82Å; L1630-M2150 HydrophobicContact CB-CE 3.33Å; L1630-M2150 HydrophobicContact CB-CG 3.44Å; L1630-M2150 VanDerWaalsContact CB-CG 3.44Å; L1630-M2150 HydrophobicContact CB-SD 4.11Å; L1630-M2150 HydrophobicContact CD1-CE 4.05Å; L1630-M2150 HydrophobicContact CG-CE 4.23Å; L1630-M2150 WeakPolarHBondContact O-CA 3.33Å; V1631-M2150 WeakPolarHBondContact O-CE 3.37Å; C1632-M2150 WeakPolarHBondContact CA-SD 3.45Å; C1632-M2150 HydrophobicContact CB-CB 3.32Å; C1632-M2150 HydrophobicContact CB-CG 3.92Å; C1632-M2150 HydrophobicContact CB-SD 3.7Å; C1632-M2150 PolarHBondContact N-SD 3.08Å; C1632-M2150 WeakPolarHBondContact SG-CB 3.48Å; C1632-M2150 VanDerWaalsContact SG-SD 3.6Å; I1669-M2150 CarbonylContact C-O 3.55Å
2151	S	29.6	Very low	34.3	Very low	4 Å²	4	50.5 Å²	50.5	3%	0.028	25%	0.251	C	S	.	.			trans	81.8	78.9	138	43.8	0	0	0	0	127.9	P1571 C1625 K1670 V1671	P1571-S2151 WeakPolarHBondContact CD-O 3.44Å; C1625-S2151 PolarHBondContact O-N 2.85Å; K1670-S2151 CarbonylContact C-O 3.56Å; K1670-S2151 WeakPolarHBondContact CA-OG 3.47Å; V1671-S2151 PolarHBondContact N-OG 2.91Å
2152	T	28.1	Very low	34.7	Very low	2 Å²	2	50.5 Å²	50.5	1%	0.012	25%	0.248	C	C	.	.			trans	77.6	122.1	142.8	62.5	0	0	0	0	129.3	S1570 P1571 D1623 S1626 V1671 F1723 F1744 I1745	S1570-T2152 PolarHBondContact OG-O 2.92Å; P1571-T2152 VanDerWaalsContact CD-N 3.3Å; P1571-T2152 WeakPolarHBondContact CD-O 3.49Å; P1571-T2152 VanDerWaalsContact CG-N 3.32Å; D1623-T2152 WeakPolarHBondContact OD1-CA 3.46Å; S1626-T2152 WeakPolarHBondContact OG-CG2 3.44Å; S1626-T2152 PolarHBondContact OG-N 2.83Å; V1671-T2152 HydrophobicContact CG1-CG2 4.04Å; V1671-T2152 VanDerWaalsContact CG1-OG1 3.24Å; V1671-T2152 WeakPolarHBondContact CG1-OG1 3.4Å; F1723-T2152 HydrophobicContact CD2-CG2 4.37Å; F1723-T2152 HydrophobicContact CE2-CG2 3.92Å; F1744-T2152 HydrophobicContact CD1-CG2 3.8Å; F1744-T2152 HydrophobicContact CE1-CG2 3.86Å; I1745-T2152 HydrophobicContact CD1-CG2 4.11Å
2153	S	33.1	Very low	35.4	Very low	2 Å²	2	49.4 Å²	49.4	1%	0.014	24%	0.238	C	C	.	.			trans	130.5	-133.6	137.8	88.3	0	0	0	0	125.6	P1571 N1572 S1573 D1623 S1720 H2347	P1571-S2153 CarbonylContact O-C 3.59Å; P1571-S2153 PolarHBondContact O-OG 3.15Å; N1572-S2153 WeakPolarHBondContact CB-O 3.4Å; N1572-S2153 VanDerWaalsContact CG-O 3.24Å; N1572-S2153 PolarHBondContact ND2-O 3.31Å; S1573-S2153 PolarHBondContact OG-OG 3.05Å; D1623-S2153 PolarHBondContact OD1-N 3.03Å; S1720-S2153 VanDerWaalsContact CB-OG 3.25Å; S1720-S2153 WeakPolarHBondContact CB-OG 2.99Å; S1720-S2153 WeakPolarHBondContact OG-CB 3.44Å; S1720-S2153 PolarHBondContact OG-OG 2.79Å; S2153-H2347 VanDerWaalsContact C-CD2 3.42Å; S2153-H2347 VanDerWaalsContact CB-CD2 3.42Å; S2153-H2347 WeakPolarHBondContact CB-CD2 3.42Å; S2153-H2347 PolarHBondContact OG-CD2 3.48Å
2154	K	31.8	Very low	36.1	Very low	46 Å²	46	46.9 Å²	46.9	20%	0.2	23%	0.233	C	C	.	.				-112.6	99.9	-129.4	-159.8	92.6	-56.6	75.6	0	116.4	P1571 N1572 N1721 D1722 I2346 H2347	P1571-K2154 PolarHBondContact O-N 3.18Å; N1572-K2154 VanDerWaalsContact C-C 3.41Å; N1572-K2154 CarbonylContact C-O 3.6Å; N1572-K2154 CarbonylContact O-C 3.59Å; N1721-K2154 HydrophobicContact CB-CB 3.55Å; N1721-K2154 HydrophobicContact CB-CG 3.79Å; N1721-K2154 VanDerWaalsContact ND2-CG 3.32Å; N1721-K2154 WeakPolarHBondContact ND2-CG 3.48Å; D1722-K2154 VanDerWaalsContact OD2-CD 3.28Å; D1722-K2154 WeakPolarHBondContact OD2-CD 3.45Å; D1722-K2154 WeakPolarHBondContact OD2-CE 3.29Å; D1722-K2154 IonicContact OD2-NZ 3.41Å; D1722-K2154 PolarHBondContact OD2-NZ 3.4Å; K2154-I2346 PolarHBondContact O-N 1.95Å; K2154-H2347 WeakPolarHBondContact CA-CD2 3.27Å; K2154-H2347 WeakPolarHBondContact CA-CE1 3.29Å; K2154-H2347 WeakPolarHBondContact CA-ND1 3.39Å; K2154-H2347 WeakPolarHBondContact CA-NE2 3.33Å; K2154-H2347 HydrophobicContact CB-CB 3.62Å; K2154-H2347 WeakPolarHBondContact CB-CD2 2.96Å; K2154-H2347 WeakPolarHBondContact CB-CE1 3.47Å; K2154-H2347 WeakPolarHBondContact CB-ND1 3.48Å; K2154-H2347 WeakPolarHBondContact CB-NE2 3.46Å; K2154-H2347 WeakPolarHBondContact CD-CE1 3.48Å; K2154-H2347 WeakPolarHBondContact CE-CE1 3.25Å; K2154-H2347 WeakPolarHBondContact CG-CE1 3.45Å; K2154-H2347 WeakPolarHBondContact CG-ND1 3.32Å; K2154-H2347 WeakPolarHBondContact CG-NE2 3.48Å; K2154-H2347 PolarHBondContact N-CD2 2.59Å; K2154-H2347 PolarHBondContact N-NE2 3.4Å; K2154-H2347 PolarHBondContact NZ-CE1 2.91Å; K2154-H2347 PolarHBondContact NZ-NE2 2.74Å; K2154-H2347 WeakPolarHBondContact O-CB 3.33Å; K2154-H2347 PolarHBondContact O-N 2.86Å; K2154-H2347 PolarHBondContact O-ND1 2.78Å
2155	D	31.8	Very low	37	Very low	35 Å²	35	50.2 Å²	50.2	19%	0.187	25%	0.252	C	S	.	.			trans	58.9	67.1	135.4	-50.7	-14.3	0	0	0	128	N1572 K2143 I2346 H2347	N1572-D2155 PolarHBondContact O-N 3Å; K2143-D2155 WeakPolarHBondContact CE-OD1 3.4Å; K2143-D2155 IonicContact NZ-OD1 2.61Å; K2143-D2155 PolarHBondContact NZ-OD1 3Å; K2143-D2155 IonicContact NZ-OD2 3.05Å; D2155-I2346 WeakPolarHBondContact O-CB 3.43Å; D2155-I2346 VanDerWaalsContact O-CD1 3.25Å; D2155-I2346 WeakPolarHBondContact O-CD1 3.38Å; D2155-I2346 WeakPolarHBondContact O-CG1 3.48Å; D2155-H2347 WeakPolarHBondContact CB-ND1 3.26Å; D2155-H2347 PolarHBondContact N-ND1 2.91Å; D2155-H2347 IonicContact OD1-CE1 4Å; D2155-H2347 PolarHBondContact OD1-CE1 3.13Å; D2155-H2347 IonicContact OD1-ND1 3.9Å; D2155-H2347 IonicContact OD2-CE1 2.64Å; D2155-H2347 PolarHBondContact OD2-CE1 2.93Å; D2155-H2347 IonicContact OD2-ND1 3.47Å; D2155-H2347 PolarHBondContact OD2-ND1 3.39Å
2156	S	31.9	Very low	38	Very low	8 Å²	8	48 Å²	48	6%	0.056	24%	0.241	C	C	.	.			trans	-97.3	135.9	-168.3	39.5	0	0	0	0	123.7	R1620 A2141 S2344	R1620-S2156 WeakPolarHBondContact CD-OG 3.37Å; R1620-S2156 VanDerWaalsContact CZ-CB 3.46Å; R1620-S2156 PolarHBondContact NE-OG 3.36Å; R1620-S2156 VanDerWaalsContact NE-OG 3.16Å; R1620-S2156 PolarHBondContact NH1-O 2.96Å; R1620-S2156 PolarHBondContact NH1-OG 2.88Å; R1620-S2156 PolarHBondContact NH2-O 3.45Å; A2141-S2156 VanDerWaalsContact CB-O 3.31Å; A2141-S2156 WeakPolarHBondContact CB-O 3.35Å; S2156-S2344 WeakPolarHBondContact CB-O 3.48Å; S2156-S2344 PolarHBondContact OG-O 3.06Å
2157	Y	39.9	Very low	39.2	Very low	70 Å²	70	43.9 Å²	43.9	28%	0.275	22%	0.221	S	C	.	.			trans	-69.9	144.2	173.9	-66.3	-42.2	0	0	0	114.1	R1620 I2138 A2141 L2298 P2315 I2346	R1620-Y2157 PolarHBondContact NH2-O 3.25Å; I2138-Y2157 HydrophobicContact CD1-CD2 4.44Å; I2138-Y2157 HydrophobicContact CD1-CE2 3.95Å; A2141-Y2157 HydrophobicContact CB-CD1 3.72Å; A2141-Y2157 HydrophobicContact CB-CE1 4.25Å; Y2157-L2298 WeakPolarHBondContact O-CD2 3.34Å; Y2157-P2315 HydrophobicContact CD2-CG 3.93Å; Y2157-P2315 HydrophobicContact CE2-CG 4.41Å; Y2157-I2346 HydrophobicContact CD1-CD1 3.81Å; Y2157-I2346 HydrophobicContact CD2-CD1 3.12Å; Y2157-I2346 HydrophobicContact CD2-CG1 4.3Å; Y2157-I2346 HydrophobicContact CE1-CD1 4Å; Y2157-I2346 HydrophobicContact CE2-CD1 3.35Å; Y2157-I2346 HydrophobicContact CG-CD1 3.29Å
2158	Q	38.2	Very low	40.9	Very low	45 Å²	45	42.4 Å²	42.4	21%	0.21	22%	0.215	C	C	.	.			trans	-137	92.8	-165.3	-143.3	166.8	-9	0	0	117.6	R2317	Q2158-R2317 HydrophobicContact CB-CB 4.49Å; Q2158-R2317 HydrophobicContact CG-CB 3.97Å; Q2158-R2317 HydrophobicContact CG-CG 3.65Å
2159	F	43.2	Very low	42.7	Very low	13 Å²	13	41 Å²	41	6%	0.057	21%	0.205	C	C	.	.			trans	-81.7	151	161	-120.3	-78	0	0	0	111.4	R2169 L2171 Y2225 V2316 R2317	F2159-R2169 HydrophobicContact CE1-CB 3.7Å; F2159-R2169 HydrophobicContact CE1-CG 3.83Å; F2159-R2169 HydrophobicContact CZ-CB 4.01Å; F2159-L2171 HydrophobicContact CE2-CB 4.44Å; F2159-L2171 HydrophobicContact CE2-CD1 4.13Å; F2159-L2171 HydrophobicContact CE2-CG 4.47Å; F2159-Y2225 HydrophobicContact CD1-CD1 4.19Å; F2159-Y2225 AromaticContact CD1-CE1 3.62Å; F2159-Y2225 HydrophobicContact CD1-CE1 3.62Å; F2159-Y2225 AromaticContact CD2-CE1 3.77Å; F2159-Y2225 HydrophobicContact CD2-CE1 3.77Å; F2159-Y2225 HydrophobicContact CE1-CD1 4.05Å; F2159-Y2225 AromaticContact CE1-CE1 3.46Å; F2159-Y2225 HydrophobicContact CE1-CE1 3.46Å; F2159-Y2225 VanDerWaalsContact CE1-CE1 3.46Å; F2159-Y2225 AromaticContact CE1-CZ 3.84Å; F2159-Y2225 AromaticContact CE2-CE1 3.67Å; F2159-Y2225 HydrophobicContact CE2-CE1 3.67Å; F2159-Y2225 AromaticContact CE2-CZ 3.5Å; F2159-Y2225 VanDerWaalsContact CE2-CZ 3.5Å; F2159-Y2225 WeakPolarHBondContact CE2-OH 3.42Å; F2159-Y2225 AromaticContact CG-CE1 3.76Å; F2159-Y2225 HydrophobicContact CG-CE1 3.76Å; F2159-Y2225 HydrophobicContact CZ-CD1 4.43Å; F2159-Y2225 AromaticContact CZ-CE1 3.5Å; F2159-Y2225 HydrophobicContact CZ-CE1 3.5Å; F2159-Y2225 HydrophobicContact CZ-CE2 4.2Å; F2159-Y2225 AromaticContact CZ-CZ 3.38Å; F2159-Y2225 VanDerWaalsContact CZ-OH 3.29Å; F2159-Y2225 WeakPolarHBondContact CZ-OH 3.29Å; F2159-V2316 HydrophobicContact CB-CG1 4.21Å; F2159-V2316 HydrophobicContact CD2-CG1 3.65Å; F2159-V2316 HydrophobicContact CE2-CG1 4.29Å; F2159-V2316 HydrophobicContact CG-CG1 4.26Å; F2159-R2317 WeakPolarHBondContact CB-O 3.29Å; F2159-R2317 CarbonylContact O-C 3.4Å; F2159-R2317 WeakPolarHBondContact O-CB 3.12Å; F2159-R2317 VanDerWaalsContact O-CG 3.24Å; F2159-R2317 WeakPolarHBondContact O-CG 3.25Å
2160	W	40.2	Very low	44.7	Very low	44 Å²	44	42.6 Å²	42.6	17%	0.167	21%	0.21	C	C	.	.			trans	-137.6	131	174.8	-63.7	72.6	0	0	0	110	T1614 T2162 S2228	T1614-W2160 HydrophobicContact CG2-CD2 4.18Å; T1614-W2160 HydrophobicContact CG2-CE3 3.89Å; T1614-W2160 HydrophobicContact CG2-CH2 3.58Å; T1614-W2160 HydrophobicContact CG2-CZ2 3.95Å; T1614-W2160 HydrophobicContact CG2-CZ3 3.56Å; W2160-T2162 HydrophobicContact CE3-CG2 4.31Å; W2160-S2228 WeakPolarHBondContact O-CB 3.09Å; W2160-S2228 PolarHBondContact O-OG 3.04Å
2161	I	49.7	Very low	46.6	Very low	3 Å²	3	41.2 Å²	41.2	2%	0.015	20%	0.203	C	C	.	.			trans	-125.8	78.5	179.1	-54.2	-174.7	0	0	0	110.1	F2167 R2169 C2288 I2318	I2161-F2167 HydrophobicContact CG2-CD1 4.46Å; I2161-R2169 HydrophobicContact CD1-CB 4.24Å; I2161-R2169 HydrophobicContact CD1-CG 3.42Å; I2161-R2169 VanDerWaalsContact CD1-CG 3.42Å; I2161-R2169 HydrophobicContact CG1-CG 3.82Å; I2161-C2288 VanDerWaalsContact CD1-SG 3.6Å; I2161-I2318 HydrophobicContact CD1-CG2 3.37Å; I2161-I2318 HydrophobicContact CG1-CG2 3.8Å
2162	T	41	Very low	48.5	Very low	37 Å²	37	42.7 Å²	42.7	23%	0.227	21%	0.21	C	C	.	.			trans	-94.9	9.1	-168	44.2	0	0	0	0	115.4	W2160 S2228	W2160-T2162 HydrophobicContact CE3-CG2 4.31Å; T2162-S2228 PolarHBondContact OG1-O 3.15Å
2163	E	50.6	Low	50.2	Low	57 Å²	57	42.8 Å²	42.8	27%	0.266	21%	0.211	S	C	.	.			trans	-119.5	125.5	-170.7	-75.5	164.9	169.4	0	0	111.4	D2165 H2166 R2169 S2231	E2163-D2165 PolarHBondContact O-N 3.24Å; E2163-D2165 VanDerWaalsContact O-N 3.1Å; E2163-H2166 PolarHBondContact O-N 3.16Å; E2163-R2169 IonicContact OE2-NH2 3.39Å; E2163-S2231 WeakPolarHBondContact CG-OG 3.44Å; E2163-S2231 VanDerWaalsContact OE1-CB 3.26Å; E2163-S2231 WeakPolarHBondContact OE1-CB 3.43Å; E2163-S2231 PolarHBondContact OE1-OG 2.93Å
2164	T	46.9	Very low	51.3	Low	80 Å²	80	43.8 Å²	43.8	49%	0.491	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.1	-173.8	45.6	0	0	0	0	115.1	F2167	T2164-F2167 WeakPolarHBondContact O-CE2 3.49Å
2165	D	51.8	Low	52.5	Low	129 Å²	129	41.9 Å²	41.9	69%	0.69	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-19.2	-166.5	-60.8	7.8	0	0	0	112.1	E2163	E2163-D2165 PolarHBondContact O-N 3.24Å; E2163-D2165 VanDerWaalsContact O-N 3.1Å
2166	H	56.7	Low	53.3	Low	116 Å²	116	41.3 Å²	41.3	54%	0.537	21%	0.205	S	C	.	.			trans	-139.8	70	-164.1	-69.3	-13.9	0	0	0	113.6	E2163 T2168	E2163-H2166 PolarHBondContact O-N 3.16Å; H2166-T2168 PolarHBondContact O-N 3.32Å
2167	F	58.7	Low	54.1	Low	44 Å²	44	42.5 Å²	42.5	19%	0.193	21%	0.212	C	C	.	.			trans	-69.3	-7.6	173.1	-61.8	-67.1	0	0	0	114.9	I2161 T2164 C2288 P2290 I2320	I2161-F2167 HydrophobicContact CG2-CD1 4.46Å; T2164-F2167 WeakPolarHBondContact O-CE2 3.49Å; F2167-C2288 HydrophobicContact CB-CB 4.09Å; F2167-C2288 WeakPolarHBondContact CB-O 3.11Å; F2167-C2288 HydrophobicContact CD1-CB 4.33Å; F2167-C2288 PolarHBondContact O-N 3.28Å; F2167-P2290 HydrophobicContact CD1-CB 4.42Å; F2167-P2290 HydrophobicContact CD2-CB 4.22Å; F2167-P2290 HydrophobicContact CD2-CG 4.05Å; F2167-P2290 HydrophobicContact CE1-CB 3.97Å; F2167-P2290 HydrophobicContact CE2-CB 3.72Å; F2167-P2290 HydrophobicContact CE2-CG 3.82Å; F2167-P2290 HydrophobicContact CZ-CB 3.6Å; F2167-P2290 HydrophobicContact CZ-CG 4.23Å; F2167-I2320 HydrophobicContact CD1-CG2 4.15Å; F2167-I2320 HydrophobicContact CE1-CB 4.44Å; F2167-I2320 HydrophobicContact CE1-CG2 3.43Å; F2167-I2320 VanDerWaalsContact CE1-CG2 3.43Å; F2167-I2320 HydrophobicContact CZ-CG2 4.05Å
2168	T	66.7	Low	54.3	Low	57 Å²	57	43 Å²	43	35%	0.35	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.4	174.4	49.3	0	0	0	0	112.3	H2166 V2286 K2287	H2166-T2168 PolarHBondContact O-N 3.32Å; T2168-V2286 CarbonylContact C-O 3.54Å; T2168-V2286 WeakPolarHBondContact CA-O 3.38Å; T2168-K2287 HydrophobicContact CG2-CB 4Å; T2168-K2287 HydrophobicContact CG2-CD 4.23Å; T2168-K2287 HydrophobicContact CG2-CG 4.23Å
2169	R	67.3	Low	55	Low	6 Å²	6	41.5 Å²	41.5	2%	0.023	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	169.4	174.4	-67.6	-65.5	170.1	142	-15.8	112.3	F2159 I2161 E2163 E2224 S2228 V2286	F2159-R2169 HydrophobicContact CE1-CB 3.7Å; F2159-R2169 HydrophobicContact CE1-CG 3.83Å; F2159-R2169 HydrophobicContact CZ-CB 4.01Å; I2161-R2169 HydrophobicContact CD1-CB 4.24Å; I2161-R2169 HydrophobicContact CD1-CG 3.42Å; I2161-R2169 VanDerWaalsContact CD1-CG 3.42Å; I2161-R2169 HydrophobicContact CG1-CG 3.82Å; E2163-R2169 IonicContact OE2-NH2 3.39Å; R2169-E2224 VanDerWaalsContact NH1-C 3.33Å; R2169-E2224 PolarHBondContact NH1-O 2.91Å; R2169-S2228 PolarHBondContact NH1-OG 2.87Å; R2169-S2228 VanDerWaalsContact NH1-OG 3.11Å; R2169-V2286 HydrophobicContact CB-CG2 4.41Å; R2169-V2286 PolarHBondContact N-O 3.01Å; R2169-V2286 PolarHBondContact O-N 2.89Å; R2169-V2286 VanDerWaalsContact O-O 3.08Å
2170	R	71.4	Confident	55.5	Low	61 Å²	61	41.1 Å²	41.1	23%	0.23	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131	-177.3	-79.9	175.9	-80.4	-175.4	-7.9	111	I2221 E2224 L2283 Q2285	R2170-I2221 HydrophobicContact CB-CD1 3.87Å; R2170-I2221 HydrophobicContact CB-CG1 3.67Å; R2170-I2221 HydrophobicContact CB-CG2 4.29Å; R2170-I2221 HydrophobicContact CG-CG1 4.43Å; R2170-I2221 WeakPolarHBondContact O-CG2 3.45Å; R2170-E2224 IonicContact CZ-OE1 2.79Å; R2170-E2224 IonicContact NE-OE1 3.24Å; R2170-E2224 IonicContact NE-OE2 3.8Å; R2170-E2224 IonicContact NH2-OE1 2.81Å; R2170-E2224 PolarHBondContact NH2-OE1 2.79Å; R2170-E2224 IonicContact NH2-OE2 3.82Å; R2170-L2283 HydrophobicContact CB-CD1 4.15Å; R2170-L2283 HydrophobicContact CG-CD1 4.46Å; R2170-Q2285 HydrophobicContact CG-CG 4.36Å
2171	L	70.7	Confident	56.2	Low	7 Å²	7	45.3 Å²	45.3	4%	0.037	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.4	-175.9	-173.2	149.4	0	0	0	110.2	F2159 I2173 V2284 V2286 V2316	F2159-L2171 HydrophobicContact CE2-CB 4.44Å; F2159-L2171 HydrophobicContact CE2-CD1 4.13Å; F2159-L2171 HydrophobicContact CE2-CG 4.47Å; L2171-I2173 HydrophobicContact CD2-CD1 3.78Å; L2171-I2173 HydrophobicContact CD2-CG1 3.52Å; L2171-V2284 PolarHBondContact N-O 2.99Å; L2171-V2284 PolarHBondContact O-N 2.73Å; L2171-V2286 HydrophobicContact CB-CG2 4.5Å; L2171-V2316 HydrophobicContact CD1-CG1 4.06Å; L2171-V2316 HydrophobicContact CD1-CG2 3.64Å
2172	L	68.8	Low	56.2	Low	35 Å²	35	46.6 Å²	46.6	18%	0.183	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.9	-172.6	-143.7	77.6	0	0	0	110.7	V2212 V2218 I2221 L2281 L2283	L2172-V2212 HydrophobicContact CD1-CG2 4.03Å; L2172-V2218 HydrophobicContact CD1-CG2 4.49Å; L2172-V2218 HydrophobicContact CD2-CG1 3.96Å; L2172-I2221 HydrophobicContact CD1-CD1 3.92Å; L2172-L2281 HydrophobicContact CD2-CD2 3.8Å; L2172-L2281 HydrophobicContact CG-CD2 4.19Å; L2172-L2283 HydrophobicContact CD1-CD1 4.13Å
2173	I	64.2	Low	56.8	Low	3 Å²	3	45.6 Å²	45.6	2%	0.015	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	136.5	-173.2	-52.8	-171.9	0	0	0	110.2	I2136 L2171 W2282 V2284 L2303 I2314	I2136-I2173 HydrophobicContact CD1-CG2 4.27Å; I2136-I2173 HydrophobicContact CG2-CG2 3.68Å; L2171-I2173 HydrophobicContact CD2-CD1 3.78Å; L2171-I2173 HydrophobicContact CD2-CG1 3.52Å; I2173-W2282 HydrophobicContact CB-CB 4.43Å; I2173-W2282 PolarHBondContact N-O 3.5Å; I2173-W2282 PolarHBondContact O-N 3.42Å; I2173-V2284 HydrophobicContact CD1-CB 4.24Å; I2173-V2284 HydrophobicContact CD1-CG2 3.49Å; I2173-V2284 VanDerWaalsContact CD1-CG2 3.49Å; I2173-V2284 HydrophobicContact CG1-CG2 4.41Å; I2173-L2303 HydrophobicContact CD1-CD1 4.25Å; I2173-L2303 HydrophobicContact CD1-CD2 3.9Å; I2173-L2303 HydrophobicContact CD1-CG 4.47Å; I2173-L2303 HydrophobicContact CG2-CD2 4.02Å; I2173-I2314 HydrophobicContact CD1-CD1 4.15Å; I2173-I2314 HydrophobicContact CG1-CD1 4.4Å
2174	F	55.6	Low	57	Low	23 Å²	23	48 Å²	48	10%	0.101	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.9	174.1	-171.9	-90.2	0	0	0	111.9	F2025 L2137 V2280 L2281	F2025-F2174 HydrophobicContact CD1-CZ 4.38Å; F2025-F2174 HydrophobicContact CD2-CD2 4.28Å; F2025-F2174 AromaticContact CD2-CE2 3.78Å; F2025-F2174 HydrophobicContact CD2-CE2 3.78Å; F2025-F2174 HydrophobicContact CD2-CZ 4.26Å; F2025-F2174 HydrophobicContact CE1-CE1 4.05Å; F2025-F2174 HydrophobicContact CE1-CE2 4.17Å; F2025-F2174 AromaticContact CE1-CZ 3.67Å; F2025-F2174 HydrophobicContact CE1-CZ 3.67Å; F2025-F2174 HydrophobicContact CE2-CD1 4.29Å; F2025-F2174 AromaticContact CE2-CD2 3.42Å; F2025-F2174 HydrophobicContact CE2-CD2 3.42Å; F2025-F2174 VanDerWaalsContact CE2-CD2 3.42Å; F2025-F2174 HydrophobicContact CE2-CE1 4.11Å; F2025-F2174 AromaticContact CE2-CE2 3.18Å; F2025-F2174 HydrophobicContact CE2-CE2 3.18Å; F2025-F2174 AromaticContact CE2-CG 3.96Å; F2025-F2174 HydrophobicContact CE2-CG 3.96Å; F2025-F2174 AromaticContact CE2-CZ 3.55Å; F2025-F2174 HydrophobicContact CE2-CZ 3.55Å; F2025-F2174 HydrophobicContact CG-CE2 4.49Å; F2025-F2174 AromaticContact CZ-CD1 3.83Å; F2025-F2174 HydrophobicContact CZ-CD1 3.83Å; F2025-F2174 AromaticContact CZ-CD2 3.8Å; F2025-F2174 HydrophobicContact CZ-CD2 3.8Å; F2025-F2174 AromaticContact CZ-CE1 3.45Å; F2025-F2174 HydrophobicContact CZ-CE1 3.45Å; F2025-F2174 VanDerWaalsContact CZ-CE1 3.45Å; F2025-F2174 AromaticContact CZ-CE2 3.4Å; F2025-F2174 HydrophobicContact CZ-CE2 3.4Å; F2025-F2174 VanDerWaalsContact CZ-CE2 3.4Å; F2025-F2174 AromaticContact CZ-CG 3.98Å; F2025-F2174 HydrophobicContact CZ-CG 3.98Å; F2025-F2174 AromaticContact CZ-CZ 3.2Å; F2025-F2174 HydrophobicContact CZ-CZ 3.2Å; L2137-F2174 HydrophobicContact CB-CB 4.01Å; F2174-V2280 WeakPolarHBondContact CA-O 3.4Å; F2174-V2280 HydrophobicContact CD1-CG1 4.4Å; F2174-V2280 HydrophobicContact CD2-CG1 3.91Å; F2174-V2280 HydrophobicContact CE1-CG1 3.82Å; F2174-V2280 HydrophobicContact CE2-CB 4.19Å; F2174-V2280 HydrophobicContact CE2-CG1 3.27Å; F2174-V2280 HydrophobicContact CG-CG1 4.45Å; F2174-V2280 HydrophobicContact CZ-CG1 3.23Å; F2174-L2281 HydrophobicContact CD2-CD1 4.05Å; F2174-L2281 HydrophobicContact CE2-CD1 4.42Å
2175	I	57.9	Low	57.1	Low	6 Å²	6	49.1 Å²	49.1	3%	0.031	26%	0.264	C	S	.	.			trans	-121.7	121.3	178	-59.6	-171.5	0	0	0	109.2	T2179 L2183 L2193 V2280 W2282	I2175-T2179 HydrophobicContact CG2-CG2 3.81Å; I2175-L2183 HydrophobicContact CG2-CD1 4.15Å; I2175-L2193 HydrophobicContact CD1-CD1 4.04Å; I2175-L2193 HydrophobicContact CD1-CD2 3.6Å; I2175-L2193 HydrophobicContact CD1-CG 4.5Å; I2175-V2280 PolarHBondContact N-O 3.11Å; I2175-V2280 WeakPolarHBondContact O-CG1 3.4Å; I2175-W2282 HydrophobicContact CD1-CD2 3.91Å; I2175-W2282 HydrophobicContact CD1-CG 3.78Å; I2175-W2282 HydrophobicContact CG1-CG 4.28Å
2176	P	48.5	Very low	56.8	Low	23 Å²	23	52.8 Å²	52.8	15%	0.149	28%	0.277	C	S	.	.			trans	-57.5	146.8	-173.4	-28.3	36	0	0	0	114.5	I2134 R2135 A2178 T2179 S2180	I2134-P2176 HydrophobicContact CG2-CG 3.9Å; R2135-P2176 VanDerWaalsContact O-CD 3.28Å; R2135-P2176 WeakPolarHBondContact O-CD 3.49Å; R2135-P2176 WeakPolarHBondContact O-CG 3.37Å; P2176-A2178 VanDerWaalsContact C-N 3.3Å; P2176-A2178 PolarHBondContact O-N 3.04Å; P2176-A2178 VanDerWaalsContact O-N 3.15Å; P2176-T2179 CarbonylContact O-C 3.31Å; P2176-T2179 WeakPolarHBondContact O-CA 3.47Å; P2176-T2179 VanDerWaalsContact O-CB 3.3Å; P2176-T2179 WeakPolarHBondContact O-CB 3.5Å; P2176-T2179 PolarHBondContact O-N 2.78Å; P2176-S2180 PolarHBondContact O-N 3.26Å
2177	P	48.1	Very low	56.3	Low	33 Å²	33	54.5 Å²	54.5	21%	0.214	29%	0.285	C	S	.	.	H	α-helix	trans	-56.5	-34.1	-176.3	-29.2	36	0	0	0	115.7	L2020 T2179 S2180 F2181 V2280	L2020-P2177 HydrophobicContact CD2-CB 4.4Å; P2177-T2179 VanDerWaalsContact C-N 3.33Å; P2177-S2180 WeakPolarHBondContact CA-OG 3.25Å; P2177-S2180 PolarHBondContact O-OG 3.04Å; P2177-F2181 VanDerWaalsContact O-CB 3.23Å; P2177-F2181 WeakPolarHBondContact O-CB 3.39Å; P2177-F2181 PolarHBondContact O-N 2.89Å; P2177-V2280 HydrophobicContact CG-CG1 4.26Å; P2177-V2280 HydrophobicContact CG-CG2 4.47Å
2178	A	44.8	Very low	55.8	Low	81 Å²	81	54 Å²	54	67%	0.669	28%	0.284	S	S	*	.	H	α-helix	trans	-68.2	-34.1	174.3	0	0	0	0	0	112.2	P2176 A2182	P2176-A2178 VanDerWaalsContact C-N 3.3Å; P2176-A2178 PolarHBondContact O-N 3.04Å; P2176-A2178 VanDerWaalsContact O-N 3.15Å; A2178-A2182 WeakPolarHBondContact O-CB 3.48Å; A2178-A2182 PolarHBondContact O-N 2.86Å; A2178-A2182 VanDerWaalsContact O-N 3.08Å
2179	T	51.5	Low	54.9	Low	13 Å²	13	52.7 Å²	52.7	8%	0.08	28%	0.281	C	S	.	.	H	α-helix	trans	-75.3	-41.8	176.4	-47.5	0	0	0	0	111.4	I2134 I2175 P2176 P2177 A2182 L2183 L2305	I2134-T2179 HydrophobicContact CD1-CG2 3.79Å; I2134-T2179 HydrophobicContact CG1-CG2 4.44Å; I2134-T2179 HydrophobicContact CG2-CG2 4.42Å; I2175-T2179 HydrophobicContact CG2-CG2 3.81Å; P2176-T2179 CarbonylContact O-C 3.31Å; P2176-T2179 WeakPolarHBondContact O-CA 3.47Å; P2176-T2179 VanDerWaalsContact O-CB 3.3Å; P2176-T2179 WeakPolarHBondContact O-CB 3.5Å; P2176-T2179 PolarHBondContact O-N 2.78Å; P2177-T2179 VanDerWaalsContact C-N 3.33Å; T2179-A2182 PolarHBondContact O-N 3.06Å; T2179-L2183 HydrophobicContact CG2-CD1 4.25Å; T2179-L2183 WeakPolarHBondContact O-CG 3.21Å; T2179-L2183 PolarHBondContact O-N 3.23Å; T2179-L2305 HydrophobicContact CG2-CD2 3.94Å
2180	S	55.2	Low	53.9	Low	5 Å²	5	56.4 Å²	56.4	4%	0.035	31%	0.309	C	S	.	.	H	α-helix	trans	-67.7	-37.3	175.3	69.4	0	0	0	0	111.6	P2176 P2177 A2182 L2183 N2184 H2278	P2176-S2180 PolarHBondContact O-N 3.26Å; P2177-S2180 WeakPolarHBondContact CA-OG 3.25Å; P2177-S2180 PolarHBondContact O-OG 3.04Å; S2180-A2182 VanDerWaalsContact C-N 3.35Å; S2180-A2182 PolarHBondContact O-N 2.73Å; S2180-L2183 PolarHBondContact O-N 3.23Å; S2180-N2184 VanDerWaalsContact O-CB 3.29Å; S2180-N2184 WeakPolarHBondContact O-CB 3.37Å; S2180-N2184 PolarHBondContact O-N 3.13Å; S2180-H2278 WeakPolarHBondContact CB-O 3.34Å; S2180-H2278 PolarHBondContact OG-O 2.95Å
2181	F	54.3	Low	52.8	Low	132 Å²	132	59.7 Å²	59.7	58%	0.579	33%	0.331	S	S	*	.	H	α-helix	trans	-62.1	-40.1	171.1	-167.4	-91.1	0	0	0	112.2	P2177 N2184 M2185	P2177-F2181 VanDerWaalsContact O-CB 3.23Å; P2177-F2181 WeakPolarHBondContact O-CB 3.39Å; P2177-F2181 PolarHBondContact O-N 2.89Å; F2181-N2184 PolarHBondContact O-N 2.9Å; F2181-M2185 HydrophobicContact CD1-CE 4.11Å; F2181-M2185 HydrophobicContact CE1-CE 3.89Å; F2181-M2185 PolarHBondContact O-N 2.97Å
2182	A	49.7	Very low	52.1	Low	31 Å²	31	61.7 Å²	61.7	26%	0.256	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-44	173.3	0	0	0	0	0	112.3	A2178 T2179 S2180 N2184 M2185 L2188	A2178-A2182 WeakPolarHBondContact O-CB 3.48Å; A2178-A2182 PolarHBondContact O-N 2.86Å; A2178-A2182 VanDerWaalsContact O-N 3.08Å; T2179-A2182 PolarHBondContact O-N 3.06Å; S2180-A2182 VanDerWaalsContact C-N 3.35Å; S2180-A2182 PolarHBondContact O-N 2.73Å; A2182-N2184 PolarHBondContact O-N 3.33Å; A2182-M2185 WeakPolarHBondContact O-CB 3.28Å; A2182-M2185 PolarHBondContact O-N 2.84Å; A2182-L2188 HydrophobicContact CB-CD2 4.09Å; A2182-L2188 WeakPolarHBondContact O-CB 3.47Å; A2182-L2188 WeakPolarHBondContact O-CD2 3.22Å
2183	L	53.1	Low	51.7	Low	15 Å²	15	60.6 Å²	60.6	8%	0.079	33%	0.333	C	S	.	.	H	α-helix	trans	-63.3	-23.8	174.3	-72.1	163.7	0	0	0	113.1	I2175 T2179 S2180 L2193 L2305	I2175-L2183 HydrophobicContact CG2-CD1 4.15Å; T2179-L2183 HydrophobicContact CG2-CD1 4.25Å; T2179-L2183 WeakPolarHBondContact O-CG 3.21Å; T2179-L2183 PolarHBondContact O-N 3.23Å; S2180-L2183 PolarHBondContact O-N 3.23Å; L2183-L2193 HydrophobicContact CD1-CD1 4.23Å; L2183-L2305 HydrophobicContact CD2-CD2 4.26Å; L2183-L2305 HydrophobicContact CD2-CG 4.5Å
2184	N	55	Low	51.6	Low	108 Å²	108	62.1 Å²	62.1	58%	0.578	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-2.8	178	-156.3	20.1	0	0	0	113.4	S2180 F2181 A2182	S2180-N2184 VanDerWaalsContact O-CB 3.29Å; S2180-N2184 WeakPolarHBondContact O-CB 3.37Å; S2180-N2184 PolarHBondContact O-N 3.13Å; F2181-N2184 PolarHBondContact O-N 2.9Å; A2182-N2184 PolarHBondContact O-N 3.33Å
2185	M	49	Very low	52.1	Low	104 Å²	104	61.7 Å²	61.7	51%	0.512	34%	0.34	S	S	.	.	S	Bend	trans	-73.4	141	168.9	-66.3	-167.9	-179.7	0	0	110.6	F2181 A2182 E2187 L2188 G2189	F2181-M2185 HydrophobicContact CD1-CE 4.11Å; F2181-M2185 HydrophobicContact CE1-CE 3.89Å; F2181-M2185 PolarHBondContact O-N 2.97Å; A2182-M2185 WeakPolarHBondContact O-CB 3.28Å; A2182-M2185 PolarHBondContact O-N 2.84Å; M2185-E2187 PolarHBondContact O-N 3.02Å; M2185-E2187 VanDerWaalsContact O-N 3.1Å; M2185-L2188 HydrophobicContact CB-CB 4.47Å; M2185-L2188 PolarHBondContact O-N 2.89Å; M2185-G2189 PolarHBondContact O-N 2.96Å
2186	Q	46.5	Very low	52.3	Low	205 Å²	205	66.1 Å²	66.1	96%	0.958	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-57.1	-30.2	-177.6	-74.3	-176	-31.2	0	0	113.8	L2188	Q2186-L2188 VanDerWaalsContact C-N 3.25Å; Q2186-L2188 PolarHBondContact O-N 3.11Å
2187	E	44.7	Very low	52.9	Low	153 Å²	153	65.5 Å²	65.5	72%	0.715	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-74.9	-9.5	175.6	-61.2	-162.9	166.7	0	0	114.1	M2185 K2192	M2185-E2187 PolarHBondContact O-N 3.02Å; M2185-E2187 VanDerWaalsContact O-N 3.1Å; E2187-K2192 PolarHBondContact O-NZ 3.41Å
2188	L	48.5	Very low	53.4	Low	34 Å²	34	66.9 Å²	66.9	18%	0.178	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-125.8	7.4	-168.2	-112.3	79.1	0	0	0	115.4	A2182 M2185 Q2186 S2307	A2182-L2188 HydrophobicContact CB-CD2 4.09Å; A2182-L2188 WeakPolarHBondContact O-CB 3.47Å; A2182-L2188 WeakPolarHBondContact O-CD2 3.22Å; M2185-L2188 HydrophobicContact CB-CB 4.47Å; M2185-L2188 PolarHBondContact O-N 2.89Å; Q2186-L2188 VanDerWaalsContact C-N 3.25Å; Q2186-L2188 PolarHBondContact O-N 3.11Å; L2188-S2307 WeakPolarHBondContact CD2-OG 3.23Å
2189	G	47.6	Very low	54.2	Low	28 Å²	28	63.7 Å²	63.7	29%	0.289	33%	0.328	S	S	.	.			trans	-52.4	169.9	-165.6	0	0	0	0	0	119.3	M2185 D2191 K2192	M2185-G2189 PolarHBondContact O-N 2.96Å; G2189-D2191 VanDerWaalsContact C-N 3.26Å; G2189-D2191 PolarHBondContact O-N 2.78Å; G2189-K2192 WeakPolarHBondContact O-CB 3.09Å; G2189-K2192 WeakPolarHBondContact O-CG 3.41Å; G2189-K2192 PolarHBondContact O-N 2.87Å
2190	S	47.3	Very low	54.8	Low	85 Å²	85	66.1 Å²	66.1	59%	0.594	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-20.2	-52.5	-171.9	47.1	0	0	0	0	117.5	K2192 L2193	S2190-K2192 PolarHBondContact O-N 3.45Å; S2190-L2193 PolarHBondContact O-N 2.93Å
2191	D	48.7	Very low	55.1	Low	129 Å²	129	67.6 Å²	67.6	69%	0.69	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-70.6	11.1	-168.9	-43.7	-8.4	0	0	0	113.5	G2189	G2189-D2191 VanDerWaalsContact C-N 3.26Å; G2189-D2191 PolarHBondContact O-N 2.78Å
2192	K	54.9	Low	55.8	Low	49 Å²	49	61.3 Å²	61.3	21%	0.213	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-110.5	-7.9	-178	-63.4	-170.6	-169.1	-175.4	0	114.5	E2187 G2189 S2190 L2194 R2306	E2187-K2192 PolarHBondContact O-NZ 3.41Å; G2189-K2192 WeakPolarHBondContact O-CB 3.09Å; G2189-K2192 WeakPolarHBondContact O-CG 3.41Å; G2189-K2192 PolarHBondContact O-N 2.87Å; S2190-K2192 PolarHBondContact O-N 3.45Å; K2192-L2194 PolarHBondContact O-N 2.94Å; K2192-R2306 HydrophobicContact CB-CB 3.97Å; K2192-R2306 HydrophobicContact CG-CB 4.2Å; K2192-R2306 PolarHBondContact O-N 3.39Å
2193	L	60.8	Low	56.7	Low	13 Å²	13	60 Å²	60	7%	0.068	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	85.2	168.4	-166.4	87.4	0	0	0	109.5	I2175 L2183 S2190 P2209 W2282 L2305	I2175-L2193 HydrophobicContact CD1-CD1 4.04Å; I2175-L2193 HydrophobicContact CD1-CD2 3.6Å; I2175-L2193 HydrophobicContact CD1-CG 4.5Å; L2183-L2193 HydrophobicContact CD1-CD1 4.23Å; S2190-L2193 PolarHBondContact O-N 2.93Å; L2193-P2209 HydrophobicContact CD2-CB 4.03Å; L2193-P2209 HydrophobicContact CD2-CG 4.49Å; L2193-W2282 HydrophobicContact CD2-CD2 4.26Å; L2193-W2282 HydrophobicContact CD2-CE3 3.78Å; L2193-W2282 HydrophobicContact CD2-CH2 4.45Å; L2193-W2282 HydrophobicContact CD2-CZ3 3.89Å; L2193-L2305 HydrophobicContact CD1-CD1 3.7Å; L2193-L2305 HydrophobicContact CD1-CG 4.18Å
2194	L	62.7	Low	57.5	Low	34 Å²	34	62.9 Å²	62.9	18%	0.178	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	119.5	-179.6	-101.5	160.6	0	0	0	109.8	K2192 L2303 S2304	K2192-L2194 PolarHBondContact O-N 2.94Å; L2194-L2303 CarbonylContact O-C 3.5Å; L2194-L2303 WeakPolarHBondContact O-CA 3.44Å; L2194-S2304 WeakPolarHBondContact CB-OG 3.22Å; L2194-S2304 PolarHBondContact N-O 3.13Å; L2194-S2304 PolarHBondContact O-N 3.25Å; L2194-S2304 PolarHBondContact O-OG 2.85Å
2195	V	65.7	Low	58.2	Low	14 Å²	14	59.7 Å²	59.7	9%	0.085	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	132	171.6	-172.8	0	0	0	0	109.5	I2205 P2209 V2284 V2301 V2302 L2303	V2195-I2205 HydrophobicContact CB-CD1 4.36Å; V2195-I2205 HydrophobicContact CG1-CD1 3.73Å; V2195-P2209 HydrophobicContact CB-CG 3.68Å; V2195-P2209 HydrophobicContact CG2-CB 4.15Å; V2195-P2209 HydrophobicContact CG2-CG 3.27Å; V2195-V2284 HydrophobicContact CG1-CG1 4.45Å; V2195-V2284 HydrophobicContact CG1-CG2 4.37Å; V2195-V2284 HydrophobicContact CG2-CG2 4.48Å; V2195-V2301 HydrophobicContact CG1-CG1 3.31Å; V2195-V2302 CarbonylContact C-O 3.16Å; V2195-V2302 VanDerWaalsContact CA-O 3.27Å; V2195-V2302 WeakPolarHBondContact CA-O 3.21Å; V2195-L2303 HydrophobicContact CG1-CG 4.24Å; V2195-L2303 HydrophobicContact CG2-CB 4.21Å; V2195-L2303 HydrophobicContact CG2-CD2 3.56Å; V2195-L2303 HydrophobicContact CG2-CG 3.63Å
2196	R	61.2	Low	59.1	Low	99 Å²	99	57.8 Å²	57.8	37%	0.374	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	127.6	-178.1	-60.3	177.8	179	-165.7	-6.9	109.5	Q2198 V2301 V2302	R2196-Q2198 PolarHBondContact O-N 2.81Å; R2196-V2301 CarbonylContact O-C 3.56Å; R2196-V2301 WeakPolarHBondContact O-CA 3.1Å; R2196-V2302 PolarHBondContact N-O 3.37Å; R2196-V2302 PolarHBondContact O-N 2.94Å
2197	S	60.6	Low	60.1	Low	11 Å²	11	51.4 Å²	51.4	8%	0.077	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	132.9	152.5	173.7	0	0	0	0	107.3	F2199 L2203 I2205 V2299	S2197-F2199 PolarHBondContact O-N 2.85Å; S2197-F2199 VanDerWaalsContact O-N 3.11Å; S2197-F2199 WeakPolarHBondContact OG-CA 3.02Å; S2197-F2199 PolarHBondContact OG-N 2.66Å; S2197-F2199 PolarHBondContact OG-O 2.94Å; S2197-L2203 WeakPolarHBondContact CB-O 3.31Å; S2197-L2203 PolarHBondContact OG-O 3.32Å; S2197-I2205 VanDerWaalsContact N-CD1 3.31Å; S2197-V2299 WeakPolarHBondContact OG-CG1 3.27Å
2198	Q	58.7	Low	61	Low	62 Å²	62	48.3 Å²	48.3	29%	0.29	27%	0.267	S	S	.	.	S	Bend	trans	-55.9	-21.2	165.1	-85.1	-179.2	-4.4	0	0	110.9	R2196 N2300 V2302 E2313	R2196-Q2198 PolarHBondContact O-N 2.81Å; Q2198-N2300 HydrophobicContact CB-CB 4.49Å; Q2198-N2300 VanDerWaalsContact CD-CB 3.46Å; Q2198-N2300 HydrophobicContact CG-CB 3.87Å; Q2198-N2300 PolarHBondContact N-O 2.66Å; Q2198-N2300 PolarHBondContact OE1-ND2 2.85Å; Q2198-V2302 HydrophobicContact CG-CG2 3.77Å; Q2198-E2313 VanDerWaalsContact NE2-CD 3.29Å; Q2198-E2313 PolarHBondContact NE2-OE1 2.91Å; Q2198-E2313 PolarHBondContact NE2-OE2 2.94Å; Q2198-E2313 VanDerWaalsContact NE2-OE2 3.1Å
2199	F	62.9	Low	61.9	Low	13 Å²	13	47.9 Å²	47.9	6%	0.057	27%	0.266	C	S	.	.			trans	-139.7	69.1	-162.2	-46.9	-57.6	0	0	0	111.1	S1558 N1576 I1578 S2197 E2201 I2202 L2203 V2299	S1558-F2199 VanDerWaalsContact OG-CD1 3.24Å; S1558-F2199 WeakPolarHBondContact OG-CD1 3.48Å; N1576-F2199 VanDerWaalsContact ND2-CD2 3.29Å; N1576-F2199 WeakPolarHBondContact ND2-CD2 3.24Å; N1576-F2199 WeakPolarHBondContact ND2-CE2 3.4Å; I1578-F2199 HydrophobicContact CD1-CB 3.64Å; I1578-F2199 HydrophobicContact CD1-CD1 3.08Å; I1578-F2199 HydrophobicContact CD1-CD2 3.13Å; I1578-F2199 HydrophobicContact CD1-CE1 3.34Å; I1578-F2199 HydrophobicContact CD1-CE2 3.4Å; I1578-F2199 HydrophobicContact CD1-CG 2.97Å; I1578-F2199 HydrophobicContact CD1-CZ 3.51Å; I1578-F2199 HydrophobicContact CG1-CD1 4.48Å; I1578-F2199 HydrophobicContact CG1-CD2 4.49Å; I1578-F2199 HydrophobicContact CG1-CG 4.34Å; I1578-F2199 HydrophobicContact CG2-CB 3.88Å; I1578-F2199 HydrophobicContact CG2-CD1 4.41Å; I1578-F2199 HydrophobicContact CG2-CG 4.27Å; S2197-F2199 PolarHBondContact O-N 2.85Å; S2197-F2199 VanDerWaalsContact O-N 3.11Å; S2197-F2199 WeakPolarHBondContact OG-CA 3.02Å; S2197-F2199 PolarHBondContact OG-N 2.66Å; S2197-F2199 PolarHBondContact OG-O 2.94Å; F2199-E2201 PolarHBondContact O-N 3.39Å; F2199-I2202 PolarHBondContact O-N 2.87Å; F2199-L2203 PolarHBondContact O-N 3.02Å; F2199-V2299 HydrophobicContact CB-CG1 4.27Å; F2199-V2299 HydrophobicContact CD2-CB 4.4Å; F2199-V2299 HydrophobicContact CD2-CG1 4Å
2200	P	64.2	Low	63.2	Low	65 Å²	65	49.1 Å²	49.1	42%	0.422	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-14.5	-168.9	28.5	-36.9	0	0	0	114.6	T1581 I2202 E2204	T1581-P2200 HydrophobicContact CG2-CG 3.73Å; P2200-I2202 VanDerWaalsContact C-N 3.27Å; P2200-E2204 PolarHBondContact O-N 2.62Å
2201	E	62.1	Low	64.2	Low	36 Å²	36	47 Å²	47	17%	0.168	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-17.1	175.7	-163.9	176.4	-108.5	0	0	113.1	P1579 W1580 T1581 D1582 L1583 F2199 I2289	P1579-E2201 VanDerWaalsContact C-OE2 3.27Å; P1579-E2201 VanDerWaalsContact CB-OE2 3.29Å; P1579-E2201 WeakPolarHBondContact CB-OE2 3.5Å; P1579-E2201 VanDerWaalsContact O-OE2 3.12Å; W1580-E2201 VanDerWaalsContact O-OE2 3.06Å; T1581-E2201 WeakPolarHBondContact CA-OE1 3.47Å; T1581-E2201 WeakPolarHBondContact CA-OE2 3.48Å; T1581-E2201 HydrophobicContact CG2-CB 3.71Å; T1581-E2201 PolarHBondContact N-OE2 2.79Å; T1581-E2201 VanDerWaalsContact N-OE2 3.13Å; D1582-E2201 PolarHBondContact N-OE1 2.82Å; L1583-E2201 WeakPolarHBondContact CB-OE1 3.35Å; L1583-E2201 PolarHBondContact N-OE1 3.25Å; F2199-E2201 PolarHBondContact O-N 3.39Å; E2201-I2289 WeakPolarHBondContact O-CB 3.3Å
2202	I	67.6	Low	65.1	Low	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-60.1	168.6	-56.4	177.5	0	0	0	109.3	I1578 P1579 D1616 F2199 P2200 C2288 I2289 I2295 T2297 I2318	I1578-I2202 HydrophobicContact CB-CD1 4.06Å; I1578-I2202 HydrophobicContact CG1-CD1 4.24Å; I1578-I2202 HydrophobicContact CG2-CD1 3.34Å; I1578-I2202 HydrophobicContact CG2-CG1 3.82Å; P1579-I2202 HydrophobicContact CG-CD1 4.33Å; P1579-I2202 HydrophobicContact CG-CG1 3.9Å; D1616-I2202 HydrophobicContact CB-CG2 3.65Å; D1616-I2202 WeakPolarHBondContact OD1-CG2 3.37Å; F2199-I2202 PolarHBondContact O-N 2.87Å; P2200-I2202 VanDerWaalsContact C-N 3.27Å; I2202-C2288 VanDerWaalsContact O-CA 3.26Å; I2202-C2288 WeakPolarHBondContact O-CA 3.3Å; I2202-I2289 PolarHBondContact O-N 3.4Å; I2202-I2295 HydrophobicContact CD1-CD1 3.28Å; I2202-I2295 HydrophobicContact CG1-CD1 3.69Å; I2202-T2297 HydrophobicContact CD1-CG2 3.65Å; I2202-T2297 HydrophobicContact CG2-CG2 4.07Å; I2202-I2318 HydrophobicContact CG2-CD1 3.75Å
2203	L	69.6	Low	65.8	Low	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	84.1	-172.9	-167.8	83	0	0	0	109.4	S2197 F2199 V2286 V2299 V2301 I2318	S2197-L2203 WeakPolarHBondContact CB-O 3.31Å; S2197-L2203 PolarHBondContact OG-O 3.32Å; F2199-L2203 PolarHBondContact O-N 3.02Å; L2203-V2286 HydrophobicContact CD1-CB 3.7Å; L2203-V2286 HydrophobicContact CD1-CG1 4.03Å; L2203-V2286 HydrophobicContact CD1-CG2 4.2Å; L2203-V2286 HydrophobicContact CD2-CB 4.5Å; L2203-V2286 HydrophobicContact CD2-CG1 3.91Å; L2203-V2286 HydrophobicContact CG-CB 3.95Å; L2203-V2286 HydrophobicContact CG-CG1 3.76Å; L2203-V2299 HydrophobicContact CB-CG1 3.84Å; L2203-V2299 HydrophobicContact CD2-CB 4.22Å; L2203-V2299 HydrophobicContact CD2-CG1 3.69Å; L2203-V2299 HydrophobicContact CG-CG1 4.43Å; L2203-V2301 HydrophobicContact CD2-CG2 3.63Å; L2203-I2318 HydrophobicContact CB-CD1 4.02Å; L2203-I2318 HydrophobicContact CD1-CD1 3.58Å; L2203-I2318 HydrophobicContact CD1-CG1 4.15Å; L2203-I2318 HydrophobicContact CG-CD1 4.3Å
2204	E	69.6	Low	66.1	Low	76 Å²	76	48.1 Å²	48.1	36%	0.355	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.9	175.5	179.7	-175	-159.8	0	0	109.8	P2200 V2206 V2286 K2287 I2289	P2200-E2204 PolarHBondContact O-N 2.62Å; E2204-V2206 PolarHBondContact O-N 2.95Å; E2204-V2286 CarbonylContact O-C 3.49Å; E2204-V2286 VanDerWaalsContact O-CA 3.31Å; E2204-V2286 WeakPolarHBondContact O-CA 3.3Å; E2204-K2287 HydrophobicContact CB-CB 4.29Å; E2204-K2287 PolarHBondContact N-O 2.68Å; E2204-K2287 PolarHBondContact O-N 2.9Å; E2204-K2287 WeakPolarHBondContact OE2-CD 3Å; E2204-K2287 WeakPolarHBondContact OE2-CE 3.33Å; E2204-K2287 IonicContact OE2-NZ 2.88Å; E2204-K2287 PolarHBondContact OE2-NZ 3.02Å; E2204-I2289 HydrophobicContact CB-CD1 4.33Å
2205	I	70.2	Confident	66.2	Low	42 Å²	42	48.6 Å²	48.6	22%	0.215	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	97.2	172.7	-62.8	-174.2	0	0	0	108.8	V2195 S2197 Q2207 V2284 Q2285 V2286 V2301	V2195-I2205 HydrophobicContact CB-CD1 4.36Å; V2195-I2205 HydrophobicContact CG1-CD1 3.73Å; S2197-I2205 VanDerWaalsContact N-CD1 3.31Å; I2205-Q2207 VanDerWaalsContact C-N 3.27Å; I2205-Q2207 WeakPolarHBondContact CG2-O 3.04Å; I2205-Q2207 PolarHBondContact O-N 2.91Å; I2205-V2284 HydrophobicContact CD1-CG1 4.22Å; I2205-V2284 HydrophobicContact CG1-CG1 4.44Å; I2205-V2284 HydrophobicContact CG2-CG1 3.9Å; I2205-Q2285 CarbonylContact C-O 3.25Å; I2205-Q2285 WeakPolarHBondContact CA-O 3.07Å; I2205-V2286 HydrophobicContact CG1-CG1 4.04Å; I2205-V2301 HydrophobicContact CD1-CG1 4.33Å
2206	V	67.8	Low	66.4	Low	64 Å²	64	53 Å²	53	39%	0.388	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	-30.1	-172.8	-168.3	0	0	0	0	112.8	E2204 Q2285 K2287	E2204-V2206 PolarHBondContact O-N 2.95Å; V2206-Q2285 HydrophobicContact CB-CB 4.2Å; V2206-Q2285 HydrophobicContact CB-CG 3.97Å; V2206-Q2285 HydrophobicContact CG2-CG 4.21Å; V2206-Q2285 PolarHBondContact N-O 3.44Å; V2206-K2287 HydrophobicContact CG2-CB 3.29Å
2207	Q	67.7	Low	66.8	Low	71 Å²	71	49.7 Å²	49.7	33%	0.332	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	136.8	-171.9	-163.2	164.4	98.9	0	0	110.3	I2205 Q2285	I2205-Q2207 VanDerWaalsContact C-N 3.27Å; I2205-Q2207 WeakPolarHBondContact CG2-O 3.04Å; I2205-Q2207 PolarHBondContact O-N 2.91Å; Q2207-Q2285 HydrophobicContact CB-CB 3.83Å
2208	S	61.8	Low	67	Low	88 Å²	88	50.1 Å²	50.1	62%	0.615	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.2	145.7	174.4	54.6	0	0	0	0	111	R2210	S2208-R2210 PolarHBondContact O-N 2.76Å
2209	P	68.6	Low	67.5	Low	24 Å²	24	47.5 Å²	47.5	16%	0.156	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	127.7	175.9	-18	28.3	0	0	0	109.9	L2193 V2195 W2282 L2283 V2284	L2193-P2209 HydrophobicContact CD2-CB 4.03Å; L2193-P2209 HydrophobicContact CD2-CG 4.49Å; V2195-P2209 HydrophobicContact CB-CG 3.68Å; V2195-P2209 HydrophobicContact CG2-CB 4.15Å; V2195-P2209 HydrophobicContact CG2-CG 3.27Å; P2209-W2282 HydrophobicContact CB-CE3 3.82Å; P2209-W2282 HydrophobicContact CB-CZ3 4.21Å; P2209-W2282 WeakPolarHBondContact O-CZ3 3.43Å; P2209-L2283 WeakPolarHBondContact CA-O 3.41Å; P2209-V2284 HydrophobicContact CB-CG2 4.18Å; P2209-V2284 HydrophobicContact CG-CG2 4.32Å
2210	R	73.9	Confident	67.8	Low	54 Å²	54	50.4 Å²	50.4	20%	0.204	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.4	176.4	60.6	173.7	174	87.1	-8.1	110.8	S2208 E2217 W2282 L2283	S2208-R2210 PolarHBondContact O-N 2.76Å; R2210-E2217 IonicContact CZ-OE1 2.7Å; R2210-E2217 VanDerWaalsContact CZ-OE1 3.26Å; R2210-E2217 IonicContact CZ-OE2 3.73Å; R2210-E2217 VanDerWaalsContact NH1-CD 3.28Å; R2210-E2217 IonicContact NH1-OE1 3.85Å; R2210-E2217 PolarHBondContact NH1-OE1 2.8Å; R2210-E2217 IonicContact NH1-OE2 3.64Å; R2210-E2217 PolarHBondContact NH1-OE2 3.41Å; R2210-E2217 IonicContact NH2-OE1 3.09Å; R2210-E2217 PolarHBondContact NH2-OE1 3.06Å; R2210-W2282 CarbonylContact O-C 3.52Å; R2210-W2282 VanDerWaalsContact O-CA 3.29Å; R2210-W2282 WeakPolarHBondContact O-CA 3.13Å; R2210-L2283 HydrophobicContact CG-CB 4.39Å; R2210-L2283 PolarHBondContact N-O 2.85Å; R2210-L2283 VanDerWaalsContact NH2-CD2 3.35Å; R2210-L2283 PolarHBondContact O-N 3.26Å
2211	P	69.4	Low	68	Low	40 Å²	40	47.6 Å²	47.6	26%	0.26	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	142.5	168	24.4	-32.8	0	0	0	110.4	Q2213 Q2279 L2281	P2211-Q2213 PolarHBondContact O-N 3.46Å; P2211-Q2279 HydrophobicContact CB-CB 4.29Å; P2211-Q2279 HydrophobicContact CB-CG 4.38Å; P2211-L2281 CarbonylContact C-O 3.52Å; P2211-L2281 VanDerWaalsContact CA-O 3.27Å; P2211-L2281 WeakPolarHBondContact CA-O 3.47Å
2212	V	67.5	Low	68.2	Low	12 Å²	12	47.6 Å²	47.6	7%	0.073	25%	0.254	C	S	.	.			trans	-64.1	130.9	176.6	174	0	0	0	0	109	L2172 S2214 E2217 V2218 L2276 L2281 L2283	L2172-V2212 HydrophobicContact CD1-CG2 4.03Å; V2212-S2214 VanDerWaalsContact CG1-O 3.26Å; V2212-S2214 WeakPolarHBondContact CG1-O 3.48Å; V2212-E2217 HydrophobicContact CG1-CB 4.31Å; V2212-V2218 HydrophobicContact CG1-CG2 3.96Å; V2212-L2276 WeakPolarHBondContact O-CD2 3.19Å; V2212-L2281 HydrophobicContact CB-CB 4.21Å; V2212-L2281 HydrophobicContact CG2-CB 3.97Å; V2212-L2281 PolarHBondContact N-O 3.31Å; V2212-L2283 HydrophobicContact CG2-CB 4.2Å
2213	Q	69.3	Low	68.2	Low	152 Å²	152	51 Å²	51	71%	0.71	27%	0.269	S	S	*	.			trans	-93.4	-21.5	-170.2	-66.8	-171.1	-4.9	0	0	114.2	P2211 E2217	P2211-Q2213 PolarHBondContact O-N 3.46Å; Q2213-E2217 PolarHBondContact N-OE2 2.76Å
2214	S	66.8	Low	68	Low	52 Å²	52	53.2 Å²	53.2	36%	0.364	28%	0.279	S	S	.	.			trans	-151.3	159.1	175	71.7	0	0	0	0	111.7	V2212 L2216 E2217	V2212-S2214 VanDerWaalsContact CG1-O 3.26Å; V2212-S2214 WeakPolarHBondContact CG1-O 3.48Å; S2214-L2216 VanDerWaalsContact C-N 3.26Å; S2214-L2216 PolarHBondContact O-N 3.03Å; S2214-E2217 WeakPolarHBondContact O-CB 3.49Å; S2214-E2217 PolarHBondContact O-N 2.63Å; S2214-E2217 PolarHBondContact OG-N 3.44Å
2215	L	65.9	Low	67.7	Low	44 Å²	44	52.4 Å²	52.4	23%	0.23	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-30.8	173.1	-72.7	157.8	0	0	0	111.9	E2217 V2218 V2219 I2260 I2263 E2264	L2215-E2217 PolarHBondContact O-N 2.96Å; L2215-V2218 WeakPolarHBondContact O-CB 3.44Å; L2215-V2218 PolarHBondContact O-N 2.73Å; L2215-V2219 PolarHBondContact O-N 3.09Å; L2215-I2260 HydrophobicContact CB-CD1 4.45Å; L2215-I2260 HydrophobicContact CB-CG2 4.33Å; L2215-I2260 HydrophobicContact CD2-CG1 4.46Å; L2215-I2263 HydrophobicContact CD1-CB 4.37Å; L2215-I2263 HydrophobicContact CD1-CG2 3.53Å; L2215-E2264 HydrophobicContact CD1-CG 4.49Å
2216	L	69	Low	67.3	Low	107 Å²	107	53 Å²	53	56%	0.56	28%	0.281	S	S	*	.	H	α-helix	trans	-58.4	-36.2	174.7	-161.2	75.4	0	0	0	112.3	S2214 V2218 V2219 D2220	S2214-L2216 VanDerWaalsContact C-N 3.26Å; S2214-L2216 PolarHBondContact O-N 3.03Å; L2216-V2218 PolarHBondContact O-N 2.85Å; L2216-V2219 WeakPolarHBondContact O-CB 3.28Å; L2216-V2219 PolarHBondContact O-N 2.8Å; L2216-V2219 VanDerWaalsContact O-N 3.11Å; L2216-D2220 PolarHBondContact O-N 3.4Å; L2216-D2220 VanDerWaalsContact O-N 3.16Å
2217	E	69.3	Low	67.1	Low	29 Å²	29	58 Å²	58	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-28.2	175.7	-176.2	163.1	-126.5	0	0	112.3	R2210 V2212 Q2213 S2214 L2215 I2221	R2210-E2217 IonicContact CZ-OE1 2.7Å; R2210-E2217 VanDerWaalsContact CZ-OE1 3.26Å; R2210-E2217 IonicContact CZ-OE2 3.73Å; R2210-E2217 VanDerWaalsContact NH1-CD 3.28Å; R2210-E2217 IonicContact NH1-OE1 3.85Å; R2210-E2217 PolarHBondContact NH1-OE1 2.8Å; R2210-E2217 IonicContact NH1-OE2 3.64Å; R2210-E2217 PolarHBondContact NH1-OE2 3.41Å; R2210-E2217 IonicContact NH2-OE1 3.09Å; R2210-E2217 PolarHBondContact NH2-OE1 3.06Å; V2212-E2217 HydrophobicContact CG1-CB 4.31Å; Q2213-E2217 PolarHBondContact N-OE2 2.76Å; S2214-E2217 WeakPolarHBondContact O-CB 3.49Å; S2214-E2217 PolarHBondContact O-N 2.63Å; S2214-E2217 PolarHBondContact OG-N 3.44Å; L2215-E2217 PolarHBondContact O-N 2.96Å; E2217-I2221 WeakPolarHBondContact O-CD1 3.29Å; E2217-I2221 WeakPolarHBondContact O-CG1 3.33Å
2218	V	65	Low	66.5	Low	20 Å²	20	54.8 Å²	54.8	12%	0.121	28%	0.278	C	S	.	.	H	α-helix	trans	-75.7	-37.3	174.5	-171.4	0	0	0	0	111.6	L2172 V2212 L2215 L2216 I2221 Y2222	L2172-V2218 HydrophobicContact CD1-CG2 4.49Å; L2172-V2218 HydrophobicContact CD2-CG1 3.96Å; V2212-V2218 HydrophobicContact CG1-CG2 3.96Å; L2215-V2218 WeakPolarHBondContact O-CB 3.44Å; L2215-V2218 PolarHBondContact O-N 2.73Å; L2216-V2218 PolarHBondContact O-N 2.85Å; V2218-I2221 PolarHBondContact O-N 3.18Å; V2218-Y2222 PolarHBondContact O-N 3.31Å
2219	V	69.6	Low	66.1	Low	7 Å²	7	54 Å²	54	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-45.8	178.7	178.4	0	0	0	0	111.4	L2215 L2216 I2221 Y2222 K2223 I2260	L2215-V2219 PolarHBondContact O-N 3.09Å; L2216-V2219 WeakPolarHBondContact O-CB 3.28Å; L2216-V2219 PolarHBondContact O-N 2.8Å; L2216-V2219 VanDerWaalsContact O-N 3.11Å; V2219-I2221 VanDerWaalsContact C-N 3.29Å; V2219-I2221 PolarHBondContact O-N 3.28Å; V2219-Y2222 PolarHBondContact O-N 3.31Å; V2219-K2223 HydrophobicContact CG1-CD 3.96Å; V2219-K2223 VanDerWaalsContact CG1-CE 3.44Å; V2219-K2223 VanDerWaalsContact CG1-NZ 3.3Å; V2219-K2223 WeakPolarHBondContact O-CG 3.32Å; V2219-K2223 PolarHBondContact O-N 2.6Å; V2219-I2260 HydrophobicContact CG2-CD1 3.36Å
2220	D	69.4	Low	65.6	Low	73 Å²	73	56.7 Å²	56.7	39%	0.39	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-36.9	-178.1	-77	-14.8	0	0	0	111.8	L2216 K2223 E2224	L2216-D2220 PolarHBondContact O-N 3.4Å; L2216-D2220 VanDerWaalsContact O-N 3.16Å; D2220-K2223 PolarHBondContact O-N 3.01Å; D2220-E2224 WeakPolarHBondContact O-CB 3.03Å; D2220-E2224 PolarHBondContact O-N 3Å
2221	I	67.4	Low	64.6	Low	6 Å²	6	56.5 Å²	56.5	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-47	176.2	-63.2	166.4	0	0	0	110.5	R2170 L2172 E2217 V2218 V2219 K2223 E2224 Y2225 L2283	R2170-I2221 HydrophobicContact CB-CD1 3.87Å; R2170-I2221 HydrophobicContact CB-CG1 3.67Å; R2170-I2221 HydrophobicContact CB-CG2 4.29Å; R2170-I2221 HydrophobicContact CG-CG1 4.43Å; R2170-I2221 WeakPolarHBondContact O-CG2 3.45Å; L2172-I2221 HydrophobicContact CD1-CD1 3.92Å; E2217-I2221 WeakPolarHBondContact O-CD1 3.29Å; E2217-I2221 WeakPolarHBondContact O-CG1 3.33Å; V2218-I2221 PolarHBondContact O-N 3.18Å; V2219-I2221 VanDerWaalsContact C-N 3.29Å; V2219-I2221 PolarHBondContact O-N 3.28Å; I2221-K2223 VanDerWaalsContact C-N 3.28Å; I2221-K2223 PolarHBondContact O-N 3.15Å; I2221-E2224 VanDerWaalsContact O-CB 3.29Å; I2221-E2224 WeakPolarHBondContact O-CB 3.29Å; I2221-E2224 PolarHBondContact O-N 3.3Å; I2221-E2224 VanDerWaalsContact O-N 3.08Å; I2221-Y2225 HydrophobicContact CG2-CD2 3.98Å; I2221-Y2225 HydrophobicContact CG2-CE2 3.74Å; I2221-Y2225 VanDerWaalsContact O-CD2 3.28Å; I2221-Y2225 WeakPolarHBondContact O-CD2 3.29Å; I2221-Y2225 PolarHBondContact O-N 2.98Å; I2221-L2283 HydrophobicContact CD1-CD1 3.38Å
2222	Y	66.5	Low	63.5	Low	36 Å²	36	56.3 Å²	56.3	14%	0.141	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-36	176.9	-111.1	-77.1	0	0	0	112.6	V2218 V2219 S2226 W2252 L2253 V2256	V2218-Y2222 PolarHBondContact O-N 3.31Å; V2219-Y2222 PolarHBondContact O-N 3.31Å; Y2222-S2226 WeakPolarHBondContact O-CB 2.91Å; Y2222-S2226 PolarHBondContact O-N 2.93Å; Y2222-W2252 HydrophobicContact CE1-CB 4.39Å; Y2222-W2252 VanDerWaalsContact OH-CE3 3.26Å; Y2222-L2253 HydrophobicContact CD1-CD1 4.28Å; Y2222-V2256 HydrophobicContact CD2-CG2 4.41Å; Y2222-V2256 HydrophobicContact CE2-CG2 4.22Å
2223	K	67.9	Low	62.5	Low	73 Å²	73	61.5 Å²	61.5	32%	0.317	32%	0.317	S	S	.	.	H	α-helix	trans	-68.5	-34.3	172.7	-71.2	170.5	-179.6	169.4	0	112.7	V2219 D2220 I2221 S2226 R2227 H2257	V2219-K2223 HydrophobicContact CG1-CD 3.96Å; V2219-K2223 VanDerWaalsContact CG1-CE 3.44Å; V2219-K2223 VanDerWaalsContact CG1-NZ 3.3Å; V2219-K2223 WeakPolarHBondContact O-CG 3.32Å; V2219-K2223 PolarHBondContact O-N 2.6Å; D2220-K2223 PolarHBondContact O-N 3.01Å; I2221-K2223 VanDerWaalsContact C-N 3.28Å; I2221-K2223 PolarHBondContact O-N 3.15Å; K2223-S2226 PolarHBondContact O-N 3.29Å; K2223-R2227 PolarHBondContact O-N 2.84Å; K2223-H2257 PolarHBondContact NZ-NE2 2.94Å
2224	E	66.4	Low	61.1	Low	47 Å²	47	59.2 Å²	59.2	22%	0.22	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-46.3	175.6	-157.7	167.4	-96	0	0	110.9	R2169 R2170 D2220 I2221 R2227	R2169-E2224 VanDerWaalsContact NH1-C 3.33Å; R2169-E2224 PolarHBondContact NH1-O 2.91Å; R2170-E2224 IonicContact CZ-OE1 2.79Å; R2170-E2224 IonicContact NE-OE1 3.24Å; R2170-E2224 IonicContact NE-OE2 3.8Å; R2170-E2224 IonicContact NH2-OE1 2.81Å; R2170-E2224 PolarHBondContact NH2-OE1 2.79Å; R2170-E2224 IonicContact NH2-OE2 3.82Å; D2220-E2224 WeakPolarHBondContact O-CB 3.03Å; D2220-E2224 PolarHBondContact O-N 3Å; I2221-E2224 VanDerWaalsContact O-CB 3.29Å; I2221-E2224 WeakPolarHBondContact O-CB 3.29Å; I2221-E2224 PolarHBondContact O-N 3.3Å; I2221-E2224 VanDerWaalsContact O-N 3.08Å; E2224-R2227 PolarHBondContact O-N 3.02Å
2225	Y	62	Low	59.6	Low	59 Å²	59	60.4 Å²	60.4	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-47.1	171	-79.9	-80	0	0	0	112.9	F2159 I2221 R2227 S2228 F2229	F2159-Y2225 HydrophobicContact CD1-CD1 4.19Å; F2159-Y2225 AromaticContact CD1-CE1 3.62Å; F2159-Y2225 HydrophobicContact CD1-CE1 3.62Å; F2159-Y2225 AromaticContact CD2-CE1 3.77Å; F2159-Y2225 HydrophobicContact CD2-CE1 3.77Å; F2159-Y2225 HydrophobicContact CE1-CD1 4.05Å; F2159-Y2225 AromaticContact CE1-CE1 3.46Å; F2159-Y2225 HydrophobicContact CE1-CE1 3.46Å; F2159-Y2225 VanDerWaalsContact CE1-CE1 3.46Å; F2159-Y2225 AromaticContact CE1-CZ 3.84Å; F2159-Y2225 AromaticContact CE2-CE1 3.67Å; F2159-Y2225 HydrophobicContact CE2-CE1 3.67Å; F2159-Y2225 AromaticContact CE2-CZ 3.5Å; F2159-Y2225 VanDerWaalsContact CE2-CZ 3.5Å; F2159-Y2225 WeakPolarHBondContact CE2-OH 3.42Å; F2159-Y2225 AromaticContact CG-CE1 3.76Å; F2159-Y2225 HydrophobicContact CG-CE1 3.76Å; F2159-Y2225 HydrophobicContact CZ-CD1 4.43Å; F2159-Y2225 AromaticContact CZ-CE1 3.5Å; F2159-Y2225 HydrophobicContact CZ-CE1 3.5Å; F2159-Y2225 HydrophobicContact CZ-CE2 4.2Å; F2159-Y2225 AromaticContact CZ-CZ 3.38Å; F2159-Y2225 VanDerWaalsContact CZ-OH 3.29Å; F2159-Y2225 WeakPolarHBondContact CZ-OH 3.29Å; I2221-Y2225 HydrophobicContact CG2-CD2 3.98Å; I2221-Y2225 HydrophobicContact CG2-CE2 3.74Å; I2221-Y2225 VanDerWaalsContact O-CD2 3.28Å; I2221-Y2225 WeakPolarHBondContact O-CD2 3.29Å; I2221-Y2225 PolarHBondContact O-N 2.98Å; Y2225-R2227 PolarHBondContact O-N 2.68Å; Y2225-S2228 PolarHBondContact O-N 2.74Å; Y2225-S2228 PolarHBondContact O-OG 3.28Å; Y2225-F2229 PolarHBondContact O-N 2.82Å
2226	S	62.9	Low	58.1	Low	54 Å²	54	64.1 Å²	64.1	38%	0.378	36%	0.361	S	S	.	.	H	α-helix	trans	-57.5	-33.3	-177.5	173.1	0	0	0	0	112.7	Y2222 K2223	Y2222-S2226 WeakPolarHBondContact O-CB 2.91Å; Y2222-S2226 PolarHBondContact O-N 2.93Å; K2223-S2226 PolarHBondContact O-N 3.29Å
2227	R	62.1	Low	56.4	Low	170 Å²	170	64.3 Å²	64.3	64%	0.642	37%	0.367	S	S	*	.	H	α-helix	trans	-71.5	-50.4	178.7	-73.9	179.1	-177.9	155.4	2.1	113.6	K2223 E2224 Y2225 F2229 S2230 S2231	K2223-R2227 PolarHBondContact O-N 2.84Å; E2224-R2227 PolarHBondContact O-N 3.02Å; Y2225-R2227 PolarHBondContact O-N 2.68Å; R2227-F2229 PolarHBondContact O-N 3.16Å; R2227-S2230 WeakPolarHBondContact O-CA 3.15Å; R2227-S2230 WeakPolarHBondContact O-CB 3.4Å; R2227-S2230 PolarHBondContact O-N 2.74Å; R2227-S2230 PolarHBondContact O-OG 2.8Å; R2227-S2231 PolarHBondContact O-N 2.88Å
2228	S	55.9	Low	55	Low	3 Å²	3	66.1 Å²	66.1	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-65.7	-28.4	-178	53	0	0	0	0	112.9	W2160 T2162 R2169 Y2225 S2230	W2160-S2228 WeakPolarHBondContact O-CB 3.09Å; W2160-S2228 PolarHBondContact O-OG 3.04Å; T2162-S2228 PolarHBondContact OG1-O 3.15Å; R2169-S2228 PolarHBondContact NH1-OG 2.87Å; R2169-S2228 VanDerWaalsContact NH1-OG 3.11Å; Y2225-S2228 PolarHBondContact O-N 2.74Å; Y2225-S2228 PolarHBondContact O-OG 3.28Å; S2228-S2230 PolarHBondContact O-N 2.89Å
2229	F	53.9	Low	53.7	Low	73 Å²	73	70.6 Å²	70.6	32%	0.32	42%	0.417	S	S	.	.	H	α-helix	trans	-65.5	-20	171.9	-139.8	-84.5	0	0	0	113.3	Y2225 R2227 L2233 V2245 L2249	Y2225-F2229 PolarHBondContact O-N 2.82Å; R2227-F2229 PolarHBondContact O-N 3.16Å; F2229-L2233 VanDerWaalsContact O-CD1 3.23Å; F2229-L2233 WeakPolarHBondContact O-CD1 3.3Å; F2229-V2245 HydrophobicContact CE1-CG1 3.72Å; F2229-V2245 HydrophobicContact CZ-CG1 3.85Å; F2229-L2249 HydrophobicContact CD1-CD1 3.92Å; F2229-L2249 HydrophobicContact CD2-CD1 4.14Å; F2229-L2249 HydrophobicContact CE1-CD1 4.15Å; F2229-L2249 HydrophobicContact CE2-CD1 4.35Å; F2229-L2249 HydrophobicContact CG-CD1 3.91Å; F2229-L2249 HydrophobicContact CZ-CD1 4.36Å
2230	S	57.1	Low	52.1	Low	79 Å²	79	74.8 Å²	74.8	55%	0.552	45%	0.446	S	S	*	.	H	α-helix	trans	-95.6	-33.4	-177	73.9	0	0	0	0	114.7	R2227 S2228 S2232 L2233	R2227-S2230 WeakPolarHBondContact O-CA 3.15Å; R2227-S2230 WeakPolarHBondContact O-CB 3.4Å; R2227-S2230 PolarHBondContact O-N 2.74Å; R2227-S2230 PolarHBondContact O-OG 2.8Å; S2228-S2230 PolarHBondContact O-N 2.89Å; S2230-S2232 VanDerWaalsContact C-N 3.32Å; S2230-S2232 PolarHBondContact O-N 3.39Å; S2230-L2233 WeakPolarHBondContact O-CD1 2.98Å
2231	S	53.2	Low	50.5	Low	50 Å²	50	76.9 Å²	76.9	35%	0.35	45%	0.449	S	S	.	.	H	α-helix	trans	-76	-19	-179.3	44.1	0	0	0	0	113.7	E2163 R2227 L2233	E2163-S2231 WeakPolarHBondContact CG-OG 3.44Å; E2163-S2231 VanDerWaalsContact OE1-CB 3.26Å; E2163-S2231 WeakPolarHBondContact OE1-CB 3.43Å; E2163-S2231 PolarHBondContact OE1-OG 2.93Å; R2227-S2231 PolarHBondContact O-N 2.88Å; S2231-L2233 VanDerWaalsContact C-N 3.27Å; S2231-L2233 PolarHBondContact O-N 2.68Å
2232	S	47.4	Very low	48.9	Very low	37 Å²	37	81 Å²	81	26%	0.259	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-64.7	-20	179.8	-164.6	0	0	0	0	115	S2230 A2234	S2230-S2232 VanDerWaalsContact C-N 3.32Å; S2230-S2232 PolarHBondContact O-N 3.39Å; S2232-A2234 VanDerWaalsContact C-N 3.33Å; S2232-A2234 PolarHBondContact O-N 3.23Å
2233	L	46.3	Very low	47.6	Very low	121 Å²	121	83.9 Å²	83.9	63%	0.634	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-77.4	-4.3	-166.3	-77.8	86.5	0	0	0	116	F2229 S2230 S2231 S2235	F2229-L2233 VanDerWaalsContact O-CD1 3.23Å; F2229-L2233 WeakPolarHBondContact O-CD1 3.3Å; S2230-L2233 WeakPolarHBondContact O-CD1 2.98Å; S2231-L2233 VanDerWaalsContact C-N 3.27Å; S2231-L2233 PolarHBondContact O-N 2.68Å; L2233-S2235 PolarHBondContact O-N 2.97Å
2234	A	40.1	Very low	46.2	Very low	103 Å²	103	84.4 Å²	84.4	85%	0.851	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-85.3	-4.1	-166.9	0	0	0	0	0	116.2	S2232	S2232-A2234 VanDerWaalsContact C-N 3.33Å; S2232-A2234 PolarHBondContact O-N 3.23Å
2235	S	35.4	Very low	44.9	Very low	77 Å²	77	83.5 Å²	83.5	54%	0.538	51%	0.509	S	S	.	.	S	Bend	trans	-100.8	143.6	-176.7	-167.9	0	0	0	0	112.9	L2233 T2237	L2233-S2235 PolarHBondContact O-N 2.97Å; S2235-T2237 PolarHBondContact O-N 3.23Å
2236	S	32.9	Very low	44.3	Very low	122 Å²	122	85 Å²	85	85%	0.853	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	28.7	-160.4	69.3	0	0	0	0	116.4
2237	T	34.2	Very low	43.6	Very low	112 Å²	112	86.2 Å²	86.2	69%	0.687	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.2	4.2	-176.5	52.8	0	0	0	0	114	S2235	S2235-T2237 PolarHBondContact O-N 3.23Å
2238	L	40	Very low	42.7	Very low	67 Å²	67	83.2 Å²	83.2	35%	0.351	52%	0.523	S	S	.	.			trans	-116.7	13.4	-168.6	-81.4	158.1	0	0	0	115.2	S2240 Y2241	L2238-S2240 PolarHBondContact O-N 3.05Å; L2238-Y2241 HydrophobicContact CD2-CD2 4.16Å; L2238-Y2241 HydrophobicContact CD2-CE2 3.83Å
2239	A	37.1	Very low	42.3	Very low	114 Å²	114	86 Å²	86	94%	0.942	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	14.8	-170.1	0	0	0	0	0	116.5
2240	S	36.9	Very low	42.3	Very low	94 Å²	94	85.9 Å²	85.9	66%	0.657	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	6.9	-172.8	53.9	0	0	0	0	115.5	L2238	L2238-S2240 PolarHBondContact O-N 3.05Å
2241	Y	35	Very low	42	Very low	117 Å²	117	86.8 Å²	86.8	46%	0.459	54%	0.541	S	S	.	.			trans	-75.7	129.4	176.3	-94	-82.7	0	0	0	112.8	L2238	L2238-Y2241 HydrophobicContact CD2-CD2 4.16Å; L2238-Y2241 HydrophobicContact CD2-CE2 3.83Å
2242	P	33	Very low	41.9	Very low	92 Å²	92	86.7 Å²	86.7	60%	0.597	53%	0.533	S	S	*	.			trans	-66.6	152.9	169.4	-20.9	33.8	0	0	0	113.1	T2244	P2242-T2244 PolarHBondContact O-N 2.93Å
2243	S	39.6	Very low	42.4	Very low	97 Å²	97	87.3 Å²	87.3	68%	0.678	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	11.5	-173	60.4	0	0	0	0	116.2	T2246	S2243-T2246 PolarHBondContact O-OG1 2.95Å
2244	T	38.6	Very low	43	Very low	85 Å²	85	87.1 Å²	87.1	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-88.2	-29.4	-173.4	47.3	0	0	0	0	113.8	P2242 T2246 T2247 E2248	P2242-T2244 PolarHBondContact O-N 2.93Å; T2244-T2246 VanDerWaalsContact C-N 3.31Å; T2244-T2246 PolarHBondContact O-N 2.82Å; T2244-T2247 WeakPolarHBondContact CA-OG1 3.26Å; T2244-T2247 PolarHBondContact O-N 2.83Å; T2244-T2247 PolarHBondContact O-OG1 3.09Å; T2244-E2248 PolarHBondContact O-N 3.19Å
2245	V	40.1	Very low	43.5	Very low	28 Å²	28	84.4 Å²	84.4	17%	0.17	50%	0.499	C	S	.	.	H	α-helix	trans	-67.9	-33.6	-179.2	-176.1	0	0	0	0	111.4	F2229 L2249	F2229-V2245 HydrophobicContact CE1-CG1 3.72Å; F2229-V2245 HydrophobicContact CZ-CG1 3.85Å; V2245-L2249 PolarHBondContact O-N 3.01Å
2246	T	47.7	Very low	44.2	Very low	90 Å²	90	81.8 Å²	81.8	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-72.8	-30.5	175.8	48.2	0	0	0	0	112.8	S2243 T2244 S2250	S2243-T2246 PolarHBondContact O-OG1 2.95Å; T2244-T2246 VanDerWaalsContact C-N 3.31Å; T2244-T2246 PolarHBondContact O-N 2.82Å; T2246-S2250 PolarHBondContact O-N 2.96Å
2247	T	48.9	Very low	45.5	Very low	79 Å²	79	80.6 Å²	80.6	49%	0.485	46%	0.461	S	S	.	.	H	α-helix	trans	-72.3	-44.7	175.3	43.6	0	0	0	0	112.2	T2244 L2249 S2250 H2251	T2244-T2247 WeakPolarHBondContact CA-OG1 3.26Å; T2244-T2247 PolarHBondContact O-N 2.83Å; T2244-T2247 PolarHBondContact O-OG1 3.09Å; T2247-L2249 PolarHBondContact O-N 3.02Å; T2247-S2250 PolarHBondContact O-N 3.19Å; T2247-S2250 VanDerWaalsContact O-N 3.14Å; T2247-S2250 PolarHBondContact O-OG 2.76Å; T2247-H2251 PolarHBondContact O-N 3Å
2248	E	42.6	Very low	46.6	Very low	108 Å²	108	79.5 Å²	79.5	51%	0.505	45%	0.448	S	S	.	.	H	α-helix	trans	-57.1	-49.8	178	-82.3	-60.3	140.3	0	0	112.8	T2244 S2250 H2251 W2252	T2244-E2248 PolarHBondContact O-N 3.19Å; E2248-S2250 VanDerWaalsContact C-N 3.28Å; E2248-S2250 PolarHBondContact O-N 3.16Å; E2248-H2251 PolarHBondContact O-N 3.41Å; E2248-H2251 VanDerWaalsContact O-N 3.11Å; E2248-W2252 PolarHBondContact O-N 3.5Å
2249	L	48.1	Very low	47	Very low	60 Å²	60	79.1 Å²	79.1	31%	0.314	44%	0.444	S	S	.	.	H	α-helix	trans	-62.1	-34.2	177.1	-87.9	160.5	0	0	0	112.7	F2229 V2245 T2247 L2253	F2229-L2249 HydrophobicContact CD1-CD1 3.92Å; F2229-L2249 HydrophobicContact CD2-CD1 4.14Å; F2229-L2249 HydrophobicContact CE1-CD1 4.15Å; F2229-L2249 HydrophobicContact CE2-CD1 4.35Å; F2229-L2249 HydrophobicContact CG-CD1 3.91Å; F2229-L2249 HydrophobicContact CZ-CD1 4.36Å; V2245-L2249 PolarHBondContact O-N 3.01Å; T2247-L2249 PolarHBondContact O-N 3.02Å; L2249-L2253 PolarHBondContact O-N 3.07Å; L2249-L2253 VanDerWaalsContact O-N 3.14Å
2250	S	54.5	Low	47.7	Very low	71 Å²	71	74.4 Å²	74.4	50%	0.497	40%	0.403	S	S	.	.	H	α-helix	trans	-70.5	-34.9	174.6	78	0	0	0	0	112.6	T2246 T2247 E2248 L2253 H2254	T2246-S2250 PolarHBondContact O-N 2.96Å; T2247-S2250 PolarHBondContact O-N 3.19Å; T2247-S2250 VanDerWaalsContact O-N 3.14Å; T2247-S2250 PolarHBondContact O-OG 2.76Å; E2248-S2250 VanDerWaalsContact C-N 3.28Å; E2248-S2250 PolarHBondContact O-N 3.16Å; S2250-L2253 PolarHBondContact O-N 3.16Å; S2250-H2254 PolarHBondContact O-N 3.14Å
2251	H	51.2	Low	48.5	Very low	99 Å²	99	71.4 Å²	71.4	46%	0.458	39%	0.387	S	S	.	.	H	α-helix	trans	-71.9	-42.2	179.5	-156.8	-123.1	0	0	0	111	T2247 E2248 L2253 H2254 I2255	T2247-H2251 PolarHBondContact O-N 3Å; E2248-H2251 PolarHBondContact O-N 3.41Å; E2248-H2251 VanDerWaalsContact O-N 3.11Å; H2251-L2253 VanDerWaalsContact C-N 3.35Å; H2251-L2253 PolarHBondContact O-N 3.15Å; H2251-H2254 PolarHBondContact O-N 3.07Å; H2251-I2255 WeakPolarHBondContact O-CB 3.46Å; H2251-I2255 WeakPolarHBondContact O-CG1 3.27Å; H2251-I2255 PolarHBondContact O-N 2.74Å
2252	W	49.8	Very low	49.3	Very low	48 Å²	48	70.7 Å²	70.7	18%	0.182	39%	0.387	C	S	.	.	H	α-helix	trans	-58.9	-42.5	169.6	-94.6	91.4	0	0	0	112.7	L2028 W2031 Y2222 E2248 H2254 I2255 V2256	L2028-W2252 HydrophobicContact CD1-CH2 4.25Å; L2028-W2252 HydrophobicContact CD2-CH2 4.06Å; L2028-W2252 HydrophobicContact CG-CH2 4.1Å; W2031-W2252 HydrophobicContact CE3-CZ2 4.42Å; W2031-W2252 HydrophobicContact CZ3-CZ2 4.08Å; W2031-W2252 AromaticContact CZ3-NE1 3.92Å; Y2222-W2252 HydrophobicContact CE1-CB 4.39Å; Y2222-W2252 VanDerWaalsContact OH-CE3 3.26Å; E2248-W2252 PolarHBondContact O-N 3.5Å; W2252-H2254 VanDerWaalsContact C-N 3.33Å; W2252-H2254 PolarHBondContact O-N 3.04Å; W2252-I2255 PolarHBondContact O-N 2.61Å; W2252-V2256 HydrophobicContact CE3-CG2 4.2Å; W2252-V2256 WeakPolarHBondContact O-CB 3.27Å; W2252-V2256 VanDerWaalsContact O-CG2 3.29Å; W2252-V2256 WeakPolarHBondContact O-CG2 3.34Å; W2252-V2256 PolarHBondContact O-N 2.83Å
2253	L	58	Low	49.9	Very low	50 Å²	50	67.3 Å²	67.3	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-64.8	-37.4	176.9	-155.1	80.2	0	0	0	112	Y2222 L2249 S2250 H2251 H2257	Y2222-L2253 HydrophobicContact CD1-CD1 4.28Å; L2249-L2253 PolarHBondContact O-N 3.07Å; L2249-L2253 VanDerWaalsContact O-N 3.14Å; S2250-L2253 PolarHBondContact O-N 3.16Å; H2251-L2253 VanDerWaalsContact C-N 3.35Å; H2251-L2253 PolarHBondContact O-N 3.15Å; L2253-H2257 PolarHBondContact O-N 2.98Å; L2253-H2257 VanDerWaalsContact O-N 3.11Å
2254	H	60.2	Low	50.5	Low	117 Å²	117	67.5 Å²	67.5	54%	0.542	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-48.9	174.8	-167.4	-71.7	0	0	0	111.7	S2250 H2251 W2252 V2256 H2257 E2258	S2250-H2254 PolarHBondContact O-N 3.14Å; H2251-H2254 PolarHBondContact O-N 3.07Å; W2252-H2254 VanDerWaalsContact C-N 3.33Å; W2252-H2254 PolarHBondContact O-N 3.04Å; H2254-V2256 VanDerWaalsContact C-N 3.35Å; H2254-V2256 PolarHBondContact O-N 3.12Å; H2254-H2257 PolarHBondContact O-N 2.79Å; H2254-E2258 IonicContact CE1-OE2 2.76Å; H2254-E2258 IonicContact ND1-OE2 3.97Å; H2254-E2258 WeakPolarHBondContact O-CB 3.4Å; H2254-E2258 PolarHBondContact O-N 3.36Å
2255	I	50.8	Low	51.1	Low	46 Å²	46	68.9 Å²	68.9	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-42.7	178.6	-69.3	166.9	0	0	0	110.6	W2031 H2251 W2252 H2257 E2258 Q2259	W2031-I2255 HydrophobicContact CH2-CD1 3.94Å; H2251-I2255 WeakPolarHBondContact O-CB 3.46Å; H2251-I2255 WeakPolarHBondContact O-CG1 3.27Å; H2251-I2255 PolarHBondContact O-N 2.74Å; W2252-I2255 PolarHBondContact O-N 2.61Å; I2255-H2257 VanDerWaalsContact C-N 3.35Å; I2255-H2257 PolarHBondContact O-N 2.78Å; I2255-E2258 PolarHBondContact O-N 2.77Å; I2255-Q2259 HydrophobicContact CG2-CG 3.94Å; I2255-Q2259 WeakPolarHBondContact O-CB 3.35Å; I2255-Q2259 WeakPolarHBondContact O-CG 3.47Å; I2255-Q2259 PolarHBondContact O-N 3.39Å
2256	V	49.7	Very low	51.3	Low	22 Å²	22	73.1 Å²	73.1	13%	0.133	38%	0.379	C	S	.	.	H	α-helix	trans	-64.2	-38.1	176.6	170.2	0	0	0	0	111.4	Y2222 W2252 H2254 I2260	Y2222-V2256 HydrophobicContact CD2-CG2 4.41Å; Y2222-V2256 HydrophobicContact CE2-CG2 4.22Å; W2252-V2256 HydrophobicContact CE3-CG2 4.2Å; W2252-V2256 WeakPolarHBondContact O-CB 3.27Å; W2252-V2256 VanDerWaalsContact O-CG2 3.29Å; W2252-V2256 WeakPolarHBondContact O-CG2 3.34Å; W2252-V2256 PolarHBondContact O-N 2.83Å; H2254-V2256 VanDerWaalsContact C-N 3.35Å; H2254-V2256 PolarHBondContact O-N 3.12Å; V2256-I2260 HydrophobicContact CG1-CD1 3.81Å; V2256-I2260 VanDerWaalsContact O-CB 3.29Å; V2256-I2260 WeakPolarHBondContact O-CB 3.31Å; V2256-I2260 VanDerWaalsContact O-CG1 3.23Å; V2256-I2260 WeakPolarHBondContact O-CG1 3.48Å; V2256-I2260 PolarHBondContact O-N 2.77Å
2257	H	59.2	Low	51	Low	97 Å²	97	73.5 Å²	73.5	45%	0.449	38%	0.381	S	S	.	.	H	α-helix	trans	-69	-40.9	173.7	-103.9	-28.3	0	0	0	113	K2223 L2253 H2254 I2255 I2260 G2261	K2223-H2257 PolarHBondContact NZ-NE2 2.94Å; L2253-H2257 PolarHBondContact O-N 2.98Å; L2253-H2257 VanDerWaalsContact O-N 3.11Å; H2254-H2257 PolarHBondContact O-N 2.79Å; I2255-H2257 VanDerWaalsContact C-N 3.35Å; I2255-H2257 PolarHBondContact O-N 2.78Å; H2257-I2260 PolarHBondContact O-N 3.33Å; H2257-G2261 PolarHBondContact O-N 2.81Å
2258	E	57.9	Low	50.8	Low	89 Å²	89	76.4 Å²	76.4	42%	0.416	39%	0.392	S	S	.	.	H	α-helix	trans	-70.6	-40.4	-179.9	-163.4	-165.8	133.2	0	0	112.5	H2254 I2255 G2261 K2262	H2254-E2258 IonicContact CE1-OE2 2.76Å; H2254-E2258 IonicContact ND1-OE2 3.97Å; H2254-E2258 WeakPolarHBondContact O-CB 3.4Å; H2254-E2258 PolarHBondContact O-N 3.36Å; I2255-E2258 PolarHBondContact O-N 2.77Å; E2258-G2261 PolarHBondContact O-N 3.06Å; E2258-K2262 PolarHBondContact O-N 2.81Å; E2258-K2262 VanDerWaalsContact O-N 3.07Å; E2258-K2262 IonicContact OE1-NZ 3.67Å; E2258-K2262 PolarHBondContact OE1-NZ 3.27Å
2259	Q	48.4	Very low	50.6	Low	58 Å²	58	75 Å²	75	27%	0.271	40%	0.395	S	S	.	.	H	α-helix	trans	-68.2	-37.6	174.6	-70.5	-72.9	-25.9	0	0	111.4	I2255 K2262 I2263	I2255-Q2259 HydrophobicContact CG2-CG 3.94Å; I2255-Q2259 WeakPolarHBondContact O-CB 3.35Å; I2255-Q2259 WeakPolarHBondContact O-CG 3.47Å; I2255-Q2259 PolarHBondContact O-N 3.39Å; Q2259-K2262 PolarHBondContact O-N 3.04Å; Q2259-I2263 WeakPolarHBondContact O-CB 3.34Å; Q2259-I2263 WeakPolarHBondContact O-CD1 3.37Å; Q2259-I2263 WeakPolarHBondContact O-CG1 3.1Å; Q2259-I2263 PolarHBondContact O-N 3.28Å
2260	I	51.9	Low	49.9	Very low	15 Å²	15	79.1 Å²	79.1	8%	0.077	42%	0.417	C	S	.	.	H	α-helix	trans	-68.2	-36.1	175.2	-73.3	172.7	0	0	0	111.3	L2215 V2219 V2256 H2257 I2263 E2264	L2215-I2260 HydrophobicContact CB-CD1 4.45Å; L2215-I2260 HydrophobicContact CB-CG2 4.33Å; L2215-I2260 HydrophobicContact CD2-CG1 4.46Å; V2219-I2260 HydrophobicContact CG2-CD1 3.36Å; V2256-I2260 HydrophobicContact CG1-CD1 3.81Å; V2256-I2260 VanDerWaalsContact O-CB 3.29Å; V2256-I2260 WeakPolarHBondContact O-CB 3.31Å; V2256-I2260 VanDerWaalsContact O-CG1 3.23Å; V2256-I2260 WeakPolarHBondContact O-CG1 3.48Å; V2256-I2260 PolarHBondContact O-N 2.77Å; H2257-I2260 PolarHBondContact O-N 3.33Å; I2260-I2263 PolarHBondContact O-N 2.93Å; I2260-E2264 HydrophobicContact CG2-CG 4.26Å; I2260-E2264 WeakPolarHBondContact O-CB 3.32Å; I2260-E2264 WeakPolarHBondContact O-CG 3.37Å; I2260-E2264 PolarHBondContact O-N 2.91Å
2261	G	54	Low	48.9	Very low	32 Å²	32	83 Å²	83	33%	0.33	43%	0.432	S	S	.	.	H	α-helix	trans	-56.4	-51.6	168.5	0	0	0	0	0	112.2	H2257 E2258 I2263 E2264 D2265	H2257-G2261 PolarHBondContact O-N 2.81Å; E2258-G2261 PolarHBondContact O-N 3.06Å; G2261-I2263 VanDerWaalsContact C-N 3.35Å; G2261-I2263 PolarHBondContact O-N 3.23Å; G2261-E2264 PolarHBondContact O-N 2.93Å; G2261-D2265 PolarHBondContact O-N 2.77Å
2262	K	51.9	Low	48.2	Very low	102 Å²	102	82.8 Å²	82.8	44%	0.443	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-37.5	177.5	-74.3	165.9	174.7	166.3	0	113.4	E2258 Q2259 D2266	E2258-K2262 PolarHBondContact O-N 2.81Å; E2258-K2262 VanDerWaalsContact O-N 3.07Å; E2258-K2262 IonicContact OE1-NZ 3.67Å; E2258-K2262 PolarHBondContact OE1-NZ 3.27Å; Q2259-K2262 PolarHBondContact O-N 3.04Å; K2262-D2266 WeakPolarHBondContact O-CB 3.04Å; K2262-D2266 PolarHBondContact O-N 2.98Å
2263	I	44.9	Very low	47.9	Very low	21 Å²	21	84.3 Å²	84.3	11%	0.108	45%	0.45	C	S	.	.	H	α-helix	trans	-74.9	-34.1	178.4	-65.3	161.2	0	0	0	111.2	W2024 L2215 Q2259 I2260 G2261 V2267	W2024-I2263 HydrophobicContact CG-CD1 4.19Å; L2215-I2263 HydrophobicContact CD1-CB 4.37Å; L2215-I2263 HydrophobicContact CD1-CG2 3.53Å; Q2259-I2263 WeakPolarHBondContact O-CB 3.34Å; Q2259-I2263 WeakPolarHBondContact O-CD1 3.37Å; Q2259-I2263 WeakPolarHBondContact O-CG1 3.1Å; Q2259-I2263 PolarHBondContact O-N 3.28Å; I2260-I2263 PolarHBondContact O-N 2.93Å; G2261-I2263 VanDerWaalsContact C-N 3.35Å; G2261-I2263 PolarHBondContact O-N 3.23Å; I2263-V2267 HydrophobicContact CG2-CG2 4.3Å; I2263-V2267 VanDerWaalsContact O-CB 3.24Å; I2263-V2267 WeakPolarHBondContact O-CB 3.44Å; I2263-V2267 WeakPolarHBondContact O-CG2 3.17Å; I2263-V2267 PolarHBondContact O-N 2.92Å
2264	E	51.1	Low	47.4	Very low	100 Å²	100	82.8 Å²	82.8	47%	0.467	44%	0.443	S	S	.	.	H	α-helix	trans	-69.4	-35.8	172.9	-73.2	-175.7	155.3	0	0	111.5	L2215 I2260 G2261 I2268	L2215-E2264 HydrophobicContact CD1-CG 4.49Å; I2260-E2264 HydrophobicContact CG2-CG 4.26Å; I2260-E2264 WeakPolarHBondContact O-CB 3.32Å; I2260-E2264 WeakPolarHBondContact O-CG 3.37Å; I2260-E2264 PolarHBondContact O-N 2.91Å; G2261-E2264 PolarHBondContact O-N 2.93Å; E2264-I2268 WeakPolarHBondContact O-CD1 3.36Å; E2264-I2268 WeakPolarHBondContact O-CG1 3.46Å
2265	D	51.5	Low	46.8	Very low	114 Å²	114	79.3 Å²	79.3	61%	0.61	43%	0.428	S	S	*	.	H	α-helix	trans	-65.2	-51.4	169.8	-76.2	-32.3	0	0	0	112	G2261 V2267 I2268	G2261-D2265 PolarHBondContact O-N 2.77Å; D2265-V2267 VanDerWaalsContact C-N 3.27Å; D2265-V2267 PolarHBondContact O-N 2.78Å; D2265-I2268 WeakPolarHBondContact O-CB 3.4Å; D2265-I2268 PolarHBondContact O-N 3.28Å
2266	D	45.5	Very low	47.1	Very low	117 Å²	117	81.6 Å²	81.6	63%	0.626	44%	0.44	S	S	*	.	H	α-helix	trans	-62.2	-30.7	179.9	-82	-19.3	0	0	0	112.8	K2262 I2268 S2269	K2262-D2266 WeakPolarHBondContact O-CB 3.04Å; K2262-D2266 PolarHBondContact O-N 2.98Å; D2266-I2268 PolarHBondContact O-N 2.73Å; D2266-S2269 PolarHBondContact O-N 2.68Å
2267	V	41.2	Very low	47.1	Very low	98 Å²	98	86.5 Å²	86.5	59%	0.594	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.4	177.1	161.4	0	0	0	0	112.6	I2263 D2265	I2263-V2267 HydrophobicContact CG2-CG2 4.3Å; I2263-V2267 VanDerWaalsContact O-CB 3.24Å; I2263-V2267 WeakPolarHBondContact O-CB 3.44Å; I2263-V2267 WeakPolarHBondContact O-CG2 3.17Å; I2263-V2267 PolarHBondContact O-N 2.92Å; D2265-V2267 VanDerWaalsContact C-N 3.27Å; D2265-V2267 PolarHBondContact O-N 2.78Å
2268	I	44.5	Very low	46.9	Very low	140 Å²	140	84.6 Å²	84.6	72%	0.718	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-18.6	179.5	-67.9	165.8	0	0	0	112.1	E2264 D2265 D2266	E2264-I2268 WeakPolarHBondContact O-CD1 3.36Å; E2264-I2268 WeakPolarHBondContact O-CG1 3.46Å; D2265-I2268 WeakPolarHBondContact O-CB 3.4Å; D2265-I2268 PolarHBondContact O-N 3.28Å; D2266-I2268 PolarHBondContact O-N 2.73Å
2269	S	39	Very low	47.2	Very low	80 Å²	80	83.8 Å²	83.8	56%	0.559	45%	0.447	S	S	*	.	S	Bend	trans	-116.8	60.4	-168.4	61.7	0	0	0	0	115.9	D2266	D2266-S2269 PolarHBondContact O-N 2.68Å
2270	D	31.9	Very low	47.7	Very low	146 Å²	146	81.4 Å²	81.4	78%	0.781	44%	0.437	S	S	*	.	S	Bend	trans	69.9	140.1	164.2	-81.9	-45.4	0	0	0	120.8
2271	L	34	Very low	48.3	Very low	153 Å²	153	82.1 Å²	82.1	80%	0.801	44%	0.441	S	S	*	.	S	Bend	trans	70.3	27.9	146.4	-71.6	166.4	0	0	0	122.5
2272	N	36.1	Very low	49.1	Very low	93 Å²	93	81.5 Å²	81.5	50%	0.497	43%	0.428	S	S	.	.				176.3	115.7	123.6	-101.2	-64.3	0	0	0	114	S2274	N2272-S2274 PolarHBondContact O-N 2.95Å
2273	P	44.6	Very low	50.2	Low	81 Å²	81	76.7 Å²	76.7	53%	0.526	41%	0.407	S	S	.	.			trans	-82.5	59.8	177	34.5	-36.1	0	0	0	112.1	I2275 K2277	P2273-I2275 PolarHBondContact O-N 2.99Å; P2273-K2277 HydrophobicContact CG-CD 4.25Å; P2273-K2277 WeakPolarHBondContact O-CB 3.42Å; P2273-K2277 PolarHBondContact O-N 2.9Å
2274	S	46.9	Very low	51.5	Low	17 Å²	17	75.8 Å²	75.8	12%	0.119	40%	0.403	C	S	.	.	H	α-helix	trans	-61.6	-40.2	-163.7	59	0	0	0	0	114.7	S2019 N2272 K2277 H2278	S2019-S2274 PolarHBondContact O-OG 2.83Å; N2272-S2274 PolarHBondContact O-N 2.95Å; S2274-K2277 PolarHBondContact O-N 3.43Å; S2274-H2278 WeakPolarHBondContact O-CB 3.48Å; S2274-H2278 PolarHBondContact O-N 2.89Å; S2274-H2278 PolarHBondContact O-ND1 2.94Å
2275	I	48.4	Very low	52.6	Low	44 Å²	44	73.2 Å²	73.2	23%	0.226	39%	0.391	C	S	.	.	H	α-helix	trans	-63	-52.4	-172.1	-49.4	171.5	0	0	0	112.4	P2022 W2024 P2273 V2280 L2281	P2022-I2275 HydrophobicContact CB-CD1 4.15Å; P2022-I2275 HydrophobicContact CG-CD1 3.44Å; P2022-I2275 VanDerWaalsContact CG-CD1 3.44Å; P2022-I2275 HydrophobicContact CG-CG1 3.46Å; P2022-I2275 VanDerWaalsContact CG-CG1 3.46Å; W2024-I2275 HydrophobicContact CZ2-CD1 4.16Å; P2273-I2275 PolarHBondContact O-N 2.99Å; I2275-V2280 WeakPolarHBondContact O-CG2 3.17Å; I2275-V2280 PolarHBondContact O-N 3.08Å; I2275-L2281 HydrophobicContact CG2-CD1 4.1Å
2276	L	56.7	Low	53.6	Low	94 Å²	94	68 Å²	68	49%	0.492	36%	0.363	S	S	.	.	H	α-helix	trans	-73.4	-39	179.4	-75	159.4	0	0	0	111	V2212 H2278 Q2279	V2212-L2276 WeakPolarHBondContact O-CD2 3.19Å; L2276-H2278 VanDerWaalsContact C-N 3.33Å; L2276-H2278 PolarHBondContact O-N 2.91Å; L2276-Q2279 PolarHBondContact O-N 2.94Å; L2276-Q2279 VanDerWaalsContact O-N 3.14Å
2277	K	49.9	Very low	54.8	Low	126 Å²	126	65.7 Å²	65.7	55%	0.548	35%	0.347	S	S	.	.	H	α-helix	trans	-65.4	-31.3	-178.3	-174.8	177.1	175.9	-175.4	0	113.7	P2273 S2274	P2273-K2277 HydrophobicContact CG-CD 4.25Å; P2273-K2277 WeakPolarHBondContact O-CB 3.42Å; P2273-K2277 PolarHBondContact O-N 2.9Å; S2274-K2277 PolarHBondContact O-N 3.43Å
2278	H	55.4	Low	56.1	Low	56 Å²	56	61 Å²	61	26%	0.259	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	11.6	176	-59.4	91.9	0	0	0	113.3	S2180 S2274 L2276 V2280	S2180-H2278 WeakPolarHBondContact CB-O 3.34Å; S2180-H2278 PolarHBondContact OG-O 2.95Å; S2274-H2278 WeakPolarHBondContact O-CB 3.48Å; S2274-H2278 PolarHBondContact O-N 2.89Å; S2274-H2278 PolarHBondContact O-ND1 2.94Å; L2276-H2278 VanDerWaalsContact C-N 3.33Å; L2276-H2278 PolarHBondContact O-N 2.91Å; H2278-V2280 VanDerWaalsContact C-N 3.29Å; H2278-V2280 HydrophobicContact CB-CG2 3.63Å; H2278-V2280 PolarHBondContact O-N 3.35Å
2279	Q	63	Low	57.2	Low	73 Å²	73	56.5 Å²	56.5	34%	0.341	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	47.9	174.8	-59.6	-178.1	5.7	0	0	113.1	P2211 L2276 W2282	P2211-Q2279 HydrophobicContact CB-CB 4.29Å; P2211-Q2279 HydrophobicContact CB-CG 4.38Å; L2276-Q2279 PolarHBondContact O-N 2.94Å; L2276-Q2279 VanDerWaalsContact O-N 3.14Å; Q2279-W2282 PolarHBondContact O-NE1 3.02Å
2280	V	59.5	Low	58.2	Low	8 Å²	8	54.7 Å²	54.7	5%	0.048	28%	0.282	C	S	.	.			trans	-86.9	-26.1	-168.1	-156.7	0	0	0	0	112.4	F2174 I2175 P2177 I2275 H2278	F2174-V2280 WeakPolarHBondContact CA-O 3.4Å; F2174-V2280 HydrophobicContact CD1-CG1 4.4Å; F2174-V2280 HydrophobicContact CD2-CG1 3.91Å; F2174-V2280 HydrophobicContact CE1-CG1 3.82Å; F2174-V2280 HydrophobicContact CE2-CB 4.19Å; F2174-V2280 HydrophobicContact CE2-CG1 3.27Å; F2174-V2280 HydrophobicContact CG-CG1 4.45Å; F2174-V2280 HydrophobicContact CZ-CG1 3.23Å; I2175-V2280 PolarHBondContact N-O 3.11Å; I2175-V2280 WeakPolarHBondContact O-CG1 3.4Å; P2177-V2280 HydrophobicContact CG-CG1 4.26Å; P2177-V2280 HydrophobicContact CG-CG2 4.47Å; I2275-V2280 WeakPolarHBondContact O-CG2 3.17Å; I2275-V2280 PolarHBondContact O-N 3.08Å; H2278-V2280 VanDerWaalsContact C-N 3.29Å; H2278-V2280 HydrophobicContact CB-CG2 3.63Å; H2278-V2280 PolarHBondContact O-N 3.35Å
2281	L	64.1	Low	59.6	Low	30 Å²	30	47.8 Å²	47.8	16%	0.157	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	135	172.8	-92.2	88.1	0	0	0	112	W2024 L2172 F2174 P2211 V2212 I2275	W2024-L2281 HydrophobicContact CH2-CD1 4.32Å; L2172-L2281 HydrophobicContact CD2-CD2 3.8Å; L2172-L2281 HydrophobicContact CG-CD2 4.19Å; F2174-L2281 HydrophobicContact CD2-CD1 4.05Å; F2174-L2281 HydrophobicContact CE2-CD1 4.42Å; P2211-L2281 CarbonylContact C-O 3.52Å; P2211-L2281 VanDerWaalsContact CA-O 3.27Å; P2211-L2281 WeakPolarHBondContact CA-O 3.47Å; V2212-L2281 HydrophobicContact CB-CB 4.21Å; V2212-L2281 HydrophobicContact CG2-CB 3.97Å; V2212-L2281 PolarHBondContact N-O 3.31Å; I2275-L2281 HydrophobicContact CG2-CD1 4.1Å
2282	W	71.4	Confident	60.7	Low	18 Å²	18	41 Å²	41	7%	0.068	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.1	179.3	-70.1	63.4	0	0	0	111.2	I2173 I2175 L2193 P2209 R2210 Q2279	I2173-W2282 HydrophobicContact CB-CB 4.43Å; I2173-W2282 PolarHBondContact N-O 3.5Å; I2173-W2282 PolarHBondContact O-N 3.42Å; I2175-W2282 HydrophobicContact CD1-CD2 3.91Å; I2175-W2282 HydrophobicContact CD1-CG 3.78Å; I2175-W2282 HydrophobicContact CG1-CG 4.28Å; L2193-W2282 HydrophobicContact CD2-CD2 4.26Å; L2193-W2282 HydrophobicContact CD2-CE3 3.78Å; L2193-W2282 HydrophobicContact CD2-CH2 4.45Å; L2193-W2282 HydrophobicContact CD2-CZ3 3.89Å; P2209-W2282 HydrophobicContact CB-CE3 3.82Å; P2209-W2282 HydrophobicContact CB-CZ3 4.21Å; P2209-W2282 WeakPolarHBondContact O-CZ3 3.43Å; R2210-W2282 CarbonylContact O-C 3.52Å; R2210-W2282 VanDerWaalsContact O-CA 3.29Å; R2210-W2282 WeakPolarHBondContact O-CA 3.13Å; Q2279-W2282 PolarHBondContact O-NE1 3.02Å
2283	L	75.2	Confident	61.3	Low	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.6	179.2	-171.1	75.2	0	0	0	110	R2170 L2172 P2209 R2210 V2212 I2221	R2170-L2283 HydrophobicContact CB-CD1 4.15Å; R2170-L2283 HydrophobicContact CG-CD1 4.46Å; L2172-L2283 HydrophobicContact CD1-CD1 4.13Å; P2209-L2283 WeakPolarHBondContact CA-O 3.41Å; R2210-L2283 HydrophobicContact CG-CB 4.39Å; R2210-L2283 PolarHBondContact N-O 2.85Å; R2210-L2283 VanDerWaalsContact NH2-CD2 3.35Å; R2210-L2283 PolarHBondContact O-N 3.26Å; V2212-L2283 HydrophobicContact CG2-CB 4.2Å; I2221-L2283 HydrophobicContact CD1-CD1 3.38Å
2284	V	72.3	Confident	61.7	Low	1 Å²	1	32.7 Å²	32.7	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.2	168.2	176	0	0	0	0	108.3	L2171 I2173 V2195 I2205 P2209 V2286	L2171-V2284 PolarHBondContact N-O 2.99Å; L2171-V2284 PolarHBondContact O-N 2.73Å; I2173-V2284 HydrophobicContact CD1-CB 4.24Å; I2173-V2284 HydrophobicContact CD1-CG2 3.49Å; I2173-V2284 VanDerWaalsContact CD1-CG2 3.49Å; I2173-V2284 HydrophobicContact CG1-CG2 4.41Å; V2195-V2284 HydrophobicContact CG1-CG1 4.45Å; V2195-V2284 HydrophobicContact CG1-CG2 4.37Å; V2195-V2284 HydrophobicContact CG2-CG2 4.48Å; I2205-V2284 HydrophobicContact CD1-CG1 4.22Å; I2205-V2284 HydrophobicContact CG1-CG1 4.44Å; I2205-V2284 HydrophobicContact CG2-CG1 3.9Å; P2209-V2284 HydrophobicContact CB-CG2 4.18Å; P2209-V2284 HydrophobicContact CG-CG2 4.32Å; V2284-V2286 HydrophobicContact CG1-CG1 4.28Å
2285	Q	73.5	Confident	62.1	Low	47 Å²	47	31.9 Å²	31.9	22%	0.22	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	130.8	177.6	-168.3	177.8	0.8	0	0	109.5	R2170 I2205 V2206 Q2207	R2170-Q2285 HydrophobicContact CG-CG 4.36Å; I2205-Q2285 CarbonylContact C-O 3.25Å; I2205-Q2285 WeakPolarHBondContact CA-O 3.07Å; V2206-Q2285 HydrophobicContact CB-CB 4.2Å; V2206-Q2285 HydrophobicContact CB-CG 3.97Å; V2206-Q2285 HydrophobicContact CG2-CG 4.21Å; V2206-Q2285 PolarHBondContact N-O 3.44Å; Q2207-Q2285 HydrophobicContact CB-CB 3.83Å
2286	V	72	Confident	62.7	Low	5 Å²	5	29.8 Å²	29.8	3%	0.03	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138	-174.1	-81.9	0	0	0	0	111	T2168 R2169 L2171 L2203 E2204 I2205 V2284	T2168-V2286 CarbonylContact C-O 3.54Å; T2168-V2286 WeakPolarHBondContact CA-O 3.38Å; R2169-V2286 HydrophobicContact CB-CG2 4.41Å; R2169-V2286 PolarHBondContact N-O 3.01Å; R2169-V2286 PolarHBondContact O-N 2.89Å; R2169-V2286 VanDerWaalsContact O-O 3.08Å; L2171-V2286 HydrophobicContact CB-CG2 4.5Å; L2203-V2286 HydrophobicContact CD1-CB 3.7Å; L2203-V2286 HydrophobicContact CD1-CG1 4.03Å; L2203-V2286 HydrophobicContact CD1-CG2 4.2Å; L2203-V2286 HydrophobicContact CD2-CB 4.5Å; L2203-V2286 HydrophobicContact CD2-CG1 3.91Å; L2203-V2286 HydrophobicContact CG-CB 3.95Å; L2203-V2286 HydrophobicContact CG-CG1 3.76Å; E2204-V2286 CarbonylContact O-C 3.49Å; E2204-V2286 VanDerWaalsContact O-CA 3.31Å; E2204-V2286 WeakPolarHBondContact O-CA 3.3Å; I2205-V2286 HydrophobicContact CG1-CG1 4.04Å; V2284-V2286 HydrophobicContact CG1-CG1 4.28Å
2287	K	71.2	Confident	62.3	Low	67 Å²	67	25.3 Å²	25.3	29%	0.291	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.4	-179.5	165.3	169.7	158.9	-73.4	0	109.4	T2168 E2204 V2206	T2168-K2287 HydrophobicContact CG2-CB 4Å; T2168-K2287 HydrophobicContact CG2-CD 4.23Å; T2168-K2287 HydrophobicContact CG2-CG 4.23Å; E2204-K2287 HydrophobicContact CB-CB 4.29Å; E2204-K2287 PolarHBondContact N-O 2.68Å; E2204-K2287 PolarHBondContact O-N 2.9Å; E2204-K2287 WeakPolarHBondContact OE2-CD 3Å; E2204-K2287 WeakPolarHBondContact OE2-CE 3.33Å; E2204-K2287 IonicContact OE2-NZ 2.88Å; E2204-K2287 PolarHBondContact OE2-NZ 3.02Å; V2206-K2287 HydrophobicContact CG2-CB 3.29Å
2288	C	68.7	Low	62.5	Low	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	146.8	169.3	-66.5	0	0	0	0	110.7	D1616 I2161 F2167 I2202 I2318 I2320	D1616-C2288 WeakPolarHBondContact OD1-CB 3.27Å; D1616-C2288 PolarHBondContact OD1-SG 2.82Å; I2161-C2288 VanDerWaalsContact CD1-SG 3.6Å; F2167-C2288 HydrophobicContact CB-CB 4.09Å; F2167-C2288 WeakPolarHBondContact CB-O 3.11Å; F2167-C2288 HydrophobicContact CD1-CB 4.33Å; F2167-C2288 PolarHBondContact O-N 3.28Å; I2202-C2288 VanDerWaalsContact O-CA 3.26Å; I2202-C2288 WeakPolarHBondContact O-CA 3.3Å; C2288-I2318 WeakPolarHBondContact SG-CG2 3.25Å; C2288-I2320 HydrophobicContact CB-CD1 3.74Å; C2288-I2320 HydrophobicContact CB-CG1 4.2Å
2289	I	67.3	Low	62.7	Low	45 Å²	45	16.7 Å²	16.7	23%	0.231	8%	0.083	C	C	.	.			trans	-112.4	110.9	179.3	-59.6	-176.6	0	0	0	107.1	E2201 I2202 E2204 I2320	E2201-I2289 WeakPolarHBondContact O-CB 3.3Å; I2202-I2289 PolarHBondContact O-N 3.4Å; E2204-I2289 HydrophobicContact CB-CD1 4.33Å; I2289-I2320 WeakPolarHBondContact O-CD1 3.39Å
2290	P	60.3	Low	62.5	Low	43 Å²	43	13.2 Å²	13.2	28%	0.279	7%	0.067	S	C	.	.			trans	-74.1	-159.4	-165.7	33.3	-39.3	0	0	0	114	I1588 F2167 I2320	I1588-P2290 WeakPolarHBondContact CG2-O 3.19Å; F2167-P2290 HydrophobicContact CD1-CB 4.42Å; F2167-P2290 HydrophobicContact CD2-CB 4.22Å; F2167-P2290 HydrophobicContact CD2-CG 4.05Å; F2167-P2290 HydrophobicContact CE1-CB 3.97Å; F2167-P2290 HydrophobicContact CE2-CB 3.72Å; F2167-P2290 HydrophobicContact CE2-CG 3.82Å; F2167-P2290 HydrophobicContact CZ-CB 3.6Å; F2167-P2290 HydrophobicContact CZ-CG 4.23Å; P2290-I2320 HydrophobicContact CB-CD1 4.44Å; P2290-I2320 HydrophobicContact CB-CG2 3.62Å
2291	G	60.7	Low	62.6	Low	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.064	C	C	.	.			trans	-171.2	164.6	-154.9	0	0	0	0	0	129.7	I1588 L1589 S2322 L2323	I1588-G2291 VanDerWaalsContact CB-C 3.49Å; L1589-G2291 CarbonylContact C-O 3.57Å; L1589-G2291 VanDerWaalsContact CA-C 3.45Å; L1589-G2291 CarbonylContact O-C 3.44Å; L1589-G2291 WeakPolarHBondContact O-CA 3.09Å; G2291-S2322 CarbonylContact O-C 3.6Å; G2291-S2322 VanDerWaalsContact O-C 3.26Å; G2291-S2322 WeakPolarHBondContact O-CA 3.39Å; G2291-S2322 WeakPolarHBondContact O-CB 3.48Å; G2291-L2323 WeakPolarHBondContact O-CB 3.42Å; G2291-L2323 WeakPolarHBondContact O-CD1 3.09Å; G2291-L2323 PolarHBondContact O-N 3.38Å
2292	D	58.4	Low	62.5	Low	10 Å²	10	12 Å²	12	5%	0.053	6%	0.061	C	C	.	.	S	Bend	trans	-130.5	29.6	143.8	58.8	-150.2	0	0	0	122.2	I1588 L1589 Q1590 Q1639 M1641 L2323 N2324	I1588-D2292 VanDerWaalsContact CB-N 3.3Å; I1588-D2292 VanDerWaalsContact CD1-OD1 3.26Å; I1588-D2292 WeakPolarHBondContact CD1-OD1 3.48Å; I1588-D2292 VanDerWaalsContact CG1-OD2 3.28Å; I1588-D2292 WeakPolarHBondContact CG1-OD2 3.14Å; I1588-D2292 CarbonylContact O-C 3.47Å; I1588-D2292 WeakPolarHBondContact O-CA 3.49Å; I1588-D2292 PolarHBondContact O-N 2.82Å; I1588-D2292 VanDerWaalsContact O-N 3.07Å; I1588-D2292 VanDerWaalsContact O-OD2 3.13Å; L1589-D2292 PolarHBondContact O-N 3.36Å; Q1590-D2292 WeakPolarHBondContact CA-O 3.17Å; Q1590-D2292 HydrophobicContact CB-CB 3.96Å; Q1590-D2292 WeakPolarHBondContact CB-O 3.14Å; Q1639-D2292 CarbonylContact C-O 3.56Å; M1641-D2292 WeakPolarHBondContact CA-OD2 3.26Å; M1641-D2292 HydrophobicContact CB-CB 4.41Å; M1641-D2292 VanDerWaalsContact CB-CG 3.4Å; M1641-D2292 WeakPolarHBondContact CB-OD2 3.34Å; M1641-D2292 HydrophobicContact CE-CB 4.26Å; M1641-D2292 WeakPolarHBondContact CE-O 3.31Å; M1641-D2292 HydrophobicContact CG-CB 3.9Å; M1641-D2292 VanDerWaalsContact CG-CG 3.41Å; M1641-D2292 VanDerWaalsContact CG-OD2 3.31Å; M1641-D2292 WeakPolarHBondContact CG-OD2 3.41Å; M1641-D2292 PolarHBondContact N-OD2 3.3Å; M1641-D2292 HydrophobicContact SD-CB 4Å; D2292-L2323 HydrophobicContact CB-CB 4.08Å; D2292-N2324 HydrophobicContact CB-CB 4.44Å
2293	S	49	Very low	62	Low	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.058	C	C	.	.	S	Bend	trans	-99.8	0	146.3	25	0	0	0	0	131.9	I1588 L1589 Q1590 I1638 Q1639 S1640	I1588-S2293 PolarHBondContact O-N 3.36Å; I1588-S2293 PolarHBondContact O-OG 3.31Å; L1589-S2293 VanDerWaalsContact C-CA 3.41Å; L1589-S2293 VanDerWaalsContact CA-C 3.41Å; L1589-S2293 WeakPolarHBondContact CA-OG 3.33Å; L1589-S2293 VanDerWaalsContact CD2-OG 3.25Å; L1589-S2293 WeakPolarHBondContact CD2-OG 3.17Å; L1589-S2293 PolarHBondContact N-OG 3.33Å; Q1590-S2293 CarbonylContact C-O 3.57Å; Q1590-S2293 VanDerWaalsContact N-C 3.3Å; Q1590-S2293 VanDerWaalsContact N-CA 3.31Å; Q1590-S2293 CarbonylContact O-C 3.59Å; Q1590-S2293 WeakPolarHBondContact O-CA 2.97Å; I1638-S2293 CarbonylContact C-O 3.52Å; I1638-S2293 WeakPolarHBondContact CA-O 3.13Å; I1638-S2293 WeakPolarHBondContact CB-O 3.45Å; I1638-S2293 WeakPolarHBondContact CG2-O 3.44Å; Q1639-S2293 PolarHBondContact N-O 3.17Å; S1640-S2293 WeakPolarHBondContact CA-OG 3.49Å; S1640-S2293 VanDerWaalsContact CB-CB 3.43Å; S1640-S2293 WeakPolarHBondContact CB-OG 3.22Å; S1640-S2293 PolarHBondContact OG-OG 2.96Å; S1640-S2293 VanDerWaalsContact OG-OG 3.13Å
2294	P	52.2	Low	60.9	Low	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.				0	170.1	0	11.3	-11.1	0	0	0	120.8	L1589 Q1590 Y1591 P1615 I1638 I2320	L1589-P2294 VanDerWaalsContact C-N 3.28Å; L1589-P2294 HydrophobicContact CB-CB 4.15Å; L1589-P2294 VanDerWaalsContact CB-CD 3.43Å; L1589-P2294 HydrophobicContact CB-CG 3.96Å; L1589-P2294 WeakPolarHBondContact O-CD 3.27Å; Q1590-P2294 VanDerWaalsContact CA-N 3.32Å; Q1590-P2294 VanDerWaalsContact N-N 3.15Å; Y1591-P2294 VanDerWaalsContact CB-CG 3.4Å; Y1591-P2294 WeakPolarHBondContact CB-O 3.35Å; Y1591-P2294 WeakPolarHBondContact CD1-O 3.07Å; Y1591-P2294 HydrophobicContact CD2-CB 3.69Å; Y1591-P2294 HydrophobicContact CD2-CG 3.8Å; Y1591-P2294 VanDerWaalsContact CE1-C 3.41Å; Y1591-P2294 WeakPolarHBondContact CE1-O 3.44Å; Y1591-P2294 HydrophobicContact CE2-CB 4.01Å; Y1591-P2294 HydrophobicContact CG-CB 3.94Å; Y1591-P2294 HydrophobicContact CG-CG 3.99Å; P1615-P2294 HydrophobicContact CB-CB 4.36Å; P1615-P2294 HydrophobicContact CB-CG 3.73Å; P1615-P2294 VanDerWaalsContact O-CB 3.25Å; P1615-P2294 WeakPolarHBondContact O-CB 3.41Å; P1615-P2294 WeakPolarHBondContact O-CG 3.12Å; I1638-P2294 VanDerWaalsContact CA-O 3.32Å; I1638-P2294 WeakPolarHBondContact CA-O 3.41Å; I1638-P2294 WeakPolarHBondContact CG1-O 3.41Å; P2294-I2320 VanDerWaalsContact CG-O 3.28Å; P2294-I2320 WeakPolarHBondContact CG-O 3.46Å
2295	I	54.8	Low	60	Low	1 Å²	1	12.1 Å²	12.1	1%	0.005	6%	0.063	C	C	.	.			cis	80.3	94.2	7.3	106.3	149.5	0	0	0	118.9	L1577 P1579 L1589 Y1591 P1615 D1616 G1617 I1638 I2202	L1577-I2295 HydrophobicContact CB-CG2 4.47Å; L1577-I2295 VanDerWaalsContact O-CB 3.22Å; L1577-I2295 WeakPolarHBondContact O-CB 3.33Å; L1577-I2295 WeakPolarHBondContact O-CG2 3.22Å; P1579-I2295 HydrophobicContact CG-CD1 3.96Å; L1589-I2295 HydrophobicContact CB-CG1 4.48Å; L1589-I2295 HydrophobicContact CD1-CD1 3.43Å; L1589-I2295 VanDerWaalsContact CD1-CD1 3.43Å; L1589-I2295 HydrophobicContact CD1-CG1 3.63Å; L1589-I2295 HydrophobicContact CD2-CD1 3.7Å; L1589-I2295 HydrophobicContact CD2-CG1 3.84Å; L1589-I2295 HydrophobicContact CG-CD1 4.18Å; L1589-I2295 HydrophobicContact CG-CG1 4.19Å; Y1591-I2295 VanDerWaalsContact CZ-C 3.45Å; Y1591-I2295 PolarHBondContact OH-N 2.87Å; P1615-I2295 CarbonylContact C-O 3.5Å; P1615-I2295 WeakPolarHBondContact CA-O 3.41Å; D1616-I2295 CarbonylContact C-O 3.56Å; D1616-I2295 WeakPolarHBondContact CA-O 3.32Å; D1616-I2295 PolarHBondContact N-O 3.48Å; G1617-I2295 VanDerWaalsContact CA-CA 3.47Å; G1617-I2295 VanDerWaalsContact N-CD1 3.28Å; G1617-I2295 PolarHBondContact N-O 2.8Å; I1638-I2295 HydrophobicContact CD1-CG2 4.13Å; I1638-I2295 HydrophobicContact CG2-CG2 3.62Å; I2202-I2295 HydrophobicContact CD1-CD1 3.28Å; I2202-I2295 HydrophobicContact CG1-CD1 3.69Å
2296	D	61.2	Low	58.5	Low	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.065	C	C	.	.	B	Isolated β-bridge	trans	-110.4	0	157.3	141.5	74.2	0	0	0	105.8	Y1591 V1613 T1614 D1616 G1617 I1618 L1619 R2317	Y1591-D2296 HydrophobicContact CE2-CB 3.47Å; Y1591-D2296 VanDerWaalsContact CE2-CB 3.47Å; Y1591-D2296 WeakPolarHBondContact OH-CB 3.23Å; Y1591-D2296 PolarHBondContact OH-N 3.08Å; V1613-D2296 VanDerWaalsContact CA-CG 3.45Å; V1613-D2296 WeakPolarHBondContact CA-OD2 3.32Å; V1613-D2296 HydrophobicContact CB-CB 4.2Å; V1613-D2296 HydrophobicContact CG1-CB 3.6Å; T1614-D2296 VanDerWaalsContact CA-OD1 3.25Å; T1614-D2296 WeakPolarHBondContact CA-OD1 3.41Å; T1614-D2296 WeakPolarHBondContact CB-OD1 3.11Å; T1614-D2296 VanDerWaalsContact N-CB 3.31Å; T1614-D2296 PolarHBondContact N-OD1 3.28Å; T1614-D2296 WeakPolarHBondContact O-CA 3.34Å; T1614-D2296 VanDerWaalsContact O-CB 3.26Å; T1614-D2296 WeakPolarHBondContact O-CB 3.16Å; T1614-D2296 PolarHBondContact OG1-OD1 2.94Å; D1616-D2296 CarbonylContact O-C 3.59Å; D1616-D2296 WeakPolarHBondContact O-CA 3.34Å; G1617-D2296 CarbonylContact C-O 3.53Å; G1617-D2296 VanDerWaalsContact CA-CA 3.46Å; G1617-D2296 WeakPolarHBondContact CA-O 2.95Å; I1618-D2296 CarbonylContact C-O 3.57Å; I1618-D2296 WeakPolarHBondContact CA-O 3.45Å; I1618-D2296 HydrophobicContact CB-CB 4.24Å; I1618-D2296 VanDerWaalsContact CB-CG 3.42Å; I1618-D2296 WeakPolarHBondContact CB-O 3.44Å; I1618-D2296 WeakPolarHBondContact CB-OD2 3.48Å; I1618-D2296 HydrophobicContact CD1-CB 4.23Å; I1618-D2296 WeakPolarHBondContact CD1-OD1 3.41Å; I1618-D2296 HydrophobicContact CG1-CB 4.3Å; I1618-D2296 WeakPolarHBondContact CG1-OD1 3.42Å; I1618-D2296 PolarHBondContact N-O 2.91Å; L1619-D2296 WeakPolarHBondContact CA-OD2 3.36Å; L1619-D2296 HydrophobicContact CD1-CB 4.25Å; L1619-D2296 WeakPolarHBondContact CD1-OD2 3.49Å; D2296-R2317 IonicContact OD1-CZ 2.92Å; D2296-R2317 IonicContact OD1-NE 2.73Å; D2296-R2317 PolarHBondContact OD1-NE 2.86Å; D2296-R2317 VanDerWaalsContact OD1-NE 3.08Å; D2296-R2317 IonicContact OD1-NH2 3.61Å; D2296-R2317 PolarHBondContact OD1-NH2 3.48Å; D2296-R2317 IonicContact OD2-NH2 2.88Å; D2296-R2317 PolarHBondContact OD2-NH2 3.12Å
2297	T	48	Very low	57.1	Low	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.073	C	C	.	.				0	111.9	0	41.9	0	0	0	0	129.5	N1576 D1616 G1617 I1618 I2202 V2299 R2317 I2318 W2345	N1576-T2297 VanDerWaalsContact OD1-C 3.29Å; N1576-T2297 VanDerWaalsContact OD1-CA 3.22Å; N1576-T2297 WeakPolarHBondContact OD1-CA 3.36Å; D1616-T2297 HydrophobicContact CB-CG2 4.22Å; D1616-T2297 WeakPolarHBondContact CB-OG1 3.48Å; D1616-T2297 WeakPolarHBondContact O-CA 3.47Å; D1616-T2297 WeakPolarHBondContact O-CB 3.24Å; D1616-T2297 PolarHBondContact O-N 2.84Å; D1616-T2297 PolarHBondContact O-OG1 3.4Å; G1617-T2297 VanDerWaalsContact C-CG2 3.41Å; G1617-T2297 VanDerWaalsContact CA-CA 3.45Å; G1617-T2297 VanDerWaalsContact N-CG2 3.27Å; G1617-T2297 WeakPolarHBondContact O-CA 3.31Å; G1617-T2297 WeakPolarHBondContact O-CG2 3.32Å; I1618-T2297 WeakPolarHBondContact CD1-O 3.33Å; I1618-T2297 WeakPolarHBondContact CG1-O 3.34Å; I2202-T2297 HydrophobicContact CD1-CG2 3.65Å; I2202-T2297 HydrophobicContact CG2-CG2 4.07Å; T2297-V2299 HydrophobicContact CG2-CG2 3.19Å; T2297-R2317 VanDerWaalsContact O-CA 3.24Å; T2297-R2317 WeakPolarHBondContact O-CA 3.25Å; T2297-I2318 HydrophobicContact CG2-CD1 4.04Å; T2297-I2318 WeakPolarHBondContact OG1-CD1 3.16Å; T2297-I2318 WeakPolarHBondContact OG1-CG1 3.25Å; T2297-I2318 PolarHBondContact OG1-N 2.85Å; T2297-W2345 HydrophobicContact CG2-CH2 4.17Å; T2297-W2345 WeakPolarHBondContact O-CH2 3.33Å; T2297-W2345 WeakPolarHBondContact O-CZ3 3.5Å
2298	L	53.8	Low	55.7	Low	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.			trans	-79.1	0	160.1	-94.4	136.1	0	0	0	127.1	Q1574 N1576 I1618 Y2157 N2300 P2315 R2317 W2345	Q1574-L2298 HydrophobicContact CB-CB 4.01Å; Q1574-L2298 HydrophobicContact CG-CB 3.37Å; N1576-L2298 PolarHBondContact OD1-N 2.66Å; I1618-L2298 HydrophobicContact CB-CB 4.28Å; I1618-L2298 VanDerWaalsContact CB-N 3.31Å; I1618-L2298 HydrophobicContact CD1-CD1 3.94Å; I1618-L2298 HydrophobicContact CG1-CB 4Å; I1618-L2298 HydrophobicContact CG1-CD1 3.53Å; I1618-L2298 HydrophobicContact CG1-CG 4.17Å; I1618-L2298 HydrophobicContact CG2-CB 3.76Å; I1618-L2298 HydrophobicContact CG2-CD1 4.03Å; I1618-L2298 HydrophobicContact CG2-CG 4.5Å; Y2157-L2298 WeakPolarHBondContact O-CD2 3.34Å; L2298-N2300 VanDerWaalsContact O-CG 3.23Å; L2298-N2300 PolarHBondContact O-ND2 3.5Å; L2298-N2300 PolarHBondContact O-OD1 3.35Å; L2298-P2315 VanDerWaalsContact O-CA 3.24Å; L2298-P2315 WeakPolarHBondContact O-CA 3.21Å; L2298-P2315 WeakPolarHBondContact O-CB 3.2Å; L2298-R2317 HydrophobicContact CD1-CB 3.3Å; L2298-R2317 HydrophobicContact CD1-CG 3.7Å; L2298-R2317 HydrophobicContact CD2-CB 4.48Å; L2298-R2317 HydrophobicContact CG-CB 3.98Å; L2298-W2345 HydrophobicContact CB-CB 3.72Å; L2298-W2345 HydrophobicContact CB-CD2 2.74Å; L2298-W2345 VanDerWaalsContact CB-CE2 3.47Å; L2298-W2345 HydrophobicContact CB-CE3 2.59Å; L2298-W2345 HydrophobicContact CB-CG 3.32Å; L2298-W2345 HydrophobicContact CB-CH2 3.79Å; L2298-W2345 HydrophobicContact CB-CZ2 3.92Å; L2298-W2345 HydrophobicContact CB-CZ3 3.14Å; L2298-W2345 HydrophobicContact CD1-CE3 4.3Å; L2298-W2345 HydrophobicContact CD2-CB 3.52Å; L2298-W2345 HydrophobicContact CD2-CD2 3.61Å; L2298-W2345 HydrophobicContact CD2-CE3 3.02Å; L2298-W2345 HydrophobicContact CD2-CG 3.84Å; L2298-W2345 HydrophobicContact CD2-CZ3 4.26Å; L2298-W2345 HydrophobicContact CG-CB 4.18Å; L2298-W2345 HydrophobicContact CG-CD2 3.55Å; L2298-W2345 HydrophobicContact CG-CE3 2.77Å; L2298-W2345 HydrophobicContact CG-CG 4.12Å; L2298-W2345 HydrophobicContact CG-CZ3 3.45Å; L2298-W2345 VanDerWaalsContact CG-CZ3 3.45Å; L2298-W2345 WeakPolarHBondContact O-CH2 3.31Å; L2298-W2345 WeakPolarHBondContact O-CZ2 3.43Å; L2298-W2345 WeakPolarHBondContact O-CZ3 3.45Å; L2298-W2345 PolarHBondContact O-NE1 3.17Å; L2298-W2345 VanDerWaalsContact O-NE1 3.12Å
2299	V	60.7	Low	54	Low	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.093	C	C	.	.				0	86	0	152.4	0	0	0	0	93.8	S2197 F2199 L2203 T2297 V2301 I2318 W2345	S2197-V2299 WeakPolarHBondContact OG-CG1 3.27Å; F2199-V2299 HydrophobicContact CB-CG1 4.27Å; F2199-V2299 HydrophobicContact CD2-CB 4.4Å; F2199-V2299 HydrophobicContact CD2-CG1 4Å; L2203-V2299 HydrophobicContact CB-CG1 3.84Å; L2203-V2299 HydrophobicContact CD2-CB 4.22Å; L2203-V2299 HydrophobicContact CD2-CG1 3.69Å; L2203-V2299 HydrophobicContact CG-CG1 4.43Å; T2297-V2299 HydrophobicContact CG2-CG2 3.19Å; V2299-V2301 WeakPolarHBondContact O-CG2 3.35Å; V2299-V2301 PolarHBondContact O-N 3.16Å; V2299-I2318 HydrophobicContact CG2-CD1 3.96Å; V2299-W2345 HydrophobicContact CB-CH2 3.47Å; V2299-W2345 VanDerWaalsContact CB-CH2 3.47Å; V2299-W2345 HydrophobicContact CB-CZ3 3.74Å; V2299-W2345 HydrophobicContact CG2-CH2 3.19Å; V2299-W2345 HydrophobicContact CG2-CZ3 3.71Å
2300	N	57.7	Low	52.7	Low	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.091	C	C	.	.			trans	-71.6	109.8	-143.9	-62.9	-76.6	0	0	0	109.2	Q2198 L2298 V2302 E2313 I2314 F2349 I2352	Q2198-N2300 HydrophobicContact CB-CB 4.49Å; Q2198-N2300 VanDerWaalsContact CD-CB 3.46Å; Q2198-N2300 HydrophobicContact CG-CB 3.87Å; Q2198-N2300 PolarHBondContact N-O 2.66Å; Q2198-N2300 PolarHBondContact OE1-ND2 2.85Å; L2298-N2300 VanDerWaalsContact O-CG 3.23Å; L2298-N2300 PolarHBondContact O-ND2 3.5Å; L2298-N2300 PolarHBondContact O-OD1 3.35Å; N2300-V2302 HydrophobicContact CB-CG2 4.4Å; N2300-V2302 WeakPolarHBondContact O-CG2 3.23Å; N2300-V2302 PolarHBondContact O-N 3.38Å; N2300-E2313 HydrophobicContact CB-CB 3.97Å; N2300-E2313 VanDerWaalsContact CB-CD 3.5Å; N2300-E2313 HydrophobicContact CB-CG 4.14Å; N2300-E2313 WeakPolarHBondContact CB-OE2 3.46Å; N2300-E2313 PolarHBondContact OD1-OE2 3.41Å; N2300-I2314 CarbonylContact C-O 3.49Å; N2300-I2314 WeakPolarHBondContact CA-O 3.27Å; N2300-F2349 WeakPolarHBondContact OD1-CD2 3.46Å; N2300-I2352 WeakPolarHBondContact ND2-CD1 3.19Å
2301	V	63.4	Low	52	Low	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	78.8	-180	173.1	0	0	0	0	104.7	V2195 R2196 L2203 I2205 V2299 L2303 E2313 I2314 V2316	V2195-V2301 HydrophobicContact CG1-CG1 3.31Å; R2196-V2301 CarbonylContact O-C 3.56Å; R2196-V2301 WeakPolarHBondContact O-CA 3.1Å; L2203-V2301 HydrophobicContact CD2-CG2 3.63Å; I2205-V2301 HydrophobicContact CD1-CG1 4.33Å; V2299-V2301 WeakPolarHBondContact O-CG2 3.35Å; V2299-V2301 PolarHBondContact O-N 3.16Å; V2301-L2303 PolarHBondContact O-N 2.93Å; V2301-E2313 CarbonylContact O-C 3.6Å; V2301-I2314 HydrophobicContact CB-CB 4.13Å; V2301-I2314 PolarHBondContact N-O 3Å; V2301-I2314 PolarHBondContact O-N 3.26Å; V2301-I2314 VanDerWaalsContact O-N 3.14Å; V2301-V2316 HydrophobicContact CG2-CG2 3.95Å
2302	V	61.2	Low	51.4	Low	13 Å²	13	17 Å²	17	8%	0.079	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	97.1	-176.4	-167.6	0	0	0	0	109.3	V2195 R2196 Q2198 N2300 H2311 E2313	V2195-V2302 CarbonylContact C-O 3.16Å; V2195-V2302 VanDerWaalsContact CA-O 3.27Å; V2195-V2302 WeakPolarHBondContact CA-O 3.21Å; R2196-V2302 PolarHBondContact N-O 3.37Å; R2196-V2302 PolarHBondContact O-N 2.94Å; Q2198-V2302 HydrophobicContact CG-CG2 3.77Å; N2300-V2302 HydrophobicContact CB-CG2 4.4Å; N2300-V2302 WeakPolarHBondContact O-CG2 3.23Å; N2300-V2302 PolarHBondContact O-N 3.38Å; V2302-H2311 HydrophobicContact CG1-CB 4.03Å; V2302-E2313 HydrophobicContact CB-CG 4.18Å; V2302-E2313 HydrophobicContact CG1-CG 4.03Å; V2302-E2313 HydrophobicContact CG2-CG 3.83Å; V2302-E2313 VanDerWaalsContact CG2-OE1 3.22Å; V2302-E2313 WeakPolarHBondContact CG2-OE1 3.2Å
2303	L	60.8	Low	50.9	Low	4 Å²	4	17.2 Å²	17.2	2%	0.021	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	137.9	159.2	-60.2	107.8	0	0	0	108.7	I2136 I2173 L2194 V2195 V2301 H2311 I2312 I2314	I2136-L2303 HydrophobicContact CD1-CD1 3.88Å; I2136-L2303 HydrophobicContact CD1-CD2 4.24Å; I2136-L2303 HydrophobicContact CD1-CG 4.46Å; I2173-L2303 HydrophobicContact CD1-CD1 4.25Å; I2173-L2303 HydrophobicContact CD1-CD2 3.9Å; I2173-L2303 HydrophobicContact CD1-CG 4.47Å; I2173-L2303 HydrophobicContact CG2-CD2 4.02Å; L2194-L2303 CarbonylContact O-C 3.5Å; L2194-L2303 WeakPolarHBondContact O-CA 3.44Å; V2195-L2303 HydrophobicContact CG1-CG 4.24Å; V2195-L2303 HydrophobicContact CG2-CB 4.21Å; V2195-L2303 HydrophobicContact CG2-CD2 3.56Å; V2195-L2303 HydrophobicContact CG2-CG 3.63Å; V2301-L2303 PolarHBondContact O-N 2.93Å; L2303-H2311 CarbonylContact O-C 3.57Å; L2303-H2311 WeakPolarHBondContact O-CA 3.23Å; L2303-I2312 WeakPolarHBondContact CA-O 3.07Å; L2303-I2312 WeakPolarHBondContact CB-O 3.35Å; L2303-I2312 WeakPolarHBondContact CD1-O 3.23Å; L2303-I2312 PolarHBondContact N-O 2.85Å; L2303-I2312 PolarHBondContact O-N 2.9Å; L2303-I2314 HydrophobicContact CD1-CD1 3.46Å; L2303-I2314 VanDerWaalsContact CD1-CD1 3.46Å; L2303-I2314 HydrophobicContact CD1-CG1 3.7Å
2304	S	52.4	Low	51.1	Low	8 Å²	8	17.3 Å²	17.3	6%	0.056	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	123.1	-177	54.7	0	0	0	0	110.8	L2194 H2311	L2194-S2304 WeakPolarHBondContact CB-OG 3.22Å; L2194-S2304 PolarHBondContact N-O 3.13Å; L2194-S2304 PolarHBondContact O-N 3.25Å; L2194-S2304 PolarHBondContact O-OG 2.85Å; S2304-H2311 VanDerWaalsContact CB-CE1 3.44Å; S2304-H2311 WeakPolarHBondContact CB-CE1 3.32Å; S2304-H2311 WeakPolarHBondContact CB-ND1 3.46Å
2305	L	52.7	Low	50.9	Low	11 Å²	11	17.4 Å²	17.4	6%	0.058	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	103.1	174.5	-87.2	84.9	0	0	0	109.5	T2179 L2183 L2193 S2307 T2308 G2309 Q2310	T2179-L2305 HydrophobicContact CG2-CD2 3.94Å; L2183-L2305 HydrophobicContact CD2-CD2 4.26Å; L2183-L2305 HydrophobicContact CD2-CG 4.5Å; L2193-L2305 HydrophobicContact CD1-CD1 3.7Å; L2193-L2305 HydrophobicContact CD1-CG 4.18Å; L2305-S2307 PolarHBondContact O-N 2.83Å; L2305-T2308 WeakPolarHBondContact CB-OG1 3.47Å; L2305-T2308 PolarHBondContact O-N 2.8Å; L2305-T2308 VanDerWaalsContact O-N 3.16Å; L2305-G2309 PolarHBondContact O-N 3.04Å; L2305-Q2310 PolarHBondContact N-O 2.87Å
2306	R	42.9	Very low	51	Low	69 Å²	69	17.7 Å²	17.7	26%	0.26	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-13.8	-179.5	-171.3	179.7	170.8	-173.5	7.9	114.2	K2192 Q2408	K2192-R2306 HydrophobicContact CB-CB 3.97Å; K2192-R2306 HydrophobicContact CG-CB 4.2Å; K2192-R2306 PolarHBondContact O-N 3.39Å; R2306-Q2408 VanDerWaalsContact CZ-CD 3.5Å; R2306-Q2408 VanDerWaalsContact NH1-CD 3.32Å; R2306-Q2408 VanDerWaalsContact NH1-NE2 3.11Å
2307	S	41.7	Very low	50.7	Low	28 Å²	28	17.7 Å²	17.7	20%	0.196	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-34	178.2	47.5	0	0	0	0	114.5	L2188 L2305	L2188-S2307 WeakPolarHBondContact CD2-OG 3.23Å; L2305-S2307 PolarHBondContact O-N 2.83Å
2308	T	42	Very low	51.5	Low	69 Å²	69	17.8 Å²	17.8	42%	0.423	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-15.5	-175.2	60.2	0	0	0	0	113.6	L2305 Q2310	L2305-T2308 WeakPolarHBondContact CB-OG1 3.47Å; L2305-T2308 PolarHBondContact O-N 2.8Å; L2305-T2308 VanDerWaalsContact O-N 3.16Å; T2308-Q2310 PolarHBondContact O-N 3.03Å; T2308-Q2310 WeakPolarHBondContact OG1-CB 3.21Å; T2308-Q2310 WeakPolarHBondContact OG1-CG 3.43Å; T2308-Q2310 PolarHBondContact OG1-N 3.17Å; T2308-Q2310 PolarHBondContact OG1-OE1 3.42Å
2309	G	34	Very low	51.5	Low	28 Å²	28	18.4 Å²	18.4	29%	0.289	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	7.3	-172.1	0	0	0	0	0	113.3	L2305	L2305-G2309 PolarHBondContact O-N 3.04Å
2310	Q	38.7	Very low	51.7	Low	40 Å²	40	18.4 Å²	18.4	19%	0.187	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.2	176.7	-62.5	166.3	-43.1	0	0	109.7	L2305 T2308 I2360	L2305-Q2310 PolarHBondContact N-O 2.87Å; T2308-Q2310 PolarHBondContact O-N 3.03Å; T2308-Q2310 WeakPolarHBondContact OG1-CB 3.21Å; T2308-Q2310 WeakPolarHBondContact OG1-CG 3.43Å; T2308-Q2310 PolarHBondContact OG1-N 3.17Å; T2308-Q2310 PolarHBondContact OG1-OE1 3.42Å; Q2310-I2360 HydrophobicContact CB-CD1 3.82Å; Q2310-I2360 HydrophobicContact CB-CG1 4.29Å; Q2310-I2360 HydrophobicContact CG-CD1 3.84Å; Q2310-I2360 HydrophobicContact CG-CG1 3.93Å; Q2310-I2360 HydrophobicContact CG-CG2 4.1Å
2311	H	46.1	Very low	51.6	Low	41 Å²	41	20.7 Å²	20.7	19%	0.19	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143	169.9	-60.4	-144.1	0	0	0	108.6	V2302 L2303 S2304 L2356 W2406	V2302-H2311 HydrophobicContact CG1-CB 4.03Å; L2303-H2311 CarbonylContact O-C 3.57Å; L2303-H2311 WeakPolarHBondContact O-CA 3.23Å; S2304-H2311 VanDerWaalsContact CB-CE1 3.44Å; S2304-H2311 WeakPolarHBondContact CB-CE1 3.32Å; S2304-H2311 WeakPolarHBondContact CB-ND1 3.46Å; H2311-L2356 HydrophobicContact CB-CD1 3.63Å; H2311-L2356 HydrophobicContact CB-CD2 3.65Å; H2311-L2356 HydrophobicContact CB-CG 4.23Å; H2311-W2406 AromaticContact CD2-CZ3 3.92Å; H2311-W2406 AromaticContact CE1-CE3 3.76Å; H2311-W2406 AromaticContact CE1-CZ3 3.79Å; H2311-W2406 AromaticContact NE2-CE3 3.39Å; H2311-W2406 AromaticContact NE2-CZ3 3.49Å; H2311-W2406 WeakPolarHBondContact NE2-CZ3 3.35Å
2312	I	46.9	Very low	51.3	Low	36 Å²	36	20.7 Å²	20.7	19%	0.185	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	109.8	176.7	-54.4	172.4	0	0	0	105.2	I2134 I2136 L2303	I2134-I2312 HydrophobicContact CB-CD1 4.35Å; I2134-I2312 HydrophobicContact CG2-CD1 3.92Å; I2136-I2312 HydrophobicContact CD1-CB 4.06Å; I2136-I2312 HydrophobicContact CD1-CD1 3.82Å; I2136-I2312 HydrophobicContact CD1-CG2 3.82Å; I2136-I2312 HydrophobicContact CG1-CD1 4.02Å; I2136-I2312 HydrophobicContact CG1-CG2 4.28Å; L2303-I2312 WeakPolarHBondContact CA-O 3.07Å; L2303-I2312 WeakPolarHBondContact CB-O 3.35Å; L2303-I2312 WeakPolarHBondContact CD1-O 3.23Å; L2303-I2312 PolarHBondContact N-O 2.85Å; L2303-I2312 PolarHBondContact O-N 2.9Å
2313	E	48.6	Very low	51.3	Low	13 Å²	13	22.5 Å²	22.5	6%	0.061	13%	0.126	C	C	.	.			trans	-76.5	166.6	176	-66.4	-156.5	162.3	0	0	111	Q2198 N2300 V2301 V2302 F2349 I2352 L2356	Q2198-E2313 VanDerWaalsContact NE2-CD 3.29Å; Q2198-E2313 PolarHBondContact NE2-OE1 2.91Å; Q2198-E2313 PolarHBondContact NE2-OE2 2.94Å; Q2198-E2313 VanDerWaalsContact NE2-OE2 3.1Å; N2300-E2313 HydrophobicContact CB-CB 3.97Å; N2300-E2313 VanDerWaalsContact CB-CD 3.5Å; N2300-E2313 HydrophobicContact CB-CG 4.14Å; N2300-E2313 WeakPolarHBondContact CB-OE2 3.46Å; N2300-E2313 PolarHBondContact OD1-OE2 3.41Å; V2301-E2313 CarbonylContact O-C 3.6Å; V2302-E2313 HydrophobicContact CB-CG 4.18Å; V2302-E2313 HydrophobicContact CG1-CG 4.03Å; V2302-E2313 HydrophobicContact CG2-CG 3.83Å; V2302-E2313 VanDerWaalsContact CG2-OE1 3.22Å; V2302-E2313 WeakPolarHBondContact CG2-OE1 3.2Å; E2313-F2349 HydrophobicContact CB-CD2 4.04Å; E2313-F2349 HydrophobicContact CB-CE2 3.57Å; E2313-F2349 WeakPolarHBondContact O-CE2 3.23Å; E2313-F2349 VanDerWaalsContact O-CZ 3.25Å; E2313-F2349 WeakPolarHBondContact O-CZ 3.47Å; E2313-I2352 HydrophobicContact CG-CG2 4.32Å; E2313-I2352 WeakPolarHBondContact OE2-CB 3.44Å; E2313-I2352 WeakPolarHBondContact OE2-CD1 3.34Å; E2313-I2352 WeakPolarHBondContact OE2-CG2 3.39Å; E2313-L2356 HydrophobicContact CG-CD1 3.87Å
2314	I	53.4	Low	51	Low	3 Å²	3	25.6 Å²	25.6	2%	0.015	14%	0.143	C	C	.	.			trans	-141	133.5	167.3	-64.3	-177.4	0	0	0	110.1	I2136 I2138 I2173 N2300 V2301 L2303 V2316	I2136-I2314 HydrophobicContact CG2-CD1 4.17Å; I2138-I2314 HydrophobicContact CD1-CB 4.36Å; I2138-I2314 HydrophobicContact CD1-CD1 3.96Å; I2138-I2314 HydrophobicContact CD1-CG1 3.97Å; I2138-I2314 HydrophobicContact CD1-CG2 3.66Å; I2138-I2314 HydrophobicContact CG1-CD1 4.15Å; I2138-I2314 HydrophobicContact CG1-CG2 4.42Å; I2173-I2314 HydrophobicContact CD1-CD1 4.15Å; I2173-I2314 HydrophobicContact CG1-CD1 4.4Å; N2300-I2314 CarbonylContact C-O 3.49Å; N2300-I2314 WeakPolarHBondContact CA-O 3.27Å; V2301-I2314 HydrophobicContact CB-CB 4.13Å; V2301-I2314 PolarHBondContact N-O 3Å; V2301-I2314 PolarHBondContact O-N 3.26Å; V2301-I2314 VanDerWaalsContact O-N 3.14Å; L2303-I2314 HydrophobicContact CD1-CD1 3.46Å; L2303-I2314 VanDerWaalsContact CD1-CD1 3.46Å; L2303-I2314 HydrophobicContact CD1-CG1 3.7Å; I2314-V2316 HydrophobicContact CG2-CG2 3.94Å
2315	P	48.8	Very low	51	Low	1 Å²	1	29.4 Å²	29.4	1%	0.006	16%	0.16	C	C	.	.			trans	-101.2	123.3	-176.9	37.9	-30.2	0	0	0	112.3	Y2157 L2298 W2345 I2346 F2349	Y2157-P2315 HydrophobicContact CD2-CG 3.93Å; Y2157-P2315 HydrophobicContact CE2-CG 4.41Å; L2298-P2315 VanDerWaalsContact O-CA 3.24Å; L2298-P2315 WeakPolarHBondContact O-CA 3.21Å; L2298-P2315 WeakPolarHBondContact O-CB 3.2Å; P2315-W2345 VanDerWaalsContact CA-CE3 3.46Å; P2315-W2345 HydrophobicContact CB-CB 4.27Å; P2315-W2345 HydrophobicContact CB-CD2 3.32Å; P2315-W2345 HydrophobicContact CB-CE3 3.35Å; P2315-W2345 HydrophobicContact CB-CG 3.65Å; P2315-I2346 HydrophobicContact CG-CD1 4.01Å; P2315-I2346 HydrophobicContact CG-CG1 3.72Å; P2315-F2349 HydrophobicContact CB-CB 3.88Å; P2315-F2349 HydrophobicContact CB-CD1 4.39Å; P2315-F2349 HydrophobicContact CB-CD2 3.98Å; P2315-F2349 HydrophobicContact CB-CG 3.8Å; P2315-F2349 HydrophobicContact CG-CB 3.95Å; P2315-F2349 HydrophobicContact CG-CD1 3.54Å; P2315-F2349 HydrophobicContact CG-CD2 3.82Å; P2315-F2349 HydrophobicContact CG-CE1 3.92Å; P2315-F2349 HydrophobicContact CG-CE2 4.19Å; P2315-F2349 HydrophobicContact CG-CG 3.45Å; P2315-F2349 VanDerWaalsContact CG-CG 3.45Å; P2315-F2349 HydrophobicContact CG-CZ 4.22Å
2316	V	56.4	Low	51.2	Low	7 Å²	7	33.8 Å²	33.8	4%	0.042	18%	0.183	C	C	.	.			trans	-127.1	100.6	-167.9	-172	0	0	0	0	114.3	F2159 L2171 V2301 I2314 I2318 W2345	F2159-V2316 HydrophobicContact CB-CG1 4.21Å; F2159-V2316 HydrophobicContact CD2-CG1 3.65Å; F2159-V2316 HydrophobicContact CE2-CG1 4.29Å; F2159-V2316 HydrophobicContact CG-CG1 4.26Å; L2171-V2316 HydrophobicContact CD1-CG1 4.06Å; L2171-V2316 HydrophobicContact CD1-CG2 3.64Å; V2301-V2316 HydrophobicContact CG2-CG2 3.95Å; I2314-V2316 HydrophobicContact CG2-CG2 3.94Å; V2316-I2318 WeakPolarHBondContact O-CG1 3.2Å; V2316-W2345 VanDerWaalsContact C-CZ3 3.47Å; V2316-W2345 VanDerWaalsContact N-CZ3 3.34Å; V2316-W2345 VanDerWaalsContact O-CZ3 3.28Å; V2316-W2345 WeakPolarHBondContact O-CZ3 3.39Å
2317	R	54.4	Low	51.8	Low	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.203	C	C	.	.			trans	-48.5	145.1	171.9	-172.7	123.6	-124.9	-160.2	8.6	109.9	T1612 T1614 I1618 R1620 Q2158 F2159 D2296 T2297 L2298	T1612-R2317 PolarHBondContact O-NH2 2.96Å; T1612-R2317 PolarHBondContact OG1-NH1 2.73Å; T1614-R2317 HydrophobicContact CG2-CG 4.42Å; T1614-R2317 VanDerWaalsContact OG1-CD 3.27Å; T1614-R2317 WeakPolarHBondContact OG1-CD 2.99Å; T1614-R2317 WeakPolarHBondContact OG1-CG 3.37Å; T1614-R2317 PolarHBondContact OG1-NE 2.85Å; I1618-R2317 HydrophobicContact CD1-CB 4.18Å; I1618-R2317 HydrophobicContact CD1-CG 3.55Å; I1618-R2317 HydrophobicContact CG1-CG 4.47Å; R1620-R2317 VanDerWaalsContact CB-NH2 3.29Å; R1620-R2317 VanDerWaalsContact CG-CZ 3.42Å; Q2158-R2317 HydrophobicContact CB-CB 4.49Å; Q2158-R2317 HydrophobicContact CG-CB 3.97Å; Q2158-R2317 HydrophobicContact CG-CG 3.65Å; F2159-R2317 WeakPolarHBondContact CB-O 3.29Å; F2159-R2317 CarbonylContact O-C 3.4Å; F2159-R2317 WeakPolarHBondContact O-CB 3.12Å; F2159-R2317 VanDerWaalsContact O-CG 3.24Å; F2159-R2317 WeakPolarHBondContact O-CG 3.25Å; D2296-R2317 IonicContact OD1-CZ 2.92Å; D2296-R2317 IonicContact OD1-NE 2.73Å; D2296-R2317 PolarHBondContact OD1-NE 2.86Å; D2296-R2317 VanDerWaalsContact OD1-NE 3.08Å; D2296-R2317 IonicContact OD1-NH2 3.61Å; D2296-R2317 PolarHBondContact OD1-NH2 3.48Å; D2296-R2317 IonicContact OD2-NH2 2.88Å; D2296-R2317 PolarHBondContact OD2-NH2 3.12Å; T2297-R2317 VanDerWaalsContact O-CA 3.24Å; T2297-R2317 WeakPolarHBondContact O-CA 3.25Å; L2298-R2317 HydrophobicContact CD1-CB 3.3Å; L2298-R2317 HydrophobicContact CD1-CG 3.7Å; L2298-R2317 HydrophobicContact CD2-CB 4.48Å; L2298-R2317 HydrophobicContact CG-CB 3.98Å
2318	I	64.2	Low	51.8	Low	2 Å²	2	41.7 Å²	41.7	1%	0.01	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-146.2	177.1	171.8	-1.7	144.9	0	0	0	109.6	T1614 D1616 I2161 I2202 L2203 C2288 T2297 V2299 V2316	T1614-I2318 CarbonylContact C-O 3.46Å; T1614-I2318 WeakPolarHBondContact CB-O 3.47Å; T1614-I2318 CarbonylContact O-C 3.59Å; T1614-I2318 PolarHBondContact OG1-O 3.07Å; D1616-I2318 HydrophobicContact CB-CB 3.71Å; D1616-I2318 HydrophobicContact CB-CD1 3.79Å; D1616-I2318 HydrophobicContact CB-CG1 4.18Å; D1616-I2318 WeakPolarHBondContact OD2-CB 3.33Å; I2161-I2318 HydrophobicContact CD1-CG2 3.37Å; I2161-I2318 HydrophobicContact CG1-CG2 3.8Å; I2202-I2318 HydrophobicContact CG2-CD1 3.75Å; L2203-I2318 HydrophobicContact CB-CD1 4.02Å; L2203-I2318 HydrophobicContact CD1-CD1 3.58Å; L2203-I2318 HydrophobicContact CD1-CG1 4.15Å; L2203-I2318 HydrophobicContact CG-CD1 4.3Å; C2288-I2318 WeakPolarHBondContact SG-CG2 3.25Å; T2297-I2318 HydrophobicContact CG2-CD1 4.04Å; T2297-I2318 WeakPolarHBondContact OG1-CD1 3.16Å; T2297-I2318 WeakPolarHBondContact OG1-CG1 3.25Å; T2297-I2318 PolarHBondContact OG1-N 2.85Å; V2299-I2318 HydrophobicContact CG2-CD1 3.96Å; V2316-I2318 WeakPolarHBondContact O-CG1 3.2Å
2319	N	55.1	Low	51.8	Low	14 Å²	14	47.8 Å²	47.8	8%	0.075	25%	0.249	C	C	.	.			trans	-160	65.5	-165.2	-161.1	-6.2	0	0	0	120.7	T1614 P1615 D1616	T1614-N2319 VanDerWaalsContact CA-CG 3.47Å; T1614-N2319 VanDerWaalsContact CA-OD1 3.27Å; T1614-N2319 WeakPolarHBondContact CA-OD1 3.1Å; T1614-N2319 VanDerWaalsContact CB-ND2 3.32Å; T1614-N2319 WeakPolarHBondContact CB-ND2 3.38Å; T1614-N2319 WeakPolarHBondContact O-CA 3.27Å; P1615-N2319 WeakPolarHBondContact CB-OD1 3.4Å; P1615-N2319 WeakPolarHBondContact CD-OD1 3.07Å; P1615-N2319 VanDerWaalsContact CG-OD1 3.27Å; P1615-N2319 WeakPolarHBondContact CG-OD1 3.26Å; D1616-N2319 VanDerWaalsContact N-CA 3.33Å; D1616-N2319 WeakPolarHBondContact OD2-CA 3.25Å; D1616-N2319 PolarHBondContact OD2-N 3.34Å
2320	I	64.7	Low	52.1	Low	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.			trans	-88.7	117.5	178.6	-27.9	-172.1	0	0	0	118.7	L1589 P1615 D1616 F2167 C2288 I2289 P2290 P2294	L1589-I2320 HydrophobicContact CD1-CD1 3.92Å; P1615-I2320 CarbonylContact C-O 3.53Å; P1615-I2320 WeakPolarHBondContact CB-O 3.47Å; P1615-I2320 CarbonylContact O-C 3.57Å; P1615-I2320 WeakPolarHBondContact O-CA 3.41Å; P1615-I2320 PolarHBondContact O-N 3Å; D1616-I2320 HydrophobicContact CB-CG1 4.18Å; D1616-I2320 WeakPolarHBondContact OD1-CD1 3.47Å; D1616-I2320 WeakPolarHBondContact OD1-CG1 3.43Å; D1616-I2320 WeakPolarHBondContact OD2-CG1 3.1Å; D1616-I2320 PolarHBondContact OD2-N 2.84Å; D1616-I2320 VanDerWaalsContact OD2-N 3.08Å; F2167-I2320 HydrophobicContact CD1-CG2 4.15Å; F2167-I2320 HydrophobicContact CE1-CB 4.44Å; F2167-I2320 HydrophobicContact CE1-CG2 3.43Å; F2167-I2320 VanDerWaalsContact CE1-CG2 3.43Å; F2167-I2320 HydrophobicContact CZ-CG2 4.05Å; C2288-I2320 HydrophobicContact CB-CD1 3.74Å; C2288-I2320 HydrophobicContact CB-CG1 4.2Å; I2289-I2320 WeakPolarHBondContact O-CD1 3.39Å; P2290-I2320 HydrophobicContact CB-CD1 4.44Å; P2290-I2320 HydrophobicContact CB-CG2 3.62Å; P2294-I2320 VanDerWaalsContact CG-O 3.28Å; P2294-I2320 WeakPolarHBondContact CG-O 3.46Å
2321	P	55.6	Low	52.2	Low	48 Å²	48	61 Å²	61	31%	0.312	31%	0.306	S	S	.	.			trans	-70.2	179.2	166.5	33.1	-37.6	0	0	0	113.4	L2326	P2321-L2326 HydrophobicContact CB-CD1 4.48Å; P2321-L2326 HydrophobicContact CG-CD1 4.46Å
2322	S	57.7	Low	51.7	Low	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.341	C	S	.	.			trans	-112.5	160.9	-170.5	103.1	0	0	0	0	120	L1589 Q1590 G2291 N2324 Q2325 L2326	L1589-S2322 VanDerWaalsContact O-CA 3.26Å; L1589-S2322 WeakPolarHBondContact O-CA 3.29Å; L1589-S2322 WeakPolarHBondContact O-CB 3.36Å; Q1590-S2322 WeakPolarHBondContact CB-OG 3.26Å; Q1590-S2322 VanDerWaalsContact CD-OG 3.24Å; Q1590-S2322 WeakPolarHBondContact CG-OG 3.34Å; Q1590-S2322 PolarHBondContact OE1-OG 3.47Å; G2291-S2322 CarbonylContact O-C 3.6Å; G2291-S2322 VanDerWaalsContact O-C 3.26Å; G2291-S2322 WeakPolarHBondContact O-CA 3.39Å; G2291-S2322 WeakPolarHBondContact O-CB 3.48Å; S2322-N2324 PolarHBondContact OG-N 3.33Å; S2322-Q2325 CarbonylContact O-C 3.12Å; S2322-Q2325 PolarHBondContact O-N 3.14Å; S2322-Q2325 WeakPolarHBondContact OG-CA 3.45Å; S2322-Q2325 WeakPolarHBondContact OG-CB 3.45Å; S2322-Q2325 PolarHBondContact OG-N 2.83Å; S2322-L2326 WeakPolarHBondContact O-CA 3.25Å; S2322-L2326 WeakPolarHBondContact O-CB 3.23Å; S2322-L2326 WeakPolarHBondContact O-CD1 3.25Å; S2322-L2326 PolarHBondContact O-N 2.77Å
2323	L	59.6	Low	51.2	Low	51 Å²	51	69.9 Å²	69.9	27%	0.267	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-58.8	173.2	-96.1	84.7	0	0	0	111.4	I1588 G2291 D2292 Q2325 L2326 D2327	I1588-L2323 HydrophobicContact CD1-CB 4.47Å; I1588-L2323 HydrophobicContact CD1-CD1 4.13Å; I1588-L2323 HydrophobicContact CD1-CD2 3.76Å; I1588-L2323 HydrophobicContact CD1-CG 4.33Å; G2291-L2323 WeakPolarHBondContact O-CB 3.42Å; G2291-L2323 WeakPolarHBondContact O-CD1 3.09Å; G2291-L2323 PolarHBondContact O-N 3.38Å; D2292-L2323 HydrophobicContact CB-CB 4.08Å; L2323-Q2325 PolarHBondContact O-N 2.86Å; L2323-Q2325 VanDerWaalsContact O-N 3.09Å; L2323-L2326 CarbonylContact O-C 3.39Å; L2323-L2326 WeakPolarHBondContact O-CA 3.28Å; L2323-L2326 VanDerWaalsContact O-CB 3.26Å; L2323-L2326 WeakPolarHBondContact O-CB 3.17Å; L2323-L2326 PolarHBondContact O-N 3.44Å; L2323-D2327 PolarHBondContact O-N 3.04Å
2324	N	55.5	Low	50.3	Low	68 Å²	68	75.2 Å²	75.2	36%	0.364	41%	0.408	S	S	.	.	H	α-helix	trans	-68.2	-10.2	178	-107.9	-6.4	0	0	0	114	Q1590 M1641 D2292 S2322	Q1590-N2324 VanDerWaalsContact OE1-CA 3.3Å; M1641-N2324 HydrophobicContact CE-CB 4.08Å; M1641-N2324 HydrophobicContact SD-CB 3.93Å; M1641-N2324 PolarHBondContact SD-ND2 3.41Å; D2292-N2324 HydrophobicContact CB-CB 4.44Å; S2322-N2324 PolarHBondContact OG-N 3.33Å
2325	Q	52.4	Low	49.2	Very low	88 Å²	88	83.4 Å²	83.4	41%	0.411	44%	0.444	S	S	.	.	H	α-helix	trans	-99.7	-12.7	171.6	-162.7	165	57.2	0	0	112.1	Q1590 Y1591 S2322 L2323	Q1590-Q2325 HydrophobicContact CG-CB 4.21Å; Y1591-Q2325 PolarHBondContact O-NE2 3.09Å; S2322-Q2325 CarbonylContact O-C 3.12Å; S2322-Q2325 PolarHBondContact O-N 3.14Å; S2322-Q2325 WeakPolarHBondContact OG-CA 3.45Å; S2322-Q2325 WeakPolarHBondContact OG-CB 3.45Å; S2322-Q2325 PolarHBondContact OG-N 2.83Å; L2323-Q2325 PolarHBondContact O-N 2.86Å; L2323-Q2325 VanDerWaalsContact O-N 3.09Å
2326	L	56.3	Low	48.4	Very low	104 Å²	104	88.5 Å²	88.5	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-81.1	-26.8	166.1	-104.3	62.2	0	0	0	110.4	P2321 S2322 L2323	P2321-L2326 HydrophobicContact CB-CD1 4.48Å; P2321-L2326 HydrophobicContact CG-CD1 4.46Å; S2322-L2326 WeakPolarHBondContact O-CA 3.25Å; S2322-L2326 WeakPolarHBondContact O-CB 3.23Å; S2322-L2326 WeakPolarHBondContact O-CD1 3.25Å; S2322-L2326 PolarHBondContact O-N 2.77Å; L2323-L2326 CarbonylContact O-C 3.39Å; L2323-L2326 WeakPolarHBondContact O-CA 3.28Å; L2323-L2326 VanDerWaalsContact O-CB 3.26Å; L2323-L2326 WeakPolarHBondContact O-CB 3.17Å; L2323-L2326 PolarHBondContact O-N 3.44Å
2327	D	54.6	Low	47.2	Very low	128 Å²	128	90.2 Å²	90.2	68%	0.684	49%	0.49	S	S	*	.	H	α-helix	trans	-102.2	-30.4	-167.1	-94.1	-4	0	0	0	118.4	L2323	L2323-D2327 PolarHBondContact O-N 3.04Å
2328	N	43.5	Very low	46	Very low	135 Å²	135	95.5 Å²	95.5	72%	0.722	51%	0.513	S	S	*	.			trans	-112.9	153	-168	-94	-58.6	0	0	0	116.8
2329	K	42.1	Very low	44.7	Very low	197 Å²	197	97.5 Å²	97.5	86%	0.857	52%	0.521	S	S	*	.			trans	-131.3	156.6	-169.7	-68.9	-179.8	178.1	172.9	0	115.8
2330	E	39.7	Very low	43.7	Very low	188 Å²	188	98.1 Å²	98.1	88%	0.879	52%	0.524	S	S	*	.			trans	80.4	163.1	168.2	-61.4	-169.4	178.5	0	0	119.3
2331	I	41	Very low	42.5	Very low	158 Å²	158	98.1 Å²	98.1	81%	0.81	52%	0.524	S	S	*	.			trans	-147.9	144.5	-137.3	-64.3	150.8	0	0	0	113.1
2332	T	35.9	Very low	41.5	Very low	148 Å²	148	95.9 Å²	95.9	91%	0.908	51%	0.509	S	S	*	.			trans	177.2	174.7	134	27.9	0	0	0	0	114.3
2333	S	35.6	Very low	40.5	Very low	114 Å²	114	95.9 Å²	95.9	80%	0.797	51%	0.509	S	S	*	.			trans	-125.3	150.6	-146.3	59.1	0	0	0	0	119.1
2334	S	30.7	Very low	39.4	Very low	125 Å²	125	93.5 Å²	93.5	87%	0.874	50%	0.497	S	S	*	.			trans	-164.4	154.9	141	52.2	0	0	0	0	114
2335	K	28.7	Very low	38.8	Very low	175 Å²	175	90.2 Å²	90.2	76%	0.761	48%	0.479	S	S	*	.			trans	-95.3	173.1	-174.7	-69.4	178.9	176.9	176.9	0	112.5
2336	P	33.3	Very low	38.5	Very low	108 Å²	108	86.9 Å²	86.9	70%	0.701	46%	0.464	S	S	*	.			cis	-146.2	172.7	18.8	42.6	-21.6	0	0	0	121.6
2337	S	31.3	Very low	37.6	Very low	44 Å²	44	82 Å²	82	31%	0.308	44%	0.438	S	S	.	.			trans	72.8	125.2	155.8	39.4	0	0	0	0	126.1
2338	F	29.5	Very low	37	Very low	110 Å²	110	76.7 Å²	76.7	48%	0.482	41%	0.41	S	S	.	.			trans	106.9	167.4	151.1	-59.5	-46	0	0	0	124.2	V1596 H1598	V1596-F2338 PolarHBondContact O-N 2.91Å; H1598-F2338 HydrophobicContact CB-CD1 4.19Å; H1598-F2338 HydrophobicContact CB-CE1 3.55Å; H1598-F2338 HydrophobicContact CB-CZ 4.34Å; H1598-F2338 AromaticContact CD2-CZ 4Å; H1598-F2338 AromaticContact CG-CE1 3.74Å
2339	Y	35.1	Very low	37.1	Very low	45 Å²	45	71.3 Å²	71.3	18%	0.176	38%	0.38	C	S	.	.				166	0	-61.6	-106.5	16.5	0	0	0	119.1	V1596 H1598 R1633	V1596-Y2339 VanDerWaalsContact O-CD1 3.23Å; V1596-Y2339 WeakPolarHBondContact O-CD1 3.26Å; V1596-Y2339 WeakPolarHBondContact O-CE1 3.4Å; H1598-Y2339 HydrophobicContact CB-CE2 4.06Å; H1598-Y2339 PolarHBondContact N-OH 3.1Å; R1633-Y2339 HydrophobicContact CB-CD1 3.83Å; R1633-Y2339 HydrophobicContact CB-CD2 3.8Å; R1633-Y2339 HydrophobicContact CB-CE1 3.9Å; R1633-Y2339 HydrophobicContact CB-CE2 3.88Å; R1633-Y2339 HydrophobicContact CB-CG 3.77Å; R1633-Y2339 VanDerWaalsContact CD-CD2 3.45Å; R1633-Y2339 VanDerWaalsContact CG-C 3.47Å; R1633-Y2339 VanDerWaalsContact CG-CB 3.42Å; R1633-Y2339 HydrophobicContact CG-CD1 3.79Å; R1633-Y2339 HydrophobicContact CG-CD2 3.58Å; R1633-Y2339 HydrophobicContact CG-CE1 4.37Å; R1633-Y2339 HydrophobicContact CG-CE2 4.19Å; R1633-Y2339 HydrophobicContact CG-CG 3.33Å; R1633-Y2339 VanDerWaalsContact NE-CB 3.35Å; R1633-Y2339 PolarHBondContact NE-O 3.45Å; R1633-Y2339 PolarHBondContact NH2-O 3.49Å; R1633-Y2339 VanDerWaalsContact O-CE1 3.28Å; R1633-Y2339 WeakPolarHBondContact O-CE1 3.33Å
2340	L	35.4	Very low	37.3	Very low	27 Å²	27	62.5 Å²	62.5	14%	0.141	34%	0.344	C	S	.	.				0	113.7	0	-111.2	148.5	0	0	0	120.9	Q1566 R1633 V1634 D1666 V1667 L1668	Q1566-L2340 HydrophobicContact CG-CB 3.83Å; Q1566-L2340 HydrophobicContact CG-CD2 4.41Å; Q1566-L2340 WeakPolarHBondContact CG-O 3.43Å; Q1566-L2340 VanDerWaalsContact NE2-CB 3.32Å; Q1566-L2340 VanDerWaalsContact NE2-CD1 3.3Å; R1633-L2340 VanDerWaalsContact CG-N 3.29Å; R1633-L2340 VanDerWaalsContact CZ-CD1 3.42Å; V1634-L2340 PolarHBondContact O-N 2.89Å; D1666-L2340 CarbonylContact C-O 3.41Å; D1666-L2340 VanDerWaalsContact CA-O 3.3Å; D1666-L2340 WeakPolarHBondContact CA-O 3.39Å; D1666-L2340 WeakPolarHBondContact CB-O 3.26Å; D1666-L2340 CarbonylContact O-C 3.52Å; D1666-L2340 PolarHBondContact OD1-N 3.33Å; D1666-L2340 WeakPolarHBondContact OD2-CA 3.16Å; D1666-L2340 WeakPolarHBondContact OD2-CB 3.43Å; D1666-L2340 PolarHBondContact OD2-N 3.08Å; V1667-L2340 PolarHBondContact N-O 2.8Å; V1667-L2340 CarbonylContact O-C 3.54Å; V1667-L2340 VanDerWaalsContact O-C 3.26Å; V1667-L2340 WeakPolarHBondContact O-CA 3.34Å; V1667-L2340 PolarHBondContact O-N 3.01Å; L1668-L2340 HydrophobicContact CD1-CB 4.04Å; L1668-L2340 HydrophobicContact CD1-CD2 3.51Å; L1668-L2340 HydrophobicContact CD1-CG 3.58Å
2341	L	39	Very low	37.6	Very low	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.312	C	S	.	.			trans	91.6	101.9	158.6	-60.4	168.7	0	0	0	130.5	Q1566 I1567 I1568 D1666 V1667 L1668 K1670	Q1566-L2341 HydrophobicContact CB-CB 4.34Å; Q1566-L2341 HydrophobicContact CB-CD1 3.67Å; Q1566-L2341 HydrophobicContact CG-CB 4.22Å; Q1566-L2341 HydrophobicContact CG-CD1 3.74Å; Q1566-L2341 HydrophobicContact CG-CG 4.33Å; I1567-L2341 CarbonylContact C-O 3.46Å; I1567-L2341 WeakPolarHBondContact CA-O 3.37Å; I1567-L2341 WeakPolarHBondContact CB-O 3.47Å; I1567-L2341 WeakPolarHBondContact CD1-O 3.29Å; I1567-L2341 WeakPolarHBondContact CG1-O 3.27Å; I1567-L2341 PolarHBondContact N-O 2.82Å; I1567-L2341 CarbonylContact O-C 3.58Å; I1567-L2341 VanDerWaalsContact O-CB 3.32Å; I1567-L2341 WeakPolarHBondContact O-CB 3.49Å; I1568-L2341 HydrophobicContact CB-CD1 3.91Å; I1568-L2341 HydrophobicContact CB-CD2 4.32Å; I1568-L2341 HydrophobicContact CG1-CD1 3.83Å; I1568-L2341 HydrophobicContact CG2-CD1 3.67Å; I1568-L2341 HydrophobicContact CG2-CD2 3.92Å; I1568-L2341 HydrophobicContact CG2-CG 4.4Å; D1666-L2341 CarbonylContact O-C 3.57Å; D1666-L2341 VanDerWaalsContact O-C 3.27Å; V1667-L2341 PolarHBondContact O-N 2.86Å; L1668-L2341 VanDerWaalsContact CA-CA 3.44Å; L1668-L2341 VanDerWaalsContact CA-N 3.31Å; L1668-L2341 HydrophobicContact CB-CB 4.16Å; L1668-L2341 HydrophobicContact CB-CD2 3.57Å; L1668-L2341 HydrophobicContact CB-CG 3.91Å; L1668-L2341 HydrophobicContact CD1-CD2 3.92Å; L1668-L2341 HydrophobicContact CD1-CG 4.06Å; L1668-L2341 HydrophobicContact CG-CD2 4.39Å; L1668-L2341 CarbonylContact O-C 3.49Å; K1670-L2341 HydrophobicContact CD-CD2 4.28Å; K1670-L2341 HydrophobicContact CG-CD2 4.49Å
2342	N	33.8	Very low	37.9	Very low	0 Å²	0	50 Å²	50	0%	0	28%	0.283	C	S	.	.			trans	-170.9	-169.2	161.7	-138.7	-49	0	0	0	119.6	I1567 L1569 L1575 L1577 L1619 V1667 L1668	I1567-N2342 HydrophobicContact CB-CB 4.35Å; I1567-N2342 HydrophobicContact CD1-CB 4.09Å; I1567-N2342 WeakPolarHBondContact CD1-ND2 3.36Å; I1567-N2342 WeakPolarHBondContact O-CA 2.97Å; I1567-N2342 PolarHBondContact O-N 3.41Å; L1569-N2342 CarbonylContact C-O 3.49Å; L1569-N2342 WeakPolarHBondContact CB-O 3.47Å; L1575-N2342 WeakPolarHBondContact CB-OD1 3.49Å; L1575-N2342 WeakPolarHBondContact CD2-OD1 3.32Å; L1577-N2342 WeakPolarHBondContact CD2-ND2 3.47Å; L1619-N2342 HydrophobicContact CB-CB 3.87Å; L1619-N2342 WeakPolarHBondContact CB-OD1 3.4Å; L1619-N2342 HydrophobicContact CD2-CB 3.41Å; L1619-N2342 VanDerWaalsContact CD2-CB 3.41Å; L1619-N2342 VanDerWaalsContact CD2-CG 3.49Å; L1619-N2342 WeakPolarHBondContact CD2-ND2 3.5Å; L1619-N2342 HydrophobicContact CG-CB 4.21Å; V1667-N2342 HydrophobicContact CB-CB 4.27Å; V1667-N2342 HydrophobicContact CG1-CB 3.53Å; V1667-N2342 HydrophobicContact CG2-CB 4.09Å; L1668-N2342 CarbonylContact O-C 3.47Å; L1668-N2342 PolarHBondContact O-N 2.88Å
2343	F	36.6	Very low	38.5	Very low	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.251	C	S	.	.			trans	-144.6	-164.8	-145.5	-136.7	-149.8	0	0	0	119.2	L1569 S1570 S1573 Q1574 L1575 L1619 R1620 A1621 A1718 V1719 L2348	L1569-F2343 HydrophobicContact CB-CB 3.68Å; L1569-F2343 HydrophobicContact CB-CD1 4.5Å; L1569-F2343 HydrophobicContact CB-CD2 3.44Å; L1569-F2343 VanDerWaalsContact CB-CD2 3.44Å; L1569-F2343 HydrophobicContact CB-CE2 4.34Å; L1569-F2343 HydrophobicContact CB-CG 3.61Å; L1569-F2343 HydrophobicContact CD1-CB 3.48Å; L1569-F2343 VanDerWaalsContact CD1-CB 3.48Å; L1569-F2343 HydrophobicContact CD1-CD1 4.04Å; L1569-F2343 HydrophobicContact CD1-CD2 4.43Å; L1569-F2343 HydrophobicContact CD1-CG 3.72Å; L1569-F2343 HydrophobicContact CD2-CB 4.17Å; L1569-F2343 HydrophobicContact CD2-CD1 3.52Å; L1569-F2343 HydrophobicContact CD2-CD2 3.6Å; L1569-F2343 HydrophobicContact CD2-CE1 3.98Å; L1569-F2343 HydrophobicContact CD2-CE2 3.96Å; L1569-F2343 HydrophobicContact CD2-CG 3.46Å; L1569-F2343 VanDerWaalsContact CD2-CG 3.46Å; L1569-F2343 HydrophobicContact CD2-CZ 4.19Å; L1569-F2343 HydrophobicContact CG-CB 3.91Å; L1569-F2343 HydrophobicContact CG-CD1 4.18Å; L1569-F2343 HydrophobicContact CG-CD2 3.97Å; L1569-F2343 HydrophobicContact CG-CG 3.74Å; S1570-F2343 VanDerWaalsContact N-CE2 3.32Å; S1570-F2343 WeakPolarHBondContact O-CD2 3.46Å; S1570-F2343 VanDerWaalsContact O-CE2 3.31Å; S1570-F2343 WeakPolarHBondContact O-CE2 3.38Å; S1570-F2343 WeakPolarHBondContact OG-CE2 3.16Å; S1573-F2343 VanDerWaalsContact C-CZ 3.44Å; S1573-F2343 CarbonylContact O-C 3.59Å; S1573-F2343 WeakPolarHBondContact O-CD1 3.2Å; S1573-F2343 WeakPolarHBondContact O-CD2 3.46Å; S1573-F2343 WeakPolarHBondContact O-CE1 3.31Å; S1573-F2343 WeakPolarHBondContact O-CE2 3.35Å; S1573-F2343 WeakPolarHBondContact O-CG 3.43Å; S1573-F2343 WeakPolarHBondContact O-CZ 3.26Å; S1573-F2343 WeakPolarHBondContact OG-CE2 3.36Å; S1573-F2343 WeakPolarHBondContact OG-CZ 3.48Å; Q1574-F2343 VanDerWaalsContact O-CD1 3.26Å; Q1574-F2343 WeakPolarHBondContact O-CD1 3.02Å; L1575-F2343 HydrophobicContact CB-CB 3.77Å; L1575-F2343 HydrophobicContact CB-CD1 4.26Å; L1619-F2343 CarbonylContact C-O 3.46Å; L1619-F2343 CarbonylContact O-C 3.57Å; R1620-F2343 CarbonylContact C-O 3.56Å; R1620-F2343 VanDerWaalsContact C-O 3.31Å; R1620-F2343 WeakPolarHBondContact CA-O 3.48Å; R1620-F2343 PolarHBondContact N-O 3.32Å; R1620-F2343 VanDerWaalsContact N-O 3.1Å; A1621-F2343 VanDerWaalsContact CB-O 3.27Å; A1621-F2343 WeakPolarHBondContact CB-O 3.34Å; A1621-F2343 PolarHBondContact N-O 3.41Å; A1718-F2343 VanDerWaalsContact C-CZ 3.47Å; A1718-F2343 HydrophobicContact CB-CD1 3.35Å; A1718-F2343 HydrophobicContact CB-CE1 3.31Å; A1718-F2343 WeakPolarHBondContact O-CE1 3.44Å; A1718-F2343 VanDerWaalsContact O-CZ 3.22Å; A1718-F2343 WeakPolarHBondContact O-CZ 3.04Å; V1719-F2343 WeakPolarHBondContact O-CE1 3.35Å; V1719-F2343 VanDerWaalsContact O-CZ 3.31Å; V1719-F2343 WeakPolarHBondContact O-CZ 3.09Å; F2343-L2348 HydrophobicContact CE1-CB 4.44Å
2344	S	38.2	Very low	39.2	Very low	1 Å²	1	40.2 Å²	40.2	1%	0.007	22%	0.218	C	C	.	.			trans	-171.3	0	-169.3	-151.6	0	0	0	0	138.7	N1572 S1573 Q1574 L1619 R1620 A1621 S2156	N1572-S2344 CarbonylContact C-O 3.46Å; N1572-S2344 WeakPolarHBondContact CA-OG 3.46Å; N1572-S2344 CarbonylContact O-C 3.42Å; S1573-S2344 VanDerWaalsContact CA-C 3.45Å; S1573-S2344 VanDerWaalsContact O-CA 3.24Å; S1573-S2344 WeakPolarHBondContact O-CA 3.35Å; S1573-S2344 PolarHBondContact O-N 3.22Å; Q1574-S2344 VanDerWaalsContact CA-C 3.44Å; Q1574-S2344 VanDerWaalsContact CA-CA 3.43Å; Q1574-S2344 VanDerWaalsContact CB-C 3.48Å; Q1574-S2344 VanDerWaalsContact CD-O 3.22Å; Q1574-S2344 PolarHBondContact NE2-O 3.38Å; Q1574-S2344 PolarHBondContact OE1-O 2.93Å; L1619-S2344 VanDerWaalsContact O-CA 3.24Å; L1619-S2344 WeakPolarHBondContact O-CA 3.39Å; L1619-S2344 PolarHBondContact O-N 2.9Å; R1620-S2344 VanDerWaalsContact CA-OG 3.3Å; R1620-S2344 WeakPolarHBondContact CA-OG 3.5Å; R1620-S2344 WeakPolarHBondContact CG-OG 3.37Å; A1621-S2344 VanDerWaalsContact N-CB 3.31Å; A1621-S2344 PolarHBondContact N-OG 3.36Å; A1621-S2344 WeakPolarHBondContact O-CB 3.29Å; A1621-S2344 PolarHBondContact O-OG 2.96Å; S2156-S2344 WeakPolarHBondContact CB-O 3.48Å; S2156-S2344 PolarHBondContact OG-O 3.06Å
2345	W	42.5	Very low	39.8	Very low	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	S	Bend		0	-62.4	0	-130.6	-27.8	0	0	0	111.5	N1572 S1573 Q1574 N1576 T2297 L2298 V2299 P2315 V2316 H2347 L2348 F2349	N1572-W2345 PolarHBondContact O-N 3.15Å; S1573-W2345 VanDerWaalsContact C-N 3.27Å; S1573-W2345 VanDerWaalsContact CA-N 3.35Å; Q1574-W2345 VanDerWaalsContact CA-N 3.34Å; Q1574-W2345 HydrophobicContact CB-CB 3.49Å; Q1574-W2345 VanDerWaalsContact CB-CB 3.49Å; Q1574-W2345 HydrophobicContact CB-CD2 4.32Å; Q1574-W2345 HydrophobicContact CB-CG 3.51Å; Q1574-W2345 HydrophobicContact CG-CB 4.02Å; Q1574-W2345 HydrophobicContact CG-CG 4.15Å; Q1574-W2345 PolarHBondContact N-O 2.96Å; N1576-W2345 HydrophobicContact CB-CZ2 3.8Å; N1576-W2345 WeakPolarHBondContact ND2-CH2 3.24Å; N1576-W2345 WeakPolarHBondContact ND2-CZ2 3.22Å; N1576-W2345 WeakPolarHBondContact OD1-CH2 3.48Å; N1576-W2345 WeakPolarHBondContact OD1-CZ2 2.89Å; T2297-W2345 HydrophobicContact CG2-CH2 4.17Å; T2297-W2345 WeakPolarHBondContact O-CH2 3.33Å; T2297-W2345 WeakPolarHBondContact O-CZ3 3.5Å; L2298-W2345 HydrophobicContact CB-CB 3.72Å; L2298-W2345 HydrophobicContact CB-CD2 2.74Å; L2298-W2345 VanDerWaalsContact CB-CE2 3.47Å; L2298-W2345 HydrophobicContact CB-CE3 2.59Å; L2298-W2345 HydrophobicContact CB-CG 3.32Å; L2298-W2345 HydrophobicContact CB-CH2 3.79Å; L2298-W2345 HydrophobicContact CB-CZ2 3.92Å; L2298-W2345 HydrophobicContact CB-CZ3 3.14Å; L2298-W2345 HydrophobicContact CD1-CE3 4.3Å; L2298-W2345 HydrophobicContact CD2-CB 3.52Å; L2298-W2345 HydrophobicContact CD2-CD2 3.61Å; L2298-W2345 HydrophobicContact CD2-CE3 3.02Å; L2298-W2345 HydrophobicContact CD2-CG 3.84Å; L2298-W2345 HydrophobicContact CD2-CZ3 4.26Å; L2298-W2345 HydrophobicContact CG-CB 4.18Å; L2298-W2345 HydrophobicContact CG-CD2 3.55Å; L2298-W2345 HydrophobicContact CG-CE3 2.77Å; L2298-W2345 HydrophobicContact CG-CG 4.12Å; L2298-W2345 HydrophobicContact CG-CZ3 3.45Å; L2298-W2345 VanDerWaalsContact CG-CZ3 3.45Å; L2298-W2345 WeakPolarHBondContact O-CH2 3.31Å; L2298-W2345 WeakPolarHBondContact O-CZ2 3.43Å; L2298-W2345 WeakPolarHBondContact O-CZ3 3.45Å; L2298-W2345 PolarHBondContact O-NE1 3.17Å; L2298-W2345 VanDerWaalsContact O-NE1 3.12Å; V2299-W2345 HydrophobicContact CB-CH2 3.47Å; V2299-W2345 VanDerWaalsContact CB-CH2 3.47Å; V2299-W2345 HydrophobicContact CB-CZ3 3.74Å; V2299-W2345 HydrophobicContact CG2-CH2 3.19Å; V2299-W2345 HydrophobicContact CG2-CZ3 3.71Å; P2315-W2345 VanDerWaalsContact CA-CE3 3.46Å; P2315-W2345 HydrophobicContact CB-CB 4.27Å; P2315-W2345 HydrophobicContact CB-CD2 3.32Å; P2315-W2345 HydrophobicContact CB-CE3 3.35Å; P2315-W2345 HydrophobicContact CB-CG 3.65Å; V2316-W2345 VanDerWaalsContact C-CZ3 3.47Å; V2316-W2345 VanDerWaalsContact N-CZ3 3.34Å; V2316-W2345 VanDerWaalsContact O-CZ3 3.28Å; V2316-W2345 WeakPolarHBondContact O-CZ3 3.39Å; W2345-H2347 VanDerWaalsContact C-N 3.28Å; W2345-H2347 CarbonylContact O-C 3.52Å; W2345-H2347 PolarHBondContact O-N 2.86Å; W2345-L2348 CarbonylContact O-C 3.58Å; W2345-L2348 VanDerWaalsContact O-CA 3.26Å; W2345-L2348 WeakPolarHBondContact O-CA 3.38Å; W2345-L2348 WeakPolarHBondContact O-CB 3.39Å; W2345-L2348 PolarHBondContact O-N 3.1Å; W2345-F2349 HydrophobicContact CG-CB 4.27Å; W2345-F2349 PolarHBondContact O-N 3.04Å
2346	I	46.1	Very low	40.8	Very low	17 Å²	17	29.6 Å²	29.6	9%	0.087	16%	0.161	C	C	.	.	H	α-helix	trans	-73.6	-34.2	-134.7	-83.5	-173.9	0	0	0	112.7	K2154 D2155 Y2157 P2315 F2349 A2350	K2154-I2346 PolarHBondContact O-N 1.95Å; D2155-I2346 WeakPolarHBondContact O-CB 3.43Å; D2155-I2346 VanDerWaalsContact O-CD1 3.25Å; D2155-I2346 WeakPolarHBondContact O-CD1 3.38Å; D2155-I2346 WeakPolarHBondContact O-CG1 3.48Å; Y2157-I2346 HydrophobicContact CD1-CD1 3.81Å; Y2157-I2346 HydrophobicContact CD2-CD1 3.12Å; Y2157-I2346 HydrophobicContact CD2-CG1 4.3Å; Y2157-I2346 HydrophobicContact CE1-CD1 4Å; Y2157-I2346 HydrophobicContact CE2-CD1 3.35Å; Y2157-I2346 HydrophobicContact CG-CD1 3.29Å; P2315-I2346 HydrophobicContact CG-CD1 4.01Å; P2315-I2346 HydrophobicContact CG-CG1 3.72Å; I2346-F2349 HydrophobicContact CG1-CD1 4.41Å; I2346-F2349 HydrophobicContact CG2-CD1 4.23Å; I2346-F2349 CarbonylContact O-C 3.24Å; I2346-F2349 WeakPolarHBondContact O-CA 3.47Å; I2346-F2349 WeakPolarHBondContact O-CB 3.23Å; I2346-F2349 WeakPolarHBondContact O-CD1 3.33Å; I2346-F2349 PolarHBondContact O-N 3.16Å; I2346-F2349 VanDerWaalsContact O-N 3.16Å; I2346-A2350 WeakPolarHBondContact O-CB 3.47Å; I2346-A2350 PolarHBondContact O-N 3.45Å
2347	H	37.9	Very low	41.5	Very low	2 Å²	2	27.4 Å²	27.4	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-35.6	-75.8	148.7	-77.9	53.8	0	0	0	112.7	S1720 N1721 S2153 K2154 D2155 W2345 F2349 A2350 M2351	S1720-H2347 CarbonylContact O-C 3.43Å; S1720-H2347 WeakPolarHBondContact O-CA 3.45Å; S1720-H2347 VanDerWaalsContact O-CB 3.3Å; S1720-H2347 WeakPolarHBondContact O-CB 3.36Å; S1720-H2347 PolarHBondContact OG-CD2 2.94Å; S1720-H2347 VanDerWaalsContact OG-CD2 3.31Å; N1721-H2347 PolarHBondContact N-CD2 3.29Å; N1721-H2347 VanDerWaalsContact N-CD2 3.27Å; N1721-H2347 WeakPolarHBondContact OD1-CA 3.45Å; N1721-H2347 PolarHBondContact OD1-O 3.05Å; S2153-H2347 VanDerWaalsContact C-CD2 3.42Å; S2153-H2347 VanDerWaalsContact CB-CD2 3.42Å; S2153-H2347 WeakPolarHBondContact CB-CD2 3.42Å; S2153-H2347 PolarHBondContact OG-CD2 3.48Å; K2154-H2347 WeakPolarHBondContact CA-CD2 3.27Å; K2154-H2347 WeakPolarHBondContact CA-CE1 3.29Å; K2154-H2347 WeakPolarHBondContact CA-ND1 3.39Å; K2154-H2347 WeakPolarHBondContact CA-NE2 3.33Å; K2154-H2347 HydrophobicContact CB-CB 3.62Å; K2154-H2347 WeakPolarHBondContact CB-CD2 2.96Å; K2154-H2347 WeakPolarHBondContact CB-CE1 3.47Å; K2154-H2347 WeakPolarHBondContact CB-ND1 3.48Å; K2154-H2347 WeakPolarHBondContact CB-NE2 3.46Å; K2154-H2347 WeakPolarHBondContact CD-CE1 3.48Å; K2154-H2347 WeakPolarHBondContact CE-CE1 3.25Å; K2154-H2347 WeakPolarHBondContact CG-CE1 3.45Å; K2154-H2347 WeakPolarHBondContact CG-ND1 3.32Å; K2154-H2347 WeakPolarHBondContact CG-NE2 3.48Å; K2154-H2347 PolarHBondContact N-CD2 2.59Å; K2154-H2347 PolarHBondContact N-NE2 3.4Å; K2154-H2347 PolarHBondContact NZ-CE1 2.91Å; K2154-H2347 PolarHBondContact NZ-NE2 2.74Å; K2154-H2347 WeakPolarHBondContact O-CB 3.33Å; K2154-H2347 PolarHBondContact O-N 2.86Å; K2154-H2347 PolarHBondContact O-ND1 2.78Å; D2155-H2347 WeakPolarHBondContact CB-ND1 3.26Å; D2155-H2347 PolarHBondContact N-ND1 2.91Å; D2155-H2347 IonicContact OD1-CE1 4Å; D2155-H2347 PolarHBondContact OD1-CE1 3.13Å; D2155-H2347 IonicContact OD1-ND1 3.9Å; D2155-H2347 IonicContact OD2-CE1 2.64Å; D2155-H2347 PolarHBondContact OD2-CE1 2.93Å; D2155-H2347 IonicContact OD2-ND1 3.47Å; D2155-H2347 PolarHBondContact OD2-ND1 3.39Å; W2345-H2347 VanDerWaalsContact C-N 3.28Å; W2345-H2347 CarbonylContact O-C 3.52Å; W2345-H2347 PolarHBondContact O-N 2.86Å; H2347-F2349 PolarHBondContact O-N 2.77Å; H2347-A2350 CarbonylContact O-C 3.55Å; H2347-A2350 VanDerWaalsContact O-CA 3.23Å; H2347-A2350 WeakPolarHBondContact O-CA 3.25Å; H2347-A2350 PolarHBondContact O-N 3.34Å; H2347-M2351 PolarHBondContact O-N 3.11Å
2348	L	41.9	Very low	42.2	Very low	17 Å²	17	27.8 Å²	27.8	9%	0.089	14%	0.139	C	C	.	.	H	α-helix	trans	-44.2	-40.8	170.5	177.6	69.8	0	0	0	114.5	Q1574 A1718 V1719 S1720 Y1724 F2343 W2345 A2350 M2351 I2352	Q1574-L2348 WeakPolarHBondContact O-CB 3.32Å; Q1574-L2348 WeakPolarHBondContact O-CD2 3.27Å; Q1574-L2348 WeakPolarHBondContact O-CG 3.35Å; A1718-L2348 HydrophobicContact CB-CB 4.14Å; A1718-L2348 HydrophobicContact CB-CD1 3.43Å; A1718-L2348 VanDerWaalsContact CB-CD1 3.43Å; A1718-L2348 HydrophobicContact CB-CD2 3.57Å; A1718-L2348 HydrophobicContact CB-CG 3.78Å; V1719-L2348 WeakPolarHBondContact O-CA 3.49Å; V1719-L2348 PolarHBondContact O-N 2.88Å; V1719-L2348 VanDerWaalsContact O-N 3.08Å; S1720-L2348 PolarHBondContact O-N 3.07Å; S1720-L2348 VanDerWaalsContact O-N 3.16Å; Y1724-L2348 WeakPolarHBondContact OH-CD1 3.4Å; F2343-L2348 HydrophobicContact CE1-CB 4.44Å; W2345-L2348 CarbonylContact O-C 3.58Å; W2345-L2348 VanDerWaalsContact O-CA 3.26Å; W2345-L2348 WeakPolarHBondContact O-CA 3.38Å; W2345-L2348 WeakPolarHBondContact O-CB 3.39Å; W2345-L2348 PolarHBondContact O-N 3.1Å; L2348-A2350 VanDerWaalsContact C-N 3.27Å; L2348-A2350 PolarHBondContact O-N 3.38Å; L2348-M2351 HydrophobicContact CD1-CB 4.33Å; L2348-M2351 CarbonylContact O-C 3.51Å; L2348-M2351 WeakPolarHBondContact O-CA 3.18Å; L2348-M2351 WeakPolarHBondContact O-CB 3.38Å; L2348-M2351 PolarHBondContact O-N 2.85Å; L2348-I2352 PolarHBondContact O-N 3.39Å
2349	F	45.4	Very low	42.8	Very low	21 Å²	21	24.6 Å²	24.6	9%	0.092	13%	0.133	C	C	.	.	H	α-helix	trans	-68.1	-28.5	179.2	149.7	-95.1	0	0	0	112.4	N2300 E2313 P2315 W2345 I2346 H2347 I2352 V2353	N2300-F2349 WeakPolarHBondContact OD1-CD2 3.46Å; E2313-F2349 HydrophobicContact CB-CD2 4.04Å; E2313-F2349 HydrophobicContact CB-CE2 3.57Å; E2313-F2349 WeakPolarHBondContact O-CE2 3.23Å; E2313-F2349 VanDerWaalsContact O-CZ 3.25Å; E2313-F2349 WeakPolarHBondContact O-CZ 3.47Å; P2315-F2349 HydrophobicContact CB-CB 3.88Å; P2315-F2349 HydrophobicContact CB-CD1 4.39Å; P2315-F2349 HydrophobicContact CB-CD2 3.98Å; P2315-F2349 HydrophobicContact CB-CG 3.8Å; P2315-F2349 HydrophobicContact CG-CB 3.95Å; P2315-F2349 HydrophobicContact CG-CD1 3.54Å; P2315-F2349 HydrophobicContact CG-CD2 3.82Å; P2315-F2349 HydrophobicContact CG-CE1 3.92Å; P2315-F2349 HydrophobicContact CG-CE2 4.19Å; P2315-F2349 HydrophobicContact CG-CG 3.45Å; P2315-F2349 VanDerWaalsContact CG-CG 3.45Å; P2315-F2349 HydrophobicContact CG-CZ 4.22Å; W2345-F2349 HydrophobicContact CG-CB 4.27Å; W2345-F2349 PolarHBondContact O-N 3.04Å; I2346-F2349 HydrophobicContact CG1-CD1 4.41Å; I2346-F2349 HydrophobicContact CG2-CD1 4.23Å; I2346-F2349 CarbonylContact O-C 3.24Å; I2346-F2349 WeakPolarHBondContact O-CA 3.47Å; I2346-F2349 WeakPolarHBondContact O-CB 3.23Å; I2346-F2349 WeakPolarHBondContact O-CD1 3.33Å; I2346-F2349 PolarHBondContact O-N 3.16Å; I2346-F2349 VanDerWaalsContact O-N 3.16Å; H2347-F2349 PolarHBondContact O-N 2.77Å; F2349-I2352 VanDerWaalsContact C-N 3.31Å; F2349-I2352 CarbonylContact O-C 3.41Å; F2349-I2352 VanDerWaalsContact O-CA 3.3Å; F2349-I2352 WeakPolarHBondContact O-CA 3.41Å; F2349-I2352 PolarHBondContact O-N 3.17Å; F2349-V2353 HydrophobicContact CD1-CG2 4.32Å; F2349-V2353 HydrophobicContact CD2-CG2 4.12Å; F2349-V2353 HydrophobicContact CE1-CG2 3.69Å; F2349-V2353 HydrophobicContact CE2-CG2 3.41Å; F2349-V2353 VanDerWaalsContact CE2-CG2 3.41Å; F2349-V2353 HydrophobicContact CZ-CG2 3.19Å; F2349-V2353 PolarHBondContact O-N 3.17Å
2350	A	46.1	Very low	43.4	Very low	12 Å²	12	23.3 Å²	23.3	10%	0.099	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	19	160.3	0	0	0	0	0	112.1	N1721 R1955 I2346 H2347 L2348 I2354	N1721-A2350 VanDerWaalsContact CG-CB 3.49Å; N1721-A2350 VanDerWaalsContact ND2-CB 3.26Å; N1721-A2350 WeakPolarHBondContact ND2-CB 3.37Å; N1721-A2350 VanDerWaalsContact OD1-CA 3.26Å; N1721-A2350 WeakPolarHBondContact OD1-CA 3.1Å; N1721-A2350 WeakPolarHBondContact OD1-CB 3.36Å; N1721-A2350 PolarHBondContact OD1-O 2.93Å; R1955-A2350 VanDerWaalsContact CZ-O 3.24Å; R1955-A2350 PolarHBondContact NE-O 3.46Å; R1955-A2350 VanDerWaalsContact NE-O 3.1Å; R1955-A2350 PolarHBondContact NH2-O 3.18Å; I2346-A2350 WeakPolarHBondContact O-CB 3.47Å; I2346-A2350 PolarHBondContact O-N 3.45Å; H2347-A2350 CarbonylContact O-C 3.55Å; H2347-A2350 VanDerWaalsContact O-CA 3.23Å; H2347-A2350 WeakPolarHBondContact O-CA 3.25Å; H2347-A2350 PolarHBondContact O-N 3.34Å; L2348-A2350 VanDerWaalsContact C-N 3.27Å; L2348-A2350 PolarHBondContact O-N 3.38Å; A2350-I2354 HydrophobicContact CB-CD1 3.91Å; A2350-I2354 HydrophobicContact CB-CG1 3.92Å; A2350-I2354 WeakPolarHBondContact O-CD1 3.17Å; A2350-I2354 WeakPolarHBondContact O-CG1 3.46Å
2351	M	46.3	Very low	43.9	Very low	44 Å²	44	22.7 Å²	22.7	22%	0.217	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	15.7	133.6	-101.6	-117.8	23.7	0	0	118.4	Y1724 R1955 H2347 L2348	Y1724-M2351 HydrophobicContact CD1-CB 4.48Å; Y1724-M2351 HydrophobicContact CD1-CG 3.61Å; Y1724-M2351 HydrophobicContact CD1-SD 3.21Å; Y1724-M2351 WeakPolarHBondContact CD1-SD 3.09Å; Y1724-M2351 HydrophobicContact CD2-CB 3.67Å; Y1724-M2351 HydrophobicContact CD2-CG 3.31Å; Y1724-M2351 HydrophobicContact CD2-SD 4.12Å; Y1724-M2351 HydrophobicContact CE1-CB 4.05Å; Y1724-M2351 HydrophobicContact CE1-CE 3.88Å; Y1724-M2351 HydrophobicContact CE1-CG 3.59Å; Y1724-M2351 HydrophobicContact CE1-SD 3.12Å; Y1724-M2351 WeakPolarHBondContact CE1-SD 3.15Å; Y1724-M2351 HydrophobicContact CE2-CB 3.14Å; Y1724-M2351 HydrophobicContact CE2-CG 3.29Å; Y1724-M2351 HydrophobicContact CE2-SD 4.06Å; Y1724-M2351 HydrophobicContact CG-CB 4.32Å; Y1724-M2351 HydrophobicContact CG-CG 3.48Å; Y1724-M2351 VanDerWaalsContact CG-CG 3.48Å; Y1724-M2351 HydrophobicContact CG-SD 3.74Å; Y1724-M2351 VanDerWaalsContact CZ-CG 3.42Å; Y1724-M2351 VanDerWaalsContact CZ-SD 3.56Å; R1955-M2351 VanDerWaalsContact CD-CG 3.47Å; R1955-M2351 WeakPolarHBondContact CD-SD 3.47Å; R1955-M2351 HydrophobicContact CG-CG 3.96Å; R1955-M2351 HydrophobicContact CG-SD 3.73Å; R1955-M2351 PolarHBondContact NH1-O 3.16Å; R1955-M2351 VanDerWaalsContact NH2-N 3.17Å; H2347-M2351 PolarHBondContact O-N 3.11Å; L2348-M2351 HydrophobicContact CD1-CB 4.33Å; L2348-M2351 CarbonylContact O-C 3.51Å; L2348-M2351 WeakPolarHBondContact O-CA 3.18Å; L2348-M2351 WeakPolarHBondContact O-CB 3.38Å; L2348-M2351 PolarHBondContact O-N 2.85Å
2352	I	45.8	Very low	44.1	Very low	39 Å²	39	26.4 Å²	26.4	20%	0.2	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-34.7	154.1	-37.6	171.6	0	0	0	116	R1955 N2300 E2313 L2348 F2349 L2356	R1955-I2352 PolarHBondContact NH1-O 3.34Å; N2300-I2352 WeakPolarHBondContact ND2-CD1 3.19Å; E2313-I2352 HydrophobicContact CG-CG2 4.32Å; E2313-I2352 WeakPolarHBondContact OE2-CB 3.44Å; E2313-I2352 WeakPolarHBondContact OE2-CD1 3.34Å; E2313-I2352 WeakPolarHBondContact OE2-CG2 3.39Å; L2348-I2352 PolarHBondContact O-N 3.39Å; F2349-I2352 VanDerWaalsContact C-N 3.31Å; F2349-I2352 CarbonylContact O-C 3.41Å; F2349-I2352 VanDerWaalsContact O-CA 3.3Å; F2349-I2352 WeakPolarHBondContact O-CA 3.41Å; F2349-I2352 PolarHBondContact O-N 3.17Å; I2352-L2356 HydrophobicContact CG2-CD1 4.43Å; I2352-L2356 WeakPolarHBondContact O-CB 3.48Å; I2352-L2356 PolarHBondContact O-N 3.16Å; I2352-L2356 VanDerWaalsContact O-N 3.11Å
2353	V	49.8	Very low	44.4	Very low	37 Å²	37	30.8 Å²	30.8	22%	0.224	17%	0.165	C	C	.	.	H	α-helix	trans	-53.9	-86	163.4	-178.4	0	0	0	0	115.9	F2349 T2355 L2356 F2357	F2349-V2353 HydrophobicContact CD1-CG2 4.32Å; F2349-V2353 HydrophobicContact CD2-CG2 4.12Å; F2349-V2353 HydrophobicContact CE1-CG2 3.69Å; F2349-V2353 HydrophobicContact CE2-CG2 3.41Å; F2349-V2353 VanDerWaalsContact CE2-CG2 3.41Å; F2349-V2353 HydrophobicContact CZ-CG2 3.19Å; F2349-V2353 PolarHBondContact O-N 3.17Å; V2353-T2355 VanDerWaalsContact C-N 3.3Å; V2353-T2355 PolarHBondContact O-N 2.87Å; V2353-L2356 CarbonylContact O-C 2.99Å; V2353-L2356 WeakPolarHBondContact O-CA 3.43Å; V2353-L2356 WeakPolarHBondContact O-CB 3.36Å; V2353-L2356 PolarHBondContact O-N 3.34Å; V2353-F2357 PolarHBondContact O-N 2.96Å
2354	I	50.3	Low	44.6	Very low	21 Å²	21	33.8 Å²	33.8	11%	0.108	18%	0.181	C	C	.	.	H	α-helix	trans	-32.7	-21.1	173.3	-23.7	-178.5	0	0	0	120.1	V1953 D1954 R1955 P1956 A2350 F2357 I2358	V1953-I2354 VanDerWaalsContact C-CG2 3.47Å; V1953-I2354 HydrophobicContact CG1-CG2 4.25Å; V1953-I2354 WeakPolarHBondContact O-CG2 3.46Å; D1954-I2354 CarbonylContact C-O 3.54Å; D1954-I2354 WeakPolarHBondContact O-CG2 3.3Å; R1955-I2354 VanDerWaalsContact CA-CG2 3.48Å; R1955-I2354 VanDerWaalsContact CA-O 3.3Å; R1955-I2354 WeakPolarHBondContact CA-O 3.41Å; R1955-I2354 HydrophobicContact CB-CB 4.32Å; R1955-I2354 HydrophobicContact CB-CG2 4.48Å; R1955-I2354 WeakPolarHBondContact CB-O 3.25Å; R1955-I2354 VanDerWaalsContact CZ-CA 3.4Å; R1955-I2354 PolarHBondContact N-O 3.09Å; R1955-I2354 VanDerWaalsContact NE-C 3.33Å; R1955-I2354 VanDerWaalsContact NE-CB 3.35Å; R1955-I2354 VanDerWaalsContact NH2-CA 3.29Å; P1956-I2354 HydrophobicContact CG-CD1 3.99Å; P1956-I2354 HydrophobicContact CG-CG2 4.35Å; A2350-I2354 HydrophobicContact CB-CD1 3.91Å; A2350-I2354 HydrophobicContact CB-CG1 3.92Å; A2350-I2354 WeakPolarHBondContact O-CD1 3.17Å; A2350-I2354 WeakPolarHBondContact O-CG1 3.46Å; I2354-F2357 CarbonylContact O-C 3.42Å; I2354-F2357 WeakPolarHBondContact O-CB 3.31Å; I2354-I2358 PolarHBondContact O-N 2.86Å
2355	T	42.3	Very low	44.6	Very low	56 Å²	56	38.4 Å²	38.4	34%	0.344	20%	0.204	S	C	.	.	H	α-helix	trans	-107.8	-18.6	167.7	43.6	0	0	0	0	111.5	R1955 V2353 I2358 A2359	R1955-T2355 HydrophobicContact CB-CG2 3.33Å; R1955-T2355 VanDerWaalsContact CD-CG2 3.41Å; R1955-T2355 VanDerWaalsContact CD-OG1 3.29Å; R1955-T2355 WeakPolarHBondContact CD-OG1 3.43Å; R1955-T2355 HydrophobicContact CG-CG2 3.65Å; R1955-T2355 PolarHBondContact NH1-OG1 3.41Å; V2353-T2355 VanDerWaalsContact C-N 3.3Å; V2353-T2355 PolarHBondContact O-N 2.87Å; T2355-I2358 HydrophobicContact CG2-CB 4.06Å; T2355-I2358 HydrophobicContact CG2-CD1 4.4Å; T2355-I2358 HydrophobicContact CG2-CG2 4.45Å; T2355-A2359 WeakPolarHBondContact O-CA 3.29Å; T2355-A2359 WeakPolarHBondContact O-CB 3.43Å; T2355-A2359 PolarHBondContact O-N 2.96Å
2356	L	49.6	Very low	44.3	Very low	20 Å²	20	44.9 Å²	44.9	11%	0.105	23%	0.233	C	C	.	.	H	α-helix	trans	-58.6	-35.2	145.5	-85.5	163.9	0	0	0	109.1	H2311 E2313 I2352 V2353 A2359 I2360	H2311-L2356 HydrophobicContact CB-CD1 3.63Å; H2311-L2356 HydrophobicContact CB-CD2 3.65Å; H2311-L2356 HydrophobicContact CB-CG 4.23Å; E2313-L2356 HydrophobicContact CG-CD1 3.87Å; I2352-L2356 HydrophobicContact CG2-CD1 4.43Å; I2352-L2356 WeakPolarHBondContact O-CB 3.48Å; I2352-L2356 PolarHBondContact O-N 3.16Å; I2352-L2356 VanDerWaalsContact O-N 3.11Å; V2353-L2356 CarbonylContact O-C 2.99Å; V2353-L2356 WeakPolarHBondContact O-CA 3.43Å; V2353-L2356 WeakPolarHBondContact O-CB 3.36Å; V2353-L2356 PolarHBondContact O-N 3.34Å; L2356-A2359 CarbonylContact O-C 3.52Å; L2356-A2359 PolarHBondContact O-N 2.98Å; L2356-I2360 HydrophobicContact CB-CD1 4.46Å; L2356-I2360 WeakPolarHBondContact O-CA 3.48Å; L2356-I2360 WeakPolarHBondContact O-CB 3.48Å; L2356-I2360 WeakPolarHBondContact O-CD1 3.44Å; L2356-I2360 WeakPolarHBondContact O-CG1 3.22Å; L2356-I2360 PolarHBondContact O-N 2.97Å
2357	F	49.4	Very low	43.7	Very low	62 Å²	62	52 Å²	52	27%	0.272	26%	0.258	S	S	.	.	H	α-helix	trans	-67.2	-50.3	171	-122.8	-45.8	0	0	0	112.6	V1953 D1954 V2353 I2354 A2359 I2360 I2361	V1953-F2357 WeakPolarHBondContact O-CB 3.46Å; V1953-F2357 WeakPolarHBondContact O-CD2 3.49Å; V1953-F2357 WeakPolarHBondContact O-CG 3.23Å; D1954-F2357 WeakPolarHBondContact OD1-CB 3.19Å; V2353-F2357 PolarHBondContact O-N 2.96Å; I2354-F2357 CarbonylContact O-C 3.42Å; I2354-F2357 WeakPolarHBondContact O-CB 3.31Å; F2357-A2359 VanDerWaalsContact C-N 3.3Å; F2357-A2359 PolarHBondContact O-N 2.84Å; F2357-I2360 CarbonylContact O-C 3.53Å; F2357-I2360 WeakPolarHBondContact O-CA 3.35Å; F2357-I2360 WeakPolarHBondContact O-CB 3.38Å; F2357-I2360 PolarHBondContact O-N 2.92Å; F2357-I2361 HydrophobicContact CD1-CD1 4.45Å; F2357-I2361 HydrophobicContact CD1-CG1 4.19Å; F2357-I2361 PolarHBondContact O-N 3.46Å
2358	I	46.2	Very low	43.4	Very low	52 Å²	52	56.1 Å²	56.1	27%	0.267	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-40.9	170.5	-81.9	177.7	0	0	0	112.1	D1954 R1955 I2354 T2355 I2360 I2361 I2362	D1954-I2358 HydrophobicContact CB-CD1 4.34Å; D1954-I2358 HydrophobicContact CB-CG1 3.56Å; D1954-I2358 VanDerWaalsContact CG-CG1 3.41Å; D1954-I2358 PolarHBondContact OD1-N 3.03Å; D1954-I2358 VanDerWaalsContact OD1-N 3.17Å; D1954-I2358 WeakPolarHBondContact OD2-CA 3.33Å; D1954-I2358 VanDerWaalsContact OD2-CG1 3.24Å; D1954-I2358 WeakPolarHBondContact OD2-CG1 3.42Å; R1955-I2358 HydrophobicContact CB-CD1 3.67Å; R1955-I2358 HydrophobicContact CB-CG1 4.16Å; R1955-I2358 VanDerWaalsContact N-CG1 3.33Å; I2354-I2358 PolarHBondContact O-N 2.86Å; T2355-I2358 HydrophobicContact CG2-CB 4.06Å; T2355-I2358 HydrophobicContact CG2-CD1 4.4Å; T2355-I2358 HydrophobicContact CG2-CG2 4.45Å; I2358-I2360 VanDerWaalsContact C-N 3.29Å; I2358-I2360 PolarHBondContact O-N 3.02Å; I2358-I2361 PolarHBondContact O-N 2.9Å; I2358-I2362 HydrophobicContact CG2-CD1 3.55Å; I2358-I2362 HydrophobicContact CG2-CG1 4.14Å; I2358-I2362 VanDerWaalsContact O-CB 3.25Å; I2358-I2362 WeakPolarHBondContact O-CB 3.49Å; I2358-I2362 VanDerWaalsContact O-CG1 3.26Å; I2358-I2362 WeakPolarHBondContact O-CG1 3.37Å; I2358-I2362 PolarHBondContact O-N 2.83Å
2359	A	41.3	Very low	42.7	Very low	43 Å²	43	63.8 Å²	63.8	36%	0.355	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-38.4	173.9	0	0	0	0	0	110.7	T2355 L2356 F2357 H2363	T2355-A2359 WeakPolarHBondContact O-CA 3.29Å; T2355-A2359 WeakPolarHBondContact O-CB 3.43Å; T2355-A2359 PolarHBondContact O-N 2.96Å; L2356-A2359 CarbonylContact O-C 3.52Å; L2356-A2359 PolarHBondContact O-N 2.98Å; F2357-A2359 VanDerWaalsContact C-N 3.3Å; F2357-A2359 PolarHBondContact O-N 2.84Å; A2359-H2363 WeakPolarHBondContact O-CA 3.13Å; A2359-H2363 WeakPolarHBondContact O-CB 3.47Å; A2359-H2363 PolarHBondContact O-N 2.89Å
2360	I	46.9	Very low	41.8	Very low	19 Å²	19	69 Å²	69	10%	0.097	36%	0.357	C	S	.	.	H	α-helix	trans	-71.6	-38.3	177.2	-73.8	159.3	0	0	0	111.4	Q2310 L2356 F2357 I2358 H2363 I2364	Q2310-I2360 HydrophobicContact CB-CD1 3.82Å; Q2310-I2360 HydrophobicContact CB-CG1 4.29Å; Q2310-I2360 HydrophobicContact CG-CD1 3.84Å; Q2310-I2360 HydrophobicContact CG-CG1 3.93Å; Q2310-I2360 HydrophobicContact CG-CG2 4.1Å; L2356-I2360 HydrophobicContact CB-CD1 4.46Å; L2356-I2360 WeakPolarHBondContact O-CA 3.48Å; L2356-I2360 WeakPolarHBondContact O-CB 3.48Å; L2356-I2360 WeakPolarHBondContact O-CD1 3.44Å; L2356-I2360 WeakPolarHBondContact O-CG1 3.22Å; L2356-I2360 PolarHBondContact O-N 2.97Å; F2357-I2360 CarbonylContact O-C 3.53Å; F2357-I2360 WeakPolarHBondContact O-CA 3.35Å; F2357-I2360 WeakPolarHBondContact O-CB 3.38Å; F2357-I2360 PolarHBondContact O-N 2.92Å; I2358-I2360 VanDerWaalsContact C-N 3.29Å; I2358-I2360 PolarHBondContact O-N 3.02Å; I2360-H2363 CarbonylContact O-C 3.58Å; I2360-I2364 HydrophobicContact CG2-CD1 3.59Å; I2360-I2364 HydrophobicContact CG2-CG1 4.34Å; I2360-I2364 WeakPolarHBondContact O-CB 3.42Å; I2360-I2364 WeakPolarHBondContact O-CD1 3.42Å; I2360-I2364 WeakPolarHBondContact O-CG1 3.13Å; I2360-I2364 PolarHBondContact O-N 2.68Å
2361	I	46.3	Very low	40.8	Very low	14 Å²	14	75.5 Å²	75.5	7%	0.072	39%	0.389	C	S	.	.	H	α-helix	trans	-75.2	-42.1	176.6	-65.6	-159.6	0	0	0	110.6	D1954 F2357 I2358 H2363 I2364 I2365	D1954-I2361 VanDerWaalsContact CG-CD1 3.47Å; D1954-I2361 VanDerWaalsContact OD1-CD1 3.24Å; D1954-I2361 WeakPolarHBondContact OD1-CD1 3.41Å; D1954-I2361 VanDerWaalsContact OD1-CG1 3.32Å; D1954-I2361 WeakPolarHBondContact OD1-CG1 3.43Å; D1954-I2361 VanDerWaalsContact OD2-CB 3.3Å; D1954-I2361 WeakPolarHBondContact OD2-CB 3.33Å; F2357-I2361 HydrophobicContact CD1-CD1 4.45Å; F2357-I2361 HydrophobicContact CD1-CG1 4.19Å; F2357-I2361 PolarHBondContact O-N 3.46Å; I2358-I2361 PolarHBondContact O-N 2.9Å; I2361-H2363 VanDerWaalsContact C-N 3.31Å; I2361-H2363 PolarHBondContact O-N 2.73Å; I2361-I2364 PolarHBondContact O-N 3.33Å; I2361-I2365 HydrophobicContact CG2-CD1 3.64Å; I2361-I2365 HydrophobicContact CG2-CG1 4.22Å; I2361-I2365 VanDerWaalsContact O-CB 3.31Å; I2361-I2365 WeakPolarHBondContact O-CB 3.32Å; I2361-I2365 VanDerWaalsContact O-CG1 3.24Å; I2361-I2365 WeakPolarHBondContact O-CG1 3.23Å; I2361-I2365 PolarHBondContact O-N 2.79Å
2362	I	44.4	Very low	39.7	Very low	77 Å²	77	80.9 Å²	80.9	40%	0.395	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-40.8	170.9	-67	178	0	0	0	110.1	I2358 F2366	I2358-I2362 HydrophobicContact CG2-CD1 3.55Å; I2358-I2362 HydrophobicContact CG2-CG1 4.14Å; I2358-I2362 VanDerWaalsContact O-CB 3.25Å; I2358-I2362 WeakPolarHBondContact O-CB 3.49Å; I2358-I2362 VanDerWaalsContact O-CG1 3.26Å; I2358-I2362 WeakPolarHBondContact O-CG1 3.37Å; I2358-I2362 PolarHBondContact O-N 2.83Å; I2362-F2366 HydrophobicContact CG2-CD2 3.92Å; I2362-F2366 HydrophobicContact CG2-CE2 4.36Å; I2362-F2366 WeakPolarHBondContact O-CB 3.5Å; I2362-F2366 WeakPolarHBondContact O-CD2 3.3Å; I2362-F2366 PolarHBondContact O-N 2.87Å
2363	H	40.3	Very low	38.7	Very low	92 Å²	92	84.3 Å²	84.3	43%	0.426	44%	0.444	S	S	.	.	H	α-helix	trans	-75.8	-22.7	178.4	-163.7	-16.6	0	0	0	113.4	A2359 I2360 I2361 R2367	A2359-H2363 WeakPolarHBondContact O-CA 3.13Å; A2359-H2363 WeakPolarHBondContact O-CB 3.47Å; A2359-H2363 PolarHBondContact O-N 2.89Å; I2360-H2363 CarbonylContact O-C 3.58Å; I2361-H2363 VanDerWaalsContact C-N 3.31Å; I2361-H2363 PolarHBondContact O-N 2.73Å; H2363-R2367 VanDerWaalsContact O-CB 3.25Å; H2363-R2367 WeakPolarHBondContact O-CB 3.43Å; H2363-R2367 PolarHBondContact O-N 2.8Å
2364	I	40.6	Very low	37.6	Very low	64 Å²	64	87 Å²	87	33%	0.328	47%	0.465	S	S	.	.	H	α-helix	trans	-76.6	-49.2	169.3	-76.9	167.1	0	0	0	109.7	I2360 I2361 F2366 R2367 S2368	I2360-I2364 HydrophobicContact CG2-CD1 3.59Å; I2360-I2364 HydrophobicContact CG2-CG1 4.34Å; I2360-I2364 WeakPolarHBondContact O-CB 3.42Å; I2360-I2364 WeakPolarHBondContact O-CD1 3.42Å; I2360-I2364 WeakPolarHBondContact O-CG1 3.13Å; I2360-I2364 PolarHBondContact O-N 2.68Å; I2361-I2364 PolarHBondContact O-N 3.33Å; I2364-F2366 VanDerWaalsContact C-N 3.34Å; I2364-F2366 PolarHBondContact O-N 3.33Å; I2364-R2367 CarbonylContact O-C 3.56Å; I2364-R2367 PolarHBondContact O-N 3.08Å; I2364-S2368 WeakPolarHBondContact O-CB 3.26Å; I2364-S2368 PolarHBondContact O-N 2.69Å; I2364-S2368 PolarHBondContact O-OG 2.96Å
2365	I	38.5	Very low	36.5	Very low	97 Å²	97	91.1 Å²	91.1	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-59.1	-43.9	177.8	-70.6	172	0	0	0	110.8	I2361 R2367	I2361-I2365 HydrophobicContact CG2-CD1 3.64Å; I2361-I2365 HydrophobicContact CG2-CG1 4.22Å; I2361-I2365 VanDerWaalsContact O-CB 3.31Å; I2361-I2365 WeakPolarHBondContact O-CB 3.32Å; I2361-I2365 VanDerWaalsContact O-CG1 3.24Å; I2361-I2365 WeakPolarHBondContact O-CG1 3.23Å; I2361-I2365 PolarHBondContact O-N 2.79Å; I2365-R2367 VanDerWaalsContact C-N 3.26Å; I2365-R2367 PolarHBondContact O-N 3.31Å
2366	F	36	Very low	35.6	Very low	137 Å²	137	94.8 Å²	94.8	60%	0.601	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	13.6	175	-80.1	-77.3	0	0	0	114.7	I2362 I2364	I2362-F2366 HydrophobicContact CG2-CD2 3.92Å; I2362-F2366 HydrophobicContact CG2-CE2 4.36Å; I2362-F2366 WeakPolarHBondContact O-CB 3.5Å; I2362-F2366 WeakPolarHBondContact O-CD2 3.3Å; I2362-F2366 PolarHBondContact O-N 2.87Å; I2364-F2366 VanDerWaalsContact C-N 3.34Å; I2364-F2366 PolarHBondContact O-N 3.33Å
2367	R	32.3	Very low	34.5	Very low	165 Å²	165	100.7 Å²	100.7	62%	0.623	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.5	10.5	174.6	-135.1	-179.5	-163.9	154.4	15.5	117.7	H2363 I2364 I2365	H2363-R2367 VanDerWaalsContact O-CB 3.25Å; H2363-R2367 WeakPolarHBondContact O-CB 3.43Å; H2363-R2367 PolarHBondContact O-N 2.8Å; I2364-R2367 CarbonylContact O-C 3.56Å; I2364-R2367 PolarHBondContact O-N 3.08Å; I2365-R2367 VanDerWaalsContact C-N 3.26Å; I2365-R2367 PolarHBondContact O-N 3.31Å
2368	S	32.7	Very low	33.5	Very low	89 Å²	89	101.9 Å²	101.9	62%	0.622	56%	0.561	S	S	*	*	S	Bend	trans	-95.3	24.2	173	69.6	0	0	0	0	114.3	I2364	I2364-S2368 WeakPolarHBondContact O-CB 3.26Å; I2364-S2368 PolarHBondContact O-N 2.69Å; I2364-S2368 PolarHBondContact O-OG 2.96Å
2369	E	25.9	Very low	32.7	Very low	179 Å²	179	106 Å²	106	84%	0.836	58%	0.583	S	S	*	*			trans	-146.6	95.8	162.1	-136.1	174.9	-113.8	0	0	112.5
2370	T	26.6	Very low	32.2	Very low	131 Å²	131	111 Å²	111	80%	0.804	60%	0.602	S	S	*	*			trans	-174	126.4	133.6	17.5	0	0	0	0	112.6
2371	L	25.2	Very low	31.2	Very low	148 Å²	148	113.3 Å²	113.3	78%	0.775	63%	0.631	S	S	*	*			trans	84.6	106.9	146.2	-61.8	169	0	0	0	122.2
2372	I	24.5	Very low	30.3	Very low	156 Å²	156	120.3 Å²	120.3	80%	0.8	66%	0.661	S	S	*	*			trans	85.8	100.9	133.9	-55.1	161.7	0	0	0	119
2373	S	24.9	Very low	29.8	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	68%	0.677	S	S	*	*			trans	175.9	138.7	134.3	179.5	0	0	0	0	108.7
2374	S	25.2	Very low	29.2	Very low	94 Å²	94	125.7 Å²	125.7	66%	0.657	69%	0.689	S	S	*	*			cis	-166.3	160.7	-18	49	0	0	0	0	108.9
2375	S	26.6	Very low	28.8	Very low	108 Å²	108	128.2 Å²	128.2	76%	0.755	71%	0.709	S	S	*	*			trans	66.9	152.3	180	87.5	0	0	0	0	114.9
2376	N	25.4	Very low	28.3	Very low	132 Å²	132	127.1 Å²	127.1	71%	0.706	72%	0.722	S	S	*	*			cis	-155.6	137.8	-2.3	-127.7	-5.5	0	0	0	109.9
2377	N	26	Very low	28	Very low	144 Å²	144	125.9 Å²	125.9	77%	0.77	73%	0.728	S	S	*	*			trans	61.2	140.9	158.2	-62	-28.7	0	0	0	119.2
2378	S	28.1	Very low	27.7	Very low	88 Å²	88	125.5 Å²	125.5	62%	0.615	74%	0.738	S	S	*	*			cis	-163.3	163.4	-4.7	51.6	0	0	0	0	112.4
2379	N	29.1	Very low	27.6	Very low	138 Å²	138	126.4 Å²	126.4	74%	0.738	74%	0.741	S	S	*	*			trans	71.2	140	154.3	-61.1	-23.7	0	0	0	119.6
2380	I	30.2	Very low	27.7	Very low	147 Å²	147	122.7 Å²	122.7	75%	0.754	73%	0.732	S	S	*	*			cis	-151.9	132.8	-8.7	-101.1	153.7	0	0	0	108.7
2381	G	27.5	Very low	27.8	Very low	68 Å²	68	124.2 Å²	124.2	70%	0.701	74%	0.735	S	S	*	*			trans	54.7	172.6	143.7	0	0	0	0	0	122.5
2382	K	26.4	Very low	28	Very low	161 Å²	161	122.3 Å²	122.3	70%	0.7	73%	0.729	S	S	*	*			cis	-168.1	137.5	-7.5	-125.2	169.4	175	-177.5	0	112.2
2383	Y	33.9	Very low	28.1	Very low	184 Å²	184	124.8 Å²	124.8	72%	0.722	73%	0.734	S	S	*	*			trans	75.7	134	166.1	-41.1	-57.9	0	0	0	118.7
2384	S	27.3	Very low	28.1	Very low	99 Å²	99	123.4 Å²	123.4	69%	0.692	74%	0.738	S	S	*	*			cis	85.6	152.1	6.2	94.9	0	0	0	0	118.3
2385	P	33.5	Very low	28.2	Very low	116 Å²	116	122.4 Å²	122.4	75%	0.753	74%	0.742	S	S	*	*			cis	-150	155.9	-35.2	36.8	-16.5	0	0	0	118.2
2386	G	26.2	Very low	28.2	Very low	74 Å²	74	125 Å²	125	76%	0.763	75%	0.746	S	S	*	*			trans	68.8	-168.9	152.3	0	0	0	0	0	119.4
2387	P	30	Very low	28.3	Very low	111 Å²	111	123.3 Å²	123.3	72%	0.721	74%	0.744	S	S	*	*			cis	-144.3	168.9	-14.9	43.1	-25.9	0	0	0	117.7
2388	L	27	Very low	28.4	Very low	158 Å²	158	127.5 Å²	127.5	83%	0.827	75%	0.749	S	S	*	*			trans	72.9	175.2	154.2	-67.3	159.8	0	0	0	118.7
2389	P	29.9	Very low	28.5	Very low	108 Å²	108	129 Å²	129	70%	0.701	76%	0.76	S	S	*	*				-135.4	-133.8	-84	43.2	-21.3	0	0	0	112.5
2390	P	28.1	Very low	28.3	Very low	100 Å²	100	128 Å²	128	65%	0.649	76%	0.761	S	S	*	*				-121.4	-177.3	-61	38	-21.5	0	0	0	115.1
2391	L	27.9	Very low	28	Very low	163 Å²	163	127 Å²	127	85%	0.853	76%	0.763	S	S	*	*			trans	70.1	144.8	156.5	-103	67	0	0	0	117
2392	V	29.6	Very low	27.8	Very low	108 Å²	108	126.7 Å²	126.7	66%	0.655	76%	0.761	S	S	*	*			cis	-142.5	141.3	17.5	178.8	0	0	0	0	111.1
2393	K	27.1	Very low	27.6	Very low	208 Å²	208	127.3 Å²	127.3	90%	0.904	76%	0.759	S	S	*	*			trans	28.7	126.2	160	-55.3	163.4	-170.8	173.8	0	119
2394	G	25.6	Very low	27.2	Very low	83 Å²	83	123.2 Å²	123.2	86%	0.856	75%	0.746	S	S	*	*			cis	152.8	155.6	3.3	0	0	0	0	0	109.5
2395	G	25.8	Very low	27	Very low	72 Å²	72	125.5 Å²	125.5	74%	0.742	75%	0.75	S	S	*	*			cis	-178.2	-155.5	-0.6	0	0	0	0	0	111.6
2396	I	27.2	Very low	26.5	Very low	164 Å²	164	128.3 Å²	128.3	84%	0.841	75%	0.746	S	S	*	*			trans	80.1	74.8	170.7	-44.6	-177.4	0	0	0	117.7
2397	S	27	Very low	26.5	Very low	95 Å²	95	126.8 Å²	126.8	66%	0.664	72%	0.723	S	S	*	*				91	138.2	118.4	92.4	0	0	0	0	123.5
2398	R	28.6	Very low	26.4	Very low	232 Å²	232	124.6 Å²	124.6	88%	0.875	70%	0.703	S	S	*	*			trans	63.9	86.8	139.9	-68.1	167	179.1	-173.8	-0.2	119.8
2399	S	31.4	Very low	26.3	Very low	121 Å²	121	123 Å²	123	85%	0.846	70%	0.696	S	S	*	*			trans	-87.5	132.7	137	50.1	0	0	0	0	109.9
2400	P	24	Very low	26.1	Very low	116 Å²	116	128 Å²	128	75%	0.753	71%	0.707	S	S	*	*			trans	-141.7	-141.6	137.1	47.9	-32.8	0	0	0	108.5
2401	P	23.6	Very low	26.1	Very low	125 Å²	125	127.4 Å²	127.4	81%	0.812	70%	0.697	S	S	*	*			trans	-112.9	-174	-162	37.8	-18.7	0	0	0	114.3
2402	G	23.8	Very low	26.3	Very low	63 Å²	63	125.7 Å²	125.7	65%	0.649	70%	0.696	S	S	*	*			trans	107	154.2	172.3	0	0	0	0	0	113.2
2403	R	23.1	Very low	26.1	Very low	174 Å²	174	124.2 Å²	124.2	66%	0.657	70%	0.703	S	S	*	*			cis	76.4	133.9	37.4	-71.5	-179.5	157.8	171.1	-5.4	113.2
2404	Q	24.4	Very low	26.2	Very low	97 Å²	97	118 Å²	118	45%	0.453	70%	0.698	S	S	.	*			trans	78.2	162.9	169.9	-58	165.5	25.6	0	0	115.9
2405	L	23.1	Very low	26.1	Very low	148 Å²	148	119.7 Å²	119.7	78%	0.775	70%	0.696	S	S	*	*			trans	74.2	51.9	-156.7	-54.1	171.5	0	0	0	112.5
2406	W	22.6	Very low	26.3	Very low	175 Å²	175	120.9 Å²	120.9	66%	0.663	69%	0.691	S	S	*	*	S	Bend		-68.8	147.1	69	-72.7	11.8	0	0	0	117	H2311	H2311-W2406 AromaticContact CD2-CZ3 3.92Å; H2311-W2406 AromaticContact CE1-CE3 3.76Å; H2311-W2406 AromaticContact CE1-CZ3 3.79Å; H2311-W2406 AromaticContact NE2-CE3 3.39Å; H2311-W2406 AromaticContact NE2-CZ3 3.49Å; H2311-W2406 WeakPolarHBondContact NE2-CZ3 3.35Å
2407	S	27.2	Very low	26.3	Very low	42 Å²	42	119.8 Å²	119.8	29%	0.294	69%	0.687	S	S	.	*	S	Bend	trans	70.9	148.5	173.6	79	0	0	0	0	118.2
2408	Q	28.2	Very low	26.3	Very low	64 Å²	64	120.5 Å²	120.5	30%	0.299	69%	0.687	S	S	.	*			trans	76.4	114.4	173.6	-53.6	-166.4	-21	0	0	114.1	R2306 I2411	R2306-Q2408 VanDerWaalsContact CZ-CD 3.5Å; R2306-Q2408 VanDerWaalsContact NH1-CD 3.32Å; R2306-Q2408 VanDerWaalsContact NH1-NE2 3.11Å; Q2408-I2411 HydrophobicContact CG-CD1 3.96Å
2409	N	24.9	Very low	26.3	Very low	126 Å²	126	116.2 Å²	116.2	67%	0.674	68%	0.68	S	S	*	*	S	Bend	cis	-133.6	111.6	16.2	-73.5	-34.5	0	0	0	114.5
2410	F	24.3	Very low	26.1	Very low	212 Å²	212	120.3 Å²	120.3	93%	0.93	68%	0.677	S	S	*	*				-117.4	89.3	120	-110.4	-94.8	0	0	0	105.7
2411	I	28.1	Very low	26.2	Very low	88 Å²	88	122.9 Å²	122.9	45%	0.451	68%	0.679	S	S	.	*			trans	-110.7	127.7	165.8	-71.9	-179.8	0	0	0	104.7	Q2408	Q2408-I2411 HydrophobicContact CG-CD1 3.96Å
2412	P	32.5	Very low	26.7	Very low	127 Å²	127	121 Å²	121	83%	0.825	67%	0.667	S	S	*	*			trans	-78.8	160.3	-170.9	32.5	-36.1	0	0	0	112.5
2413	G	25.3	Very low	26.9	Very low	77 Å²	77	127.1 Å²	127.1	79%	0.794	68%	0.676	S	S	*	*			trans	144.7	140.8	-177.9	0	0	0	0	0	109
2414	G	28.5	Very low	27.2	Very low	78 Å²	78	123 Å²	123	80%	0.804	67%	0.674	S	S	*	*			cis	122.1	118.7	17	0	0	0	0	0	108.4
2415	S	25.2	Very low	27.3	Very low	117 Å²	117	123.5 Å²	123.5	82%	0.818	68%	0.684	S	S	*	*			trans	-58.6	160.7	175.3	82.3	0	0	0	0	111.2
2416	P	30.3	Very low	27.6	Very low	98 Å²	98	125.7 Å²	125.7	64%	0.636	69%	0.687	S	S	*	*			cis	-143.4	177.7	27	41	-21.9	0	0	0	117.3
2417	N	26.7	Very low	27.9	Very low	141 Å²	141	123.9 Å²	123.9	75%	0.754	69%	0.691	S	S	*	*			trans	70.1	135.8	160.6	-58.9	-30.7	0	0	0	116.3
2418	T	27.3	Very low	28.1	Very low	110 Å²	110	124.7 Å²	124.7	68%	0.675	71%	0.706	S	S	*	*			cis	-166.6	156.4	4.7	4.8	0	0	0	0	110.1
2419	I	27.1	Very low	28.2	Very low	141 Å²	141	128.4 Å²	128.4	72%	0.723	73%	0.727	S	S	*	*			trans	64	123.5	149.7	-66.8	164.6	0	0	0	115.9
2420	R	27.7	Very low	28.4	Very low	207 Å²	207	132 Å²	132	78%	0.781	73%	0.731	S	S	*	*			cis	-155.4	139.7	4.4	-98.7	164.6	-174.1	179.1	2	106.8
2421	Q	27.1	Very low	28.8	Very low	171 Å²	171	126 Å²	126	80%	0.799	72%	0.715	S	S	*	*				63.7	146.3	78.4	-93.1	-168.3	-19.5	0	0	116.2
2422	P	33.1	Very low	29.1	Very low	84 Å²	84	125.8 Å²	125.8	55%	0.545	72%	0.722	S	S	.	*			cis	-146.1	-155.1	-48.4	35.2	-11.5	0	0	0	113.2
2423	F	28.5	Very low	29.1	Very low	192 Å²	192	125.5 Å²	125.5	84%	0.842	71%	0.713	S	S	*	*			trans	82.5	142.5	165.3	-56.8	-56.5	0	0	0	118.2
2424	S	29.1	Very low	29.5	Very low	88 Å²	88	128.4 Å²	128.4	62%	0.615	72%	0.715	S	S	*	*			cis	-173.9	142	-10.6	48.4	0	0	0	0	114.6
2425	T	27.4	Very low	29.5	Very low	108 Å²	108	129.2 Å²	129.2	66%	0.663	71%	0.709	S	S	*	*			trans	59.6	150.6	142.7	55.4	0	0	0	0	120.9
2426	F	28.8	Very low	29.8	Very low	193 Å²	193	128.8 Å²	128.8	85%	0.846	71%	0.706	S	S	*	*			cis	-166.9	174.1	3.2	-93.6	-38.1	0	0	0	107.2
2427	D	28.3	Very low	29.8	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	71%	0.713	S	S	*	*			cis	-171.9	152.8	-25.4	175.6	48.4	0	0	0	110.7
2428	G	31.6	Very low	30	Very low	60 Å²	60	128.1 Å²	128.1	62%	0.619	71%	0.712	S	S	*	*			trans	89.5	165.4	152	0	0	0	0	0	121.1
2429	L	30.1	Very low	30.2	Very low	141 Å²	141	130.3 Å²	130.3	74%	0.738	72%	0.718	S	S	*	*			cis	-173.3	157.1	-7.4	-115.2	165.8	0	0	0	113.1
2430	R	29.1	Very low	30.2	Very low	201 Å²	201	131.8 Å²	131.8	76%	0.758	72%	0.721	S	S	*	*			trans	76.3	166.9	160.1	-65.6	173.1	-176.3	-162.7	-0.3	120.2	R2459	R2430-R2459 PolarHBondContact O-NH2 3.46Å
2431	S	32.6	Very low	30.4	Very low	86 Å²	86	126.5 Å²	126.5	60%	0.601	71%	0.714	S	S	*	*			cis	-168.2	167.9	-38.6	61.9	0	0	0	0	115.4
2432	S	34.7	Very low	30.7	Very low	84 Å²	84	126.4 Å²	126.4	59%	0.587	71%	0.713	S	S	*	*			trans	63.9	161.2	152.8	39.9	0	0	0	0	122.9
2433	N	32.4	Very low	30.4	Very low	121 Å²	121	128.7 Å²	128.7	65%	0.647	72%	0.721	S	S	*	*			cis	178.6	174.4	-38.2	-99.8	15.5	0	0	0	111.5	K1650	K1650-N2433 PolarHBondContact NZ-OD1 3.19Å
2434	V	33.4	Very low	30.4	Very low	138 Å²	138	127 Å²	127	84%	0.836	72%	0.72	S	S	*	*			trans	86.3	165.1	159.1	-162.4	0	0	0	0	118.5
2435	S	29.1	Very low	30.3	Very low	96 Å²	96	127.6 Å²	127.6	67%	0.671	72%	0.724	S	S	*	*				-173.9	155.8	-98.2	58	0	0	0	0	116.1
2436	S	32	Very low	30.3	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	73%	0.727	S	S	*	*			trans	85.6	137.7	145.5	77.3	0	0	0	0	126.2
2437	S	28.9	Very low	30.2	Very low	114 Å²	114	124.2 Å²	124.2	80%	0.797	72%	0.719	S	S	*	*			trans	95.5	169.3	138.3	93.6	0	0	0	0	120.4
2438	P	32.3	Very low	30.3	Very low	111 Å²	111	121 Å²	121	72%	0.721	71%	0.705	S	S	*	*			trans	-137.4	-164.4	-130.2	34.2	-7.9	0	0	0	118.1
2439	I	31.2	Very low	30.1	Very low	156 Å²	156	121.4 Å²	121.4	80%	0.8	70%	0.697	S	S	*	*			trans	117.3	141.1	154.4	-59.9	163.1	0	0	0	119.1
2440	H	26.9	Very low	30	Very low	173 Å²	173	120.5 Å²	120.5	80%	0.801	69%	0.685	S	S	*	*			trans	-37.9	176.2	165.3	-84.4	-43.9	0	0	0	120.3
2441	P	32.8	Very low	29.9	Very low	95 Å²	95	113.8 Å²	113.8	62%	0.617	66%	0.664	S	S	*	*			cis	-143.1	-168.7	-21.2	39.2	-19.4	0	0	0	115.7
2442	Q	32.4	Very low	29.6	Very low	169 Å²	169	115.4 Å²	115.4	79%	0.79	67%	0.666	S	S	*	*			trans	67.7	158.5	159.6	-68.4	176.6	25.1	0	0	117.3
2443	N	27.9	Very low	29.2	Very low	133 Å²	133	114.6 Å²	114.6	71%	0.711	66%	0.658	S	S	*	*			cis	-166.5	164.9	-30	-111	-11.7	0	0	0	107.7
2444	L	28.1	Very low	29	Very low	157 Å²	157	112.6 Å²	112.6	82%	0.822	65%	0.645	S	S	*	*			trans	75.8	118.6	164.3	-65.2	140.3	0	0	0	119.8
2445	S	27.2	Very low	28.6	Very low	99 Å²	99	113.4 Å²	113.4	69%	0.692	63%	0.633	S	S	*	*			trans	18.5	144.9	135.9	56.8	0	0	0	0	121.6
2446	S	26.9	Very low	28.7	Very low	104 Å²	104	113 Å²	113	73%	0.727	62%	0.622	S	S	*	*			cis	-175.4	162.7	-2	45.5	0	0	0	0	110
2447	N	26.5	Very low	28.3	Very low	126 Å²	126	109.4 Å²	109.4	67%	0.674	60%	0.597	S	S	*	*			trans	63.2	71.9	-178.3	-70.1	-2.6	0	0	0	114.4	N1403	N1403-N2447 WeakPolarHBondContact ND2-CA 3.37Å
2448	T	30.2	Very low	28.4	Very low	71 Å²	71	107 Å²	107	44%	0.436	58%	0.579	S	S	.	*			trans	-70.8	157.3	178.5	18.3	0	0	0	0	113.7	N1403 P1405	N1403-T2448 WeakPolarHBondContact CA-O 3.26Å; N1403-T2448 WeakPolarHBondContact CB-O 3.48Å; N1403-T2448 WeakPolarHBondContact CB-OG1 3.21Å; N1403-T2448 PolarHBondContact OD1-O 3.12Å; P1405-T2448 HydrophobicContact CB-CG2 4.3Å; P1405-T2448 HydrophobicContact CG-CG2 3.75Å
2449	S	26.6	Very low	28.1	Very low	67 Å²	67	107.4 Å²	107.4	47%	0.469	57%	0.566	S	S	.	*			trans	-174.9	158.8	172.3	51.1	0	0	0	0	112.4	I1404 P1405	I1404-S2449 CarbonylContact O-C 3.58Å; I1404-S2449 WeakPolarHBondContact O-CA 3.29Å; P1405-S2449 VanDerWaalsContact CA-C 3.45Å; P1405-S2449 WeakPolarHBondContact CA-O 3.43Å; P1405-S2449 VanDerWaalsContact CB-O 3.3Å; P1405-S2449 WeakPolarHBondContact CB-O 3.43Å
2450	Y	28.8	Very low	27.7	Very low	123 Å²	123	108.1 Å²	108.1	48%	0.482	56%	0.563	S	S	.	*			trans	64.7	120.2	173.3	-85.1	-83.8	0	0	0	121.4	I1404 P1405 E1406	I1404-Y2450 WeakPolarHBondContact O-CA 3.46Å; I1404-Y2450 PolarHBondContact O-N 3.29Å; P1405-Y2450 CarbonylContact C-O 3.58Å; P1405-Y2450 WeakPolarHBondContact CA-O 3.39Å; E1406-Y2450 WeakPolarHBondContact CA-O 3.44Å; E1406-Y2450 WeakPolarHBondContact CB-O 2.77Å; E1406-Y2450 WeakPolarHBondContact CG-O 3.11Å; E1406-Y2450 PolarHBondContact N-O 2.97Å
2451	N	26.6	Very low	27.7	Very low	59 Å²	59	105.8 Å²	105.8	32%	0.316	56%	0.557	S	S	.	*			trans	98.3	117.8	145.1	-57.8	-44.2	0	0	0	124.2	P1405 E1406 L1407	P1405-N2451 CarbonylContact C-O 3.34Å; P1405-N2451 VanDerWaalsContact O-O 3.12Å; E1406-N2451 CarbonylContact C-O 3.51Å; E1406-N2451 WeakPolarHBondContact CA-O 2.76Å; E1406-N2451 HydrophobicContact CG-CB 4.29Å; E1406-N2451 PolarHBondContact N-O 3.22Å; E1406-N2451 VanDerWaalsContact N-O 3.14Å; L1407-N2451 PolarHBondContact N-O 3.12Å
2452	N	27.1	Very low	27.4	Very low	120 Å²	120	108.2 Å²	108.2	64%	0.642	56%	0.564	S	S	*	*				69	161.4	114.5	-64.2	-44.5	0	0	0	129.1	L1407	L1407-N2452 VanDerWaalsContact CB-O 3.23Å; L1407-N2452 WeakPolarHBondContact CB-O 3.45Å; L1407-N2452 CarbonylContact O-C 3.5Å; L1407-N2452 WeakPolarHBondContact O-CB 3.4Å
2453	T	26.7	Very low	27.2	Very low	68 Å²	68	102.3 Å²	102.3	42%	0.417	55%	0.549	S	S	.	.			trans	38.1	139.7	159.5	80	0	0	0	0	127.6	L1407 S1408 N1409	L1407-T2453 PolarHBondContact O-OG1 3.07Å; S1408-T2453 PolarHBondContact O-OG1 2.61Å; N1409-T2453 PolarHBondContact O-OG1 3.46Å
2454	Q	27.5	Very low	27.4	Very low	79 Å²	79	102.1 Å²	102.1	37%	0.369	55%	0.552	S	S	.	*				179.8	135.7	97.6	-93	-163.9	6.3	0	0	117	L1407 N1409 H1653	L1407-Q2454 HydrophobicContact CD2-CG 4.05Å; N1409-Q2454 WeakPolarHBondContact O-CG 3.5Å; N1409-Q2454 PolarHBondContact O-NE2 2.99Å; H1653-Q2454 PolarHBondContact CE1-O 3.45Å
2455	R	26	Very low	27.5	Very low	155 Å²	155	97.8 Å²	97.8	59%	0.585	54%	0.535	S	S	*	.			trans	49.7	119.6	146.7	-51.9	176.2	-161.1	172	12.1	124.2	S1410 H1653	S1410-R2455 WeakPolarHBondContact OG-CG 3.25Å; H1653-R2455 PolarHBondContact CD2-O 3.22Å; H1653-R2455 PolarHBondContact CE1-O 2.83Å; H1653-R2455 VanDerWaalsContact CE1-O 3.32Å; H1653-R2455 PolarHBondContact ND1-O 2.93Å; H1653-R2455 PolarHBondContact NE2-O 2.92Å; H1653-R2455 VanDerWaalsContact NE2-O 3.1Å
2456	I	30	Very low	27.7	Very low	86 Å²	86	95.4 Å²	95.4	44%	0.441	53%	0.527	S	S	.	.				161.9	107.3	119.5	-81.8	156.1	0	0	0	109.5	Y1651 T1652 H1653	Y1651-I2456 HydrophobicContact CD1-CG2 4.16Å; Y1651-I2456 HydrophobicContact CG-CG2 4.41Å; T1652-I2456 VanDerWaalsContact N-CG2 3.33Å; H1653-I2456 HydrophobicContact CB-CB 4.36Å
2457	S	24.7	Very low	27.8	Very low	32 Å²	32	94.2 Å²	94.2	22%	0.224	51%	0.512	C	S	.	.			trans	-82.8	-156.6	-155.4	-44.5	0	0	0	0	117.6	S1413 Y1651	S1413-S2457 VanDerWaalsContact CB-OG 3.22Å; S1413-S2457 WeakPolarHBondContact CB-OG 3.38Å; S1413-S2457 VanDerWaalsContact OG-CB 3.22Å; S1413-S2457 WeakPolarHBondContact OG-CB 3.36Å; S1413-S2457 PolarHBondContact OG-OG 2.89Å; Y1651-S2457 WeakPolarHBondContact CB-O 3.26Å; Y1651-S2457 WeakPolarHBondContact CD1-O 3.42Å
2458	P	29.3	Very low	27.9	Very low	65 Å²	65	89.3 Å²	89.3	42%	0.422	49%	0.486	S	S	.	.			trans	-118.8	-176.8	178	41.3	-31.9	0	0	0	116.5	Y1651	Y1651-P2458 PolarHBondContact OH-O 3.23Å
2459	R	26.1	Very low	28.1	Very low	119 Å²	119	87.8 Å²	87.8	45%	0.449	48%	0.476	S	S	.	.			trans	-147.5	156.1	169.7	-103.2	179.8	179.5	-164.7	-12.3	106.9	Y1651 R2430	Y1651-R2459 HydrophobicContact CE2-CB 4.04Å; Y1651-R2459 HydrophobicContact CE2-CG 3.64Å; R2430-R2459 PolarHBondContact O-NH2 3.46Å
2460	F	24.4	Very low	28.5	Very low	170 Å²	170	87.5 Å²	87.5	75%	0.746	47%	0.47	S	S	*	.			cis	-167.7	177.3	-23.5	-137.3	-99.5	0	0	0	105.7
2461	D	26.6	Very low	28.7	Very low	125 Å²	125	85.2 Å²	85.2	67%	0.668	47%	0.466	S	S	*	.			trans	65.9	107.1	168.2	-57.1	-44.4	0	0	0	117.7
2462	L	25.4	Very low	29.1	Very low	145 Å²	145	85.7 Å²	85.7	76%	0.759	47%	0.466	S	S	*	.				70.7	89.8	81	-85.5	75.4	0	0	0	114.4
2463	G	29.5	Very low	29.5	Very low	46 Å²	46	85 Å²	85	47%	0.474	45%	0.454	S	S	.	.			trans	-128.7	106.5	173.4	0	0	0	0	0	113
2464	T	32	Very low	29.8	Very low	128 Å²	128	88.8 Å²	88.8	79%	0.785	46%	0.461	S	S	*	.			trans	-33.7	124.2	167.9	46.1	0	0	0	0	114.6
2465	S	28.6	Very low	30.2	Very low	66 Å²	66	94.2 Å²	94.2	46%	0.462	48%	0.478	S	S	.	.				72.9	117.5	64.9	82.1	0	0	0	0	115.5
2466	G	31.4	Very low	30.8	Very low	50 Å²	50	93.7 Å²	93.7	52%	0.515	48%	0.476	S	S	.	.			trans	110.9	148.3	-175.9	0	0	0	0	0	110.2
2467	D	29.9	Very low	31.1	Very low	79 Å²	79	96 Å²	96	42%	0.422	49%	0.485	S	S	.	.	S	Bend	cis	-132.9	15.7	3	-123.1	34.4	0	0	0	114.2	N2470 D2471	D2467-N2470 HydrophobicContact CB-CB 4.19Å; D2467-N2470 VanDerWaalsContact CG-CB 3.45Å; D2467-N2470 CarbonylContact O-C 3.55Å; D2467-N2470 WeakPolarHBondContact O-CA 3.5Å; D2467-N2470 VanDerWaalsContact O-CB 3.27Å; D2467-N2470 WeakPolarHBondContact O-CB 3.47Å; D2467-N2470 PolarHBondContact O-N 3.23Å; D2467-N2470 WeakPolarHBondContact OD1-CB 3.45Å; D2467-N2470 PolarHBondContact OD1-ND2 2.79Å; D2467-N2470 WeakPolarHBondContact OD2-CB 3.48Å; D2467-D2471 PolarHBondContact O-N 2.92Å
2468	L	29.6	Very low	31.5	Very low	23 Å²	23	98.2 Å²	98.2	12%	0.12	51%	0.506	C	S	.	.	H	α-helix	trans	-67.8	-39.6	175.8	-158.4	92.5	0	0	0	113.5	S1426 D1427 N2470 D2471 E2472	S1426-L2468 WeakPolarHBondContact O-CB 3.43Å; S1426-L2468 WeakPolarHBondContact O-CD2 3.04Å; S1426-L2468 WeakPolarHBondContact OG-CD1 3.44Å; D1427-L2468 HydrophobicContact CB-CD1 4.16Å; D1427-L2468 HydrophobicContact CB-CD2 4.25Å; D1427-L2468 VanDerWaalsContact OD1-CD1 3.25Å; D1427-L2468 WeakPolarHBondContact OD1-CD1 3.1Å; D1427-L2468 VanDerWaalsContact OD2-CD1 3.3Å; D1427-L2468 WeakPolarHBondContact OD2-CD1 3.38Å; L2468-N2470 PolarHBondContact O-N 3.03Å; L2468-D2471 PolarHBondContact O-N 3.42Å; L2468-D2471 VanDerWaalsContact O-N 3.15Å; L2468-E2472 WeakPolarHBondContact O-CA 3.48Å; L2468-E2472 VanDerWaalsContact O-CB 3.23Å; L2468-E2472 WeakPolarHBondContact O-CB 3.5Å; L2468-E2472 PolarHBondContact O-N 3.01Å
2469	V	34.4	Very low	31.7	Very low	38 Å²	38	101 Å²	101	23%	0.23	52%	0.516	C	S	.	.	H	α-helix	trans	-67.3	2.6	169.1	-176.4	0	0	0	0	111.1	L1509 R2473	L1509-V2469 HydrophobicContact CD1-CG2 4.11Å; V2469-R2473 VanDerWaalsContact O-CB 3.27Å; V2469-R2473 WeakPolarHBondContact O-CB 3.45Å; V2469-R2473 WeakPolarHBondContact O-CD 3.2Å; V2469-R2473 WeakPolarHBondContact O-CG 3.37Å
2470	N	33.2	Very low	31.9	Very low	62 Å²	62	99.6 Å²	99.6	33%	0.332	53%	0.525	S	S	.	.	H	α-helix	trans	-109.4	-28.4	168.2	-83.5	-16.3	0	0	0	114.5	D2467 L2468 R2473 R2474	D2467-N2470 HydrophobicContact CB-CB 4.19Å; D2467-N2470 VanDerWaalsContact CG-CB 3.45Å; D2467-N2470 CarbonylContact O-C 3.55Å; D2467-N2470 WeakPolarHBondContact O-CA 3.5Å; D2467-N2470 VanDerWaalsContact O-CB 3.27Å; D2467-N2470 WeakPolarHBondContact O-CB 3.47Å; D2467-N2470 PolarHBondContact O-N 3.23Å; D2467-N2470 WeakPolarHBondContact OD1-CB 3.45Å; D2467-N2470 PolarHBondContact OD1-ND2 2.79Å; D2467-N2470 WeakPolarHBondContact OD2-CB 3.48Å; L2468-N2470 PolarHBondContact O-N 3.03Å; N2470-R2473 CarbonylContact O-C 3.52Å; N2470-R2473 PolarHBondContact O-N 2.96Å; N2470-R2474 VanDerWaalsContact O-CG 3.31Å; N2470-R2474 WeakPolarHBondContact O-CG 3.31Å; N2470-R2474 PolarHBondContact O-N 2.89Å
2471	D	33.5	Very low	32	Very low	75 Å²	75	94.1 Å²	94.1	40%	0.401	52%	0.516	S	S	.	.	H	α-helix	trans	-79.3	-37.4	165.9	-89.8	-21	0	0	0	111.8	D2467 L2468 R2473 R2474 W2475	D2467-D2471 PolarHBondContact O-N 2.92Å; L2468-D2471 PolarHBondContact O-N 3.42Å; L2468-D2471 VanDerWaalsContact O-N 3.15Å; D2471-R2473 VanDerWaalsContact C-N 3.27Å; D2471-R2473 PolarHBondContact O-N 3.1Å; D2471-R2474 CarbonylContact O-C 3.21Å; D2471-R2474 WeakPolarHBondContact O-CA 3.48Å; D2471-R2474 WeakPolarHBondContact O-CB 3.35Å; D2471-R2474 PolarHBondContact O-N 3.42Å; D2471-R2474 WeakPolarHBondContact OD1-CD 3.37Å; D2471-R2474 IonicContact OD1-CZ 2.88Å; D2471-R2474 IonicContact OD1-NE 3.31Å; D2471-R2474 IonicContact OD1-NH1 3.46Å; D2471-R2474 PolarHBondContact OD1-NH1 3.13Å; D2471-W2475 PolarHBondContact O-N 3.02Å
2472	E	35.9	Very low	32.2	Very low	68 Å²	68	93.2 Å²	93.2	32%	0.318	52%	0.52	S	S	.	.	H	α-helix	trans	-64.6	-31.8	164	-155	-160.2	-170.3	0	0	111	L2468 R2476	L2468-E2472 WeakPolarHBondContact O-CA 3.48Å; L2468-E2472 VanDerWaalsContact O-CB 3.23Å; L2468-E2472 WeakPolarHBondContact O-CB 3.5Å; L2468-E2472 PolarHBondContact O-N 3.01Å; E2472-R2476 VanDerWaalsContact CD-NH2 3.29Å; E2472-R2476 WeakPolarHBondContact O-CB 3.37Å; E2472-R2476 WeakPolarHBondContact O-CG 3.38Å; E2472-R2476 PolarHBondContact O-N 2.93Å; E2472-R2476 IonicContact OE1-CZ 2.81Å; E2472-R2476 IonicContact OE1-NE 3.75Å; E2472-R2476 PolarHBondContact OE1-NE 2.88Å; E2472-R2476 IonicContact OE1-NH2 3.56Å; E2472-R2476 PolarHBondContact OE1-NH2 2.97Å; E2472-R2476 IonicContact OE2-CZ 3.01Å; E2472-R2476 IonicContact OE2-NE 3.63Å; E2472-R2476 PolarHBondContact OE2-NE 2.9Å; E2472-R2476 IonicContact OE2-NH2 3.5Å; E2472-R2476 PolarHBondContact OE2-NH2 2.63Å
2473	R	35.8	Very low	32.4	Very low	105 Å²	105	93.5 Å²	93.5	40%	0.396	52%	0.52	S	S	.	.	H	α-helix	trans	-73.6	-25.6	165.8	-80.1	174.1	-174.9	154.6	-2	113.5	V2469 N2470 D2471 R2476 Q2477	V2469-R2473 VanDerWaalsContact O-CB 3.27Å; V2469-R2473 WeakPolarHBondContact O-CB 3.45Å; V2469-R2473 WeakPolarHBondContact O-CD 3.2Å; V2469-R2473 WeakPolarHBondContact O-CG 3.37Å; N2470-R2473 CarbonylContact O-C 3.52Å; N2470-R2473 PolarHBondContact O-N 2.96Å; D2471-R2473 VanDerWaalsContact C-N 3.27Å; D2471-R2473 PolarHBondContact O-N 3.1Å; R2473-R2476 CarbonylContact O-C 3.05Å; R2473-Q2477 WeakPolarHBondContact O-CA 3.22Å; R2473-Q2477 WeakPolarHBondContact O-CB 3.35Å; R2473-Q2477 WeakPolarHBondContact O-CG 3.32Å; R2473-Q2477 PolarHBondContact O-N 2.91Å
2474	R	32.6	Very low	32.6	Very low	149 Å²	149	98 Å²	98	56%	0.562	53%	0.533	S	S	*	.	H	α-helix	trans	-70.9	-39.6	171.2	-80.1	155.7	170.9	169.9	6.3	111.1	N2470 D2471 Q2477 A2478	N2470-R2474 VanDerWaalsContact O-CG 3.31Å; N2470-R2474 WeakPolarHBondContact O-CG 3.31Å; N2470-R2474 PolarHBondContact O-N 2.89Å; D2471-R2474 CarbonylContact O-C 3.21Å; D2471-R2474 WeakPolarHBondContact O-CA 3.48Å; D2471-R2474 WeakPolarHBondContact O-CB 3.35Å; D2471-R2474 PolarHBondContact O-N 3.42Å; D2471-R2474 WeakPolarHBondContact OD1-CD 3.37Å; D2471-R2474 IonicContact OD1-CZ 2.88Å; D2471-R2474 IonicContact OD1-NE 3.31Å; D2471-R2474 IonicContact OD1-NH1 3.46Å; D2471-R2474 PolarHBondContact OD1-NH1 3.13Å; R2474-Q2477 PolarHBondContact O-N 2.85Å; R2474-A2478 VanDerWaalsContact O-CB 3.28Å; R2474-A2478 WeakPolarHBondContact O-CB 3.49Å; R2474-A2478 PolarHBondContact O-N 3.01Å
2475	W	35.2	Very low	32.7	Very low	192 Å²	192	102.4 Å²	102.4	73%	0.727	54%	0.536	S	S	*	.	H	α-helix	trans	-66.1	-45.1	169.6	-80.7	85.5	0	0	0	111.6	D2471 Q2477 A2478 L2479	D2471-W2475 PolarHBondContact O-N 3.02Å; W2475-Q2477 VanDerWaalsContact C-N 3.27Å; W2475-Q2477 PolarHBondContact O-N 2.91Å; W2475-A2478 PolarHBondContact O-N 3.34Å; W2475-L2479 WeakPolarHBondContact O-CB 2.98Å; W2475-L2479 VanDerWaalsContact O-CG 3.29Å; W2475-L2479 WeakPolarHBondContact O-CG 3.31Å; W2475-L2479 PolarHBondContact O-N 3.07Å
2476	R	38.7	Very low	33	Very low	145 Å²	145	105.5 Å²	105.5	55%	0.547	55%	0.546	S	S	.	.	H	α-helix	trans	-70.7	-13.7	174.3	-65.1	169.1	-178.7	-146.9	8.6	114	E2472 R2473 S2480	E2472-R2476 VanDerWaalsContact CD-NH2 3.29Å; E2472-R2476 WeakPolarHBondContact O-CB 3.37Å; E2472-R2476 WeakPolarHBondContact O-CG 3.38Å; E2472-R2476 PolarHBondContact O-N 2.93Å; E2472-R2476 IonicContact OE1-CZ 2.81Å; E2472-R2476 IonicContact OE1-NE 3.75Å; E2472-R2476 PolarHBondContact OE1-NE 2.88Å; E2472-R2476 IonicContact OE1-NH2 3.56Å; E2472-R2476 PolarHBondContact OE1-NH2 2.97Å; E2472-R2476 IonicContact OE2-CZ 3.01Å; E2472-R2476 IonicContact OE2-NE 3.63Å; E2472-R2476 PolarHBondContact OE2-NE 2.9Å; E2472-R2476 IonicContact OE2-NH2 3.5Å; E2472-R2476 PolarHBondContact OE2-NH2 2.63Å; R2473-R2476 CarbonylContact O-C 3.05Å; R2476-S2480 WeakPolarHBondContact O-CB 3.27Å; R2476-S2480 PolarHBondContact O-N 3Å
2477	Q	35.4	Very low	33.2	Very low	134 Å²	134	109.1 Å²	109.1	63%	0.626	55%	0.545	S	S	*	.	H	α-helix	trans	-95.7	-24	170.7	-76.8	171.6	-10.6	0	0	112.8	R2473 R2474 W2475 S2480	R2473-Q2477 WeakPolarHBondContact O-CA 3.22Å; R2473-Q2477 WeakPolarHBondContact O-CB 3.35Å; R2473-Q2477 WeakPolarHBondContact O-CG 3.32Å; R2473-Q2477 PolarHBondContact O-N 2.91Å; R2474-Q2477 PolarHBondContact O-N 2.85Å; W2475-Q2477 VanDerWaalsContact C-N 3.27Å; W2475-Q2477 PolarHBondContact O-N 2.91Å; Q2477-S2480 WeakPolarHBondContact CA-OG 3.4Å; Q2477-S2480 PolarHBondContact O-OG 2.92Å
2478	A	33.4	Very low	33.4	Very low	79 Å²	79	111.3 Å²	111.3	65%	0.653	56%	0.556	S	S	*	*	H	α-helix	trans	-74.1	-37.2	167.3	0	0	0	0	0	111	R2474 W2475 S2480	R2474-A2478 VanDerWaalsContact O-CB 3.28Å; R2474-A2478 WeakPolarHBondContact O-CB 3.49Å; R2474-A2478 PolarHBondContact O-N 3.01Å; W2475-A2478 PolarHBondContact O-N 3.34Å; A2478-S2480 VanDerWaalsContact C-N 3.33Å
2479	L	35	Very low	33.5	Very low	123 Å²	123	114.1 Å²	114.1	64%	0.644	58%	0.578	S	S	*	*	S	Bend	trans	-81.2	-6	176.4	-66.4	169.8	0	0	0	113.7	W2475 G2481	W2475-L2479 WeakPolarHBondContact O-CB 2.98Å; W2475-L2479 VanDerWaalsContact O-CG 3.29Å; W2475-L2479 WeakPolarHBondContact O-CG 3.31Å; W2475-L2479 PolarHBondContact O-N 3.07Å; L2479-G2481 PolarHBondContact O-N 3.13Å; L2479-G2481 VanDerWaalsContact O-N 3.13Å
2480	S	30.2	Very low	33.2	Very low	90 Å²	90	120.5 Å²	120.5	63%	0.629	60%	0.603	S	S	*	*	S	Bend	trans	-84.9	38.8	175.9	67.3	0	0	0	0	113.4	R2476 Q2477 A2478	R2476-S2480 WeakPolarHBondContact O-CB 3.27Å; R2476-S2480 PolarHBondContact O-N 3Å; Q2477-S2480 WeakPolarHBondContact CA-OG 3.4Å; Q2477-S2480 PolarHBondContact O-OG 2.92Å; A2478-S2480 VanDerWaalsContact C-N 3.33Å
2481	G	26.4	Very low	32.9	Very low	55 Å²	55	124 Å²	124	57%	0.567	62%	0.621	S	S	*	*	S	Bend	trans	-132.6	104.3	-173.5	0	0	0	0	0	114.2	L2479	L2479-G2481 PolarHBondContact O-N 3.13Å; L2479-G2481 VanDerWaalsContact O-N 3.13Å
2482	S	29.9	Very low	32.6	Very low	106 Å²	106	127.5 Å²	127.5	74%	0.741	68%	0.675	S	S	*	*			trans	59.5	88.1	169.9	-161.4	0	0	0	0	116.8	N2484	S2482-N2484 PolarHBondContact O-N 2.7Å
2483	I	30.6	Very low	32.4	Very low	150 Å²	150	130.5 Å²	130.5	77%	0.769	69%	0.693	S	S	*	*	S	Bend	trans	-71.1	5.9	-176.5	-79.1	167	0	0	0	114.9
2484	N	33.2	Very low	32.2	Very low	140 Å²	140	131.8 Å²	131.8	75%	0.749	71%	0.709	S	S	*	*	S	Bend	trans	-109	26.4	-162.3	-67.8	2.3	0	0	0	116	S2482	S2482-N2484 PolarHBondContact O-N 2.7Å
2485	R	33.6	Very low	32.2	Very low	221 Å²	221	130.8 Å²	130.8	83%	0.834	72%	0.717	S	S	*	*	S	Bend	trans	-151.7	8.9	-173.1	-125.1	-179.5	-167.3	-177.9	3.3	120.6
2486	L	36	Very low	32	Very low	132 Å²	132	127.2 Å²	127.2	69%	0.691	72%	0.716	S	S	*	*	S	Bend	trans	-132	24.9	179.2	-85.1	167.4	0	0	0	112.6	N1687	N1687-L2486 VanDerWaalsContact ND2-C 3.32Å; N1687-L2486 WeakPolarHBondContact ND2-CB 3.23Å; N1687-L2486 PolarHBondContact ND2-O 3.39Å
2487	R	35.8	Very low	31.6	Very low	126 Å²	126	126.1 Å²	126.1	48%	0.475	73%	0.727	S	S	.	*	S	Bend	trans	-109	15.4	-177.9	-161.1	172.1	178.8	-172.3	-1.8	112.8	N1687	N1687-R2487 PolarHBondContact O-NE 2.87Å
2488	D	32.6	Very low	31.3	Very low	124 Å²	124	125.6 Å²	125.6	66%	0.663	73%	0.734	S	S	*	*	S	Bend	trans	-127.8	36.3	-174	-51.9	-75.5	0	0	0	110.1
2489	S	31.2	Very low	31.2	Very low	83 Å²	83	128.9 Å²	128.9	58%	0.58	74%	0.739	S	S	*	*	S	Bend	trans	-153.4	-4.4	-170.4	-51.1	0	0	0	0	118.9
2490	F	29.9	Very low	30.9	Very low	172 Å²	172	129.4 Å²	129.4	75%	0.754	75%	0.747	S	S	*	*			trans	-138.7	7.6	179.8	-84.5	-73.7	0	0	0	116.2	G2492	F2490-G2492 PolarHBondContact O-N 2.8Å; F2490-G2492 VanDerWaalsContact O-N 3.07Å
2491	D	25.1	Very low	31	Very low	134 Å²	134	132.7 Å²	132.7	72%	0.717	76%	0.756	S	S	*	*			trans	-71.7	90.8	157	-94.6	-47.2	0	0	0	108.5
2492	G	27.3	Very low	31.4	Very low	149 Å²	149	139.7 Å²	139.7	100%	1.536	77%	0.774	S	S	*	*			trans	-169.3	0	179.7	0	0	0	0	0	113	F2490	F2490-G2492 PolarHBondContact O-N 2.8Å; F2490-G2492 VanDerWaalsContact O-N 3.07Å

Retrieved 2,492 of 2,492 residues in 3699.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).