A0A3Q0KG41_SCHMA Loading...

Putative cadherin AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KG41, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,235 aa.

						>A0A3Q0KG41_SCHMA|A0A3Q0KG41
MLRIDFLQWNWLVARQQCHLLIIILFYINLIQSRTVRFRLDEEIQLNTRIGSLLKYIQDDASELFTVDHITGDITVVHRLDRELLCNIDHQNIKPGKYGKVIKEWMPNLIHSTICELYFSVNCLNTTLFSNNSNRNRNRILRDTNDNGCKFLPSDQQIIRIREDAPVNETRFTLNTPYDPDDFVEGNSVKPDRIWINTDYSIATSQSIQNYFKLHSLSSSKNVTTPNIYLELELIHKLDYEEQKTYSFQIVADDGYSSADHQCYLNVTVLVEDCNDHMPTFKQSMYTVNIKADDEDADENGKIIYSFVSYSDDSDDGNYFYIHSETGEIKLQRRLNHRLKSSHSLKVFAKNPDNTTSRQIKSFHTSKLSTTQVIVNVIDVNDHFPRIRIISPTGSKSLELIEETPPGQDIGIIDVFDGDTGKNAQVNCKLTDQTIPNVLRLISVDSEIMSKEMSNSNQKYKLTLQKLIDREEFPIIEFNVVCWDGGIPSLSSNLTYKVNVLDINDHDPVCDQNTYTVDVMEDSSPERIKKNFEFLTIHATDKDEGRNAKLHFSLDQETPTYIMNLITVNATTGTLSTMGNLDREKLTKFSVTLICADHGEPKRMTKVKINVNVLDYNDNSPTYSQPYFEFTITENNNVGQLVGNFQIADDDVDKNAELVVQIEENTEQKQVYLASFGNSLGIHNDMKQLKLHSKDLLISTGLQETKHTDEYIPHFKLHSQKFPRKNVSSSNNEPTLYDVKLYIESIIDREGLIMKYKDIVSNPFPHYGVLEHINHFYYDNRITELSSKTNYSIITPIILLLISAHDKGIPKLSEHVSIHIHVLDENDNSPRFIYPDPTDVNRTKTIVSYKEPSGYAFTQVLAIDIDAGENGTILYFIHSGNDHHYFKLNPKNGILSINKKIPYTGIGEYLLTLEARDCGQPYRFTLTEFIIEIDQSPSKAYLTTNIYQLHNSNEIMNYGASGNTLNLYIIIAIITGACIISIILLFLVFLFLQRTKRNHNDRCNTLENTIRKYDVINMKEIQSNFTTTIQSQHYNGNKFLDYEVHPFPNCSQQLPSYEDGNTNLELINQPNGSLFLLPVETDYNYGQNSFNKIPGNYWSTNTNIMNDNNDIVNMQTNENRINLTVSSYNTNSLYNEYTNYHNGDKINITGCQDICQTILNGQCSIPFSMPEACSELTNITKHPHILMSSMDNWPKLSTTDFTSNIIIPTDCDSGNGDSVEIQPNLSTKVYFLGRT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	46.5	Very low	50.1	Low	233 Å²	233	183.4 Å²	183.4	100%	1.148	84%	0.837	S	S	*	*				0	84.6	0	177.3	175.7	173.8	0	0	108.2
2	L	45.1	Very low	50.3	Low	158 Å²	158	180.3 Å²	180.3	83%	0.827	83%	0.831	S	S	*	*			trans	-179.5	49.9	170.2	-107.2	169.8	0	0	0	108.7
3	R	42.2	Very low	50.7	Low	244 Å²	244	176.2 Å²	176.2	92%	0.921	83%	0.827	S	S	*	*			trans	-137.6	33.8	-172.3	-154.9	-174.5	-168.2	-169.6	4.2	111.4
4	I	51.4	Low	51	Low	131 Å²	131	170.1 Å²	170.1	67%	0.672	82%	0.822	S	S	*	*			trans	-128.9	-32.4	-165.6	-69.8	178.8	0	0	0	112.5	F6	I4-F6 VanDerWaalsContact C-N 3.25Å; I4-F6 PolarHBondContact O-N 3.38Å
5	D	51.5	Low	51.1	Low	116 Å²	116	174.4 Å²	174.4	62%	0.62	83%	0.826	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-2.8	-162	-48.4	-73.8	0	0	0	115.8
6	F	51.1	Low	51.3	Low	211 Å²	211	175.1 Å²	175.1	93%	0.925	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-0.3	-175.9	-144.1	-96.7	0	0	0	114.9	I4	I4-F6 VanDerWaalsContact C-N 3.25Å; I4-F6 PolarHBondContact O-N 3.38Å
7	L	52.8	Low	51.6	Low	160 Å²	160	175.8 Å²	175.8	84%	0.838	83%	0.831	S	S	*	*	S	Bend	trans	-108.1	-9.5	-173.9	-94.7	162.9	0	0	0	115.4
8	Q	52.3	Low	51.8	Low	164 Å²	164	172.4 Å²	172.4	77%	0.766	83%	0.828	S	S	*	*	S	Bend	trans	-92.9	-11	-165.8	-148.5	169.1	10.2	0	0	115.1
9	W	51	Low	51.9	Low	220 Å²	220	172.7 Å²	172.7	83%	0.833	83%	0.828	S	S	*	*	G	3₁₀ helix	trans	-80.1	-31.9	-172	-147.5	63.4	0	0	0	114.3	W11	W9-W11 VanDerWaalsContact C-N 3.26Å; W9-W11 PolarHBondContact O-N 2.7Å
10	N	54	Low	52.1	Low	142 Å²	142	171.8 Å²	171.8	76%	0.759	83%	0.827	S	S	*	*	G	3₁₀ helix	trans	-71.8	-9.6	-172.5	-77.3	-15.1	0	0	0	115.3
11	W	53.4	Low	52.3	Low	238 Å²	238	171.4 Å²	171.4	90%	0.902	83%	0.828	S	S	*	*	G	3₁₀ helix	trans	-83.4	-11.2	-173.7	-129.9	82.7	0	0	0	114.6	W9	W9-W11 VanDerWaalsContact C-N 3.26Å; W9-W11 PolarHBondContact O-N 2.7Å
12	L	52.5	Low	52.8	Low	146 Å²	146	167.3 Å²	167.3	76%	0.764	81%	0.81	S	S	*	*	S	Bend	trans	-81.1	-24.1	-172.7	-103.3	158	0	0	0	114.7	A14	L12-A14 PolarHBondContact O-N 3.1Å
13	V	56	Low	53.5	Low	127 Å²	127	167 Å²	167	77%	0.77	81%	0.807	S	S	*	*	G	3₁₀ helix	trans	-73.7	-28	-170.4	-178.7	0	0	0	0	113.2	R15	V13-R15 PolarHBondContact O-N 2.92Å
14	A	54.2	Low	54.3	Low	92 Å²	92	162.4 Å²	162.4	76%	0.76	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-75.6	-14.5	-167.9	0	0	0	0	0	115.8	L12 Q16	L12-A14 PolarHBondContact O-N 3.1Å; A14-Q16 PolarHBondContact O-N 3.45Å
15	R	53.4	Low	54.5	Low	234 Å²	234	163.5 Å²	163.5	88%	0.883	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-86.2	-8.6	-163.8	-158.8	169.9	-178.8	175.1	0.6	115.3	V13	V13-R15 PolarHBondContact O-N 2.92Å
16	Q	53.9	Low	54.3	Low	185 Å²	185	166.8 Å²	166.8	86%	0.864	82%	0.815	S	S	*	*	S	Bend	trans	-96.5	-8.5	-160.5	-150.7	167.4	6.1	0	0	116.2	A14	A14-Q16 PolarHBondContact O-N 3.45Å
17	Q	55.6	Low	54.1	Low	187 Å²	187	166.2 Å²	166.2	87%	0.874	81%	0.808	S	S	*	*	S	Bend	trans	-91.2	-12.5	-170.6	-74.2	-170.9	-21.6	0	0	117	H19	Q17-H19 PolarHBondContact O-N 2.67Å
18	C	55	Low	53.6	Low	116 Å²	116	166.6 Å²	166.6	78%	0.784	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-7.2	-165.2	-71.3	0	0	0	0	117.1
19	H	54.7	Low	53.1	Low	177 Å²	177	165.8 Å²	165.8	82%	0.819	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-8	-164.7	-98.7	-74.8	0	0	0	117	Q17	Q17-H19 PolarHBondContact O-N 2.67Å
20	L	55.5	Low	52.3	Low	155 Å²	155	162.7 Å²	162.7	81%	0.812	81%	0.809	S	S	*	*	S	Bend	trans	-88	-16.6	-162.6	-158.1	67.5	0	0	0	115.8	I22	L20-I22 PolarHBondContact O-N 2.97Å
21	L	56.8	Low	50.8	Low	163 Å²	163	164 Å²	164	85%	0.853	81%	0.814	S	S	*	*	S	Bend	trans	-85.1	-1.1	-156.9	-145.2	88	0	0	0	117.2
22	I	57.1	Low	49.1	Very low	148 Å²	148	162.1 Å²	162.1	76%	0.759	82%	0.816	S	S	*	*	S	Bend	trans	-99.5	-4.9	-153.9	-68.7	175.2	0	0	0	115.6	L20	L20-I22 PolarHBondContact O-N 2.97Å
23	I	59.1	Low	48.2	Very low	151 Å²	151	161.3 Å²	161.3	77%	0.774	82%	0.822	S	S	*	*			trans	-101.1	-1	-152.2	-68.7	174.2	0	0	0	118
24	I	58.7	Low	47.1	Very low	147 Å²	147	166.7 Å²	166.7	75%	0.754	83%	0.829	S	S	*	*			trans	-106.1	-2.7	-142.5	-77	173.9	0	0	0	123.3
25	L	56	Low	46.9	Very low	155 Å²	155	167.2 Å²	167.2	81%	0.812	82%	0.823	S	S	*	*			trans	-119.5	0	-152	-58.8	157.6	0	0	0	120.7
26	F	47.3	Very low	47	Very low	184 Å²	184	161.7 Å²	161.7	81%	0.807	81%	0.814	S	S	*	*				0	0	0	-87.7	-55.4	0	0	0	127.4
27	Y	47.6	Very low	47.5	Very low	199 Å²	199	159.9 Å²	159.9	78%	0.78	80%	0.799	S	S	*	*				0	0	0	-21.6	-96.4	0	0	0	126.4
28	I	42.2	Very low	48.2	Very low	168 Å²	168	155 Å²	155	86%	0.862	78%	0.776	S	S	*	*				0	0	0	3.5	167.8	0	0	0	121.3
29	N	41.3	Very low	48.8	Very low	148 Å²	148	156.4 Å²	156.4	79%	0.791	76%	0.764	S	S	*	*				0	0	0	-83.5	-81	0	0	0	119.5
30	L	34.1	Very low	49.9	Very low	155 Å²	155	149.4 Å²	149.4	81%	0.812	73%	0.733	S	S	*	*				0	0	0	-153.9	71	0	0	0	117
31	I	22.4	Very low	51	Low	169 Å²	169	145.6 Å²	145.6	87%	0.867	71%	0.714	S	S	*	*				0	0	0	-65.7	167.2	0	0	0	122.9
32	Q	18.7	Very low	52.1	Low	199 Å²	199	138.3 Å²	138.3	93%	0.93	68%	0.675	S	S	*	*				0	0	0	-132.9	-178.4	11.2	0	0	123
33	S	32.2	Very low	53.3	Low	128 Å²	128	134.9 Å²	134.9	90%	0.895	66%	0.656	S	S	*	*				0	0	0	74.8	0	0	0	0	124.6
34	R	32.9	Very low	54.2	Low	241 Å²	241	129.4 Å²	129.4	91%	0.909	63%	0.628	S	S	*	*				0	156.6	0	-170	-174.6	-176.2	-129.7	4.5	122.3
35	T	50.2	Low	55.2	Low	103 Å²	103	130.2 Å²	130.2	63%	0.632	63%	0.628	S	S	*	*			trans	-158.5	0	-175.9	49.1	0	0	0	0	123.6	Y118	T35-Y118 VanDerWaalsContact CB-CE1 3.47Å; T35-Y118 HydrophobicContact CG2-CD1 3.87Å; T35-Y118 HydrophobicContact CG2-CE1 4.1Å; T35-Y118 WeakPolarHBondContact OG1-CE1 3.38Å
36	V	56.2	Low	56.4	Low	117 Å²	117	127.5 Å²	127.5	71%	0.709	61%	0.614	S	S	*	*				0	0	0	-173.9	0	0	0	0	121.4	R139	V36-R139 PolarHBondContact O-NE 2.91Å; V36-R139 PolarHBondContact O-NH2 2.89Å
37	R	63.4	Low	58	Low	147 Å²	147	124.9 Å²	124.9	56%	0.555	61%	0.609	S	S	*	*				0	155.9	0	-41.4	-153.5	108.4	107.6	-6.2	125.9	E116 R139	R37-E116 IonicContact CZ-OE1 2.63Å; R37-E116 IonicContact NE-OE1 3.89Å; R37-E116 PolarHBondContact NE-OE1 3.2Å; R37-E116 IonicContact NH2-OE1 2.89Å; R37-E116 PolarHBondContact NH2-OE1 2.97Å; R37-E116 IonicContact NH2-OE2 3.65Å; R37-E116 PolarHBondContact NH2-OE2 3.08Å; R37-R139 HydrophobicContact CB-CG 3.39Å; R37-R139 HydrophobicContact CG-CG 3.82Å; R37-R139 VanDerWaalsContact NE-NH1 3.18Å
38	F	70.6	Confident	59.5	Low	85 Å²	85	118 Å²	118	37%	0.373	59%	0.587	S	S	.	*			trans	-157.7	-171.1	166.8	-100	-82.6	0	0	0	116.8	I50 L53 I74 R139	F38-I50 HydrophobicContact CD1-CG2 4.11Å; F38-L53 HydrophobicContact CE2-CD2 4.11Å; F38-I74 HydrophobicContact CD2-CD1 3.89Å; F38-I74 HydrophobicContact CE1-CD1 4.44Å; F38-I74 HydrophobicContact CE2-CD1 3.36Å; F38-I74 HydrophobicContact CZ-CD1 3.68Å; F38-R139 WeakPolarHBondContact O-CA 3.38Å; F38-R139 WeakPolarHBondContact O-CB 3.18Å
39	R	68.1	Low	61.3	Low	145 Å²	145	117.7 Å²	117.7	55%	0.547	58%	0.575	S	S	.	*			trans	-145.8	145.9	176.3	-90.7	-167.3	-177.4	-167.7	-8.2	116.3	N138	R39-N138 VanDerWaalsContact CG-O 3.23Å; R39-N138 WeakPolarHBondContact CG-O 3.4Å; R39-N138 PolarHBondContact NE-O 3.21Å
40	L	78	Confident	62.8	Low	30 Å²	30	112.2 Å²	112.2	16%	0.157	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	168.2	178.5	-76.4	167.3	0	0	0	113.5	I44 I50 F65 V76 L80 I140 L141 R142	L40-I44 HydrophobicContact CD2-CD1 4.09Å; L40-I50 HydrophobicContact CD1-CD1 4.01Å; L40-I50 HydrophobicContact CD1-CG1 4.34Å; L40-I50 HydrophobicContact CD1-CG2 4.3Å; L40-I50 HydrophobicContact CD2-CG1 4.09Å; L40-I50 HydrophobicContact CD2-CG2 3.98Å; L40-I50 HydrophobicContact CG-CG2 4.11Å; L40-F65 HydrophobicContact CD1-CE1 3.88Å; L40-F65 HydrophobicContact CD1-CZ 4.18Å; L40-V76 HydrophobicContact CD1-CG2 4.4Å; L40-L80 HydrophobicContact CD1-CD1 3.54Å; L40-I140 PolarHBondContact N-O 3.38Å; L40-I140 VanDerWaalsContact N-O 3.12Å; L40-L141 HydrophobicContact CB-CD1 3.87Å; L40-L141 CarbonylContact O-C 3.57Å; L40-L141 WeakPolarHBondContact O-CA 3.15Å; L40-R142 WeakPolarHBondContact O-CB 3.33Å; L40-R142 PolarHBondContact O-N 2.8Å
41	D	77.5	Confident	64.5	Low	76 Å²	76	105.7 Å²	105.7	41%	0.406	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	158.5	159.3	-46.1	-49.4	0	0	0	109.6	I44 L141 R142	D41-I44 HydrophobicContact CB-CD1 3.98Å; D41-I44 HydrophobicContact CB-CG1 4.27Å; D41-I44 WeakPolarHBondContact O-CD1 3.28Å; D41-I44 VanDerWaalsContact O-CG1 3.29Å; D41-I44 WeakPolarHBondContact O-CG1 3.23Å; D41-L141 WeakPolarHBondContact O-CD1 3.33Å; D41-R142 HydrophobicContact CB-CB 4.08Å; D41-R142 VanDerWaalsContact OD1-CB 3.3Å; D41-R142 WeakPolarHBondContact OD1-CB 3.33Å; D41-R142 WeakPolarHBondContact OD1-CD 3.47Å; D41-R142 IonicContact OD1-NH1 2.7Å
42	E	80.7	Confident	66.4	Low	9 Å²	9	100.3 Å²	100.3	4%	0.042	49%	0.493	C	S	.	.	S	Bend	trans	-82.3	173.1	175.7	79.4	179.4	142.8	0	0	113.8	I44 L80 R82 L141 R142 D143 T144	E42-I44 PolarHBondContact O-N 2.85Å; E42-L80 WeakPolarHBondContact CA-O 3.41Å; E42-L80 VanDerWaalsContact CB-O 3.3Å; E42-L80 WeakPolarHBondContact CB-O 3.31Å; E42-R82 HydrophobicContact CB-CB 4.31Å; E42-R82 WeakPolarHBondContact OE2-CB 3.43Å; E42-R82 PolarHBondContact OE2-N 2.74Å; E42-L141 HydrophobicContact CB-CD1 4.22Å; E42-L141 HydrophobicContact CB-CG 4.34Å; E42-R142 WeakPolarHBondContact CB-O 3.43Å; E42-R142 WeakPolarHBondContact CG-O 3.31Å; E42-R142 PolarHBondContact N-O 3.42Å; E42-D143 WeakPolarHBondContact OE1-CA 3.21Å; E42-T144 PolarHBondContact OE1-N 3.06Å
43	E	81.6	Confident	68.3	Low	76 Å²	76	93.2 Å²	93.2	36%	0.355	46%	0.461	S	S	.	.	S	Bend	trans	50.6	16.9	-175.2	-65.8	-57.2	91.9	0	0	115.3	Q45 R79 L80	E43-Q45 PolarHBondContact O-N 2.77Å; E43-R79 VanDerWaalsContact CD-CZ 3.49Å; E43-R79 WeakPolarHBondContact OE1-CD 3.39Å; E43-R79 WeakPolarHBondContact OE1-CG 3.35Å; E43-R79 IonicContact OE1-CZ 2.89Å; E43-R79 IonicContact OE1-NE 3.46Å; E43-R79 PolarHBondContact OE1-NE 2.78Å; E43-R79 IonicContact OE1-NH2 3.71Å; E43-R79 PolarHBondContact OE1-NH2 3.22Å; E43-R79 IonicContact OE2-CZ 3.99Å; E43-R79 VanDerWaalsContact OE2-CZ 3.22Å; E43-R79 IonicContact OE2-NE 3.32Å; E43-R79 PolarHBondContact OE2-NE 3.47Å; E43-R79 IonicContact OE2-NH2 2.9Å; E43-R79 PolarHBondContact OE2-NH2 2.7Å; E43-L80 PolarHBondContact N-O 2.7Å
44	I	79.4	Confident	69.1	Low	36 Å²	36	93 Å²	93	19%	0.185	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-59.7	131.9	175	-82.2	-175.3	0	0	0	109.9	L40 D41 E42 L46 T48 V76	L40-I44 HydrophobicContact CD2-CD1 4.09Å; D41-I44 HydrophobicContact CB-CD1 3.98Å; D41-I44 HydrophobicContact CB-CG1 4.27Å; D41-I44 WeakPolarHBondContact O-CD1 3.28Å; D41-I44 VanDerWaalsContact O-CG1 3.29Å; D41-I44 WeakPolarHBondContact O-CG1 3.23Å; E42-I44 PolarHBondContact O-N 2.85Å; I44-L46 PolarHBondContact O-N 3.13Å; I44-T48 HydrophobicContact CG2-CG2 3.67Å; I44-T48 WeakPolarHBondContact CG2-OG1 3.42Å; I44-V76 HydrophobicContact CG2-CG2 4.47Å
45	Q	79.5	Confident	69.7	Low	165 Å²	165	89.6 Å²	89.6	77%	0.771	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-56.2	135.6	179.7	-65	-176.3	-6.7	0	0	111.8	E43 T48	E43-Q45 PolarHBondContact O-N 2.77Å; Q45-T48 VanDerWaalsContact O-CB 3.31Å; Q45-T48 WeakPolarHBondContact O-CB 3.38Å; Q45-T48 PolarHBondContact O-N 3.07Å; Q45-T48 PolarHBondContact O-OG1 3.34Å
46	L	80.9	Confident	69.3	Low	97 Å²	97	93.8 Å²	93.8	51%	0.508	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	145.8	179.4	-58.1	178	0	0	0	111.8	I44 T48	I44-L46 PolarHBondContact O-N 3.13Å; L46-T48 VanDerWaalsContact C-N 3.3Å
47	N	79.6	Confident	68.6	Low	130 Å²	130	90.9 Å²	90.9	70%	0.695	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	9.9	-172.5	-43.6	-84	0	0	0	115.7	V76	N47-V76 WeakPolarHBondContact CA-O 3.37Å; N47-V76 PolarHBondContact N-O 3.19Å
48	T	80.5	Confident	67.4	Low	53 Å²	53	91.3 Å²	91.3	33%	0.325	44%	0.435	S	S	.	.			trans	-64.2	139.3	169.8	-64.2	0	0	0	0	111.4	I44 Q45 L46 T75 V76	I44-T48 HydrophobicContact CG2-CG2 3.67Å; I44-T48 WeakPolarHBondContact CG2-OG1 3.42Å; Q45-T48 VanDerWaalsContact O-CB 3.31Å; Q45-T48 WeakPolarHBondContact O-CB 3.38Å; Q45-T48 PolarHBondContact O-N 3.07Å; Q45-T48 PolarHBondContact O-OG1 3.34Å; L46-T48 VanDerWaalsContact C-N 3.3Å; T48-T75 WeakPolarHBondContact O-CA 3.26Å; T48-V76 PolarHBondContact O-N 2.72Å
49	R	79.3	Confident	65.7	Low	162 Å²	162	92.6 Å²	92.6	61%	0.611	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.6	-173.9	-179.4	-177.4	-179.9	-109.9	-2.4	111.8	D73 T75	R49-D73 IonicContact CZ-OD1 3.59Å; R49-D73 IonicContact CZ-OD2 3.05Å; R49-D73 IonicContact NE-OD1 3.83Å; R49-D73 PolarHBondContact NE-OD1 3.33Å; R49-D73 IonicContact NE-OD2 3.85Å; R49-D73 PolarHBondContact NE-OD2 2.81Å; R49-D73 IonicContact NH2-OD1 2.76Å; R49-D73 PolarHBondContact NH2-OD1 2.98Å; R49-D73 IonicContact NH2-OD2 2.67Å; R49-D73 PolarHBondContact NH2-OD2 2.72Å; R49-T75 HydrophobicContact CB-CG2 4.43Å
50	I	72.9	Confident	64.5	Low	33 Å²	33	90.6 Å²	90.6	17%	0.169	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-43.1	-165.8	-45.6	169.5	0	0	0	112.5	F38 L40 F65 I74 V76	F38-I50 HydrophobicContact CD1-CG2 4.11Å; L40-I50 HydrophobicContact CD1-CD1 4.01Å; L40-I50 HydrophobicContact CD1-CG1 4.34Å; L40-I50 HydrophobicContact CD1-CG2 4.3Å; L40-I50 HydrophobicContact CD2-CG1 4.09Å; L40-I50 HydrophobicContact CD2-CG2 3.98Å; L40-I50 HydrophobicContact CG-CG2 4.11Å; I50-F65 HydrophobicContact CD1-CD1 3.46Å; I50-F65 VanDerWaalsContact CD1-CD1 3.46Å; I50-F65 HydrophobicContact CD1-CE1 3.57Å; I50-I74 HydrophobicContact CB-CB 4.25Å; I50-I74 WeakPolarHBondContact CB-O 3.45Å; I50-I74 HydrophobicContact CD1-CB 4.23Å; I50-I74 HydrophobicContact CD1-CG2 3.81Å; I50-I74 WeakPolarHBondContact CG1-O 3.31Å; I50-I74 PolarHBondContact N-O 2.68Å; I50-V76 HydrophobicContact CD1-CG2 3.75Å; I50-V76 HydrophobicContact CG1-CG2 3.99Å
51	G	69.5	Low	62.7	Low	18 Å²	18	93.9 Å²	93.9	19%	0.186	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.4	176.6	-178.3	0	0	0	0	0	112.9	D73 I74	G51-D73 CarbonylContact O-C 3.6Å; G51-D73 WeakPolarHBondContact O-CA 3.38Å; G51-I74 WeakPolarHBondContact O-CG1 3.21Å; G51-I74 PolarHBondContact O-N 3.48Å
52	S	63.3	Low	61.3	Low	57 Å²	57	92.1 Å²	92.1	40%	0.399	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.9	-170.3	175.5	0	0	0	0	114.3	T71 G72 D73	S52-T71 PolarHBondContact OG-O 3.42Å; S52-G72 CarbonylContact C-O 3.56Å; S52-G72 VanDerWaalsContact CA-O 3.31Å; S52-G72 WeakPolarHBondContact CA-O 3.47Å; S52-D73 WeakPolarHBondContact CB-OD1 3.5Å
53	L	59	Low	60.4	Low	50 Å²	50	99.7 Å²	99.7	26%	0.262	51%	0.507	S	S	.	.			trans	-104.8	35.1	-179.2	-71.5	172.3	0	0	0	114.2	F38 K55 I57 V67 G72 I74 F119 V121	F38-L53 HydrophobicContact CE2-CD2 4.11Å; L53-K55 VanDerWaalsContact C-N 3.31Å; L53-K55 PolarHBondContact O-N 3.37Å; L53-I57 HydrophobicContact CB-CD1 4.3Å; L53-V67 HydrophobicContact CD1-CG1 4.01Å; L53-V67 HydrophobicContact CD1-CG2 4.08Å; L53-G72 PolarHBondContact N-O 2.73Å; L53-I74 HydrophobicContact CD1-CD1 3.89Å; L53-I74 HydrophobicContact CD1-CG1 3.96Å; L53-I74 HydrophobicContact CG-CD1 4Å; L53-I74 HydrophobicContact CG-CG1 4.19Å; L53-F119 HydrophobicContact CD1-CE2 4.4Å; L53-V121 HydrophobicContact CD1-CG2 4.48Å
54	L	48.7	Very low	59.5	Low	123 Å²	123	97.7 Å²	97.7	64%	0.644	50%	0.498	S	S	*	.			trans	-71.9	59.4	-164.5	-151.5	87.2	0	0	0	117.7	T71	L54-T71 WeakPolarHBondContact CD1-O 3.46Å
55	K	44	Very low	59.2	Low	169 Å²	169	97.3 Å²	97.3	74%	0.735	50%	0.495	S	S	*	.	S	Bend	trans	-167.6	114.7	150.7	-117.1	178	-177.5	-179	0	111.4	L53	L53-K55 VanDerWaalsContact C-N 3.31Å; L53-K55 PolarHBondContact O-N 3.37Å
56	Y	43.6	Very low	58.9	Low	192 Å²	192	92.8 Å²	92.8	75%	0.753	48%	0.479	S	S	*	.			trans	67	104.9	-177.6	-46.1	-76.9	0	0	0	113.8
57	I	39.8	Very low	58.2	Low	56 Å²	56	89.7 Å²	89.7	29%	0.287	46%	0.464	S	S	.	.			trans	-129.3	131.9	174.9	-61.6	171.1	0	0	0	107.5	L53 V67	L53-I57 HydrophobicContact CB-CD1 4.3Å; I57-V67 HydrophobicContact CD1-CG1 4.18Å
58	Q	38.2	Very low	57.7	Low	155 Å²	155	86 Å²	86	72%	0.724	45%	0.445	S	S	*	.			trans	-150.2	139.3	148.8	-165.6	164.4	8.9	0	0	107.8
59	D	36.5	Very low	56.8	Low	113 Å²	113	90.3 Å²	90.3	60%	0.604	46%	0.461	S	S	*	.			trans	-74.8	144.9	-161	-56.6	-72.4	0	0	0	114.9
60	D	43.1	Very low	56.1	Low	102 Å²	102	88.6 Å²	88.6	55%	0.545	46%	0.462	S	S	.	.			trans	-139.3	124.1	148.7	-122.9	-36	0	0	0	106	N122	D60-N122 PolarHBondContact OD2-ND2 2.89Å
61	A	38.7	Very low	55.8	Low	99 Å²	99	89.6 Å²	89.6	82%	0.818	47%	0.47	S	S	*	.			trans	-86.1	138.3	-156.7	0	0	0	0	0	114.3
62	S	49.2	Very low	55.6	Low	40 Å²	40	88.8 Å²	88.8	28%	0.28	46%	0.461	S	S	.	.			trans	-118.5	120	160.8	175.8	0	0	0	0	107.6	L64 F65	S62-L64 PolarHBondContact O-N 2.86Å; S62-F65 PolarHBondContact O-N 2.88Å
63	E	61.8	Low	56	Low	167 Å²	167	87.1 Å²	87.1	78%	0.78	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.5	-164	-59.3	-178	144	0	0	114.5	H78	E63-H78 PolarHBondContact O-CE1 3.05Å; E63-H78 PolarHBondContact O-ND1 3Å
64	L	63.1	Low	56.7	Low	35 Å²	35	84.9 Å²	84.9	18%	0.183	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-27.7	-178.6	-55.8	174.7	0	0	0	113.6	S62 V77 H78 L85 L117	S62-L64 PolarHBondContact O-N 2.86Å; L64-V77 PolarHBondContact O-N 3.47Å; L64-H78 HydrophobicContact CD2-CB 4.3Å; L64-L85 HydrophobicContact CD1-CD1 4.36Å; L64-L85 HydrophobicContact CD1-CD2 3.74Å; L64-L85 HydrophobicContact CD2-CD2 3.82Å; L64-L85 HydrophobicContact CG-CD2 4.44Å; L64-L117 HydrophobicContact CD1-CD1 4.2Å; L64-L117 HydrophobicContact CD1-CD2 3.89Å
65	F	73	Confident	58.2	Low	28 Å²	28	80.9 Å²	80.9	12%	0.123	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.6	-170	-57.4	-64.1	0	0	0	112.2	L40 I50 S62 I74 T75 V76 L80 L117 F119	L40-F65 HydrophobicContact CD1-CE1 3.88Å; L40-F65 HydrophobicContact CD1-CZ 4.18Å; I50-F65 HydrophobicContact CD1-CD1 3.46Å; I50-F65 VanDerWaalsContact CD1-CD1 3.46Å; I50-F65 HydrophobicContact CD1-CE1 3.57Å; S62-F65 PolarHBondContact O-N 2.88Å; F65-I74 HydrophobicContact CB-CG2 3.81Å; F65-I74 HydrophobicContact CD1-CG2 4.35Å; F65-I74 HydrophobicContact CG-CG2 4.25Å; F65-T75 WeakPolarHBondContact CA-O 3.49Å; F65-V76 HydrophobicContact CE1-CG2 4.44Å; F65-L80 HydrophobicContact CE1-CD1 4.28Å; F65-L80 HydrophobicContact CE1-CD2 4.2Å; F65-L80 HydrophobicContact CZ-CD2 4.18Å; F65-L117 HydrophobicContact CE2-CB 4.19Å; F65-L117 HydrophobicContact CE2-CD1 3.84Å; F65-L117 HydrophobicContact CZ-CD1 3.67Å; F65-F119 HydrophobicContact CD2-CD1 4.21Å; F65-F119 HydrophobicContact CD2-CE1 4.26Å
66	T	72.3	Confident	59.7	Low	70 Å²	70	72.8 Å²	72.8	43%	0.429	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.2	165.7	44.3	0	0	0	0	110.9	I74 T75 V77	T66-I74 CarbonylContact O-C 3.54Å; T66-I74 VanDerWaalsContact O-CA 3.3Å; T66-I74 WeakPolarHBondContact O-CA 3.45Å; T66-T75 PolarHBondContact N-O 3.14Å; T66-T75 VanDerWaalsContact N-O 3.15Å; T66-T75 PolarHBondContact O-N 2.77Å; T66-T75 PolarHBondContact OG1-OG1 2.68Å; T66-V77 HydrophobicContact CG2-CG2 3.74Å; T66-V77 VanDerWaalsContact OG1-CG2 3.24Å; T66-V77 WeakPolarHBondContact OG1-CG2 3.48Å
67	V	67	Low	61.3	Low	32 Å²	32	66.3 Å²	66.3	19%	0.194	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123.4	170.9	-172.8	0	0	0	0	108.7	L53 I57 H69 D73 I74	L53-V67 HydrophobicContact CD1-CG1 4.01Å; L53-V67 HydrophobicContact CD1-CG2 4.08Å; I57-V67 HydrophobicContact CD1-CG1 4.18Å; V67-H69 PolarHBondContact O-N 3.3Å; V67-D73 CarbonylContact C-O 3.16Å; V67-D73 WeakPolarHBondContact CA-O 3.48Å; V67-I74 HydrophobicContact CG2-CG1 4.33Å
68	D	67.5	Low	62.9	Low	53 Å²	53	68.2 Å²	68.2	28%	0.283	37%	0.37	S	S	.	.			trans	-71.3	109.7	169	173	19.6	0	0	0	110	I70 T71 G72 D73	D68-I70 PolarHBondContact O-N 2.87Å; D68-I70 PolarHBondContact OD1-N 3.23Å; D68-T71 WeakPolarHBondContact CB-OG1 3.27Å; D68-T71 VanDerWaalsContact CG-OG1 3.32Å; D68-T71 PolarHBondContact O-N 3.2Å; D68-T71 VanDerWaalsContact OD2-CB 3.31Å; D68-T71 WeakPolarHBondContact OD2-CB 3.21Å; D68-T71 VanDerWaalsContact OD2-CG2 3.24Å; D68-T71 WeakPolarHBondContact OD2-CG2 3.4Å; D68-T71 PolarHBondContact OD2-N 3.01Å; D68-T71 VanDerWaalsContact OD2-N 3.11Å; D68-T71 PolarHBondContact OD2-OG1 3.39Å; D68-G72 WeakPolarHBondContact O-CA 3.39Å; D68-G72 PolarHBondContact O-N 2.8Å; D68-D73 PolarHBondContact N-O 3.27Å
69	H	63.1	Low	64.9	Low	143 Å²	143	67 Å²	67	66%	0.662	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-20.6	173.2	68.1	-50	0	0	0	116.2	V67	V67-H69 PolarHBondContact O-N 3.3Å
70	I	63.2	Low	66.8	Low	125 Å²	125	61.6 Å²	61.6	64%	0.641	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-54.8	-179.6	-56	175	0	0	0	111.4	D68	D68-I70 PolarHBondContact O-N 2.87Å; D68-I70 PolarHBondContact OD1-N 3.23Å
71	T	66.7	Low	68.6	Low	55 Å²	55	58.1 Å²	58.1	34%	0.337	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-12.1	-176.9	60.8	0	0	0	0	113.6	S52 L54 D68 D73	S52-T71 PolarHBondContact OG-O 3.42Å; L54-T71 WeakPolarHBondContact CD1-O 3.46Å; D68-T71 WeakPolarHBondContact CB-OG1 3.27Å; D68-T71 VanDerWaalsContact CG-OG1 3.32Å; D68-T71 PolarHBondContact O-N 3.2Å; D68-T71 VanDerWaalsContact OD2-CB 3.31Å; D68-T71 WeakPolarHBondContact OD2-CB 3.21Å; D68-T71 VanDerWaalsContact OD2-CG2 3.24Å; D68-T71 WeakPolarHBondContact OD2-CG2 3.4Å; D68-T71 PolarHBondContact OD2-N 3.01Å; D68-T71 VanDerWaalsContact OD2-N 3.11Å; D68-T71 PolarHBondContact OD2-OG1 3.39Å; T71-D73 PolarHBondContact O-N 2.98Å; T71-D73 WeakPolarHBondContact OG1-CB 3.41Å; T71-D73 VanDerWaalsContact OG1-CG 3.24Å; T71-D73 PolarHBondContact OG1-N 2.69Å; T71-D73 VanDerWaalsContact OG1-N 3.11Å; T71-D73 PolarHBondContact OG1-OD2 3.19Å
72	G	65.6	Low	70.6	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.278	C	S	.	.			trans	68.7	4.9	-165.8	0	0	0	0	0	113.8	S52 L53 D68	S52-G72 CarbonylContact C-O 3.56Å; S52-G72 VanDerWaalsContact CA-O 3.31Å; S52-G72 WeakPolarHBondContact CA-O 3.47Å; L53-G72 PolarHBondContact N-O 2.73Å; D68-G72 WeakPolarHBondContact O-CA 3.39Å; D68-G72 PolarHBondContact O-N 2.8Å
73	D	72	Confident	71.9	Confident	23 Å²	23	55.5 Å²	55.5	12%	0.123	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	131.2	-171.9	-74.3	-26.5	0	0	0	112.4	R49 G51 S52 V67 D68 T71	R49-D73 IonicContact CZ-OD1 3.59Å; R49-D73 IonicContact CZ-OD2 3.05Å; R49-D73 IonicContact NE-OD1 3.83Å; R49-D73 PolarHBondContact NE-OD1 3.33Å; R49-D73 IonicContact NE-OD2 3.85Å; R49-D73 PolarHBondContact NE-OD2 2.81Å; R49-D73 IonicContact NH2-OD1 2.76Å; R49-D73 PolarHBondContact NH2-OD1 2.98Å; R49-D73 IonicContact NH2-OD2 2.67Å; R49-D73 PolarHBondContact NH2-OD2 2.72Å; G51-D73 CarbonylContact O-C 3.6Å; G51-D73 WeakPolarHBondContact O-CA 3.38Å; S52-D73 WeakPolarHBondContact CB-OD1 3.5Å; V67-D73 CarbonylContact C-O 3.16Å; V67-D73 WeakPolarHBondContact CA-O 3.48Å; D68-D73 PolarHBondContact N-O 3.27Å; T71-D73 PolarHBondContact O-N 2.98Å; T71-D73 WeakPolarHBondContact OG1-CB 3.41Å; T71-D73 VanDerWaalsContact OG1-CG 3.24Å; T71-D73 PolarHBondContact OG1-N 2.69Å; T71-D73 VanDerWaalsContact OG1-N 3.11Å; T71-D73 PolarHBondContact OG1-OD2 3.19Å
74	I	73.7	Confident	72.5	Confident	3 Å²	3	54 Å²	54	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	132.7	175.2	-41.7	167.5	0	0	0	109	F38 I50 G51 L53 F65 T66 V67 F119	F38-I74 HydrophobicContact CD2-CD1 3.89Å; F38-I74 HydrophobicContact CE1-CD1 4.44Å; F38-I74 HydrophobicContact CE2-CD1 3.36Å; F38-I74 HydrophobicContact CZ-CD1 3.68Å; I50-I74 HydrophobicContact CB-CB 4.25Å; I50-I74 WeakPolarHBondContact CB-O 3.45Å; I50-I74 HydrophobicContact CD1-CB 4.23Å; I50-I74 HydrophobicContact CD1-CG2 3.81Å; I50-I74 WeakPolarHBondContact CG1-O 3.31Å; I50-I74 PolarHBondContact N-O 2.68Å; G51-I74 WeakPolarHBondContact O-CG1 3.21Å; G51-I74 PolarHBondContact O-N 3.48Å; L53-I74 HydrophobicContact CD1-CD1 3.89Å; L53-I74 HydrophobicContact CD1-CG1 3.96Å; L53-I74 HydrophobicContact CG-CD1 4Å; L53-I74 HydrophobicContact CG-CG1 4.19Å; F65-I74 HydrophobicContact CB-CG2 3.81Å; F65-I74 HydrophobicContact CD1-CG2 4.35Å; F65-I74 HydrophobicContact CG-CG2 4.25Å; T66-I74 CarbonylContact O-C 3.54Å; T66-I74 VanDerWaalsContact O-CA 3.3Å; T66-I74 WeakPolarHBondContact O-CA 3.45Å; V67-I74 HydrophobicContact CG2-CG1 4.33Å; I74-F119 HydrophobicContact CD1-CZ 4.07Å
75	T	80.1	Confident	72.9	Confident	38 Å²	38	54.7 Å²	54.7	23%	0.233	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.1	176.5	45.6	0	0	0	0	112.3	T48 R49 F65 T66	T48-T75 WeakPolarHBondContact O-CA 3.26Å; R49-T75 HydrophobicContact CB-CG2 4.43Å; F65-T75 WeakPolarHBondContact CA-O 3.49Å; T66-T75 PolarHBondContact N-O 3.14Å; T66-T75 VanDerWaalsContact N-O 3.15Å; T66-T75 PolarHBondContact O-N 2.77Å; T66-T75 PolarHBondContact OG1-OG1 2.68Å
76	V	76.4	Confident	72.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	127.4	176	-177.8	0	0	0	0	110.4	L40 I44 N47 T48 I50 F65 H78 L80	L40-V76 HydrophobicContact CD1-CG2 4.4Å; I44-V76 HydrophobicContact CG2-CG2 4.47Å; N47-V76 WeakPolarHBondContact CA-O 3.37Å; N47-V76 PolarHBondContact N-O 3.19Å; T48-V76 PolarHBondContact O-N 2.72Å; I50-V76 HydrophobicContact CD1-CG2 3.75Å; I50-V76 HydrophobicContact CG1-CG2 3.99Å; F65-V76 HydrophobicContact CE1-CG2 4.44Å; V76-H78 VanDerWaalsContact CG1-O 3.22Å; V76-H78 WeakPolarHBondContact CG1-O 3.32Å; V76-L80 HydrophobicContact CB-CD1 4.47Å; V76-L80 HydrophobicContact CG1-CD1 3.78Å; V76-L80 HydrophobicContact CG1-CD2 4.47Å; V76-L80 HydrophobicContact CG1-CG 3.77Å; V76-L80 HydrophobicContact CG2-CD1 3.78Å
77	V	75.6	Confident	72.1	Confident	56 Å²	56	58.3 Å²	58.3	34%	0.339	30%	0.298	S	S	.	.			trans	-115.7	-27	-178.3	177.6	0	0	0	0	113.6	L64 T66	L64-V77 PolarHBondContact O-N 3.47Å; T66-V77 HydrophobicContact CG2-CG2 3.74Å; T66-V77 VanDerWaalsContact OG1-CG2 3.24Å; T66-V77 WeakPolarHBondContact OG1-CG2 3.48Å
78	H	73.5	Confident	71.3	Confident	96 Å²	96	63 Å²	63	44%	0.444	32%	0.321	S	S	.	.	S	Bend	trans	-117.5	161.8	176.2	-71	98.5	0	0	0	111.3	E63 L64 V76 L80	E63-H78 PolarHBondContact O-CE1 3.05Å; E63-H78 PolarHBondContact O-ND1 3Å; L64-H78 HydrophobicContact CD2-CB 4.3Å; V76-H78 VanDerWaalsContact CG1-O 3.22Å; V76-H78 WeakPolarHBondContact CG1-O 3.32Å; H78-L80 PolarHBondContact O-N 2.83Å
79	R	80.5	Confident	70.3	Confident	128 Å²	128	66.2 Å²	66.2	48%	0.483	34%	0.338	S	S	.	.			trans	-53.3	126.5	173.3	-173.9	-171.2	-169.3	-145.5	0.8	108.5	E43 D81	E43-R79 VanDerWaalsContact CD-CZ 3.49Å; E43-R79 WeakPolarHBondContact OE1-CD 3.39Å; E43-R79 WeakPolarHBondContact OE1-CG 3.35Å; E43-R79 IonicContact OE1-CZ 2.89Å; E43-R79 IonicContact OE1-NE 3.46Å; E43-R79 PolarHBondContact OE1-NE 2.78Å; E43-R79 IonicContact OE1-NH2 3.71Å; E43-R79 PolarHBondContact OE1-NH2 3.22Å; E43-R79 IonicContact OE2-CZ 3.99Å; E43-R79 VanDerWaalsContact OE2-CZ 3.22Å; E43-R79 IonicContact OE2-NE 3.32Å; E43-R79 PolarHBondContact OE2-NE 3.47Å; E43-R79 IonicContact OE2-NH2 2.9Å; E43-R79 PolarHBondContact OE2-NH2 2.7Å; R79-D81 HydrophobicContact CG-CB 4.13Å; R79-D81 IonicContact CZ-OD2 3.67Å; R79-D81 IonicContact NH1-OD2 3.72Å; R79-D81 PolarHBondContact NH1-OD2 2.88Å; R79-D81 PolarHBondContact O-N 2.95Å
80	L	77.7	Confident	69.4	Low	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.344	C	S	.	.			trans	-94	88.4	170.9	-64.4	179.5	0	0	0	107.3	L40 E42 E43 F65 V76 H78 L85 L117 L141	L40-L80 HydrophobicContact CD1-CD1 3.54Å; E42-L80 WeakPolarHBondContact CA-O 3.41Å; E42-L80 VanDerWaalsContact CB-O 3.3Å; E42-L80 WeakPolarHBondContact CB-O 3.31Å; E43-L80 PolarHBondContact N-O 2.7Å; F65-L80 HydrophobicContact CE1-CD1 4.28Å; F65-L80 HydrophobicContact CE1-CD2 4.2Å; F65-L80 HydrophobicContact CZ-CD2 4.18Å; V76-L80 HydrophobicContact CB-CD1 4.47Å; V76-L80 HydrophobicContact CG1-CD1 3.78Å; V76-L80 HydrophobicContact CG1-CD2 4.47Å; V76-L80 HydrophobicContact CG1-CG 3.77Å; V76-L80 HydrophobicContact CG2-CD1 3.78Å; H78-L80 PolarHBondContact O-N 2.83Å; L80-L85 HydrophobicContact CD2-CD1 4.06Å; L80-L117 HydrophobicContact CD2-CD1 4.38Å; L80-L141 HydrophobicContact CB-CD1 4.3Å; L80-L141 HydrophobicContact CB-CD2 4.46Å; L80-L141 HydrophobicContact CD1-CD1 4.41Å
81	D	80.4	Confident	68.5	Low	29 Å²	29	68.9 Å²	68.9	16%	0.155	35%	0.348	C	S	.	.			trans	-99.8	109.5	176.7	172.7	-38.9	0	0	0	105.8	R79 E83 L84 L85	R79-D81 HydrophobicContact CG-CB 4.13Å; R79-D81 IonicContact CZ-OD2 3.67Å; R79-D81 IonicContact NH1-OD2 3.72Å; R79-D81 PolarHBondContact NH1-OD2 2.88Å; R79-D81 PolarHBondContact O-N 2.95Å; D81-E83 VanDerWaalsContact C-N 3.29Å; D81-E83 PolarHBondContact O-N 3.08Å; D81-L84 HydrophobicContact CB-CB 4.12Å; D81-L84 VanDerWaalsContact CG-CB 3.46Å; D81-L84 WeakPolarHBondContact OD1-CB 3.4Å; D81-L84 PolarHBondContact OD1-N 3.29Å; D81-L85 WeakPolarHBondContact O-CB 3.47Å; D81-L85 WeakPolarHBondContact O-CD1 3.47Å; D81-L85 WeakPolarHBondContact O-CG 3.35Å; D81-L85 PolarHBondContact O-N 3.22Å
82	R	79.9	Confident	67.3	Low	37 Å²	37	72.6 Å²	72.6	14%	0.14	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-32.7	-166.6	-172.9	-165.2	71.3	132.3	2.6	111.7	E42 C115 L141 D143 P180 D182	E42-R82 HydrophobicContact CB-CB 4.31Å; E42-R82 WeakPolarHBondContact OE2-CB 3.43Å; E42-R82 PolarHBondContact OE2-N 2.74Å; R82-C115 HydrophobicContact CG-CB 4.18Å; R82-L141 HydrophobicContact CB-CD2 3.87Å; R82-L141 HydrophobicContact CB-CG 4.25Å; R82-L141 HydrophobicContact CG-CB 4.49Å; R82-L141 HydrophobicContact CG-CD2 4.01Å; R82-L141 HydrophobicContact CG-CG 4.13Å; R82-D143 IonicContact CZ-OD1 2.74Å; R82-D143 IonicContact NE-OD1 2.73Å; R82-D143 PolarHBondContact NE-OD1 3.04Å; R82-D143 VanDerWaalsContact NE-OD1 3.15Å; R82-D143 IonicContact NH1-OD1 2.9Å; R82-D143 PolarHBondContact NH1-OD1 2.91Å; R82-D143 IonicContact NH2-OD1 3.02Å; R82-D143 PolarHBondContact NH2-OD1 3.37Å; R82-P180 PolarHBondContact NH2-O 2.82Å; R82-D182 IonicContact NH1-OD2 2.61Å
83	E	77.2	Confident	65.8	Low	47 Å²	47	77.7 Å²	77.7	22%	0.22	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-47.1	-175.9	-74.6	48.8	-107.5	0	0	110.8	D81 L85 P180	D81-E83 VanDerWaalsContact C-N 3.29Å; D81-E83 PolarHBondContact O-N 3.08Å; E83-L85 VanDerWaalsContact C-N 3.3Å; E83-L85 PolarHBondContact O-N 3.37Å; E83-P180 HydrophobicContact CG-CB 3.68Å; E83-P180 HydrophobicContact CG-CG 4.43Å
84	L	74	Confident	63.8	Low	136 Å²	136	83.8 Å²	83.8	71%	0.712	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-34.7	177	-176.8	66.5	0	0	0	112.1	D81 C86	D81-L84 HydrophobicContact CB-CB 4.12Å; D81-L84 VanDerWaalsContact CG-CB 3.46Å; D81-L84 WeakPolarHBondContact OD1-CB 3.4Å; D81-L84 PolarHBondContact OD1-N 3.29Å; L84-C86 PolarHBondContact O-N 2.8Å
85	L	71.7	Confident	62	Low	49 Å²	49	86 Å²	86	26%	0.257	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-10	-170.4	-72.7	175.7	0	0	0	114.9	L64 L80 D81 E83 L117 L141	L64-L85 HydrophobicContact CD1-CD1 4.36Å; L64-L85 HydrophobicContact CD1-CD2 3.74Å; L64-L85 HydrophobicContact CD2-CD2 3.82Å; L64-L85 HydrophobicContact CG-CD2 4.44Å; L80-L85 HydrophobicContact CD2-CD1 4.06Å; D81-L85 WeakPolarHBondContact O-CB 3.47Å; D81-L85 WeakPolarHBondContact O-CD1 3.47Å; D81-L85 WeakPolarHBondContact O-CG 3.35Å; D81-L85 PolarHBondContact O-N 3.22Å; E83-L85 VanDerWaalsContact C-N 3.3Å; E83-L85 PolarHBondContact O-N 3.37Å; L85-L117 HydrophobicContact CB-CD2 4.28Å; L85-L117 HydrophobicContact CD1-CD1 4.25Å; L85-L117 HydrophobicContact CD1-CD2 4.38Å; L85-L141 HydrophobicContact CD1-CD2 4.29Å
86	C	70.5	Confident	60	Low	61 Å²	61	87.2 Å²	87.2	41%	0.412	45%	0.451	S	S	.	.	S	Bend	trans	-135.3	22.9	-162.2	-79.6	0	0	0	0	116.8	L84 C115	L84-C86 PolarHBondContact O-N 2.8Å; C86-C115 HydrophobicContact CB-CB 3.92Å; C86-C115 WeakPolarHBondContact CB-SG 3.47Å; C86-C115 WeakPolarHBondContact SG-CA 3.01Å; C86-C115 WeakPolarHBondContact SG-CB 3.33Å; C86-C115 CovalentContact SG-SG 2.05Å; C86-C115 PolarHBondContact SG-SG 3.05Å
87	N	57.4	Low	58.1	Low	114 Å²	114	97.2 Å²	97.2	61%	0.61	50%	0.495	S	S	*	.			trans	-141.1	139.6	-178.6	-145.6	-8.4	0	0	0	113.7
88	I	51.2	Low	56	Low	130 Å²	130	105.9 Å²	105.9	67%	0.667	52%	0.523	S	S	*	.			trans	-141.6	154.9	-173.3	-64.1	-175	0	0	0	112.8	H111	I88-H111 PolarHBondContact O-CE1 3.47Å
89	D	46.7	Very low	53.8	Low	121 Å²	121	103.5 Å²	103.5	65%	0.647	52%	0.524	S	S	*	.			trans	-121.2	-179.5	-149.6	-174.9	33.6	0	0	0	116.6
90	H	43	Very low	51.5	Low	169 Å²	169	106.1 Å²	106.1	78%	0.782	54%	0.54	S	S	*	.			trans	-62.9	-169.3	174.6	-73.7	-86.6	0	0	0	116
91	Q	44	Very low	49.3	Very low	155 Å²	155	109.6 Å²	109.6	72%	0.724	56%	0.56	S	S	*	*			trans	108.1	152	168.4	-60.7	-173	54.2	0	0	115.4
92	N	42.1	Very low	47	Very low	133 Å²	133	110.6 Å²	110.6	71%	0.711	57%	0.565	S	S	*	*			cis	-171.4	132.3	-20.6	-105.8	-30.8	0	0	0	109.8
93	I	33.6	Very low	44.5	Very low	106 Å²	106	118.4 Å²	118.4	54%	0.544	60%	0.6	S	S	.	*			trans	-146.1	140	153.7	-33.1	179	0	0	0	112	I102	I93-I102 HydrophobicContact CB-CD1 3.92Å; I93-I102 HydrophobicContact CB-CG2 4.47Å; I93-I102 HydrophobicContact CG2-CD1 3.58Å; I93-I102 WeakPolarHBondContact O-CB 3.4Å
94	K	30.3	Very low	42.3	Very low	151 Å²	151	121.6 Å²	121.6	66%	0.657	62%	0.615	S	S	*	*			trans	-143	163.3	165.1	-87	179.5	176.7	-179.6	0	109.7	V101 I102	K94-V101 HydrophobicContact CB-CG2 4.06Å; K94-V101 HydrophobicContact CD-CB 3.83Å; K94-V101 HydrophobicContact CD-CG2 3.63Å; K94-V101 HydrophobicContact CG-CB 3.93Å; K94-V101 HydrophobicContact CG-CG2 3.84Å; K94-I102 HydrophobicContact CG-CB 4.47Å
95	P	37.1	Very low	40.2	Very low	50 Å²	50	126.2 Å²	126.2	33%	0.325	62%	0.623	S	S	.	*			trans	-120.7	178.8	-142.7	42.2	-35.1	0	0	0	118.6	V101 I102	P95-V101 HydrophobicContact CG-CG2 4.4Å; P95-I102 HydrophobicContact CB-CD1 3.91Å; P95-I102 HydrophobicContact CB-CG1 3.72Å; P95-I102 HydrophobicContact CG-CG1 4.07Å
96	G	36.9	Very low	38.3	Very low	63 Å²	63	132 Å²	132	65%	0.649	65%	0.651	S	S	*	*			trans	-134.1	172.1	145.7	0	0	0	0	0	110.2	Y98	G96-Y98 CarbonylContact C-O 3.48Å
97	K	36.1	Very low	36.4	Very low	210 Å²	210	134.2 Å²	134.2	91%	0.913	67%	0.665	S	S	*	*	S	Bend	cis	-162	101.5	5.8	176.2	-175	-179.5	-179.2	0	108.1
98	Y	31.6	Very low	35.3	Very low	238 Å²	238	136 Å²	136	93%	0.933	67%	0.674	S	S	*	*	S	Bend	cis	-38	129.5	3.8	-66.9	-92.7	0	0	0	114.8	G96	G96-Y98 CarbonylContact C-O 3.48Å
99	G	27.8	Very low	34.5	Very low	46 Å²	46	138.2 Å²	138.2	47%	0.474	69%	0.686	S	S	.	*			trans	-92.4	100.7	176.2	0	0	0	0	0	111.8
100	K	33.4	Very low	34.1	Very low	184 Å²	184	140.1 Å²	140.1	80%	0.8	70%	0.695	S	S	*	*			trans	179.7	143.1	144.2	-101.5	161.7	179.3	-173.3	0	113
101	V	31.1	Very low	33.9	Very low	72 Å²	72	137.9 Å²	137.9	44%	0.436	69%	0.685	S	S	.	*			cis	-152.4	71.1	-31	33.1	0	0	0	0	111.1	K94 P95	K94-V101 HydrophobicContact CB-CG2 4.06Å; K94-V101 HydrophobicContact CD-CB 3.83Å; K94-V101 HydrophobicContact CD-CG2 3.63Å; K94-V101 HydrophobicContact CG-CB 3.93Å; K94-V101 HydrophobicContact CG-CG2 3.84Å; P95-V101 HydrophobicContact CG-CG2 4.4Å
102	I	30.8	Very low	33.9	Very low	51 Å²	51	135.4 Å²	135.4	26%	0.262	68%	0.684	S	S	.	*			trans	28	126.6	165.3	-57.3	-171.4	0	0	0	120.1	I93 K94 P95 E104	I93-I102 HydrophobicContact CB-CD1 3.92Å; I93-I102 HydrophobicContact CB-CG2 4.47Å; I93-I102 HydrophobicContact CG2-CD1 3.58Å; I93-I102 WeakPolarHBondContact O-CB 3.4Å; K94-I102 HydrophobicContact CG-CB 4.47Å; P95-I102 HydrophobicContact CB-CD1 3.91Å; P95-I102 HydrophobicContact CB-CG1 3.72Å; P95-I102 HydrophobicContact CG-CG1 4.07Å; I102-E104 HydrophobicContact CG2-CB 4.14Å; I102-E104 HydrophobicContact CG2-CG 3.94Å; I102-E104 VanDerWaalsContact CG2-OE2 3.24Å; I102-E104 WeakPolarHBondContact CG2-OE2 3.23Å
103	K	28.6	Very low	34.5	Very low	201 Å²	201	132.6 Å²	132.6	87%	0.874	67%	0.672	S	S	*	*			trans	-168.3	108.4	140.3	-101.5	169.1	-178	-169.6	0	104.8
104	E	31.6	Very low	35.8	Very low	113 Å²	113	132.1 Å²	132.1	53%	0.528	67%	0.67	S	S	.	*				45.7	104.8	52.4	-67.2	177.3	162.7	0	0	110.4	I102	I102-E104 HydrophobicContact CG2-CB 4.14Å; I102-E104 HydrophobicContact CG2-CG 3.94Å; I102-E104 VanDerWaalsContact CG2-OE2 3.24Å; I102-E104 WeakPolarHBondContact CG2-OE2 3.23Å
105	W	29.3	Very low	37.5	Very low	233 Å²	233	125.9 Å²	125.9	88%	0.883	65%	0.645	S	S	*	*				53.1	76.9	61.4	-66.2	49.5	0	0	0	112.4
106	M	30.7	Very low	38.9	Very low	170 Å²	170	124.9 Å²	124.9	84%	0.837	64%	0.636	S	S	*	*				160.5	147.3	116.6	-85.4	174.3	173.8	0	0	112
107	P	30.2	Very low	40.2	Very low	109 Å²	109	123.9 Å²	123.9	71%	0.708	62%	0.616	S	S	*	*			trans	-101.3	158.6	-178.4	38.8	-34.7	0	0	0	114.5
108	N	34.9	Very low	41.5	Very low	150 Å²	150	119.1 Å²	119.1	80%	0.802	59%	0.593	S	S	*	*			trans	41.3	119.7	147.6	-55	-2.6	0	0	0	120.5
109	L	34.2	Very low	42.9	Very low	177 Å²	177	110.6 Å²	110.6	93%	0.927	56%	0.561	S	S	*	*			trans	-144.1	160.1	147.3	-135.7	73.4	0	0	0	110.1
110	I	39.9	Very low	44.1	Very low	161 Å²	161	112.2 Å²	112.2	83%	0.826	57%	0.565	S	S	*	*			trans	-124.5	142.3	-159.6	-64.6	170.4	0	0	0	112.1
111	H	37.5	Very low	45.1	Very low	122 Å²	122	105.9 Å²	105.9	57%	0.565	54%	0.541	S	S	*	.			trans	-87	168	176.4	-69.2	112.4	0	0	0	113.4	I88	I88-H111 PolarHBondContact O-CE1 3.47Å
112	S	44.5	Very low	46	Very low	103 Å²	103	107.4 Å²	107.4	72%	0.72	55%	0.547	S	S	*	.			trans	-121.9	136	-168	109	0	0	0	0	114.4	I114	S112-I114 PolarHBondContact O-N 2.86Å
113	T	54.1	Low	47	Very low	75 Å²	75	109.5 Å²	109.5	46%	0.46	57%	0.565	S	S	.	*	S	Bend	trans	-86.2	44.7	-163.5	71.2	0	0	0	0	115.6	T224 T225	T113-T224 PolarHBondContact OG1-OG1 3.19Å; T113-T225 HydrophobicContact CG2-CG2 3.88Å
114	I	62	Low	47.9	Very low	95 Å²	95	108.3 Å²	108.3	49%	0.487	57%	0.567	S	S	.	*			trans	-137.1	115.3	171	-44.7	178	0	0	0	108.5	S112 E116	S112-I114 PolarHBondContact O-N 2.86Å; I114-E116 HydrophobicContact CB-CG 3.91Å; I114-E116 HydrophobicContact CG2-CG 3.42Å; I114-E116 VanDerWaalsContact CG2-CG 3.42Å; I114-E116 PolarHBondContact O-N 2.85Å
115	C	64.8	Low	48.4	Very low	21 Å²	21	109.6 Å²	109.6	14%	0.142	58%	0.578	C	S	.	*			trans	-75.3	80.2	178.1	-162.9	0	0	0	0	110.3	R82 C86 L141	R82-C115 HydrophobicContact CG-CB 4.18Å; C86-C115 HydrophobicContact CB-CB 3.92Å; C86-C115 WeakPolarHBondContact CB-SG 3.47Å; C86-C115 WeakPolarHBondContact SG-CA 3.01Å; C86-C115 WeakPolarHBondContact SG-CB 3.33Å; C86-C115 CovalentContact SG-SG 2.05Å; C86-C115 PolarHBondContact SG-SG 3.05Å; C115-L141 PolarHBondContact O-N 3.1Å
116	E	67.2	Low	48.8	Very low	28 Å²	28	104 Å²	104	13%	0.131	57%	0.57	C	S	.	*			trans	-101.6	97.7	-178.9	-67.8	-149.8	117.7	0	0	109.5	R37 I114 Y118 R139	R37-E116 IonicContact CZ-OE1 2.63Å; R37-E116 IonicContact NE-OE1 3.89Å; R37-E116 PolarHBondContact NE-OE1 3.2Å; R37-E116 IonicContact NH2-OE1 2.89Å; R37-E116 PolarHBondContact NH2-OE1 2.97Å; R37-E116 IonicContact NH2-OE2 3.65Å; R37-E116 PolarHBondContact NH2-OE2 3.08Å; I114-E116 HydrophobicContact CB-CG 3.91Å; I114-E116 HydrophobicContact CG2-CG 3.42Å; I114-E116 VanDerWaalsContact CG2-CG 3.42Å; I114-E116 PolarHBondContact O-N 2.85Å; E116-Y118 HydrophobicContact CB-CD2 4.33Å; E116-Y118 HydrophobicContact CB-CE2 3.67Å; E116-Y118 WeakPolarHBondContact O-CD2 3.4Å; E116-Y118 VanDerWaalsContact O-CE2 3.26Å; E116-Y118 WeakPolarHBondContact O-CE2 3.4Å; E116-Y118 PolarHBondContact O-N 3.09Å; E116-Y118 PolarHBondContact OE2-OH 3.06Å; E116-R139 HydrophobicContact CB-CB 4.29Å; E116-R139 HydrophobicContact CG-CB 3.85Å; E116-R139 HydrophobicContact CG-CG 4.41Å; E116-R139 VanDerWaalsContact OE1-CB 3.27Å; E116-R139 WeakPolarHBondContact OE1-CB 3.2Å; E116-R139 VanDerWaalsContact OE1-CD 3.25Å; E116-R139 WeakPolarHBondContact OE1-CD 3.45Å; E116-R139 WeakPolarHBondContact OE1-CG 3.3Å; E116-R139 IonicContact OE1-CZ 3.94Å; E116-R139 IonicContact OE1-NE 3.51Å; E116-R139 IonicContact OE1-NH1 2.64Å; E116-R139 PolarHBondContact OE1-NH1 2.93Å; E116-R139 IonicContact OE2-CZ 2.7Å; E116-R139 IonicContact OE2-NH1 3.46Å; E116-R139 PolarHBondContact OE2-NH1 3.16Å
117	L	64.9	Low	49.3	Very low	42 Å²	42	102.6 Å²	102.6	22%	0.22	57%	0.571	C	S	.	*			trans	-69.2	127.2	174.4	-65.2	172.2	0	0	0	110.8	L64 F65 L80 L85	L64-L117 HydrophobicContact CD1-CD1 4.2Å; L64-L117 HydrophobicContact CD1-CD2 3.89Å; F65-L117 HydrophobicContact CE2-CB 4.19Å; F65-L117 HydrophobicContact CE2-CD1 3.84Å; F65-L117 HydrophobicContact CZ-CD1 3.67Å; L80-L117 HydrophobicContact CD2-CD1 4.38Å; L85-L117 HydrophobicContact CB-CD2 4.28Å; L85-L117 HydrophobicContact CD1-CD1 4.25Å; L85-L117 HydrophobicContact CD1-CD2 4.38Å
118	Y	61.6	Low	49.2	Very low	110 Å²	110	105 Å²	105	43%	0.431	58%	0.577	S	S	.	*			trans	-113.1	127.6	-178.7	-73.5	-94.1	0	0	0	110.9	T35 E116 R139	T35-Y118 VanDerWaalsContact CB-CE1 3.47Å; T35-Y118 HydrophobicContact CG2-CD1 3.87Å; T35-Y118 HydrophobicContact CG2-CE1 4.1Å; T35-Y118 WeakPolarHBondContact OG1-CE1 3.38Å; E116-Y118 HydrophobicContact CB-CD2 4.33Å; E116-Y118 HydrophobicContact CB-CE2 3.67Å; E116-Y118 WeakPolarHBondContact O-CD2 3.4Å; E116-Y118 VanDerWaalsContact O-CE2 3.26Å; E116-Y118 WeakPolarHBondContact O-CE2 3.4Å; E116-Y118 PolarHBondContact O-N 3.09Å; E116-Y118 PolarHBondContact OE2-OH 3.06Å; Y118-R139 PolarHBondContact OH-NH1 3.04Å
119	F	61.5	Low	49.2	Very low	60 Å²	60	107.9 Å²	107.9	26%	0.263	58%	0.583	S	S	.	*			trans	-134.8	149.1	162.5	62	-85.3	0	0	0	109.6	L53 F65 I74 V121	L53-F119 HydrophobicContact CD1-CE2 4.4Å; F65-F119 HydrophobicContact CD2-CD1 4.21Å; F65-F119 HydrophobicContact CD2-CE1 4.26Å; I74-F119 HydrophobicContact CD1-CZ 4.07Å; F119-V121 HydrophobicContact CD2-CG2 4.03Å; F119-V121 HydrophobicContact CE2-CG2 3.92Å
120	S	53.5	Low	48.9	Very low	80 Å²	80	103.3 Å²	103.3	56%	0.559	57%	0.565	S	S	*	*			trans	-110.7	106.6	-174.4	52.1	0	0	0	0	111.5
121	V	55	Low	48.4	Very low	51 Å²	51	101.8 Å²	101.8	31%	0.309	56%	0.559	S	S	.	*			trans	-84.1	117.1	168.1	-172.7	0	0	0	0	108.4	L53 F119	L53-V121 HydrophobicContact CD1-CG2 4.48Å; F119-V121 HydrophobicContact CD2-CG2 4.03Å; F119-V121 HydrophobicContact CE2-CG2 3.92Å
122	N	50.2	Low	47.9	Very low	104 Å²	104	102.5 Å²	102.5	56%	0.556	57%	0.567	S	S	*	*			trans	-76.5	131	-173.1	-91.4	-46.8	0	0	0	111.8	D60	D60-N122 PolarHBondContact OD2-ND2 2.89Å
123	C	51.4	Low	47.2	Very low	94 Å²	94	102.2 Å²	102.2	64%	0.635	57%	0.565	S	S	*	*			trans	-135.5	129.7	-174.3	-71.3	0	0	0	0	112.2
124	L	46.8	Very low	45.9	Very low	177 Å²	177	104.5 Å²	104.5	93%	0.927	57%	0.574	S	S	*	*			trans	-88.1	125.8	-177.6	-75	163.4	0	0	0	113
125	N	41.2	Very low	44.3	Very low	139 Å²	139	110 Å²	110	74%	0.743	59%	0.589	S	S	*	*			trans	34.7	127.6	140.1	179.7	27.5	0	0	0	120.8
126	T	37.7	Very low	42.7	Very low	116 Å²	116	115.6 Å²	115.6	71%	0.712	62%	0.617	S	S	*	*			cis	-162.7	161.4	-30.2	47.3	0	0	0	0	106.4
127	T	42	Very low	41.1	Very low	140 Å²	140	124.6 Å²	124.6	86%	0.859	65%	0.65	S	S	*	*			trans	-172.7	158.8	134	13.9	0	0	0	0	110.4
128	L	28.8	Very low	39.7	Very low	160 Å²	160	127.6 Å²	127.6	84%	0.838	67%	0.666	S	S	*	*			trans	-75.8	145.2	172.9	-55.9	85.9	0	0	0	109.8
129	F	33.7	Very low	38.9	Very low	211 Å²	211	122.7 Å²	122.7	93%	0.925	65%	0.647	S	S	*	*				-156.8	165.1	126.6	-120.8	-81.2	0	0	0	113.4
130	S	28.6	Very low	38.6	Very low	80 Å²	80	122.7 Å²	122.7	56%	0.559	65%	0.649	S	S	*	*			trans	-75.1	153.3	-165	-173.3	0	0	0	0	116
131	N	28.7	Very low	39.5	Very low	130 Å²	130	119.4 Å²	119.4	70%	0.695	63%	0.625	S	S	*	*			trans	69.6	128.6	142.3	-79.1	3.8	0	0	0	122.7
132	N	28.3	Very low	40.3	Very low	137 Å²	137	122.1 Å²	122.1	73%	0.733	63%	0.63	S	S	*	*			trans	84.3	134.4	131	-71.1	-11.1	0	0	0	121.5
133	S	28.8	Very low	41.7	Very low	97 Å²	97	117.8 Å²	117.8	68%	0.678	61%	0.607	S	S	*	*			trans	91.5	134.4	145.7	89.4	0	0	0	0	118.2
134	N	27.9	Very low	43	Very low	122 Å²	122	116.3 Å²	116.3	65%	0.652	60%	0.595	S	S	*	*			trans	82	121.3	138.3	-71.5	-38.3	0	0	0	120.8
135	R	28.4	Very low	44.6	Very low	212 Å²	212	109.9 Å²	109.9	80%	0.8	56%	0.562	S	S	*	*			trans	84.2	119.7	142	-63.8	158.5	-175	179	-2.1	117.6
136	N	29.8	Very low	46.5	Very low	138 Å²	138	107.1 Å²	107.1	74%	0.738	55%	0.547	S	S	*	.			trans	28	117.1	130.3	-46.7	16.7	0	0	0	117
137	R	34	Very low	48.5	Very low	217 Å²	217	104 Å²	104	82%	0.819	53%	0.526	S	S	*	.			trans	170.1	98.3	132.2	-86.6	141.6	-150.8	-159.4	2.2	109.3
138	N	35.8	Very low	50.3	Low	104 Å²	104	98 Å²	98	56%	0.556	49%	0.492	S	S	*	.			trans	-66.9	138.8	171.8	-53.7	10.5	0	0	0	108.9	R39 I140	R39-N138 VanDerWaalsContact CG-O 3.23Å; R39-N138 WeakPolarHBondContact CG-O 3.4Å; R39-N138 PolarHBondContact NE-O 3.21Å; N138-I140 HydrophobicContact CB-CD1 3.99Å; N138-I140 HydrophobicContact CB-CG1 3.95Å; N138-I140 PolarHBondContact O-N 2.9Å
139	R	44.6	Very low	53.1	Low	8 Å²	8	90.8 Å²	90.8	3%	0.03	45%	0.454	C	S	.	.			trans	-71.5	127.2	162.6	-54.3	170.5	-169.7	104.2	-11.7	107.1	V36 R37 F38 E116 Y118	V36-R139 PolarHBondContact O-NE 2.91Å; V36-R139 PolarHBondContact O-NH2 2.89Å; R37-R139 HydrophobicContact CB-CG 3.39Å; R37-R139 HydrophobicContact CG-CG 3.82Å; R37-R139 VanDerWaalsContact NE-NH1 3.18Å; F38-R139 WeakPolarHBondContact O-CA 3.38Å; F38-R139 WeakPolarHBondContact O-CB 3.18Å; E116-R139 HydrophobicContact CB-CB 4.29Å; E116-R139 HydrophobicContact CG-CB 3.85Å; E116-R139 HydrophobicContact CG-CG 4.41Å; E116-R139 VanDerWaalsContact OE1-CB 3.27Å; E116-R139 WeakPolarHBondContact OE1-CB 3.2Å; E116-R139 VanDerWaalsContact OE1-CD 3.25Å; E116-R139 WeakPolarHBondContact OE1-CD 3.45Å; E116-R139 WeakPolarHBondContact OE1-CG 3.3Å; E116-R139 IonicContact OE1-CZ 3.94Å; E116-R139 IonicContact OE1-NE 3.51Å; E116-R139 IonicContact OE1-NH1 2.64Å; E116-R139 PolarHBondContact OE1-NH1 2.93Å; E116-R139 IonicContact OE2-CZ 2.7Å; E116-R139 IonicContact OE2-NH1 3.46Å; E116-R139 PolarHBondContact OE2-NH1 3.16Å; Y118-R139 PolarHBondContact OH-NH1 3.04Å
140	I	56.2	Low	55.5	Low	60 Å²	60	86.8 Å²	86.8	31%	0.308	44%	0.437	S	S	.	.			trans	-149.1	126.9	174.6	-57.7	-178.2	0	0	0	106.3	L40 N138 R142	L40-I140 PolarHBondContact N-O 3.38Å; L40-I140 VanDerWaalsContact N-O 3.12Å; N138-I140 HydrophobicContact CB-CD1 3.99Å; N138-I140 HydrophobicContact CB-CG1 3.95Å; N138-I140 PolarHBondContact O-N 2.9Å; I140-R142 HydrophobicContact CG2-CG 4.36Å
141	L	71.3	Confident	58.4	Low	10 Å²	10	83.3 Å²	83.3	5%	0.052	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.5	150.3	178.4	62.6	0	0	0	106.5	L40 D41 E42 L80 R82 L85 C115	L40-L141 HydrophobicContact CB-CD1 3.87Å; L40-L141 CarbonylContact O-C 3.57Å; L40-L141 WeakPolarHBondContact O-CA 3.15Å; D41-L141 WeakPolarHBondContact O-CD1 3.33Å; E42-L141 HydrophobicContact CB-CD1 4.22Å; E42-L141 HydrophobicContact CB-CG 4.34Å; L80-L141 HydrophobicContact CB-CD1 4.3Å; L80-L141 HydrophobicContact CB-CD2 4.46Å; L80-L141 HydrophobicContact CD1-CD1 4.41Å; R82-L141 HydrophobicContact CB-CD2 3.87Å; R82-L141 HydrophobicContact CB-CG 4.25Å; R82-L141 HydrophobicContact CG-CB 4.49Å; R82-L141 HydrophobicContact CG-CD2 4.01Å; R82-L141 HydrophobicContact CG-CG 4.13Å; L85-L141 HydrophobicContact CD1-CD2 4.29Å; C115-L141 PolarHBondContact O-N 3.1Å
142	R	72.4	Confident	60.8	Low	108 Å²	108	81.1 Å²	81.1	41%	0.408	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	166.1	-173.2	-120.3	175.7	166	-145	-24.2	112.3	L40 D41 E42 I140 E185	L40-R142 WeakPolarHBondContact O-CB 3.33Å; L40-R142 PolarHBondContact O-N 2.8Å; D41-R142 HydrophobicContact CB-CB 4.08Å; D41-R142 VanDerWaalsContact OD1-CB 3.3Å; D41-R142 WeakPolarHBondContact OD1-CB 3.33Å; D41-R142 WeakPolarHBondContact OD1-CD 3.47Å; D41-R142 IonicContact OD1-NH1 2.7Å; E42-R142 WeakPolarHBondContact CB-O 3.43Å; E42-R142 WeakPolarHBondContact CG-O 3.31Å; E42-R142 PolarHBondContact N-O 3.42Å; I140-R142 HydrophobicContact CG2-CG 4.36Å; R142-E185 IonicContact CZ-OE1 2.76Å; R142-E185 VanDerWaalsContact CZ-OE1 3.26Å; R142-E185 IonicContact CZ-OE2 3.99Å; R142-E185 IonicContact NE-OE1 2.67Å; R142-E185 PolarHBondContact NE-OE1 3.32Å; R142-E185 IonicContact NE-OE2 3.41Å; R142-E185 PolarHBondContact NE-OE2 2.87Å; R142-E185 VanDerWaalsContact NH2-CD 3.32Å; R142-E185 IonicContact NH2-OE1 3.58Å; R142-E185 PolarHBondContact NH2-OE1 2.64Å; R142-E185 IonicContact NH2-OE2 3.34Å; R142-E185 PolarHBondContact NH2-OE2 2.7Å
143	D	78.5	Confident	63.5	Low	13 Å²	13	80 Å²	80	7%	0.07	40%	0.4	C	S	.	.			trans	-117	152.2	-160.8	178.6	104.3	0	0	0	113.3	E42 R82 D181 D182 N187	E42-D143 WeakPolarHBondContact OE1-CA 3.21Å; R82-D143 IonicContact CZ-OD1 2.74Å; R82-D143 IonicContact NE-OD1 2.73Å; R82-D143 PolarHBondContact NE-OD1 3.04Å; R82-D143 VanDerWaalsContact NE-OD1 3.15Å; R82-D143 IonicContact NH1-OD1 2.9Å; R82-D143 PolarHBondContact NH1-OD1 2.91Å; R82-D143 IonicContact NH2-OD1 3.02Å; R82-D143 PolarHBondContact NH2-OD1 3.37Å; D143-D181 WeakPolarHBondContact OD1-CA 3.14Å; D143-D182 HydrophobicContact CB-CB 3.41Å; D143-D182 VanDerWaalsContact CB-CB 3.41Å; D143-D182 WeakPolarHBondContact OD1-CB 3.27Å; D143-D182 PolarHBondContact OD1-N 2.99Å; D143-D182 WeakPolarHBondContact OD2-CB 3.41Å; D143-D182 PolarHBondContact OD2-N 3.23Å; D143-N187 PolarHBondContact OD2-ND2 2.82Å
144	T	79.4	Confident	66.3	Low	63 Å²	63	77.4 Å²	77.4	39%	0.387	38%	0.381	S	S	.	.			trans	-128.8	138.7	173.8	-53.5	0	0	0	0	110.1	E42 D146	E42-T144 PolarHBondContact OE1-N 3.06Å; T144-D146 PolarHBondContact O-N 2.98Å
145	N	79.9	Confident	69.2	Low	43 Å²	43	75.5 Å²	75.5	23%	0.23	37%	0.371	C	S	.	.			trans	-68.7	96.9	169.1	-177.8	-89.8	0	0	0	109.3	D181 N187 D254 H261	N145-D181 WeakPolarHBondContact CA-OD2 3.33Å; N145-N187 HydrophobicContact CB-CB 3.77Å; N145-N187 PolarHBondContact N-ND2 2.72Å; N145-N187 PolarHBondContact ND2-O 2.8Å; N145-N187 VanDerWaalsContact ND2-O 3.14Å; N145-D254 PolarHBondContact ND2-OD2 2.8Å; N145-H261 PolarHBondContact OD1-CE1 3.18Å; N145-H261 PolarHBondContact OD1-ND1 3.28Å
146	D	82.2	Confident	72.1	Confident	81 Å²	81	71 Å²	71	43%	0.433	36%	0.359	S	S	.	.			trans	-130.7	-1	175.6	101.7	-30.2	0	0	0	113.8	T144 D181	T144-D146 PolarHBondContact O-N 2.98Å; D146-D181 PolarHBondContact N-OD2 3.2Å; D146-D181 VanDerWaalsContact N-OD2 3.1Å
147	N	79.6	Confident	75	Confident	50 Å²	50	65.9 Å²	65.9	27%	0.267	33%	0.331	S	S	.	.			trans	-123.1	98.9	-179.8	-60	-82.3	0	0	0	114.4	C149 P180 D181	N147-C149 PolarHBondContact O-N 2.9Å; N147-P180 HydrophobicContact CB-CG 3.25Å; N147-D181 VanDerWaalsContact CB-OD1 3.28Å; N147-D181 WeakPolarHBondContact CB-OD1 3.25Å; N147-D181 PolarHBondContact N-OD2 2.8Å; N147-D181 PolarHBondContact ND2-OD1 2.83Å
148	G	79.6	Confident	77.7	Confident	14 Å²	14	61.1 Å²	61.1	14%	0.144	32%	0.32	C	S	.	.			trans	-52.8	133.5	168.4	0	0	0	0	0	113.8	K150 D260	G148-K150 PolarHBondContact O-NZ 3.49Å; G148-D260 WeakPolarHBondContact CA-O 3.16Å
149	C	86.6	Confident	80.3	Confident	8 Å²	8	56.5 Å²	56.5	5%	0.054	30%	0.296	C	S	.	.			trans	-57.1	156.2	-172.3	74.2	0	0	0	0	114.2	N147 D179 V189 C263	N147-C149 PolarHBondContact O-N 2.9Å; C149-D179 HydrophobicContact CB-CB 3.83Å; C149-V189 HydrophobicContact CB-CG2 3.47Å; C149-V189 VanDerWaalsContact CB-CG2 3.47Å; C149-C263 VanDerWaalsContact C-SG 3.56Å; C149-C263 HydrophobicContact CB-CB 4.19Å; C149-C263 WeakPolarHBondContact CB-SG 3.42Å; C149-C263 VanDerWaalsContact O-CB 3.24Å; C149-C263 WeakPolarHBondContact O-CB 3.14Å; C149-C263 WeakPolarHBondContact SG-CB 3.4Å; C149-C263 PolarHBondContact SG-N 3.32Å; C149-C263 CovalentContact SG-SG 2.05Å; C149-C263 PolarHBondContact SG-SG 2.9Å
150	K	85.8	Confident	82.4	Confident	128 Å²	128	63.5 Å²	63.5	56%	0.557	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147	135.4	176.7	-60.4	179.1	-174.3	66.4	0	110	G148 L152 Y178	G148-K150 PolarHBondContact O-NZ 3.49Å; K150-L152 PolarHBondContact O-N 2.92Å; K150-Y178 PolarHBondContact N-O 2.83Å; K150-Y178 WeakPolarHBondContact O-CA 3.39Å; K150-Y178 PolarHBondContact O-N 2.75Å
151	F	88.1	Confident	84	Confident	7 Å²	7	60.7 Å²	60.7	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	125.6	172.4	-78.2	-87.3	0	0	0	110.6	S154 N175 P177 L230 I250 A252 C263 Y264 L265	F151-S154 WeakPolarHBondContact CB-O 3.48Å; F151-S154 CarbonylContact O-C 3.53Å; F151-S154 WeakPolarHBondContact O-CA 3.49Å; F151-S154 PolarHBondContact O-N 3.46Å; F151-N175 HydrophobicContact CB-CB 4.44Å; F151-N175 HydrophobicContact CD1-CB 4.35Å; F151-N175 VanDerWaalsContact CD1-O 3.26Å; F151-N175 WeakPolarHBondContact CD1-O 3.25Å; F151-P177 HydrophobicContact CD1-CB 4.3Å; F151-P177 HydrophobicContact CE1-CB 4.02Å; F151-P177 HydrophobicContact CE1-CG 4.22Å; F151-P177 HydrophobicContact CZ-CB 4.17Å; F151-L230 HydrophobicContact CE1-CD1 3.97Å; F151-I250 HydrophobicContact CZ-CG2 4.27Å; F151-A252 HydrophobicContact CE2-CB 4.06Å; F151-A252 HydrophobicContact CZ-CB 3.82Å; F151-C263 HydrophobicContact CD2-CB 4Å; F151-C263 HydrophobicContact CE2-CB 4.17Å; F151-Y264 VanDerWaalsContact CD2-C 3.46Å; F151-Y264 WeakPolarHBondContact CD2-O 3.19Å; F151-L265 HydrophobicContact CB-CB 4.42Å; F151-L265 HydrophobicContact CB-CD1 4.22Å; F151-L265 HydrophobicContact CD1-CB 3.79Å; F151-L265 HydrophobicContact CD1-CD1 4.42Å; F151-L265 HydrophobicContact CD1-CD2 3.89Å; F151-L265 HydrophobicContact CD1-CG 4.24Å; F151-L265 HydrophobicContact CD2-CB 3.71Å; F151-L265 HydrophobicContact CE1-CB 3.84Å; F151-L265 HydrophobicContact CE1-CD2 3.97Å; F151-L265 HydrophobicContact CE1-CG 4.49Å; F151-L265 HydrophobicContact CE2-CB 3.77Å; F151-L265 HydrophobicContact CG-CB 3.71Å; F151-L265 HydrophobicContact CG-CD1 4.32Å; F151-L265 HydrophobicContact CG-CG 4.4Å; F151-L265 HydrophobicContact CZ-CB 3.83Å
152	L	80.4	Confident	84.8	Confident	83 Å²	83	65.7 Å²	65.7	44%	0.435	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.7	174.6	-72.5	-175.9	0	0	0	111	K150 N175 T176 Y178	K150-L152 PolarHBondContact O-N 2.92Å; L152-N175 WeakPolarHBondContact O-CB 3.36Å; L152-T176 PolarHBondContact N-O 3.37Å; L152-T176 PolarHBondContact O-N 2.86Å; L152-Y178 VanDerWaalsContact CD1-CB 3.49Å; L152-Y178 HydrophobicContact CD1-CD1 3.67Å; L152-Y178 HydrophobicContact CD1-CD2 4.1Å; L152-Y178 HydrophobicContact CD1-CE1 4.41Å; L152-Y178 HydrophobicContact CD1-CG 3.48Å; L152-Y178 VanDerWaalsContact CD1-CG 3.48Å; L152-Y178 HydrophobicContact CG-CD1 4.39Å; L152-Y178 HydrophobicContact CG-CG 4.19Å
153	P	83.8	Confident	85.6	Confident	115 Å²	115	60.6 Å²	60.6	75%	0.747	31%	0.306	S	S	*	.	S	Bend	cis	-80.4	-4.5	2.1	33.1	-37.3	0	0	0	115.4
154	S	87.1	Confident	85.9	Confident	41 Å²	41	64.1 Å²	64.1	29%	0.287	33%	0.325	S	S	.	.			trans	-156	156.9	178.2	168.8	0	0	0	0	112.6	F151 Q156 N175 L265	F151-S154 WeakPolarHBondContact CB-O 3.48Å; F151-S154 CarbonylContact O-C 3.53Å; F151-S154 WeakPolarHBondContact O-CA 3.49Å; F151-S154 PolarHBondContact O-N 3.46Å; S154-Q156 PolarHBondContact O-N 2.85Å; S154-Q156 PolarHBondContact OG-N 3.17Å; S154-Q156 PolarHBondContact OG-O 2.87Å; S154-N175 PolarHBondContact O-ND2 3.39Å; S154-L265 WeakPolarHBondContact O-CD1 3.13Å
155	D	88.7	Confident	86.2	Confident	82 Å²	82	61.5 Å²	61.5	44%	0.439	31%	0.31	S	S	.	.	S	Bend	trans	-58.6	-6.1	160.6	63.9	-51.9	0	0	0	114.8	L265 N266	D155-L265 CarbonylContact O-C 3.59Å; D155-L265 WeakPolarHBondContact O-CA 3.22Å; D155-N266 PolarHBondContact O-N 2.76Å
156	Q	89.6	Confident	86.5	Confident	119 Å²	119	62.7 Å²	62.7	56%	0.556	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.1	180	-57.8	178.8	25.9	0	0	110.4	S154 N175 N266	S154-Q156 PolarHBondContact O-N 2.85Å; S154-Q156 PolarHBondContact OG-N 3.17Å; S154-Q156 PolarHBondContact OG-O 2.87Å; Q156-N175 PolarHBondContact O-ND2 3.26Å; Q156-N175 VanDerWaalsContact O-ND2 3.14Å; Q156-N266 WeakPolarHBondContact CA-O 3.17Å; Q156-N266 HydrophobicContact CG-CB 4.42Å
157	Q	91.2	Very high	86.7	Confident	30 Å²	30	61.2 Å²	61.2	14%	0.14	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	128.9	171.6	-170.4	177.3	5.2	0	0	110.8	I159 T173 N175 L265 N266 V267 T268	Q157-I159 HydrophobicContact CG-CG1 4.19Å; Q157-T173 PolarHBondContact NE2-O 3.29Å; Q157-N175 PolarHBondContact OE1-OD1 2.72Å; Q157-L265 HydrophobicContact CB-CD1 4.03Å; Q157-N266 PolarHBondContact N-O 2.73Å; Q157-V267 WeakPolarHBondContact O-CA 3.49Å; Q157-T268 PolarHBondContact O-N 3.15Å
158	I	90.7	Very high	87	Confident	117 Å²	117	63.6 Å²	63.6	60%	0.6	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	118.3	169.2	-59.4	177.5	0	0	0	107.3	T268 L270	I158-T268 CarbonylContact C-O 3.56Å; I158-T268 WeakPolarHBondContact CA-O 3.48Å; I158-L270 HydrophobicContact CG2-CD1 3.55Å; I158-L270 HydrophobicContact CG2-CG 3.82Å
159	I	90.1	Very high	87.3	Confident	7 Å²	7	70.4 Å²	70.4	4%	0.036	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	138.1	172.8	-50.7	178.9	0	0	0	107.4	Q157 I161 F172 L174 L232 V267 T268 V269 L270	Q157-I159 HydrophobicContact CG-CG1 4.19Å; I159-I161 HydrophobicContact CG2-CD1 3.97Å; I159-I161 HydrophobicContact CG2-CG1 3.62Å; I159-F172 HydrophobicContact CD1-CB 4.24Å; I159-F172 HydrophobicContact CG2-CB 3.94Å; I159-F172 HydrophobicContact CG2-CD1 3.47Å; I159-F172 VanDerWaalsContact CG2-CD1 3.47Å; I159-F172 HydrophobicContact CG2-CD2 3.98Å; I159-F172 HydrophobicContact CG2-CE1 3.96Å; I159-F172 HydrophobicContact CG2-CE2 4.42Å; I159-F172 HydrophobicContact CG2-CG 3.49Å; I159-F172 VanDerWaalsContact CG2-CG 3.49Å; I159-F172 HydrophobicContact CG2-CZ 4.42Å; I159-L174 HydrophobicContact CD1-CD2 3.81Å; I159-L232 HydrophobicContact CD1-CD2 3.77Å; I159-V267 HydrophobicContact CD1-CG1 3.57Å; I159-V267 HydrophobicContact CG1-CG1 4.04Å; I159-T268 PolarHBondContact N-O 3.33Å; I159-V269 HydrophobicContact CB-CG2 4.28Å; I159-V269 HydrophobicContact CD1-CG2 4.42Å; I159-L270 PolarHBondContact O-N 3.47Å
160	R	90	Very high	87.1	Confident	155 Å²	155	71.1 Å²	71.1	59%	0.585	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	119.8	173.1	-82.1	165	173.1	-100.3	-2.4	108	F172 L270 E272	R160-F172 WeakPolarHBondContact O-CE1 3.45Å; R160-L270 WeakPolarHBondContact CA-O 3.43Å; R160-E272 HydrophobicContact CB-CG 3.95Å; R160-E272 WeakPolarHBondContact CD-OE1 3.24Å; R160-E272 HydrophobicContact CG-CG 4.12Å; R160-E272 WeakPolarHBondContact CG-OE1 3.31Å; R160-E272 IonicContact CZ-OE1 3.54Å; R160-E272 IonicContact NE-OE1 3.2Å; R160-E272 IonicContact NH1-OE1 3.13Å; R160-E272 PolarHBondContact NH1-OE1 2.85Å
161	I	89.9	Confident	87.3	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	112.3	-176	-46.3	-174.4	0	0	0	108.4	I159 A165 F172 F212 L234 L238 V269 L270 V271 E272	I159-I161 HydrophobicContact CG2-CD1 3.97Å; I159-I161 HydrophobicContact CG2-CG1 3.62Å; I161-A165 HydrophobicContact CG2-CB 3.87Å; I161-F172 HydrophobicContact CB-CE2 4.08Å; I161-F172 HydrophobicContact CB-CZ 4.02Å; I161-F172 HydrophobicContact CD1-CD2 3.81Å; I161-F172 HydrophobicContact CD1-CE2 3.52Å; I161-F172 HydrophobicContact CD1-CZ 4.21Å; I161-F172 HydrophobicContact CG1-CD2 4.05Å; I161-F172 HydrophobicContact CG1-CE1 4.28Å; I161-F172 HydrophobicContact CG1-CE2 3.45Å; I161-F172 VanDerWaalsContact CG1-CE2 3.45Å; I161-F172 HydrophobicContact CG1-CZ 3.6Å; I161-F172 HydrophobicContact CG2-CE2 3.69Å; I161-F172 HydrophobicContact CG2-CZ 3.81Å; I161-F212 HydrophobicContact CD1-CE1 3.62Å; I161-F212 HydrophobicContact CD1-CZ 4.21Å; I161-L234 HydrophobicContact CG2-CD2 4.49Å; I161-L238 HydrophobicContact CB-CD1 3.83Å; I161-L238 HydrophobicContact CD1-CD1 4.41Å; I161-L238 HydrophobicContact CG2-CD1 3.51Å; I161-V269 HydrophobicContact CB-CG1 4.38Å; I161-V269 HydrophobicContact CD1-CB 4.42Å; I161-V269 HydrophobicContact CD1-CG1 3.6Å; I161-V269 HydrophobicContact CD1-CG2 3.93Å; I161-V269 HydrophobicContact CG1-CG1 3.87Å; I161-L270 PolarHBondContact N-O 2.83Å; I161-V271 CarbonylContact O-C 3.58Å; I161-V271 WeakPolarHBondContact O-CA 3.14Å; I161-E272 PolarHBondContact O-N 2.69Å
162	R	87.9	Confident	87.3	Confident	114 Å²	114	72.2 Å²	72.2	43%	0.43	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	139.1	168.6	-70.2	177.5	58.9	78	-2	110.2	D164 A165 E272 C274	R162-D164 WeakPolarHBondContact CB-OD1 3.41Å; R162-D164 IonicContact CZ-OD1 3.22Å; R162-D164 IonicContact CZ-OD2 3.79Å; R162-D164 IonicContact NE-OD1 3.61Å; R162-D164 PolarHBondContact NE-OD1 3.16Å; R162-D164 IonicContact NE-OD2 2.98Å; R162-D164 PolarHBondContact NE-OD2 3.06Å; R162-D164 VanDerWaalsContact NH2-CG 3.34Å; R162-D164 IonicContact NH2-OD1 2.64Å; R162-D164 PolarHBondContact NH2-OD1 3.22Å; R162-D164 IonicContact NH2-OD2 3.89Å; R162-D164 PolarHBondContact NH2-OD2 3.1Å; R162-D164 PolarHBondContact O-N 3.05Å; R162-A165 WeakPolarHBondContact O-CB 2.99Å; R162-A165 PolarHBondContact O-N 2.93Å; R162-A165 VanDerWaalsContact O-N 3.08Å; R162-E272 WeakPolarHBondContact CA-O 3.08Å; R162-E272 HydrophobicContact CG-CB 4.29Å; R162-C274 PolarHBondContact NH1-SG 2.9Å; R162-C274 PolarHBondContact NH2-SG 3.27Å; R162-C274 VanDerWaalsContact NH2-SG 3.39Å
163	E	88.1	Confident	87.6	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.1	178.9	75	-159.3	107.9	0	0	114.1	A165 K237 L238 Y240 V271 E272 D273 C274	E163-A165 PolarHBondContact O-N 3.48Å; E163-K237 IonicContact OE2-NZ 2.77Å; E163-L238 HydrophobicContact CB-CB 4.15Å; E163-Y240 VanDerWaalsContact OE1-CB 3.29Å; E163-Y240 WeakPolarHBondContact OE1-CB 3.41Å; E163-Y240 WeakPolarHBondContact OE2-CB 3.12Å; E163-Y240 PolarHBondContact OE2-N 3.19Å; E163-V271 HydrophobicContact CB-CG1 3.89Å; E163-E272 PolarHBondContact N-O 3.09Å; E163-D273 WeakPolarHBondContact OE1-CA 3.47Å; E163-C274 HydrophobicContact CG-CB 3.87Å; E163-C274 PolarHBondContact OE1-N 3.37Å
164	D	85.6	Confident	87.9	Confident	87 Å²	87	67.7 Å²	67.7	47%	0.465	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	3.3	169.8	79.3	-10.9	0	0	0	114	R162	R162-D164 WeakPolarHBondContact CB-OD1 3.41Å; R162-D164 IonicContact CZ-OD1 3.22Å; R162-D164 IonicContact CZ-OD2 3.79Å; R162-D164 IonicContact NE-OD1 3.61Å; R162-D164 PolarHBondContact NE-OD1 3.16Å; R162-D164 IonicContact NE-OD2 2.98Å; R162-D164 PolarHBondContact NE-OD2 3.06Å; R162-D164 VanDerWaalsContact NH2-CG 3.34Å; R162-D164 IonicContact NH2-OD1 2.64Å; R162-D164 PolarHBondContact NH2-OD1 3.22Å; R162-D164 IonicContact NH2-OD2 3.89Å; R162-D164 PolarHBondContact NH2-OD2 3.1Å; R162-D164 PolarHBondContact O-N 3.05Å
165	A	85.1	Confident	88	Confident	9 Å²	9	66.7 Å²	66.7	7%	0.074	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-55.3	121.9	178.2	0	0	0	0	0	112	I161 R162 E163 V167 T170 L234	I161-A165 HydrophobicContact CG2-CB 3.87Å; R162-A165 WeakPolarHBondContact O-CB 2.99Å; R162-A165 PolarHBondContact O-N 2.93Å; R162-A165 VanDerWaalsContact O-N 3.08Å; E163-A165 PolarHBondContact O-N 3.48Å; A165-V167 PolarHBondContact O-N 2.86Å; A165-T170 HydrophobicContact CB-CG2 3.93Å; A165-T170 WeakPolarHBondContact CB-OG1 3.41Å; A165-L234 HydrophobicContact CB-CD2 3.64Å
166	P	86.8	Confident	87.8	Confident	68 Å²	68	65.4 Å²	65.4	44%	0.442	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-63.4	122.6	-177.9	24.3	-34.2	0	0	0	111.8	E169 T170	P166-E169 HydrophobicContact CB-CB 4.06Å; P166-E169 HydrophobicContact CB-CG 4.49Å; P166-E169 HydrophobicContact CG-CB 4.06Å; P166-E169 PolarHBondContact O-N 3.38Å; P166-T170 WeakPolarHBondContact CD-OG1 3.33Å; P166-T170 WeakPolarHBondContact CG-OG1 3.35Å; P166-T170 VanDerWaalsContact N-OG1 3.13Å; P166-T170 WeakPolarHBondContact O-CB 3.41Å; P166-T170 PolarHBondContact O-N 2.96Å; P166-T170 PolarHBondContact O-OG1 2.87Å
167	V	86.9	Confident	87.7	Confident	49 Å²	49	60.2 Å²	60.2	30%	0.297	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	135	-176.2	-169.4	0	0	0	0	110.7	A165 E169 I235 K237	A165-V167 PolarHBondContact O-N 2.86Å; V167-E169 PolarHBondContact O-N 2.77Å; V167-I235 WeakPolarHBondContact CG1-O 3.16Å; V167-K237 HydrophobicContact CG2-CB 4.49Å
168	N	85.6	Confident	87.3	Confident	101 Å²	101	63.8 Å²	63.8	54%	0.54	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	-4.1	-170	-46.4	-81.9	0	0	0	115.9	L234	N168-L234 WeakPolarHBondContact CA-O 3.34Å; N168-L234 PolarHBondContact N-O 3.43Å
169	E	84.4	Confident	87	Confident	157 Å²	157	58.7 Å²	58.7	73%	0.734	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-33	172.8	-60.8	-173.2	175.9	0	0	111.9	P166 V167 R171	P166-E169 HydrophobicContact CB-CB 4.06Å; P166-E169 HydrophobicContact CB-CG 4.49Å; P166-E169 HydrophobicContact CG-CB 4.06Å; P166-E169 PolarHBondContact O-N 3.38Å; V167-E169 PolarHBondContact O-N 2.77Å; E169-R171 PolarHBondContact O-N 2.89Å
170	T	84.3	Confident	86.4	Confident	22 Å²	22	59.5 Å²	59.5	14%	0.135	29%	0.29	C	S	.	.			trans	-77.3	124.2	-178.7	-49.4	0	0	0	0	111.3	A165 P166 F172 L234	A165-T170 HydrophobicContact CB-CG2 3.93Å; A165-T170 WeakPolarHBondContact CB-OG1 3.41Å; P166-T170 WeakPolarHBondContact CD-OG1 3.33Å; P166-T170 WeakPolarHBondContact CG-OG1 3.35Å; P166-T170 VanDerWaalsContact N-OG1 3.13Å; P166-T170 WeakPolarHBondContact O-CB 3.41Å; P166-T170 PolarHBondContact O-N 2.96Å; P166-T170 PolarHBondContact O-OG1 2.87Å; T170-F172 HydrophobicContact CG2-CD2 4.29Å; T170-F172 HydrophobicContact CG2-CE2 3.37Å; T170-F172 HydrophobicContact CG2-CZ 3.65Å; T170-L234 PolarHBondContact O-N 3.12Å
171	R	88.2	Confident	86	Confident	107 Å²	107	52.4 Å²	52.4	40%	0.404	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.9	179	-59.8	-168.7	174.8	-169.5	-3.1	111.5	E169 E231 L232 E233	E169-R171 PolarHBondContact O-N 2.89Å; R171-E231 WeakPolarHBondContact CD-OE2 3.43Å; R171-E231 IonicContact CZ-OE2 3.99Å; R171-E231 IonicContact NE-OE2 3.26Å; R171-E231 IonicContact NH1-OE2 2.86Å; R171-E231 PolarHBondContact NH1-OE2 2.05Å; R171-L232 VanDerWaalsContact CA-O 3.31Å; R171-L232 WeakPolarHBondContact CA-O 3.44Å; R171-E233 HydrophobicContact CG-CB 4.27Å; R171-E233 HydrophobicContact CG-CG 4.43Å; R171-E233 IonicContact CZ-OE1 2.77Å; R171-E233 VanDerWaalsContact CZ-OE1 3.3Å; R171-E233 IonicContact NE-OE1 3.47Å; R171-E233 PolarHBondContact NE-OE1 3.28Å; R171-E233 IonicContact NH2-OE1 3.4Å; R171-E233 PolarHBondContact NH2-OE1 3.34Å
172	F	88.3	Confident	85.3	Confident	51 Å²	51	53.9 Å²	53.9	22%	0.224	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.9	177.6	-64.5	-85.3	0	0	0	110.9	I159 R160 I161 T170 L174 E231 L232	I159-F172 HydrophobicContact CD1-CB 4.24Å; I159-F172 HydrophobicContact CG2-CB 3.94Å; I159-F172 HydrophobicContact CG2-CD1 3.47Å; I159-F172 VanDerWaalsContact CG2-CD1 3.47Å; I159-F172 HydrophobicContact CG2-CD2 3.98Å; I159-F172 HydrophobicContact CG2-CE1 3.96Å; I159-F172 HydrophobicContact CG2-CE2 4.42Å; I159-F172 HydrophobicContact CG2-CG 3.49Å; I159-F172 VanDerWaalsContact CG2-CG 3.49Å; I159-F172 HydrophobicContact CG2-CZ 4.42Å; R160-F172 WeakPolarHBondContact O-CE1 3.45Å; I161-F172 HydrophobicContact CB-CE2 4.08Å; I161-F172 HydrophobicContact CB-CZ 4.02Å; I161-F172 HydrophobicContact CD1-CD2 3.81Å; I161-F172 HydrophobicContact CD1-CE2 3.52Å; I161-F172 HydrophobicContact CD1-CZ 4.21Å; I161-F172 HydrophobicContact CG1-CD2 4.05Å; I161-F172 HydrophobicContact CG1-CE1 4.28Å; I161-F172 HydrophobicContact CG1-CE2 3.45Å; I161-F172 VanDerWaalsContact CG1-CE2 3.45Å; I161-F172 HydrophobicContact CG1-CZ 3.6Å; I161-F172 HydrophobicContact CG2-CE2 3.69Å; I161-F172 HydrophobicContact CG2-CZ 3.81Å; T170-F172 HydrophobicContact CG2-CD2 4.29Å; T170-F172 HydrophobicContact CG2-CE2 3.37Å; T170-F172 HydrophobicContact CG2-CZ 3.65Å; F172-L174 PolarHBondContact O-N 3.37Å; F172-E231 WeakPolarHBondContact O-CA 3.4Å; F172-L232 HydrophobicContact CB-CB 4.45Å; F172-L232 PolarHBondContact N-O 3.32Å; F172-L232 PolarHBondContact O-N 3.39Å
173	T	87.5	Confident	84.6	Confident	96 Å²	96	51.4 Å²	51.4	59%	0.589	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	117.3	170.4	52.2	0	0	0	0	109.3	Q157 L230	Q157-T173 PolarHBondContact NE2-O 3.29Å; T173-L230 WeakPolarHBondContact CA-O 3.25Å
174	L	89.6	Confident	83.7	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.042	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-80.3	158.9	175	-68.4	156.1	0	0	0	110.6	I159 F172 T176 L214 L230 L232 I250 L265 V267	I159-L174 HydrophobicContact CD1-CD2 3.81Å; F172-L174 PolarHBondContact O-N 3.37Å; L174-T176 PolarHBondContact O-N 3.08Å; L174-L214 HydrophobicContact CD1-CD1 3.38Å; L174-L230 HydrophobicContact CB-CB 3.73Å; L174-L230 HydrophobicContact CD1-CB 3.93Å; L174-L230 HydrophobicContact CG-CB 4.44Å; L174-L230 PolarHBondContact N-O 2.92Å; L174-L232 HydrophobicContact CD1-CB 4Å; L174-L232 HydrophobicContact CD1-CD1 4.39Å; L174-L232 HydrophobicContact CD2-CB 4.39Å; L174-L232 HydrophobicContact CG-CB 4.16Å; L174-I250 HydrophobicContact CD1-CD1 3.49Å; L174-I250 VanDerWaalsContact CD1-CD1 3.49Å; L174-I250 HydrophobicContact CD2-CD1 4.01Å; L174-I250 HydrophobicContact CG-CD1 4.34Å; L174-L265 HydrophobicContact CB-CD2 4.32Å; L174-L265 HydrophobicContact CD2-CD2 4.3Å; L174-V267 HydrophobicContact CD2-CG1 4.24Å; L174-V267 HydrophobicContact CD2-CG2 3.85Å
175	N	89	Confident	83	Confident	20 Å²	20	55.5 Å²	55.5	11%	0.107	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-53.1	134.3	165	-68	2.3	0	0	0	108.1	F151 L152 S154 Q156 Q157 L265	F151-N175 HydrophobicContact CB-CB 4.44Å; F151-N175 HydrophobicContact CD1-CB 4.35Å; F151-N175 VanDerWaalsContact CD1-O 3.26Å; F151-N175 WeakPolarHBondContact CD1-O 3.25Å; L152-N175 WeakPolarHBondContact O-CB 3.36Å; S154-N175 PolarHBondContact O-ND2 3.39Å; Q156-N175 PolarHBondContact O-ND2 3.26Å; Q156-N175 VanDerWaalsContact O-ND2 3.14Å; Q157-N175 PolarHBondContact OE1-OD1 2.72Å; N175-L265 HydrophobicContact CB-CD1 3.84Å; N175-L265 HydrophobicContact CB-CD2 3.93Å
176	T	85.3	Confident	82.4	Confident	55 Å²	55	56.5 Å²	56.5	34%	0.337	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	139.3	-176.2	54.8	0	0	0	0	109.9	L152 L174 Y178 I228	L152-T176 PolarHBondContact N-O 3.37Å; L152-T176 PolarHBondContact O-N 2.86Å; L174-T176 PolarHBondContact O-N 3.08Å; T176-Y178 PolarHBondContact O-N 2.85Å; T176-Y178 VanDerWaalsContact O-N 3.1Å; T176-I228 WeakPolarHBondContact CG2-O 3.36Å
177	P	86.4	Confident	82.1	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.058	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	115.9	167.3	28.6	-31	0	0	0	107.3	F151 V189 I194 I228 A252	F151-P177 HydrophobicContact CD1-CB 4.3Å; F151-P177 HydrophobicContact CE1-CB 4.02Å; F151-P177 HydrophobicContact CE1-CG 4.22Å; F151-P177 HydrophobicContact CZ-CB 4.17Å; P177-V189 HydrophobicContact CB-CG1 4.12Å; P177-V189 HydrophobicContact CB-CG2 4.39Å; P177-V189 HydrophobicContact CG-CG1 3.88Å; P177-I194 HydrophobicContact CG-CD1 3.87Å; P177-I228 HydrophobicContact CG-CG2 4.45Å; P177-A252 HydrophobicContact CB-CB 3.87Å; P177-A252 HydrophobicContact CG-CB 4.19Å
178	Y	83	Confident	81.8	Confident	105 Å²	105	53.3 Å²	53.3	41%	0.412	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128.1	169.7	177.9	-98	0	0	0	108.1	K150 L152 T176 P180	K150-Y178 PolarHBondContact N-O 2.83Å; K150-Y178 WeakPolarHBondContact O-CA 3.39Å; K150-Y178 PolarHBondContact O-N 2.75Å; L152-Y178 VanDerWaalsContact CD1-CB 3.49Å; L152-Y178 HydrophobicContact CD1-CD1 3.67Å; L152-Y178 HydrophobicContact CD1-CD2 4.1Å; L152-Y178 HydrophobicContact CD1-CE1 4.41Å; L152-Y178 HydrophobicContact CD1-CG 3.48Å; L152-Y178 VanDerWaalsContact CD1-CG 3.48Å; L152-Y178 HydrophobicContact CG-CD1 4.39Å; L152-Y178 HydrophobicContact CG-CG 4.19Å; T176-Y178 PolarHBondContact O-N 2.85Å; T176-Y178 VanDerWaalsContact O-N 3.1Å; Y178-P180 HydrophobicContact CE1-CB 3.67Å; Y178-P180 HydrophobicContact CE1-CG 4.31Å
179	D	84.8	Confident	81.6	Confident	10 Å²	10	48.6 Å²	48.6	5%	0.053	25%	0.25	C	S	.	.			trans	-138.6	112.7	180	170.8	-33.2	0	0	0	102.1	C149 D181 S188 V189	C149-D179 HydrophobicContact CB-CB 3.83Å; D179-D181 PolarHBondContact O-N 2.9Å; D179-D181 WeakPolarHBondContact OD1-CB 3.31Å; D179-D181 PolarHBondContact OD1-N 2.98Å; D179-S188 WeakPolarHBondContact CB-OG 3.18Å; D179-S188 VanDerWaalsContact CG-CA 3.48Å; D179-S188 VanDerWaalsContact CG-OG 3.27Å; D179-S188 PolarHBondContact O-OG 2.83Å; D179-S188 WeakPolarHBondContact OD1-CA 3.34Å; D179-S188 PolarHBondContact OD1-OG 3.46Å; D179-S188 VanDerWaalsContact OD2-CA 3.31Å; D179-S188 WeakPolarHBondContact OD2-CA 3.09Å; D179-V189 HydrophobicContact CB-CB 4.3Å; D179-V189 HydrophobicContact CB-CG2 3.87Å; D179-V189 WeakPolarHBondContact OD2-CG2 3.42Å; D179-V189 PolarHBondContact OD2-N 3.12Å
180	P	77.7	Confident	81.2	Confident	24 Å²	24	43.4 Å²	43.4	16%	0.156	23%	0.226	C	C	.	.			trans	-76.3	-10	-167.1	33.5	-36.7	0	0	0	112.8	R82 E83 N147 Y178	R82-P180 PolarHBondContact NH2-O 2.82Å; E83-P180 HydrophobicContact CG-CB 3.68Å; E83-P180 HydrophobicContact CG-CG 4.43Å; N147-P180 HydrophobicContact CB-CG 3.25Å; Y178-P180 HydrophobicContact CE1-CB 3.67Å; Y178-P180 HydrophobicContact CE1-CG 4.31Å
181	D	82	Confident	80.8	Confident	6 Å²	6	43.4 Å²	43.4	3%	0.032	23%	0.226	C	C	.	.	S	Bend	trans	-74.5	167.5	-176.1	-55	-13.4	0	0	0	110.5	D143 N145 D146 N147 D179 F183 N187 S188	D143-D181 WeakPolarHBondContact OD1-CA 3.14Å; N145-D181 WeakPolarHBondContact CA-OD2 3.33Å; D146-D181 PolarHBondContact N-OD2 3.2Å; D146-D181 VanDerWaalsContact N-OD2 3.1Å; N147-D181 VanDerWaalsContact CB-OD1 3.28Å; N147-D181 WeakPolarHBondContact CB-OD1 3.25Å; N147-D181 PolarHBondContact N-OD2 2.8Å; N147-D181 PolarHBondContact ND2-OD1 2.83Å; D179-D181 PolarHBondContact O-N 2.9Å; D179-D181 WeakPolarHBondContact OD1-CB 3.31Å; D179-D181 PolarHBondContact OD1-N 2.98Å; D181-F183 PolarHBondContact O-N 3.38Å; D181-F183 VanDerWaalsContact O-N 3.17Å; D181-N187 HydrophobicContact CB-CB 3.78Å; D181-S188 WeakPolarHBondContact O-CB 3.43Å
182	D	75.3	Confident	80.3	Confident	33 Å²	33	44.8 Å²	44.8	18%	0.176	24%	0.241	C	C	.	.			trans	-80	109.1	-170.3	-165.3	0.6	0	0	0	110.9	R82 D143 V184 E185 G186 N187	R82-D182 IonicContact NH1-OD2 2.61Å; D143-D182 HydrophobicContact CB-CB 3.41Å; D143-D182 VanDerWaalsContact CB-CB 3.41Å; D143-D182 WeakPolarHBondContact OD1-CB 3.27Å; D143-D182 PolarHBondContact OD1-N 2.99Å; D143-D182 WeakPolarHBondContact OD2-CB 3.41Å; D143-D182 PolarHBondContact OD2-N 3.23Å; D182-V184 PolarHBondContact O-N 2.77Å; D182-V184 VanDerWaalsContact OD1-CB 3.27Å; D182-V184 WeakPolarHBondContact OD1-CB 3.16Å; D182-V184 WeakPolarHBondContact OD1-CG2 3.33Å; D182-V184 PolarHBondContact OD1-N 3.45Å; D182-E185 HydrophobicContact CB-CB 4.44Å; D182-E185 PolarHBondContact O-N 2.74Å; D182-G186 PolarHBondContact O-N 3.37Å; D182-N187 PolarHBondContact O-N 2.84Å
183	F	72.9	Confident	80.2	Confident	62 Å²	62	46.6 Å²	46.6	27%	0.272	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-28.9	167.9	-176.5	-97.4	0	0	0	113.2	D181 G186 K190 P226	D181-F183 PolarHBondContact O-N 3.38Å; D181-F183 VanDerWaalsContact O-N 3.17Å; F183-G186 WeakPolarHBondContact O-CA 3.49Å; F183-G186 PolarHBondContact O-N 3.03Å; F183-K190 HydrophobicContact CE2-CG 4.31Å; F183-P226 HydrophobicContact CB-CG 3.9Å; F183-P226 HydrophobicContact CD1-CB 4.33Å; F183-P226 VanDerWaalsContact CD1-CD 3.45Å; F183-P226 HydrophobicContact CD1-CG 3.48Å; F183-P226 VanDerWaalsContact CD1-CG 3.48Å; F183-P226 HydrophobicContact CD2-CG 3.52Å; F183-P226 HydrophobicContact CE1-CB 4.19Å; F183-P226 HydrophobicContact CE1-CG 3.77Å; F183-P226 HydrophobicContact CE2-CB 4.5Å; F183-P226 HydrophobicContact CE2-CG 3.8Å; F183-P226 VanDerWaalsContact CG-CD 3.5Å; F183-P226 HydrophobicContact CG-CG 3.32Å; F183-P226 HydrophobicContact CZ-CB 4.28Å; F183-P226 HydrophobicContact CZ-CG 3.92Å
184	V	69.2	Low	80.2	Confident	79 Å²	79	42.7 Å²	42.7	48%	0.479	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-36.4	-176.9	-173	0	0	0	0	112.6	D182	D182-V184 PolarHBondContact O-N 2.77Å; D182-V184 VanDerWaalsContact OD1-CB 3.27Å; D182-V184 WeakPolarHBondContact OD1-CB 3.16Å; D182-V184 WeakPolarHBondContact OD1-CG2 3.33Å; D182-V184 PolarHBondContact OD1-N 3.45Å
185	E	70.3	Confident	80.1	Confident	94 Å²	94	47.5 Å²	47.5	44%	0.439	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.6	167.2	-62	-110.7	151.4	0	0	111.2	R142 D182	R142-E185 IonicContact CZ-OE1 2.76Å; R142-E185 VanDerWaalsContact CZ-OE1 3.26Å; R142-E185 IonicContact CZ-OE2 3.99Å; R142-E185 IonicContact NE-OE1 2.67Å; R142-E185 PolarHBondContact NE-OE1 3.32Å; R142-E185 IonicContact NE-OE2 3.41Å; R142-E185 PolarHBondContact NE-OE2 2.87Å; R142-E185 VanDerWaalsContact NH2-CD 3.32Å; R142-E185 IonicContact NH2-OE1 3.58Å; R142-E185 PolarHBondContact NH2-OE1 2.64Å; R142-E185 IonicContact NH2-OE2 3.34Å; R142-E185 PolarHBondContact NH2-OE2 2.7Å; D182-E185 HydrophobicContact CB-CB 4.44Å; D182-E185 PolarHBondContact O-N 2.74Å
186	G	73.1	Confident	80	Confident	30 Å²	30	47.4 Å²	47.4	31%	0.309	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.4	18.6	169.8	0	0	0	0	0	114.1	D182 F183 K190	D182-G186 PolarHBondContact O-N 3.37Å; F183-G186 WeakPolarHBondContact O-CA 3.49Å; F183-G186 PolarHBondContact O-N 3.03Å; G186-K190 WeakPolarHBondContact O-CE 3.03Å; G186-K190 PolarHBondContact O-NZ 3.06Å
187	N	79.5	Confident	79.9	Confident	39 Å²	39	46.4 Å²	46.4	21%	0.209	23%	0.231	C	C	.	.			trans	-79.3	-40.3	-178.4	-68.7	-21.3	0	0	0	111.4	D143 N145 D181 D182	D143-N187 PolarHBondContact OD2-ND2 2.82Å; N145-N187 HydrophobicContact CB-CB 3.77Å; N145-N187 PolarHBondContact N-ND2 2.72Å; N145-N187 PolarHBondContact ND2-O 2.8Å; N145-N187 VanDerWaalsContact ND2-O 3.14Å; D181-N187 HydrophobicContact CB-CB 3.78Å; D182-N187 PolarHBondContact O-N 2.84Å
188	S	80.9	Confident	79.1	Confident	12 Å²	12	49.6 Å²	49.6	8%	0.084	25%	0.251	C	S	.	.	S	Bend	trans	-72.9	160.2	-175	-161.1	0	0	0	0	116.1	D179 D181 K190	D179-S188 WeakPolarHBondContact CB-OG 3.18Å; D179-S188 VanDerWaalsContact CG-CA 3.48Å; D179-S188 VanDerWaalsContact CG-OG 3.27Å; D179-S188 PolarHBondContact O-OG 2.83Å; D179-S188 WeakPolarHBondContact OD1-CA 3.34Å; D179-S188 PolarHBondContact OD1-OG 3.46Å; D179-S188 VanDerWaalsContact OD2-CA 3.31Å; D179-S188 WeakPolarHBondContact OD2-CA 3.09Å; D181-S188 WeakPolarHBondContact O-CB 3.43Å; S188-K190 WeakPolarHBondContact O-CG 3.31Å; S188-K190 PolarHBondContact O-NZ 2.68Å
189	V	82	Confident	78.3	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	27%	0.268	C	S	.	.			trans	-40.6	139.6	172.5	172.6	0	0	0	0	114.5	C149 P177 D179 I194 I228 A252 D254	C149-V189 HydrophobicContact CB-CG2 3.47Å; C149-V189 VanDerWaalsContact CB-CG2 3.47Å; P177-V189 HydrophobicContact CB-CG1 4.12Å; P177-V189 HydrophobicContact CB-CG2 4.39Å; P177-V189 HydrophobicContact CG-CG1 3.88Å; D179-V189 HydrophobicContact CB-CB 4.3Å; D179-V189 HydrophobicContact CB-CG2 3.87Å; D179-V189 WeakPolarHBondContact OD2-CG2 3.42Å; D179-V189 PolarHBondContact OD2-N 3.12Å; V189-I194 HydrophobicContact CG1-CD1 4.05Å; V189-I194 HydrophobicContact CG1-CG1 4.26Å; V189-I228 HydrophobicContact CB-CD1 4.29Å; V189-I228 HydrophobicContact CG1-CD1 3.92Å; V189-I228 WeakPolarHBondContact O-CD1 3.29Å; V189-A252 HydrophobicContact CG1-CB 4.21Å; V189-D254 HydrophobicContact CG2-CB 4.34Å
190	K	76.3	Confident	77.3	Confident	49 Å²	49	55.6 Å²	55.6	21%	0.213	28%	0.283	C	S	.	.			trans	-116.4	135.9	-172.9	-62.1	169.1	-176.8	58.6	0	111.4	F183 G186 S188 D192 R193 D254	F183-K190 HydrophobicContact CE2-CG 4.31Å; G186-K190 WeakPolarHBondContact O-CE 3.03Å; G186-K190 PolarHBondContact O-NZ 3.06Å; S188-K190 WeakPolarHBondContact O-CG 3.31Å; S188-K190 PolarHBondContact O-NZ 2.68Å; K190-D192 VanDerWaalsContact CB-OD1 3.28Å; K190-D192 WeakPolarHBondContact CB-OD1 3.48Å; K190-D192 PolarHBondContact O-N 3.43Å; K190-D192 VanDerWaalsContact O-N 3.1Å; K190-R193 HydrophobicContact CB-CG 4.45Å; K190-R193 PolarHBondContact O-N 2.85Å; K190-D254 PolarHBondContact NZ-O 3.22Å
191	P	75.7	Confident	76.1	Confident	21 Å²	21	57.7 Å²	57.7	14%	0.136	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24	-176.1	-25.9	32.9	0	0	0	115.8	R193 S216 I228	P191-R193 VanDerWaalsContact C-N 3.34Å; P191-S216 WeakPolarHBondContact O-CB 3.3Å; P191-S216 PolarHBondContact O-OG 3.47Å; P191-I228 HydrophobicContact CG-CG1 4.47Å
192	D	78.5	Confident	74.9	Confident	137 Å²	137	63.9 Å²	63.9	73%	0.733	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-6.9	176.3	61.5	-42.8	0	0	0	113.7	K190	K190-D192 VanDerWaalsContact CB-OD1 3.28Å; K190-D192 WeakPolarHBondContact CB-OD1 3.48Å; K190-D192 PolarHBondContact O-N 3.43Å; K190-D192 VanDerWaalsContact O-N 3.1Å
193	R	84.4	Confident	73.5	Confident	88 Å²	88	66.8 Å²	66.8	33%	0.332	36%	0.359	S	S	.	.	S	Bend	trans	-108.8	38.6	177.3	-65.5	-162	176.6	-149.9	7.7	113	K190 P191 W195 A252 D253 G255	K190-R193 HydrophobicContact CB-CG 4.45Å; K190-R193 PolarHBondContact O-N 2.85Å; P191-R193 VanDerWaalsContact C-N 3.34Å; R193-W195 WeakPolarHBondContact O-CZ3 3.35Å; R193-A252 WeakPolarHBondContact O-CA 3.3Å; R193-D253 HydrophobicContact CB-CB 4.25Å; R193-D253 VanDerWaalsContact CB-O 3.23Å; R193-D253 WeakPolarHBondContact CB-O 3.28Å; R193-D253 WeakPolarHBondContact CD-O 3.48Å; R193-D253 VanDerWaalsContact CD-OD1 3.31Å; R193-D253 WeakPolarHBondContact CD-OD1 3.4Å; R193-D253 IonicContact CZ-OD1 3.64Å; R193-D253 IonicContact NE-OD1 3.9Å; R193-D253 IonicContact NH1-OD1 2.67Å; R193-D253 PolarHBondContact NH1-OD1 3.01Å; R193-D253 PolarHBondContact O-N 2.94Å; R193-G255 VanDerWaalsContact CZ-CA 3.47Å; R193-G255 PolarHBondContact NH1-O 3.44Å; R193-G255 PolarHBondContact NH2-O 2.83Å
194	I	87.5	Confident	72.6	Confident	14 Å²	14	67.4 Å²	67.4	7%	0.072	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	122	178.3	-48	176.9	0	0	0	109.6	P177 V189 L214 I228 L230 I250 V251 A252	P177-I194 HydrophobicContact CG-CD1 3.87Å; V189-I194 HydrophobicContact CG1-CD1 4.05Å; V189-I194 HydrophobicContact CG1-CG1 4.26Å; I194-L214 HydrophobicContact CG2-CD2 4.22Å; I194-I228 HydrophobicContact CD1-CG2 3.67Å; I194-L230 HydrophobicContact CD1-CD1 4.49Å; I194-L230 HydrophobicContact CD1-CD2 3.84Å; I194-L230 HydrophobicContact CG2-CD1 3.93Å; I194-L230 HydrophobicContact CG2-CD2 4.02Å; I194-I250 HydrophobicContact CG2-CG2 3.72Å; I194-V251 WeakPolarHBondContact CA-O 3.26Å; I194-V251 WeakPolarHBondContact CG2-O 3.35Å; I194-A252 HydrophobicContact CG1-CB 4.09Å; I194-A252 HydrophobicContact CG2-CB 4.41Å
195	W	87.7	Confident	71.6	Confident	109 Å²	109	69.4 Å²	69.4	41%	0.413	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	159.9	-174.1	67.7	97.7	0	0	0	113.4	R193 I250 V251 D253	R193-W195 WeakPolarHBondContact O-CZ3 3.35Å; W195-I250 CarbonylContact O-C 3.6Å; W195-I250 WeakPolarHBondContact O-CA 3.45Å; W195-V251 HydrophobicContact CD2-CB 4.16Å; W195-V251 HydrophobicContact CH2-CB 4.12Å; W195-V251 HydrophobicContact CH2-CG1 3.76Å; W195-V251 HydrophobicContact CZ2-CB 3.72Å; W195-V251 HydrophobicContact CZ2-CG1 3.62Å; W195-V251 HydrophobicContact CZ2-CG2 4.27Å; W195-V251 HydrophobicContact CZ3-CG1 4.43Å; W195-V251 PolarHBondContact N-O 3.41Å; W195-V251 VanDerWaalsContact N-O 3.09Å; W195-V251 PolarHBondContact O-N 3.48Å; W195-D253 HydrophobicContact CH2-CB 4.1Å; W195-D253 HydrophobicContact CZ3-CB 4.04Å
196	I	87.5	Confident	71.1	Confident	18 Å²	18	67.9 Å²	67.9	9%	0.092	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	126.3	170.1	-61.4	174.1	0	0	0	108.7	T198 I208 L214 F248 I250	I196-T198 PolarHBondContact O-N 2.96Å; I196-I208 HydrophobicContact CG2-CG2 3.95Å; I196-L214 HydrophobicContact CD1-CB 4.11Å; I196-L214 HydrophobicContact CG1-CB 4.16Å; I196-L214 HydrophobicContact CG1-CD2 4.21Å; I196-F248 HydrophobicContact CD1-CE2 4.36Å; I196-F248 HydrophobicContact CG1-CD2 4.43Å; I196-F248 HydrophobicContact CG1-CE2 4.39Å; I196-F248 HydrophobicContact CG2-CB 4.48Å; I196-F248 HydrophobicContact CG2-CD2 3.94Å; I196-I250 HydrophobicContact CG1-CG1 4.33Å
197	N	83.4	Confident	70.9	Confident	34 Å²	34	69.5 Å²	69.5	18%	0.182	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	109	173.5	-172.3	-6.5	0	0	0	110.2	D199 Q249 V251	N197-D199 VanDerWaalsContact C-N 3.25Å; N197-D199 PolarHBondContact O-N 3.35Å; N197-D199 PolarHBondContact OD1-N 2.73Å; N197-Q249 HydrophobicContact CB-CB 4.11Å; N197-Q249 HydrophobicContact CB-CG 4.45Å; N197-Q249 WeakPolarHBondContact CB-O 2.94Å; N197-Q249 PolarHBondContact N-O 3.36Å; N197-Q249 PolarHBondContact ND2-OE1 2.81Å; N197-V251 HydrophobicContact CB-CG2 4.01Å
198	T	68.8	Low	70.9	Confident	76 Å²	76	68.6 Å²	68.6	47%	0.466	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-68.6	-23.8	178.4	44.6	0	0	0	0	113.5	I196 Y200	I196-T198 PolarHBondContact O-N 2.96Å; T198-Y200 VanDerWaalsContact C-N 3.31Å; T198-Y200 PolarHBondContact O-N 2.86Å
199	D	67.8	Low	70.8	Confident	145 Å²	145	73.4 Å²	73.4	78%	0.775	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-91.9	-2.1	-167.1	-57.5	5	0	0	0	111.5	N197	N197-D199 VanDerWaalsContact C-N 3.25Å; N197-D199 PolarHBondContact O-N 3.35Å; N197-D199 PolarHBondContact OD1-N 2.73Å
200	Y	62.9	Low	70.8	Confident	96 Å²	96	77 Å²	77	38%	0.376	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-98.9	-2.8	-176.3	-161.8	-99.2	0	0	0	114	T198 I202 Q249	T198-Y200 VanDerWaalsContact C-N 3.31Å; T198-Y200 PolarHBondContact O-N 2.86Å; Y200-I202 PolarHBondContact O-N 3.38Å; Y200-Q249 HydrophobicContact CD1-CB 3.65Å; Y200-Q249 HydrophobicContact CD2-CB 4.45Å; Y200-Q249 HydrophobicContact CE1-CB 4.14Å; Y200-Q249 HydrophobicContact CG-CB 3.83Å
201	S	53.4	Low	71.3	Confident	68 Å²	68	75.1 Å²	75.1	48%	0.476	41%	0.412	S	S	.	.			trans	-72.8	102.1	-175.4	61.2	0	0	0	0	112.4	A203	S201-A203 PolarHBondContact O-N 3Å
202	I	55.6	Low	72	Confident	136 Å²	136	74.2 Å²	74.2	70%	0.697	41%	0.406	S	S	*	.			trans	-75.4	105.1	177.3	-59.6	175.1	0	0	0	110.2	Y200 T204	Y200-I202 PolarHBondContact O-N 3.38Å; I202-T204 PolarHBondContact O-N 3.1Å
203	A	46.5	Very low	72.4	Confident	94 Å²	94	72.2 Å²	72.2	78%	0.777	39%	0.391	S	S	*	.	S	Bend	trans	50.5	49.6	152.7	0	0	0	0	0	118.3	S201	S201-A203 PolarHBondContact O-N 3Å
204	T	53	Low	72.7	Confident	76 Å²	76	69.7 Å²	69.7	47%	0.466	38%	0.384	S	S	.	.			trans	-127.7	150.3	158.8	39.7	0	0	0	0	110.6	I202 Q206 Q243	I202-T204 PolarHBondContact O-N 3.1Å; T204-Q206 PolarHBondContact O-N 3.33Å; T204-Q243 PolarHBondContact OG1-NE2 2.74Å
205	S	49.1	Very low	72.6	Confident	121 Å²	121	70.7 Å²	70.7	85%	0.846	39%	0.388	S	S	*	.	S	Bend	trans	-86	1.1	-159.1	35.7	0	0	0	0	116.2
206	Q	58.9	Low	72.1	Confident	62 Å²	62	67.8 Å²	67.8	29%	0.29	38%	0.384	S	S	.	.	S	Bend	trans	-118.4	143.9	172.4	-65.8	109.6	-26.4	0	0	110.3	T204 Y211 E242	T204-Q206 PolarHBondContact O-N 3.33Å; Q206-Y211 HydrophobicContact CB-CE2 3.78Å; Q206-Y211 HydrophobicContact CG-CE2 4.29Å; Q206-Y211 PolarHBondContact NE2-OH 3.26Å; Q206-E242 PolarHBondContact NE2-OE1 3.11Å
207	S	68.6	Low	71.2	Confident	64 Å²	64	70.3 Å²	70.3	45%	0.448	40%	0.398	S	S	.	.			trans	-64.6	134.5	174.5	28.2	0	0	0	0	111.4	Q209 N210	S207-Q209 PolarHBondContact O-N 2.81Å; S207-Q209 VanDerWaalsContact O-N 3.07Å; S207-N210 WeakPolarHBondContact O-CB 3.43Å; S207-N210 VanDerWaalsContact O-CG 3.24Å; S207-N210 PolarHBondContact O-N 2.81Å; S207-N210 PolarHBondContact O-OD1 2.79Å; S207-N210 VanDerWaalsContact OG-CG 3.27Å; S207-N210 PolarHBondContact OG-ND2 3.48Å; S207-N210 PolarHBondContact OG-OD1 3.22Å
208	I	79.5	Confident	70.2	Confident	20 Å²	20	71.3 Å²	71.3	10%	0.103	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-55.4	-30.6	179	-167.1	69.6	0	0	0	112.9	I196 N210 Y211 F212 Y246 F248	I196-I208 HydrophobicContact CG2-CG2 3.95Å; I208-N210 PolarHBondContact O-N 3Å; I208-N210 VanDerWaalsContact O-N 3.13Å; I208-Y211 PolarHBondContact O-N 3.37Å; I208-Y211 VanDerWaalsContact O-N 3.1Å; I208-F212 HydrophobicContact CD1-CD2 3.59Å; I208-F212 HydrophobicContact CD1-CE2 3.94Å; I208-F212 HydrophobicContact CG1-CD2 4.1Å; I208-F212 PolarHBondContact O-N 2.96Å; I208-Y246 HydrophobicContact CD1-CD1 4.06Å; I208-Y246 HydrophobicContact CD1-CG 4.41Å; I208-F248 HydrophobicContact CD1-CB 4.45Å; I208-F248 HydrophobicContact CD1-CD1 3.6Å; I208-F248 HydrophobicContact CD1-CE1 4.15Å; I208-F248 HydrophobicContact CD1-CG 4.26Å; I208-F248 HydrophobicContact CG1-CB 4.03Å; I208-F248 HydrophobicContact CG1-CD1 3.7Å; I208-F248 HydrophobicContact CG1-CE1 4.28Å; I208-F248 HydrophobicContact CG1-CG 3.89Å
209	Q	79.4	Confident	69.4	Low	113 Å²	113	71.3 Å²	71.3	53%	0.528	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-64.8	-7	174.3	-62.6	179	-6.9	0	0	114.3	S207 I235	S207-Q209 PolarHBondContact O-N 2.81Å; S207-Q209 VanDerWaalsContact O-N 3.07Å; Q209-I235 WeakPolarHBondContact O-CD1 3.12Å
210	N	83.2	Confident	68.6	Low	76 Å²	76	67.4 Å²	67.4	41%	0.406	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-83.5	-32.6	172.2	-60.3	4.7	0	0	0	111.6	S207 I208 I235 H236	S207-N210 WeakPolarHBondContact O-CB 3.43Å; S207-N210 VanDerWaalsContact O-CG 3.24Å; S207-N210 PolarHBondContact O-N 2.81Å; S207-N210 PolarHBondContact O-OD1 2.79Å; S207-N210 VanDerWaalsContact OG-CG 3.27Å; S207-N210 PolarHBondContact OG-ND2 3.48Å; S207-N210 PolarHBondContact OG-OD1 3.22Å; I208-N210 PolarHBondContact O-N 3Å; I208-N210 VanDerWaalsContact O-N 3.13Å; N210-I235 WeakPolarHBondContact O-CG1 3.37Å; N210-H236 WeakPolarHBondContact O-CB 3.22Å
211	Y	86.9	Confident	68	Low	9 Å²	9	72.8 Å²	72.8	4%	0.035	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-36.4	-174.6	-68.9	-84.8	0	0	0	112.7	Q206 I208 I235 H236 L238 Y246	Q206-Y211 HydrophobicContact CB-CE2 3.78Å; Q206-Y211 HydrophobicContact CG-CE2 4.29Å; Q206-Y211 PolarHBondContact NE2-OH 3.26Å; I208-Y211 PolarHBondContact O-N 3.37Å; I208-Y211 VanDerWaalsContact O-N 3.1Å; Y211-I235 WeakPolarHBondContact O-CG1 3.42Å; Y211-I235 PolarHBondContact O-N 2.7Å; Y211-H236 HydrophobicContact CD1-CB 3.88Å; Y211-H236 HydrophobicContact CE1-CB 4.38Å; Y211-H236 AromaticContact CE1-ND1 3.73Å; Y211-H236 HydrophobicContact CG-CB 4.49Å; Y211-L238 HydrophobicContact CD1-CD2 3.81Å; Y211-L238 HydrophobicContact CE1-CD2 4.48Å; Y211-Y246 HydrophobicContact CD1-CE1 4.26Å; Y211-Y246 HydrophobicContact CD2-CD1 4.42Å; Y211-Y246 AromaticContact CD2-CE1 3.69Å; Y211-Y246 HydrophobicContact CD2-CE1 3.69Å; Y211-Y246 HydrophobicContact CE1-CE1 4.34Å; Y211-Y246 WeakPolarHBondContact CE1-OH 3.34Å; Y211-Y246 AromaticContact CE2-CE1 3.78Å; Y211-Y246 HydrophobicContact CE2-CE1 3.78Å; Y211-Y246 AromaticContact CG-CE1 3.94Å; Y211-Y246 HydrophobicContact CG-CE1 3.94Å
212	F	88.8	Confident	67.5	Low	3 Å²	3	75.4 Å²	75.4	1%	0.013	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	142	-173	-54.6	-75.4	0	0	0	112.9	I161 I208 L232 E233 L234 L238 Y246 F248 V269	I161-F212 HydrophobicContact CD1-CE1 3.62Å; I161-F212 HydrophobicContact CD1-CZ 4.21Å; I208-F212 HydrophobicContact CD1-CD2 3.59Å; I208-F212 HydrophobicContact CD1-CE2 3.94Å; I208-F212 HydrophobicContact CG1-CD2 4.1Å; I208-F212 PolarHBondContact O-N 2.96Å; F212-L232 HydrophobicContact CB-CD1 3.86Å; F212-L232 HydrophobicContact CB-CD2 4.3Å; F212-L232 HydrophobicContact CB-CG 4.04Å; F212-L232 HydrophobicContact CD1-CD2 3.7Å; F212-L232 HydrophobicContact CD1-CG 4.04Å; F212-L232 HydrophobicContact CE1-CD2 4.32Å; F212-L232 HydrophobicContact CG-CD2 4.07Å; F212-L232 HydrophobicContact CG-CG 4.3Å; F212-E233 WeakPolarHBondContact CA-O 3.41Å; F212-L234 HydrophobicContact CD1-CD1 4.09Å; F212-L234 HydrophobicContact CE1-CD1 3.61Å; F212-L234 HydrophobicContact CZ-CD1 4.29Å; F212-L238 HydrophobicContact CE1-CD2 4.43Å; F212-L238 HydrophobicContact CZ-CD1 4.39Å; F212-L238 HydrophobicContact CZ-CD2 3.81Å; F212-Y246 HydrophobicContact CE2-CD1 4.13Å; F212-Y246 HydrophobicContact CE2-CD2 4.28Å; F212-Y246 AromaticContact CE2-CG 3.93Å; F212-Y246 HydrophobicContact CE2-CG 3.93Å; F212-Y246 HydrophobicContact CZ-CD2 4.44Å; F212-F248 HydrophobicContact CD2-CE1 4.41Å; F212-V269 HydrophobicContact CE1-CG2 4.26Å; F212-V269 HydrophobicContact CE2-CG2 4.37Å; F212-V269 HydrophobicContact CZ-CB 4.34Å; F212-V269 HydrophobicContact CZ-CG1 3.97Å; F212-V269 HydrophobicContact CZ-CG2 3.98Å
213	K	88.4	Confident	67.3	Low	94 Å²	94	74.2 Å²	74.2	41%	0.409	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.5	178.2	174.3	175.1	153.6	-142.5	0	110	E233 I235	K213-E233 HydrophobicContact CB-CB 4.43Å; K213-E233 WeakPolarHBondContact CD-OE2 3.29Å; K213-E233 WeakPolarHBondContact CE-OE2 3.46Å; K213-E233 PolarHBondContact N-O 2.8Å; K213-E233 IonicContact NZ-OE2 3.54Å; K213-E233 PolarHBondContact NZ-OE2 2.8Å; K213-E233 PolarHBondContact O-N 3.25Å; K213-I235 HydrophobicContact CB-CD1 4.14Å; K213-I235 HydrophobicContact CB-CG1 4.38Å; K213-I235 HydrophobicContact CB-CG2 3.8Å; K213-I235 HydrophobicContact CD-CG2 4.11Å
214	L	89.1	Confident	67.5	Low	35 Å²	35	73.3 Å²	73.3	18%	0.183	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.7	177.3	-177.2	61.4	0	0	0	110.7	L174 I194 I196 L230 I250	L174-L214 HydrophobicContact CD1-CD1 3.38Å; I194-L214 HydrophobicContact CG2-CD2 4.22Å; I196-L214 HydrophobicContact CD1-CB 4.11Å; I196-L214 HydrophobicContact CG1-CB 4.16Å; I196-L214 HydrophobicContact CG1-CD2 4.21Å; L214-L230 HydrophobicContact CD1-CB 4.49Å; L214-L230 HydrophobicContact CD1-CD2 4.49Å; L214-I250 HydrophobicContact CD1-CD1 4.01Å; L214-I250 HydrophobicContact CD2-CD1 4.33Å; L214-I250 HydrophobicContact CD2-CG2 4.06Å
215	H	85.6	Confident	67.4	Low	36 Å²	36	72.9 Å²	72.9	17%	0.167	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.8	168.4	-62.2	-111.4	0	0	0	109.7	L217 L230 E231 E233	H215-L217 HydrophobicContact CB-CG 4.23Å; H215-L230 WeakPolarHBondContact O-CA 3.47Å; H215-E231 HydrophobicContact CB-CB 4.32Å; H215-E231 PolarHBondContact N-O 3.46Å; H215-E231 PolarHBondContact O-N 2.71Å; H215-E233 IonicContact CD2-OE2 2.64Å; H215-E233 IonicContact CE1-OE1 3.81Å; H215-E233 IonicContact CE1-OE2 3.38Å; H215-E233 PolarHBondContact CE1-OE2 3.46Å; H215-E233 WeakPolarHBondContact NE2-CB 3Å; H215-E233 IonicContact NE2-OE1 2.65Å; H215-E233 PolarHBondContact NE2-OE1 3.18Å; H215-E233 IonicContact NE2-OE2 2.7Å; H215-E233 PolarHBondContact NE2-OE2 3.36Å
216	S	78.6	Confident	67.6	Low	47 Å²	47	68.2 Å²	68.2	33%	0.329	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	87	170	48.4	0	0	0	0	110.6	P191 S218	P191-S216 WeakPolarHBondContact O-CB 3.3Å; P191-S216 PolarHBondContact O-OG 3.47Å; S216-S218 PolarHBondContact O-N 3.02Å
217	L	68.2	Low	67.7	Low	72 Å²	72	69.3 Å²	69.3	38%	0.377	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	102.1	-177.7	-65.2	172.7	0	0	0	110.9	H215 S219 Y229 E231	H215-L217 HydrophobicContact CB-CG 4.23Å; L217-S219 PolarHBondContact O-N 2.9Å; L217-Y229 WeakPolarHBondContact CB-O 3.3Å; L217-Y229 PolarHBondContact N-O 2.79Å; L217-Y229 PolarHBondContact O-N 3.36Å; L217-E231 HydrophobicContact CD1-CG 4.13Å; L217-E231 WeakPolarHBondContact CD1-OE2 3.35Å
218	S	62.8	Low	67.9	Low	55 Å²	55	66.8 Å²	66.8	39%	0.385	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	106.5	166.9	-166.5	0	0	0	0	110.1	S216 S220	S216-S218 PolarHBondContact O-N 3.02Å; S218-S220 PolarHBondContact O-N 2.84Å
219	S	50.6	Low	67.9	Low	76 Å²	76	70.8 Å²	70.8	53%	0.531	38%	0.38	S	S	.	.			trans	-78.9	62.1	178.8	-163.4	0	0	0	0	112.1	L217 N227	L217-S219 PolarHBondContact O-N 2.9Å; S219-N227 PolarHBondContact N-O 2.91Å
220	S	52	Low	68.3	Low	62 Å²	62	65.5 Å²	65.5	43%	0.434	36%	0.355	S	S	.	.			trans	-114.4	99.6	-178.5	-168.6	0	0	0	0	113	S218 N222	S218-S220 PolarHBondContact O-N 2.84Å; S220-N222 PolarHBondContact OG-O 2.96Å
221	K	49.4	Very low	68.5	Low	209 Å²	209	63.9 Å²	63.9	91%	0.909	35%	0.345	S	S	*	.	S	Bend	trans	-100.7	-10.2	140.2	-77.5	-174.9	176.8	176.1	0	112.4
222	N	42.8	Very low	68.7	Low	124 Å²	124	63.5 Å²	63.5	66%	0.663	34%	0.344	S	S	*	.	S	Bend	trans	-114.2	131.8	173.3	-68.6	-16.3	0	0	0	108.5	S220 T224	S220-N222 PolarHBondContact OG-O 2.96Å; N222-T224 VanDerWaalsContact C-N 3.3Å; N222-T224 PolarHBondContact O-N 2.94Å
223	V	52.1	Low	68.7	Low	110 Å²	110	63.8 Å²	63.8	67%	0.667	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-9.1	-167.3	179.9	0	0	0	0	113.2
224	T	50.9	Low	68.8	Low	75 Å²	75	59.4 Å²	59.4	46%	0.46	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-12.9	-160.4	52.3	0	0	0	0	116.5	T113 N222	T113-T224 PolarHBondContact OG1-OG1 3.19Å; N222-T224 VanDerWaalsContact C-N 3.3Å; N222-T224 PolarHBondContact O-N 2.94Å
225	T	49.8	Very low	68.9	Low	67 Å²	67	60.1 Å²	60.1	41%	0.411	33%	0.33	S	S	.	.			trans	-158.7	119.8	172.6	28.6	0	0	0	0	108.2	T113 N227	T113-T225 HydrophobicContact CG2-CG2 3.88Å; T225-N227 PolarHBondContact O-N 3.22Å
226	P	54.2	Low	69	Low	23 Å²	23	63.1 Å²	63.1	15%	0.149	34%	0.344	C	S	.	.			trans	-83.6	107.1	167.6	34.7	-31.3	0	0	0	108	F183 I228	F183-P226 HydrophobicContact CB-CG 3.9Å; F183-P226 HydrophobicContact CD1-CB 4.33Å; F183-P226 VanDerWaalsContact CD1-CD 3.45Å; F183-P226 HydrophobicContact CD1-CG 3.48Å; F183-P226 VanDerWaalsContact CD1-CG 3.48Å; F183-P226 HydrophobicContact CD2-CG 3.52Å; F183-P226 HydrophobicContact CE1-CB 4.19Å; F183-P226 HydrophobicContact CE1-CG 3.77Å; F183-P226 HydrophobicContact CE2-CB 4.5Å; F183-P226 HydrophobicContact CE2-CG 3.8Å; F183-P226 VanDerWaalsContact CG-CD 3.5Å; F183-P226 HydrophobicContact CG-CG 3.32Å; F183-P226 HydrophobicContact CZ-CB 4.28Å; F183-P226 HydrophobicContact CZ-CG 3.92Å; P226-I228 HydrophobicContact CB-CG1 4.22Å; P226-I228 HydrophobicContact CG-CG1 4.39Å; P226-I228 PolarHBondContact O-N 2.81Å
227	N	61.5	Low	69.4	Low	85 Å²	85	64.6 Å²	64.6	46%	0.455	34%	0.344	S	S	.	.			trans	-68.5	98.7	155.7	-68.8	20.1	0	0	0	106	S219 T225 Y229	S219-N227 PolarHBondContact N-O 2.91Å; T225-N227 PolarHBondContact O-N 3.22Å; N227-Y229 HydrophobicContact CB-CD2 3.88Å; N227-Y229 HydrophobicContact CB-CE2 3.34Å; N227-Y229 PolarHBondContact ND2-OH 3.33Å; N227-Y229 WeakPolarHBondContact O-CD2 3.19Å; N227-Y229 PolarHBondContact O-N 2.98Å
228	I	72.8	Confident	70.4	Confident	11 Å²	11	61.2 Å²	61.2	6%	0.056	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	94.2	174.1	-57.5	-179.2	0	0	0	106.7	T176 P177 V189 P191 I194 P226 L230	T176-I228 WeakPolarHBondContact CG2-O 3.36Å; P177-I228 HydrophobicContact CG-CG2 4.45Å; V189-I228 HydrophobicContact CB-CD1 4.29Å; V189-I228 HydrophobicContact CG1-CD1 3.92Å; V189-I228 WeakPolarHBondContact O-CD1 3.29Å; P191-I228 HydrophobicContact CG-CG1 4.47Å; I194-I228 HydrophobicContact CD1-CG2 3.67Å; P226-I228 HydrophobicContact CB-CG1 4.22Å; P226-I228 HydrophobicContact CG-CG1 4.39Å; P226-I228 PolarHBondContact O-N 2.81Å; I228-L230 HydrophobicContact CG2-CD2 4.02Å; I228-L230 HydrophobicContact CG2-CG 4.31Å; I228-L230 PolarHBondContact O-N 2.83Å
229	Y	78.9	Confident	71.6	Confident	104 Å²	104	60.8 Å²	60.8	41%	0.408	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	112.9	173.2	-75.7	-79.7	0	0	0	108.8	L217 N227	L217-Y229 WeakPolarHBondContact CB-O 3.3Å; L217-Y229 PolarHBondContact N-O 2.79Å; L217-Y229 PolarHBondContact O-N 3.36Å; N227-Y229 HydrophobicContact CB-CD2 3.88Å; N227-Y229 HydrophobicContact CB-CE2 3.34Å; N227-Y229 PolarHBondContact ND2-OH 3.33Å; N227-Y229 WeakPolarHBondContact O-CD2 3.19Å; N227-Y229 PolarHBondContact O-N 2.98Å
230	L	87.4	Confident	73.4	Confident	2 Å²	2	59 Å²	59	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	118.1	169.4	-66.4	-170.2	0	0	0	108.9	F151 T173 L174 I194 L214 H215 I228	F151-L230 HydrophobicContact CE1-CD1 3.97Å; T173-L230 WeakPolarHBondContact CA-O 3.25Å; L174-L230 HydrophobicContact CB-CB 3.73Å; L174-L230 HydrophobicContact CD1-CB 3.93Å; L174-L230 HydrophobicContact CG-CB 4.44Å; L174-L230 PolarHBondContact N-O 2.92Å; I194-L230 HydrophobicContact CD1-CD1 4.49Å; I194-L230 HydrophobicContact CD1-CD2 3.84Å; I194-L230 HydrophobicContact CG2-CD1 3.93Å; I194-L230 HydrophobicContact CG2-CD2 4.02Å; L214-L230 HydrophobicContact CD1-CB 4.49Å; L214-L230 HydrophobicContact CD1-CD2 4.49Å; H215-L230 WeakPolarHBondContact O-CA 3.47Å; I228-L230 HydrophobicContact CG2-CD2 4.02Å; I228-L230 HydrophobicContact CG2-CG 4.31Å; I228-L230 PolarHBondContact O-N 2.83Å
231	E	88.3	Confident	75	Confident	43 Å²	43	58.6 Å²	58.6	20%	0.201	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.6	174.1	-67.4	-176.7	169.3	0	0	110	R171 F172 H215 L217	R171-E231 WeakPolarHBondContact CD-OE2 3.43Å; R171-E231 IonicContact CZ-OE2 3.99Å; R171-E231 IonicContact NE-OE2 3.26Å; R171-E231 IonicContact NH1-OE2 2.86Å; R171-E231 PolarHBondContact NH1-OE2 2.05Å; F172-E231 WeakPolarHBondContact O-CA 3.4Å; H215-E231 HydrophobicContact CB-CB 4.32Å; H215-E231 PolarHBondContact N-O 3.46Å; H215-E231 PolarHBondContact O-N 2.71Å; L217-E231 HydrophobicContact CD1-CG 4.13Å; L217-E231 WeakPolarHBondContact CD1-OE2 3.35Å
232	L	89.7	Confident	76.7	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	107.3	167.8	-163.6	76.8	0	0	0	108.7	I159 R171 F172 L174 F212 F248 V269	I159-L232 HydrophobicContact CD1-CD2 3.77Å; R171-L232 VanDerWaalsContact CA-O 3.31Å; R171-L232 WeakPolarHBondContact CA-O 3.44Å; F172-L232 HydrophobicContact CB-CB 4.45Å; F172-L232 PolarHBondContact N-O 3.32Å; F172-L232 PolarHBondContact O-N 3.39Å; L174-L232 HydrophobicContact CD1-CB 4Å; L174-L232 HydrophobicContact CD1-CD1 4.39Å; L174-L232 HydrophobicContact CD2-CB 4.39Å; L174-L232 HydrophobicContact CG-CB 4.16Å; F212-L232 HydrophobicContact CB-CD1 3.86Å; F212-L232 HydrophobicContact CB-CD2 4.3Å; F212-L232 HydrophobicContact CB-CG 4.04Å; F212-L232 HydrophobicContact CD1-CD2 3.7Å; F212-L232 HydrophobicContact CD1-CG 4.04Å; F212-L232 HydrophobicContact CE1-CD2 4.32Å; F212-L232 HydrophobicContact CG-CD2 4.07Å; F212-L232 HydrophobicContact CG-CG 4.3Å; L232-F248 HydrophobicContact CD1-CE2 4.14Å; L232-F248 HydrophobicContact CD1-CZ 3.72Å; L232-F248 HydrophobicContact CD2-CE1 4.37Å; L232-F248 HydrophobicContact CD2-CZ 3.77Å; L232-F248 HydrophobicContact CG-CZ 4.42Å; L232-V269 HydrophobicContact CD2-CG2 4.3Å
233	E	90.7	Very high	78.7	Confident	9 Å²	9	49 Å²	49	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130	176.5	178.6	176.1	-103.1	0	0	110.4	R171 F212 K213 H215 I235	R171-E233 HydrophobicContact CG-CB 4.27Å; R171-E233 HydrophobicContact CG-CG 4.43Å; R171-E233 IonicContact CZ-OE1 2.77Å; R171-E233 VanDerWaalsContact CZ-OE1 3.3Å; R171-E233 IonicContact NE-OE1 3.47Å; R171-E233 PolarHBondContact NE-OE1 3.28Å; R171-E233 IonicContact NH2-OE1 3.4Å; R171-E233 PolarHBondContact NH2-OE1 3.34Å; F212-E233 WeakPolarHBondContact CA-O 3.41Å; K213-E233 HydrophobicContact CB-CB 4.43Å; K213-E233 WeakPolarHBondContact CD-OE2 3.29Å; K213-E233 WeakPolarHBondContact CE-OE2 3.46Å; K213-E233 PolarHBondContact N-O 2.8Å; K213-E233 IonicContact NZ-OE2 3.54Å; K213-E233 PolarHBondContact NZ-OE2 2.8Å; K213-E233 PolarHBondContact O-N 3.25Å; H215-E233 IonicContact CD2-OE2 2.64Å; H215-E233 IonicContact CE1-OE1 3.81Å; H215-E233 IonicContact CE1-OE2 3.38Å; H215-E233 PolarHBondContact CE1-OE2 3.46Å; H215-E233 WeakPolarHBondContact NE2-CB 3Å; H215-E233 IonicContact NE2-OE1 2.65Å; H215-E233 PolarHBondContact NE2-OE1 3.18Å; H215-E233 IonicContact NE2-OE2 2.7Å; H215-E233 PolarHBondContact NE2-OE2 3.36Å; E233-I235 HydrophobicContact CG-CG2 4.1Å
234	L	90.6	Very high	80.3	Confident	1 Å²	1	48 Å²	48	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.4	173.4	-178	69.3	0	0	0	109.9	I161 A165 N168 T170 F212 H236 L238	I161-L234 HydrophobicContact CG2-CD2 4.49Å; A165-L234 HydrophobicContact CB-CD2 3.64Å; N168-L234 WeakPolarHBondContact CA-O 3.34Å; N168-L234 PolarHBondContact N-O 3.43Å; T170-L234 PolarHBondContact O-N 3.12Å; F212-L234 HydrophobicContact CD1-CD1 4.09Å; F212-L234 HydrophobicContact CE1-CD1 3.61Å; F212-L234 HydrophobicContact CZ-CD1 4.29Å; L234-H236 WeakPolarHBondContact CD1-O 2.93Å; L234-H236 WeakPolarHBondContact CG-O 3.25Å; L234-L238 HydrophobicContact CD1-CD1 3.97Å; L234-L238 HydrophobicContact CD1-CD2 3.82Å; L234-L238 HydrophobicContact CD1-CG 3.72Å; L234-L238 HydrophobicContact CD2-CD1 4.5Å; L234-L238 HydrophobicContact CD2-CG 4.41Å
235	I	90.4	Very high	82.1	Confident	50 Å²	50	47.9 Å²	47.9	26%	0.256	23%	0.233	S	C	.	.			trans	-117.1	-1.2	-174	54.1	160.3	0	0	0	114.7	V167 Q209 N210 Y211 K213 E233	V167-I235 WeakPolarHBondContact CG1-O 3.16Å; Q209-I235 WeakPolarHBondContact O-CD1 3.12Å; N210-I235 WeakPolarHBondContact O-CG1 3.37Å; Y211-I235 WeakPolarHBondContact O-CG1 3.42Å; Y211-I235 PolarHBondContact O-N 2.7Å; K213-I235 HydrophobicContact CB-CD1 4.14Å; K213-I235 HydrophobicContact CB-CG1 4.38Å; K213-I235 HydrophobicContact CB-CG2 3.8Å; K213-I235 HydrophobicContact CD-CG2 4.11Å; E233-I235 HydrophobicContact CG-CG2 4.1Å
236	H	88.4	Confident	83.9	Confident	100 Å²	100	45 Å²	45	46%	0.463	22%	0.215	S	C	.	.	S	Bend	trans	-137.6	160.2	171	-162.7	-88.9	0	0	0	110.3	N210 Y211 L234	N210-H236 WeakPolarHBondContact O-CB 3.22Å; Y211-H236 HydrophobicContact CD1-CB 3.88Å; Y211-H236 HydrophobicContact CE1-CB 4.38Å; Y211-H236 AromaticContact CE1-ND1 3.73Å; Y211-H236 HydrophobicContact CG-CB 4.49Å; L234-H236 WeakPolarHBondContact CD1-O 2.93Å; L234-H236 WeakPolarHBondContact CG-O 3.25Å
237	K	86.2	Confident	85.3	Confident	78 Å²	78	46.8 Å²	46.8	34%	0.339	23%	0.228	S	C	.	.			trans	-63.1	141.5	168.3	-160.1	-136.9	172	-151.5	0	108	E163 V167 D276	E163-K237 IonicContact OE2-NZ 2.77Å; V167-K237 HydrophobicContact CG2-CB 4.49Å; K237-D276 WeakPolarHBondContact CE-OD2 3.35Å; K237-D276 IonicContact NZ-OD1 2.88Å; K237-D276 IonicContact NZ-OD2 2.89Å; K237-D276 PolarHBondContact NZ-OD2 2.74Å
238	L	89.1	Confident	86.5	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.207	C	C	.	.			trans	-90	161.4	163.8	-56.5	174.8	0	0	0	109.1	I161 E163 Y211 F212 L234 Y246 V271	I161-L238 HydrophobicContact CB-CD1 3.83Å; I161-L238 HydrophobicContact CD1-CD1 4.41Å; I161-L238 HydrophobicContact CG2-CD1 3.51Å; E163-L238 HydrophobicContact CB-CB 4.15Å; Y211-L238 HydrophobicContact CD1-CD2 3.81Å; Y211-L238 HydrophobicContact CE1-CD2 4.48Å; F212-L238 HydrophobicContact CE1-CD2 4.43Å; F212-L238 HydrophobicContact CZ-CD1 4.39Å; F212-L238 HydrophobicContact CZ-CD2 3.81Å; L234-L238 HydrophobicContact CD1-CD1 3.97Å; L234-L238 HydrophobicContact CD1-CD2 3.82Å; L234-L238 HydrophobicContact CD1-CG 3.72Å; L234-L238 HydrophobicContact CD2-CD1 4.5Å; L234-L238 HydrophobicContact CD2-CG 4.41Å; L238-Y246 HydrophobicContact CD2-CE2 3.91Å; L238-V271 HydrophobicContact CB-CG1 4.28Å; L238-V271 HydrophobicContact CB-CG2 4.47Å; L238-V271 HydrophobicContact CD1-CG2 4.23Å
239	D	88.1	Confident	87.3	Confident	47 Å²	47	43.2 Å²	43.2	25%	0.251	21%	0.208	S	C	.	.			trans	-147.1	112.7	-176.7	-171.4	-60.6	0	0	0	105.4	E241 E242 Q243	D239-E241 VanDerWaalsContact C-N 3.29Å; D239-E241 PolarHBondContact OD1-N 3.31Å; D239-E242 HydrophobicContact CB-CB 3.97Å; D239-E242 PolarHBondContact OD1-N 3.22Å; D239-Q243 PolarHBondContact O-N 2.75Å
240	Y	88.5	Confident	87.8	Confident	37 Å²	37	38.3 Å²	38.3	15%	0.145	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-28.9	-175.8	180	-106.3	0	0	0	110.2	E163 K244 V271 D273 A297	E163-Y240 VanDerWaalsContact OE1-CB 3.29Å; E163-Y240 WeakPolarHBondContact OE1-CB 3.41Å; E163-Y240 WeakPolarHBondContact OE2-CB 3.12Å; E163-Y240 PolarHBondContact OE2-N 3.19Å; Y240-K244 HydrophobicContact CD1-CG 4.45Å; Y240-K244 HydrophobicContact CD2-CB 4.09Å; Y240-K244 HydrophobicContact CD2-CD 4.37Å; Y240-K244 HydrophobicContact CD2-CG 3.74Å; Y240-K244 HydrophobicContact CE1-CD 4Å; Y240-K244 HydrophobicContact CE1-CG 4.35Å; Y240-K244 HydrophobicContact CE2-CB 3.87Å; Y240-K244 HydrophobicContact CE2-CD 3.84Å; Y240-K244 HydrophobicContact CE2-CG 3.61Å; Y240-K244 HydrophobicContact CG-CG 4.15Å; Y240-K244 WeakPolarHBondContact O-CG 3.44Å; Y240-K244 PolarHBondContact O-NZ 2.86Å; Y240-V271 HydrophobicContact CD2-CB 3.96Å; Y240-V271 HydrophobicContact CD2-CG1 4.03Å; Y240-V271 WeakPolarHBondContact CD2-O 3.24Å; Y240-V271 WeakPolarHBondContact CE2-O 3.21Å; Y240-V271 HydrophobicContact CG-CG1 4.44Å; Y240-D273 HydrophobicContact CD1-CB 3.64Å; Y240-D273 WeakPolarHBondContact CD1-OD1 3.2Å; Y240-D273 HydrophobicContact CD2-CB 4.17Å; Y240-D273 HydrophobicContact CE1-CB 3.54Å; Y240-D273 WeakPolarHBondContact CE1-OD1 3.47Å; Y240-D273 HydrophobicContact CE2-CB 4.1Å; Y240-D273 HydrophobicContact CG-CB 3.98Å; Y240-A297 HydrophobicContact CE1-CB 3.59Å
241	E	86.3	Confident	87.9	Confident	54 Å²	54	38.4 Å²	38.4	25%	0.252	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-39.2	177.7	-82.2	39.2	-91.9	0	0	111.7	D239 K244 H277 E295	D239-E241 VanDerWaalsContact C-N 3.29Å; D239-E241 PolarHBondContact OD1-N 3.31Å; E241-K244 IonicContact OE1-NZ 3.3Å; E241-K244 PolarHBondContact OE1-NZ 3.34Å; E241-H277 IonicContact OE2-CE1 2.77Å; E241-H277 IonicContact OE2-ND1 3.73Å; E241-E295 HydrophobicContact CG-CB 4Å
242	E	84.5	Confident	87.9	Confident	115 Å²	115	36.4 Å²	36.4	54%	0.537	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-52.9	172.8	-167.8	-177.9	-167.2	0	0	111.9	Q206 D239	Q206-E242 PolarHBondContact NE2-OE1 3.11Å; D239-E242 HydrophobicContact CB-CB 3.97Å; D239-E242 PolarHBondContact OD1-N 3.22Å
243	Q	84.1	Confident	87.6	Confident	18 Å²	18	36.8 Å²	36.8	8%	0.084	18%	0.183	C	C	.	.			trans	-150.8	95.5	-173.3	-176.3	164.6	-17.8	0	0	114.6	T204 D239 T245 Y246 V271	T204-Q243 PolarHBondContact OG1-NE2 2.74Å; D239-Q243 PolarHBondContact O-N 2.75Å; Q243-T245 VanDerWaalsContact C-N 3.29Å; Q243-T245 VanDerWaalsContact CG-O 3.25Å; Q243-T245 WeakPolarHBondContact CG-O 3.31Å; Q243-T245 PolarHBondContact NE2-O 3.11Å; Q243-T245 PolarHBondContact O-N 2.64Å; Q243-Y246 HydrophobicContact CB-CE1 4.46Å; Q243-Y246 HydrophobicContact CB-CE2 4.18Å; Q243-Y246 VanDerWaalsContact CD-CE1 3.41Å; Q243-Y246 HydrophobicContact CG-CD1 4.37Å; Q243-Y246 HydrophobicContact CG-CD2 4.28Å; Q243-Y246 HydrophobicContact CG-CE1 3.99Å; Q243-Y246 HydrophobicContact CG-CE2 3.86Å; Q243-Y246 HydrophobicContact CG-CG 4.5Å; Q243-Y246 WeakPolarHBondContact O-CE2 3.26Å; Q243-V271 VanDerWaalsContact O-CG2 3.3Å; Q243-V271 WeakPolarHBondContact O-CG2 3.42Å
244	K	86.8	Confident	87.2	Confident	87 Å²	87	36.4 Å²	36.4	38%	0.378	18%	0.181	S	C	.	.	S	Bend	trans	-62.8	-23	179.6	-58.2	-174.6	-173.2	-52.1	0	115.2	Y240 E241 V271	Y240-K244 HydrophobicContact CD1-CG 4.45Å; Y240-K244 HydrophobicContact CD2-CB 4.09Å; Y240-K244 HydrophobicContact CD2-CD 4.37Å; Y240-K244 HydrophobicContact CD2-CG 3.74Å; Y240-K244 HydrophobicContact CE1-CD 4Å; Y240-K244 HydrophobicContact CE1-CG 4.35Å; Y240-K244 HydrophobicContact CE2-CB 3.87Å; Y240-K244 HydrophobicContact CE2-CD 3.84Å; Y240-K244 HydrophobicContact CE2-CG 3.61Å; Y240-K244 HydrophobicContact CG-CG 4.15Å; Y240-K244 WeakPolarHBondContact O-CG 3.44Å; Y240-K244 PolarHBondContact O-NZ 2.86Å; E241-K244 IonicContact OE1-NZ 3.3Å; E241-K244 PolarHBondContact OE1-NZ 3.34Å; K244-V271 PolarHBondContact O-N 3.3Å
245	T	87.8	Confident	86.3	Confident	73 Å²	73	37.9 Å²	37.9	45%	0.448	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	142.1	-178.1	60.6	0	0	0	0	114	Q243 V269 L270	Q243-T245 VanDerWaalsContact C-N 3.29Å; Q243-T245 VanDerWaalsContact CG-O 3.25Å; Q243-T245 WeakPolarHBondContact CG-O 3.31Å; Q243-T245 PolarHBondContact NE2-O 3.11Å; Q243-T245 PolarHBondContact O-N 2.64Å; T245-V269 WeakPolarHBondContact CA-O 3.49Å; T245-L270 HydrophobicContact CG2-CD2 3.67Å
246	Y	86.7	Confident	85.5	Confident	7 Å²	7	42.5 Å²	42.5	3%	0.027	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	120.5	169.9	-55.9	-106.9	0	0	0	109.2	I208 Y211 F212 L238 Q243 V269 V271	I208-Y246 HydrophobicContact CD1-CD1 4.06Å; I208-Y246 HydrophobicContact CD1-CG 4.41Å; Y211-Y246 HydrophobicContact CD1-CE1 4.26Å; Y211-Y246 HydrophobicContact CD2-CD1 4.42Å; Y211-Y246 AromaticContact CD2-CE1 3.69Å; Y211-Y246 HydrophobicContact CD2-CE1 3.69Å; Y211-Y246 HydrophobicContact CE1-CE1 4.34Å; Y211-Y246 WeakPolarHBondContact CE1-OH 3.34Å; Y211-Y246 AromaticContact CE2-CE1 3.78Å; Y211-Y246 HydrophobicContact CE2-CE1 3.78Å; Y211-Y246 AromaticContact CG-CE1 3.94Å; Y211-Y246 HydrophobicContact CG-CE1 3.94Å; F212-Y246 HydrophobicContact CE2-CD1 4.13Å; F212-Y246 HydrophobicContact CE2-CD2 4.28Å; F212-Y246 AromaticContact CE2-CG 3.93Å; F212-Y246 HydrophobicContact CE2-CG 3.93Å; F212-Y246 HydrophobicContact CZ-CD2 4.44Å; L238-Y246 HydrophobicContact CD2-CE2 3.91Å; Q243-Y246 HydrophobicContact CB-CE1 4.46Å; Q243-Y246 HydrophobicContact CB-CE2 4.18Å; Q243-Y246 VanDerWaalsContact CD-CE1 3.41Å; Q243-Y246 HydrophobicContact CG-CD1 4.37Å; Q243-Y246 HydrophobicContact CG-CD2 4.28Å; Q243-Y246 HydrophobicContact CG-CE1 3.99Å; Q243-Y246 HydrophobicContact CG-CE2 3.86Å; Q243-Y246 HydrophobicContact CG-CG 4.5Å; Q243-Y246 WeakPolarHBondContact O-CE2 3.26Å; Y246-V269 HydrophobicContact CD2-CG1 4.28Å; Y246-V269 PolarHBondContact N-O 3.5Å; Y246-V269 PolarHBondContact O-N 2.77Å; Y246-V271 HydrophobicContact CD2-CG2 4.07Å; Y246-V271 HydrophobicContact CE2-CG2 3.72Å
247	S	85.6	Confident	84.2	Confident	60 Å²	60	43.4 Å²	43.4	42%	0.42	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.7	176.7	-68.1	0	0	0	0	110.8	V267 T268	S247-V267 WeakPolarHBondContact CA-O 3.07Å; S247-T268 PolarHBondContact OG-OG1 3.39Å
248	F	86.7	Confident	83.4	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.009	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	172.1	176.3	62.9	-86	0	0	0	110.4	I196 I208 F212 L232 I250 V267 V269	I196-F248 HydrophobicContact CD1-CE2 4.36Å; I196-F248 HydrophobicContact CG1-CD2 4.43Å; I196-F248 HydrophobicContact CG1-CE2 4.39Å; I196-F248 HydrophobicContact CG2-CB 4.48Å; I196-F248 HydrophobicContact CG2-CD2 3.94Å; I208-F248 HydrophobicContact CD1-CB 4.45Å; I208-F248 HydrophobicContact CD1-CD1 3.6Å; I208-F248 HydrophobicContact CD1-CE1 4.15Å; I208-F248 HydrophobicContact CD1-CG 4.26Å; I208-F248 HydrophobicContact CG1-CB 4.03Å; I208-F248 HydrophobicContact CG1-CD1 3.7Å; I208-F248 HydrophobicContact CG1-CE1 4.28Å; I208-F248 HydrophobicContact CG1-CG 3.89Å; F212-F248 HydrophobicContact CD2-CE1 4.41Å; L232-F248 HydrophobicContact CD1-CE2 4.14Å; L232-F248 HydrophobicContact CD1-CZ 3.72Å; L232-F248 HydrophobicContact CD2-CE1 4.37Å; L232-F248 HydrophobicContact CD2-CZ 3.77Å; L232-F248 HydrophobicContact CG-CZ 4.42Å; F248-I250 HydrophobicContact CD2-CG1 4.25Å; F248-I250 HydrophobicContact CE2-CD1 4.09Å; F248-I250 HydrophobicContact CE2-CG1 3.93Å; F248-V267 HydrophobicContact CD1-CB 4.38Å; F248-V267 HydrophobicContact CD2-CB 4.16Å; F248-V267 HydrophobicContact CE1-CB 4.02Å; F248-V267 HydrophobicContact CE1-CG1 3.78Å; F248-V267 HydrophobicContact CE2-CB 3.78Å; F248-V267 HydrophobicContact CE2-CG1 4.1Å; F248-V267 HydrophobicContact CE2-CG2 3.97Å; F248-V267 HydrophobicContact CG-CB 4.46Å; F248-V267 HydrophobicContact CZ-CB 3.7Å; F248-V267 HydrophobicContact CZ-CG1 3.52Å; F248-V267 HydrophobicContact CZ-CG2 4.23Å; F248-V267 PolarHBondContact N-O 3.14Å; F248-V267 PolarHBondContact O-N 2.57Å; F248-V267 VanDerWaalsContact O-O 3.1Å; F248-V269 HydrophobicContact CE1-CG2 4.09Å
249	Q	88.7	Confident	82.4	Confident	20 Å²	20	45 Å²	45	9%	0.093	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.4	-178.6	-179.6	178.5	82.3	0	0	109.8	N197 Y200 Y264 L265 N266	N197-Q249 HydrophobicContact CB-CB 4.11Å; N197-Q249 HydrophobicContact CB-CG 4.45Å; N197-Q249 WeakPolarHBondContact CB-O 2.94Å; N197-Q249 PolarHBondContact N-O 3.36Å; N197-Q249 PolarHBondContact ND2-OE1 2.81Å; Y200-Q249 HydrophobicContact CD1-CB 3.65Å; Y200-Q249 HydrophobicContact CD2-CB 4.45Å; Y200-Q249 HydrophobicContact CE1-CB 4.14Å; Y200-Q249 HydrophobicContact CG-CB 3.83Å; Q249-Y264 HydrophobicContact CG-CD1 4.15Å; Q249-L265 CarbonylContact C-O 3.56Å; Q249-L265 WeakPolarHBondContact CA-O 3.42Å; Q249-N266 PolarHBondContact NE2-OD1 2.67Å
250	I	89.3	Confident	81.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	138.5	169.4	-59.9	177.6	0	0	0	107.7	F151 L174 I194 W195 I196 L214 F248 Y264 L265 V267	F151-I250 HydrophobicContact CZ-CG2 4.27Å; L174-I250 HydrophobicContact CD1-CD1 3.49Å; L174-I250 VanDerWaalsContact CD1-CD1 3.49Å; L174-I250 HydrophobicContact CD2-CD1 4.01Å; L174-I250 HydrophobicContact CG-CD1 4.34Å; I194-I250 HydrophobicContact CG2-CG2 3.72Å; W195-I250 CarbonylContact O-C 3.6Å; W195-I250 WeakPolarHBondContact O-CA 3.45Å; I196-I250 HydrophobicContact CG1-CG1 4.33Å; L214-I250 HydrophobicContact CD1-CD1 4.01Å; L214-I250 HydrophobicContact CD2-CD1 4.33Å; L214-I250 HydrophobicContact CD2-CG2 4.06Å; F248-I250 HydrophobicContact CD2-CG1 4.25Å; F248-I250 HydrophobicContact CE2-CD1 4.09Å; F248-I250 HydrophobicContact CE2-CG1 3.93Å; I250-Y264 CarbonylContact O-C 3.59Å; I250-Y264 WeakPolarHBondContact O-CA 3.43Å; I250-L265 HydrophobicContact CB-CB 4.29Å; I250-L265 PolarHBondContact N-O 3.39Å; I250-L265 PolarHBondContact O-N 3.11Å; I250-V267 HydrophobicContact CD1-CG2 3.94Å; I250-V267 HydrophobicContact CG1-CG2 4.16Å
251	V	88.8	Confident	81.2	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.03	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	142	176.2	-167.1	0	0	0	0	108.8	I194 W195 N197 C263 Y264	I194-V251 WeakPolarHBondContact CA-O 3.26Å; I194-V251 WeakPolarHBondContact CG2-O 3.35Å; W195-V251 HydrophobicContact CD2-CB 4.16Å; W195-V251 HydrophobicContact CH2-CB 4.12Å; W195-V251 HydrophobicContact CH2-CG1 3.76Å; W195-V251 HydrophobicContact CZ2-CB 3.72Å; W195-V251 HydrophobicContact CZ2-CG1 3.62Å; W195-V251 HydrophobicContact CZ2-CG2 4.27Å; W195-V251 HydrophobicContact CZ3-CG1 4.43Å; W195-V251 PolarHBondContact N-O 3.41Å; W195-V251 VanDerWaalsContact N-O 3.09Å; W195-V251 PolarHBondContact O-N 3.48Å; N197-V251 HydrophobicContact CB-CG2 4.01Å; V251-C263 WeakPolarHBondContact CA-O 3.46Å; V251-Y264 HydrophobicContact CG1-CD1 4.3Å; V251-Y264 HydrophobicContact CG1-CE1 3.99Å; V251-Y264 HydrophobicContact CG2-CD1 3.99Å; V251-Y264 HydrophobicContact CG2-CE1 3.98Å
252	A	88.3	Confident	81.2	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145	168.1	0	0	0	0	0	110.3	F151 P177 V189 R193 I194 Q262 C263	F151-A252 HydrophobicContact CE2-CB 4.06Å; F151-A252 HydrophobicContact CZ-CB 3.82Å; P177-A252 HydrophobicContact CB-CB 3.87Å; P177-A252 HydrophobicContact CG-CB 4.19Å; V189-A252 HydrophobicContact CG1-CB 4.21Å; R193-A252 WeakPolarHBondContact O-CA 3.3Å; I194-A252 HydrophobicContact CG1-CB 4.09Å; I194-A252 HydrophobicContact CG2-CB 4.41Å; A252-Q262 WeakPolarHBondContact O-CA 3.49Å; A252-C263 PolarHBondContact N-O 2.87Å; A252-C263 PolarHBondContact O-N 2.66Å
253	D	85.1	Confident	81.4	Confident	10 Å²	10	43.8 Å²	43.8	5%	0.053	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	133.7	-171.6	175.1	-59.9	0	0	0	109.2	R193 W195 G255 Q262	R193-D253 HydrophobicContact CB-CB 4.25Å; R193-D253 VanDerWaalsContact CB-O 3.23Å; R193-D253 WeakPolarHBondContact CB-O 3.28Å; R193-D253 WeakPolarHBondContact CD-O 3.48Å; R193-D253 VanDerWaalsContact CD-OD1 3.31Å; R193-D253 WeakPolarHBondContact CD-OD1 3.4Å; R193-D253 IonicContact CZ-OD1 3.64Å; R193-D253 IonicContact NE-OD1 3.9Å; R193-D253 IonicContact NH1-OD1 2.67Å; R193-D253 PolarHBondContact NH1-OD1 3.01Å; R193-D253 PolarHBondContact O-N 2.94Å; W195-D253 HydrophobicContact CH2-CB 4.1Å; W195-D253 HydrophobicContact CZ3-CB 4.04Å; D253-G255 PolarHBondContact OD1-N 3.07Å; D253-Q262 HydrophobicContact CB-CG 4.19Å; D253-Q262 PolarHBondContact OD2-NE2 2.86Å
254	D	80.6	Confident	81.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	27%	0.267	C	S	.	.			trans	-77.5	-32.5	-173.4	71.1	-8.5	0	0	0	113.5	N145 V189 K190 Y256 H261	N145-D254 PolarHBondContact ND2-OD2 2.8Å; V189-D254 HydrophobicContact CG2-CB 4.34Å; K190-D254 PolarHBondContact NZ-O 3.22Å; D254-Y256 VanDerWaalsContact OD1-CB 3.31Å; D254-Y256 WeakPolarHBondContact OD1-CB 3.49Å; D254-Y256 PolarHBondContact OD1-N 2.85Å; D254-H261 IonicContact OD1-ND1 3.58Å; D254-H261 IonicContact OD2-CE1 2.67Å; D254-H261 IonicContact OD2-CG 2.63Å; D254-H261 IonicContact OD2-ND1 3.79Å; D254-H261 PolarHBondContact OD2-ND1 3.39Å
255	G	73.2	Confident	81.9	Confident	31 Å²	31	43.2 Å²	43.2	32%	0.32	25%	0.249	S	C	.	.	S	Bend	trans	151.7	-39.8	-156.7	0	0	0	0	0	112.3	R193 D253	R193-G255 VanDerWaalsContact CZ-CA 3.47Å; R193-G255 PolarHBondContact NH1-O 3.44Å; R193-G255 PolarHBondContact NH2-O 2.83Å; D253-G255 PolarHBondContact OD1-N 3.07Å
256	Y	73.2	Confident	82	Confident	148 Å²	148	41.8 Å²	41.8	58%	0.58	24%	0.239	S	C	*	.			trans	-111.1	120.8	-156.7	-150.6	-124.1	0	0	0	111.1	D254 S258 H261	D254-Y256 VanDerWaalsContact OD1-CB 3.31Å; D254-Y256 WeakPolarHBondContact OD1-CB 3.49Å; D254-Y256 PolarHBondContact OD1-N 2.85Å; Y256-S258 VanDerWaalsContact CD1-OG 3.26Å; Y256-S258 WeakPolarHBondContact CD1-OG 3.43Å; Y256-S258 PolarHBondContact O-N 3.15Å; Y256-H261 AromaticContact CD1-CD2 3.98Å; Y256-H261 AromaticContact CD1-CE1 3.8Å; Y256-H261 AromaticContact CD1-ND1 4Å; Y256-H261 AromaticContact CD1-NE2 3.76Å
257	S	61.4	Low	82.1	Confident	118 Å²	118	41.5 Å²	41.5	83%	0.825	24%	0.238	S	C	*	.			trans	-80.5	33.9	-165.2	-48.9	0	0	0	0	115.3
258	S	69.1	Low	82.3	Confident	34 Å²	34	40.7 Å²	40.7	24%	0.238	23%	0.23	C	C	.	.	S	Bend	trans	-101.2	145.9	172.2	31.5	0	0	0	0	110.6	Y256 D260 H261	Y256-S258 VanDerWaalsContact CD1-OG 3.26Å; Y256-S258 WeakPolarHBondContact CD1-OG 3.43Å; Y256-S258 PolarHBondContact O-N 3.15Å; S258-D260 PolarHBondContact O-N 2.05Å; S258-D260 VanDerWaalsContact O-N 3.16Å; S258-H261 PolarHBondContact O-N 3.48Å; S258-H261 PolarHBondContact OG-CD2 3.28Å
259	A	67.7	Low	82.4	Confident	77 Å²	77	40.6 Å²	40.6	64%	0.636	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-60.7	-27	-178.5	0	0	0	0	0	113.1	H261 Q262	A259-H261 PolarHBondContact O-N 2.88Å; A259-Q262 PolarHBondContact O-N 3.45Å
260	D	70.7	Confident	82.5	Confident	136 Å²	136	42.1 Å²	42.1	73%	0.727	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-70.7	-12.8	179	-47.2	-69.9	0	0	0	113.4	G148 S258	G148-D260 WeakPolarHBondContact CA-O 3.16Å; S258-D260 PolarHBondContact O-N 2.05Å; S258-D260 VanDerWaalsContact O-N 3.16Å
261	H	81.1	Confident	82.5	Confident	28 Å²	28	42.5 Å²	42.5	13%	0.13	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-109.1	8.7	-179.6	-65.6	-112.7	0	0	0	112.9	N145 D254 Y256 S258 A259	N145-H261 PolarHBondContact OD1-CE1 3.18Å; N145-H261 PolarHBondContact OD1-ND1 3.28Å; D254-H261 IonicContact OD1-ND1 3.58Å; D254-H261 IonicContact OD2-CE1 2.67Å; D254-H261 IonicContact OD2-CG 2.63Å; D254-H261 IonicContact OD2-ND1 3.79Å; D254-H261 PolarHBondContact OD2-ND1 3.39Å; Y256-H261 AromaticContact CD1-CD2 3.98Å; Y256-H261 AromaticContact CD1-CE1 3.8Å; Y256-H261 AromaticContact CD1-ND1 4Å; Y256-H261 AromaticContact CD1-NE2 3.76Å; S258-H261 PolarHBondContact O-N 3.48Å; S258-H261 PolarHBondContact OG-CD2 3.28Å; A259-H261 PolarHBondContact O-N 2.88Å
262	Q	86.8	Confident	82.3	Confident	55 Å²	55	45.4 Å²	45.4	26%	0.257	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123.7	173.8	-68.7	-172.1	-22.6	0	0	110.5	A252 D253 A259 Y264	A252-Q262 WeakPolarHBondContact O-CA 3.49Å; D253-Q262 HydrophobicContact CB-CG 4.19Å; D253-Q262 PolarHBondContact OD2-NE2 2.86Å; A259-Q262 PolarHBondContact O-N 3.45Å; Q262-Y264 HydrophobicContact CB-CE2 4.2Å; Q262-Y264 WeakPolarHBondContact O-CE2 3.35Å; Q262-Y264 PolarHBondContact OE1-OH 3.43Å
263	C	87.9	Confident	82.2	Confident	9 Å²	9	46.5 Å²	46.5	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	151.1	176	51.4	0	0	0	0	112.1	C149 F151 V251 A252	C149-C263 VanDerWaalsContact C-SG 3.56Å; C149-C263 HydrophobicContact CB-CB 4.19Å; C149-C263 WeakPolarHBondContact CB-SG 3.42Å; C149-C263 VanDerWaalsContact O-CB 3.24Å; C149-C263 WeakPolarHBondContact O-CB 3.14Å; C149-C263 WeakPolarHBondContact SG-CB 3.4Å; C149-C263 PolarHBondContact SG-N 3.32Å; C149-C263 CovalentContact SG-SG 2.05Å; C149-C263 PolarHBondContact SG-SG 2.9Å; F151-C263 HydrophobicContact CD2-CB 4Å; F151-C263 HydrophobicContact CE2-CB 4.17Å; V251-C263 WeakPolarHBondContact CA-O 3.46Å; A252-C263 PolarHBondContact N-O 2.87Å; A252-C263 PolarHBondContact O-N 2.66Å
264	Y	90.2	Very high	82.1	Confident	94 Å²	94	46.1 Å²	46.1	37%	0.369	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.2	-172.3	-59.2	-92.9	0	0	0	109.8	F151 Q249 I250 V251 Q262	F151-Y264 VanDerWaalsContact CD2-C 3.46Å; F151-Y264 WeakPolarHBondContact CD2-O 3.19Å; Q249-Y264 HydrophobicContact CG-CD1 4.15Å; I250-Y264 CarbonylContact O-C 3.59Å; I250-Y264 WeakPolarHBondContact O-CA 3.43Å; V251-Y264 HydrophobicContact CG1-CD1 4.3Å; V251-Y264 HydrophobicContact CG1-CE1 3.99Å; V251-Y264 HydrophobicContact CG2-CD1 3.99Å; V251-Y264 HydrophobicContact CG2-CE1 3.98Å; Q262-Y264 HydrophobicContact CB-CE2 4.2Å; Q262-Y264 WeakPolarHBondContact O-CE2 3.35Å; Q262-Y264 PolarHBondContact OE1-OH 3.43Å
265	L	91.1	Very high	82.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	111.9	171.9	178.5	63.8	0	0	0	109	F151 S154 D155 Q157 L174 N175 Q249 I250 V267	F151-L265 HydrophobicContact CB-CB 4.42Å; F151-L265 HydrophobicContact CB-CD1 4.22Å; F151-L265 HydrophobicContact CD1-CB 3.79Å; F151-L265 HydrophobicContact CD1-CD1 4.42Å; F151-L265 HydrophobicContact CD1-CD2 3.89Å; F151-L265 HydrophobicContact CD1-CG 4.24Å; F151-L265 HydrophobicContact CD2-CB 3.71Å; F151-L265 HydrophobicContact CE1-CB 3.84Å; F151-L265 HydrophobicContact CE1-CD2 3.97Å; F151-L265 HydrophobicContact CE1-CG 4.49Å; F151-L265 HydrophobicContact CE2-CB 3.77Å; F151-L265 HydrophobicContact CG-CB 3.71Å; F151-L265 HydrophobicContact CG-CD1 4.32Å; F151-L265 HydrophobicContact CG-CG 4.4Å; F151-L265 HydrophobicContact CZ-CB 3.83Å; S154-L265 WeakPolarHBondContact O-CD1 3.13Å; D155-L265 CarbonylContact O-C 3.59Å; D155-L265 WeakPolarHBondContact O-CA 3.22Å; Q157-L265 HydrophobicContact CB-CD1 4.03Å; L174-L265 HydrophobicContact CB-CD2 4.32Å; L174-L265 HydrophobicContact CD2-CD2 4.3Å; N175-L265 HydrophobicContact CB-CD1 3.84Å; N175-L265 HydrophobicContact CB-CD2 3.93Å; Q249-L265 CarbonylContact C-O 3.56Å; Q249-L265 WeakPolarHBondContact CA-O 3.42Å; I250-L265 HydrophobicContact CB-CB 4.29Å; I250-L265 PolarHBondContact N-O 3.39Å; I250-L265 PolarHBondContact O-N 3.11Å; L265-V267 HydrophobicContact CD2-CG2 3.92Å; L265-V267 HydrophobicContact CG-CG2 3.84Å; L265-V267 PolarHBondContact O-N 3.41Å
266	N	90.4	Very high	82.5	Confident	43 Å²	43	51.6 Å²	51.6	23%	0.23	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	108.2	173.1	-59.8	-43.6	0	0	0	108.6	D155 Q156 Q157 Q249	D155-N266 PolarHBondContact O-N 2.76Å; Q156-N266 WeakPolarHBondContact CA-O 3.17Å; Q156-N266 HydrophobicContact CG-CB 4.42Å; Q157-N266 PolarHBondContact N-O 2.73Å; Q249-N266 PolarHBondContact NE2-OD1 2.67Å
267	V	89.2	Confident	82.7	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.5	-179.7	-174.9	0	0	0	0	109	Q157 I159 L174 S247 F248 I250 L265 V269	Q157-V267 WeakPolarHBondContact O-CA 3.49Å; I159-V267 HydrophobicContact CD1-CG1 3.57Å; I159-V267 HydrophobicContact CG1-CG1 4.04Å; L174-V267 HydrophobicContact CD2-CG1 4.24Å; L174-V267 HydrophobicContact CD2-CG2 3.85Å; S247-V267 WeakPolarHBondContact CA-O 3.07Å; F248-V267 HydrophobicContact CD1-CB 4.38Å; F248-V267 HydrophobicContact CD2-CB 4.16Å; F248-V267 HydrophobicContact CE1-CB 4.02Å; F248-V267 HydrophobicContact CE1-CG1 3.78Å; F248-V267 HydrophobicContact CE2-CB 3.78Å; F248-V267 HydrophobicContact CE2-CG1 4.1Å; F248-V267 HydrophobicContact CE2-CG2 3.97Å; F248-V267 HydrophobicContact CG-CB 4.46Å; F248-V267 HydrophobicContact CZ-CB 3.7Å; F248-V267 HydrophobicContact CZ-CG1 3.52Å; F248-V267 HydrophobicContact CZ-CG2 4.23Å; F248-V267 PolarHBondContact N-O 3.14Å; F248-V267 PolarHBondContact O-N 2.57Å; F248-V267 VanDerWaalsContact O-O 3.1Å; I250-V267 HydrophobicContact CD1-CG2 3.94Å; I250-V267 HydrophobicContact CG1-CG2 4.16Å; L265-V267 HydrophobicContact CD2-CG2 3.92Å; L265-V267 HydrophobicContact CG-CG2 3.84Å; L265-V267 PolarHBondContact O-N 3.41Å; V267-V269 HydrophobicContact CG1-CG2 4.48Å
268	T	89.6	Confident	83.4	Confident	43 Å²	43	44.2 Å²	44.2	26%	0.264	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	107.9	168.9	-62.3	0	0	0	0	108.6	Q157 I158 I159 S247 L270	Q157-T268 PolarHBondContact O-N 3.15Å; I158-T268 CarbonylContact C-O 3.56Å; I158-T268 WeakPolarHBondContact CA-O 3.48Å; I159-T268 PolarHBondContact N-O 3.33Å; S247-T268 PolarHBondContact OG-OG1 3.39Å; T268-L270 HydrophobicContact CG2-CD2 3.83Å; T268-L270 HydrophobicContact CG2-CG 4.4Å
269	V	88.6	Confident	84.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	118.9	164	171.3	0	0	0	0	107.8	I159 I161 F212 L232 T245 Y246 F248 V267	I159-V269 HydrophobicContact CB-CG2 4.28Å; I159-V269 HydrophobicContact CD1-CG2 4.42Å; I161-V269 HydrophobicContact CB-CG1 4.38Å; I161-V269 HydrophobicContact CD1-CB 4.42Å; I161-V269 HydrophobicContact CD1-CG1 3.6Å; I161-V269 HydrophobicContact CD1-CG2 3.93Å; I161-V269 HydrophobicContact CG1-CG1 3.87Å; F212-V269 HydrophobicContact CE1-CG2 4.26Å; F212-V269 HydrophobicContact CE2-CG2 4.37Å; F212-V269 HydrophobicContact CZ-CB 4.34Å; F212-V269 HydrophobicContact CZ-CG1 3.97Å; F212-V269 HydrophobicContact CZ-CG2 3.98Å; L232-V269 HydrophobicContact CD2-CG2 4.3Å; T245-V269 WeakPolarHBondContact CA-O 3.49Å; Y246-V269 HydrophobicContact CD2-CG1 4.28Å; Y246-V269 PolarHBondContact N-O 3.5Å; Y246-V269 PolarHBondContact O-N 2.77Å; F248-V269 HydrophobicContact CE1-CG2 4.09Å; V267-V269 HydrophobicContact CG1-CG2 4.48Å
270	L	89.5	Confident	84.8	Confident	51 Å²	51	42.5 Å²	42.5	27%	0.267	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.7	160.4	-55.7	179.4	0	0	0	106.9	I158 I159 R160 I161 T245 T268	I158-L270 HydrophobicContact CG2-CD1 3.55Å; I158-L270 HydrophobicContact CG2-CG 3.82Å; I159-L270 PolarHBondContact O-N 3.47Å; R160-L270 WeakPolarHBondContact CA-O 3.43Å; I161-L270 PolarHBondContact N-O 2.83Å; T245-L270 HydrophobicContact CG2-CD2 3.67Å; T268-L270 HydrophobicContact CG2-CD2 3.83Å; T268-L270 HydrophobicContact CG2-CG 4.4Å
271	V	89.2	Confident	85.5	Confident	8 Å²	8	37.5 Å²	37.5	5%	0.048	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	130.4	168.6	-174.4	0	0	0	0	107.4	I161 E163 L238 Y240 Q243 K244 Y246	I161-V271 CarbonylContact O-C 3.58Å; I161-V271 WeakPolarHBondContact O-CA 3.14Å; E163-V271 HydrophobicContact CB-CG1 3.89Å; L238-V271 HydrophobicContact CB-CG1 4.28Å; L238-V271 HydrophobicContact CB-CG2 4.47Å; L238-V271 HydrophobicContact CD1-CG2 4.23Å; Y240-V271 HydrophobicContact CD2-CB 3.96Å; Y240-V271 HydrophobicContact CD2-CG1 4.03Å; Y240-V271 WeakPolarHBondContact CD2-O 3.24Å; Y240-V271 WeakPolarHBondContact CE2-O 3.21Å; Y240-V271 HydrophobicContact CG-CG1 4.44Å; Q243-V271 VanDerWaalsContact O-CG2 3.3Å; Q243-V271 WeakPolarHBondContact O-CG2 3.42Å; K244-V271 PolarHBondContact O-N 3.3Å; Y246-V271 HydrophobicContact CD2-CG2 4.07Å; Y246-V271 HydrophobicContact CE2-CG2 3.72Å
272	E	85.7	Confident	85.4	Confident	66 Å²	66	43.6 Å²	43.6	31%	0.308	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	105.5	172.1	-69.8	-166.7	145.4	0	0	109.1	R160 I161 R162 E163 C274	R160-E272 HydrophobicContact CB-CG 3.95Å; R160-E272 WeakPolarHBondContact CD-OE1 3.24Å; R160-E272 HydrophobicContact CG-CG 4.12Å; R160-E272 WeakPolarHBondContact CG-OE1 3.31Å; R160-E272 IonicContact CZ-OE1 3.54Å; R160-E272 IonicContact NE-OE1 3.2Å; R160-E272 IonicContact NH1-OE1 3.13Å; R160-E272 PolarHBondContact NH1-OE1 2.85Å; I161-E272 PolarHBondContact O-N 2.69Å; R162-E272 WeakPolarHBondContact CA-O 3.08Å; R162-E272 HydrophobicContact CG-CB 4.29Å; E163-E272 PolarHBondContact N-O 3.09Å; E272-C274 PolarHBondContact O-SG 2.84Å
273	D	86.9	Confident	85	Confident	23 Å²	23	46.2 Å²	46.2	12%	0.123	23%	0.229	C	C	.	.			trans	-28.5	127.2	162.7	-175.4	83.8	0	0	0	113.8	E163 Y240 A297 N300	E163-D273 WeakPolarHBondContact OE1-CA 3.47Å; Y240-D273 HydrophobicContact CD1-CB 3.64Å; Y240-D273 WeakPolarHBondContact CD1-OD1 3.2Å; Y240-D273 HydrophobicContact CD2-CB 4.17Å; Y240-D273 HydrophobicContact CE1-CB 3.54Å; Y240-D273 WeakPolarHBondContact CE1-OD1 3.47Å; Y240-D273 HydrophobicContact CE2-CB 4.1Å; Y240-D273 HydrophobicContact CG-CB 3.98Å; D273-A297 WeakPolarHBondContact OD1-CB 3.35Å; D273-A297 PolarHBondContact OD1-N 2.67Å; D273-N300 PolarHBondContact O-ND2 3.03Å; D273-N300 VanDerWaalsContact O-ND2 3.09Å; D273-N300 WeakPolarHBondContact OD2-CB 3.41Å; D273-N300 PolarHBondContact OD2-ND2 2.9Å
274	C	83	Confident	84.5	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.014	26%	0.258	C	S	.	.			trans	-128	148.9	176.6	-64.6	0	0	0	0	110.6	R162 E163 E272 D276	R162-C274 PolarHBondContact NH1-SG 2.9Å; R162-C274 PolarHBondContact NH2-SG 3.27Å; R162-C274 VanDerWaalsContact NH2-SG 3.39Å; E163-C274 HydrophobicContact CG-CB 3.87Å; E163-C274 PolarHBondContact OE1-N 3.37Å; E272-C274 PolarHBondContact O-SG 2.84Å; C274-D276 PolarHBondContact O-N 3.49Å
275	N	81.6	Confident	83.8	Confident	72 Å²	72	50.9 Å²	50.9	39%	0.385	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	82.8	168.2	178.8	-15.4	0	0	0	110.7	H277 D296 N300 N351	N275-H277 PolarHBondContact OD1-O 2.95Å; N275-D296 WeakPolarHBondContact CA-OD2 3.45Å; N275-N300 HydrophobicContact CB-CB 4.29Å; N275-N351 WeakPolarHBondContact ND2-CB 3.23Å; N275-N351 PolarHBondContact ND2-OD1 3.07Å; N275-N351 PolarHBondContact OD1-OD1 2.86Å
276	D	80	Confident	83.2	Confident	75 Å²	75	52.1 Å²	52.1	40%	0.401	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-22.5	175.6	119.9	-22.3	0	0	0	112.6	K237 C274	K237-D276 WeakPolarHBondContact CE-OD2 3.35Å; K237-D276 IonicContact NZ-OD1 2.88Å; K237-D276 IonicContact NZ-OD2 2.89Å; K237-D276 PolarHBondContact NZ-OD2 2.74Å; C274-D276 PolarHBondContact O-N 3.49Å
277	H	78.1	Confident	82	Confident	48 Å²	48	55.2 Å²	55.2	22%	0.222	29%	0.291	C	S	.	.	S	Bend	trans	-78.7	165.5	155.2	-56	86.7	0	0	0	111.2	E241 N275 E295 D296	E241-H277 IonicContact OE2-CE1 2.77Å; E241-H277 IonicContact OE2-ND1 3.73Å; N275-H277 PolarHBondContact OD1-O 2.95Å; H277-E295 HydrophobicContact CB-CB 4.45Å; H277-D296 VanDerWaalsContact CB-OD1 3.25Å; H277-D296 WeakPolarHBondContact CB-OD1 3.26Å; H277-D296 IonicContact CG-OD1 3.51Å; H277-D296 PolarHBondContact N-OD1 2.63Å; H277-D296 IonicContact ND1-OD1 3.64Å; H277-D296 PolarHBondContact ND1-OD1 3.22Å
278	M	74.2	Confident	80.8	Confident	63 Å²	63	60.8 Å²	60.8	31%	0.31	32%	0.324	S	S	.	.			trans	-137.5	136.7	176.8	-65.8	-167.4	71.1	0	0	109.4	T280 K367	M278-T280 VanDerWaalsContact O-CG2 3.25Å; M278-T280 WeakPolarHBondContact O-CG2 3.28Å; M278-T280 PolarHBondContact O-N 2.65Å; M278-T280 VanDerWaalsContact O-N 3.12Å; M278-K367 WeakPolarHBondContact CE-O 3.39Å; M278-K367 HydrophobicContact SD-CB 4.5Å; M278-K367 HydrophobicContact SD-CD 4.29Å
279	P	85.2	Confident	79.8	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.343	C	S	.	.			trans	-63.7	115.7	-165.2	16.8	-26.8	0	0	0	112.3	A292 D294 I303 A349 S369	P279-A292 HydrophobicContact CB-CB 4.13Å; P279-D294 WeakPolarHBondContact CA-OD2 3.33Å; P279-D294 HydrophobicContact CB-CB 4.17Å; P279-D294 WeakPolarHBondContact CB-OD2 2.99Å; P279-D294 WeakPolarHBondContact CD-OD2 3.42Å; P279-D294 WeakPolarHBondContact CG-OD2 3.48Å; P279-I303 HydrophobicContact CB-CD1 3.95Å; P279-I303 HydrophobicContact CB-CG1 4.02Å; P279-I303 HydrophobicContact CB-CG2 4.01Å; P279-I303 HydrophobicContact CG-CG2 4.34Å; P279-A349 HydrophobicContact CB-CB 3.85Å; P279-A349 HydrophobicContact CG-CB 3.73Å; P279-S369 WeakPolarHBondContact O-CB 3.28Å; P279-S369 PolarHBondContact O-OG 2.9Å
280	T	82.5	Confident	79.3	Confident	76 Å²	76	65.4 Å²	65.4	47%	0.466	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.6	-169.5	67	0	0	0	0	112.8	M278 A292 D293	M278-T280 VanDerWaalsContact O-CG2 3.25Å; M278-T280 WeakPolarHBondContact O-CG2 3.28Å; M278-T280 PolarHBondContact O-N 2.65Å; M278-T280 VanDerWaalsContact O-N 3.12Å; T280-A292 CarbonylContact O-C 3.53Å; T280-A292 WeakPolarHBondContact O-CA 3.38Å; T280-A292 WeakPolarHBondContact O-CB 3.46Å; T280-D293 PolarHBondContact N-O 3.1Å; T280-D293 PolarHBondContact O-N 2.83Å; T280-D293 PolarHBondContact OG1-O 3.12Å
281	F	84.9	Confident	78.9	Confident	30 Å²	30	68.9 Å²	68.9	13%	0.132	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.5	170.5	-72.3	-73.6	0	0	0	111.1	Q283 Y286 I290 A292 Y305 V347 A349 T371	F281-Q283 VanDerWaalsContact C-N 3.25Å; F281-Q283 PolarHBondContact O-N 2.95Å; F281-Y286 HydrophobicContact CB-CE2 4.24Å; F281-Y286 HydrophobicContact CD1-CE2 4.03Å; F281-Y286 HydrophobicContact CG-CE2 4.49Å; F281-I290 HydrophobicContact CE1-CB 4.38Å; F281-A292 HydrophobicContact CD1-CB 3.94Å; F281-A292 HydrophobicContact CE1-CB 3.85Å; F281-A292 HydrophobicContact CG-CB 4.38Å; F281-A292 HydrophobicContact CZ-CB 4.21Å; F281-Y305 HydrophobicContact CE1-CD1 4.41Å; F281-Y305 HydrophobicContact CE1-CE1 4.04Å; F281-Y305 HydrophobicContact CZ-CD1 4.29Å; F281-Y305 HydrophobicContact CZ-CE1 4.28Å; F281-V347 HydrophobicContact CZ-CG1 4.12Å; F281-A349 HydrophobicContact CE2-CB 3.71Å; F281-A349 HydrophobicContact CZ-CB 3.7Å; F281-T371 HydrophobicContact CB-CG2 4.39Å; F281-T371 HydrophobicContact CD1-CG2 3.56Å; F281-T371 HydrophobicContact CD2-CG2 3.82Å; F281-T371 HydrophobicContact CE1-CG2 3.62Å; F281-T371 HydrophobicContact CE2-CG2 3.87Å; F281-T371 HydrophobicContact CG-CG2 3.67Å; F281-T371 HydrophobicContact CZ-CG2 3.77Å
282	K	78.8	Confident	78.7	Confident	156 Å²	156	68.5 Å²	68.5	68%	0.678	36%	0.358	S	S	*	.	S	Bend	trans	-71	-14.1	179.3	-78.1	172.3	172.2	154.8	0	114.8	Y286 D293	K282-Y286 PolarHBondContact N-OH 2.75Å; K282-Y286 VanDerWaalsContact N-OH 3.11Å; K282-D293 WeakPolarHBondContact CD-OD2 3.47Å; K282-D293 WeakPolarHBondContact CE-OD2 3.23Å; K282-D293 IonicContact NZ-OD1 2.68Å; K282-D293 IonicContact NZ-OD2 3.63Å; K282-D293 PolarHBondContact NZ-OD2 3.18Å
283	Q	77.9	Confident	78.6	Confident	111 Å²	111	67.1 Å²	67.1	52%	0.519	35%	0.353	S	S	.	.			trans	-135.9	141.7	175.5	-54.6	-174.6	-51.8	0	0	110.3	F281 M285 Y286 T371	F281-Q283 VanDerWaalsContact C-N 3.25Å; F281-Q283 PolarHBondContact O-N 2.95Å; Q283-M285 VanDerWaalsContact C-N 3.26Å; Q283-M285 WeakPolarHBondContact CB-O 2.98Å; Q283-Y286 HydrophobicContact CB-CD1 4.31Å; Q283-Y286 HydrophobicContact CB-CD2 4.16Å; Q283-Y286 HydrophobicContact CB-CE1 3.97Å; Q283-Y286 HydrophobicContact CB-CE2 3.8Å; Q283-Y286 HydrophobicContact CB-CG 4.41Å; Q283-Y286 HydrophobicContact CG-CE1 4Å; Q283-Y286 PolarHBondContact N-OH 2.97Å; Q283-Y286 WeakPolarHBondContact O-CE2 3.14Å; Q283-Y286 VanDerWaalsContact OE1-CD1 3.24Å; Q283-T371 PolarHBondContact O-OG1 3.04Å
284	S	78.1	Confident	78.6	Confident	98 Å²	98	67.5 Å²	67.5	69%	0.685	36%	0.355	S	S	*	.	S	Bend	trans	-72.8	-21.2	172.5	51.9	0	0	0	0	112.9	T371 Q372	S284-T371 VanDerWaalsContact C-OG1 3.32Å; S284-T371 PolarHBondContact O-OG1 3.21Å; S284-Q372 PolarHBondContact O-N 3.5Å; S284-Q372 VanDerWaalsContact O-N 3.12Å
285	M	75.7	Confident	78.8	Confident	103 Å²	103	73.6 Å²	73.6	51%	0.507	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.4	172.6	-64.4	-174.1	-68.1	0	0	111.5	Q283 Q372 I374	Q283-M285 VanDerWaalsContact C-N 3.26Å; Q283-M285 WeakPolarHBondContact CB-O 2.98Å; M285-Q372 WeakPolarHBondContact CA-O 3.15Å; M285-Q372 HydrophobicContact CG-CB 4.27Å; M285-I374 HydrophobicContact SD-CD1 3.58Å; M285-I374 VanDerWaalsContact SD-CD1 3.58Å
286	Y	77.1	Confident	79	Confident	25 Å²	25	70.7 Å²	70.7	10%	0.098	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	159.9	174	-66.8	-95.6	0	0	0	110.8	F281 K282 Q283 N289 I290 K291 T371 Q372 V373 I374	F281-Y286 HydrophobicContact CB-CE2 4.24Å; F281-Y286 HydrophobicContact CD1-CE2 4.03Å; F281-Y286 HydrophobicContact CG-CE2 4.49Å; K282-Y286 PolarHBondContact N-OH 2.75Å; K282-Y286 VanDerWaalsContact N-OH 3.11Å; Q283-Y286 HydrophobicContact CB-CD1 4.31Å; Q283-Y286 HydrophobicContact CB-CD2 4.16Å; Q283-Y286 HydrophobicContact CB-CE1 3.97Å; Q283-Y286 HydrophobicContact CB-CE2 3.8Å; Q283-Y286 HydrophobicContact CB-CG 4.41Å; Q283-Y286 HydrophobicContact CG-CE1 4Å; Q283-Y286 PolarHBondContact N-OH 2.97Å; Q283-Y286 WeakPolarHBondContact O-CE2 3.14Å; Q283-Y286 VanDerWaalsContact OE1-CD1 3.24Å; Y286-N289 WeakPolarHBondContact CD1-O 3.42Å; Y286-I290 HydrophobicContact CD1-CG2 4.44Å; Y286-I290 HydrophobicContact CD2-CG2 3.74Å; Y286-I290 HydrophobicContact CE2-CG2 4.33Å; Y286-I290 HydrophobicContact CG-CG2 3.79Å; Y286-K291 PolarHBondContact OH-O 2.93Å; Y286-T371 HydrophobicContact CD2-CG2 3.88Å; Y286-T371 VanDerWaalsContact CD2-OG1 3.31Å; Y286-T371 WeakPolarHBondContact CD2-OG1 3.36Å; Y286-T371 HydrophobicContact CE2-CG2 3.95Å; Y286-T371 WeakPolarHBondContact CE2-OG1 3.48Å; Y286-Q372 PolarHBondContact N-O 2.63Å; Y286-Q372 VanDerWaalsContact N-O 3.14Å; Y286-V373 WeakPolarHBondContact O-CA 3.16Å; Y286-I374 PolarHBondContact O-N 2.64Å; Y286-I374 VanDerWaalsContact O-N 3.07Å
287	T	66.5	Low	79.1	Confident	109 Å²	109	68.2 Å²	68.2	67%	0.669	36%	0.357	S	S	*	.	S	Bend	trans	-112.3	-37.5	-177.8	50.2	0	0	0	0	115.2
288	V	63.3	Low	79.2	Confident	117 Å²	117	73.2 Å²	73.2	71%	0.709	39%	0.386	S	S	*	.	S	Bend	trans	-138.6	-30.4	-173.5	-173.3	0	0	0	0	114.4
289	N	68.9	Low	79.4	Confident	125 Å²	125	76 Å²	76	67%	0.668	40%	0.398	S	S	*	.			trans	-135.1	140.8	175.6	-74.4	-64.3	0	0	0	109.8	Y286	Y286-N289 WeakPolarHBondContact CD1-O 3.42Å
290	I	77.5	Confident	79.1	Confident	16 Å²	16	78.2 Å²	78.2	8%	0.082	41%	0.41	C	S	.	.			trans	-111.9	151.3	170.4	53.8	169.5	0	0	0	110	F281 Y286 Y305 I322 G327 I329 V347 T371 V373	F281-I290 HydrophobicContact CE1-CB 4.38Å; Y286-I290 HydrophobicContact CD1-CG2 4.44Å; Y286-I290 HydrophobicContact CD2-CG2 3.74Å; Y286-I290 HydrophobicContact CE2-CG2 4.33Å; Y286-I290 HydrophobicContact CG-CG2 3.79Å; I290-Y305 HydrophobicContact CD1-CD1 4.04Å; I290-Y305 HydrophobicContact CD1-CE1 4.46Å; I290-I322 HydrophobicContact CD1-CD1 3.83Å; I290-G327 WeakPolarHBondContact CD1-O 3.45Å; I290-G327 WeakPolarHBondContact CG1-O 3.21Å; I290-I329 HydrophobicContact CD1-CD1 4.07Å; I290-I329 HydrophobicContact CD1-CG1 4.32Å; I290-I329 HydrophobicContact CG1-CD1 4.42Å; I290-V347 HydrophobicContact CD1-CB 4.48Å; I290-V347 HydrophobicContact CD1-CG1 3.81Å; I290-V347 HydrophobicContact CD1-CG2 4.36Å; I290-T371 HydrophobicContact CG2-CG2 4.28Å; I290-V373 HydrophobicContact CG2-CG2 3.4Å
291	K	82.6	Confident	78.9	Confident	124 Å²	124	75.6 Å²	75.6	54%	0.539	40%	0.397	S	S	.	.			trans	-148.6	131.2	162.9	-157	-149.8	173.9	-165.3	0	107.9	Y286 D293	Y286-K291 PolarHBondContact OH-O 2.93Å; K291-D293 WeakPolarHBondContact CE-OD1 3.46Å; K291-D293 IonicContact NZ-OD1 2.73Å; K291-D293 PolarHBondContact NZ-OD1 3.14Å
292	A	84.6	Confident	78.7	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	154.1	159.1	0	0	0	0	0	109.1	P279 T280 F281 I303 Y305 A349	P279-A292 HydrophobicContact CB-CB 4.13Å; T280-A292 CarbonylContact O-C 3.53Å; T280-A292 WeakPolarHBondContact O-CA 3.38Å; T280-A292 WeakPolarHBondContact O-CB 3.46Å; F281-A292 HydrophobicContact CD1-CB 3.94Å; F281-A292 HydrophobicContact CE1-CB 3.85Å; F281-A292 HydrophobicContact CG-CB 4.38Å; F281-A292 HydrophobicContact CZ-CB 4.21Å; A292-I303 HydrophobicContact CB-CD1 3.88Å; A292-I303 HydrophobicContact CB-CG2 4.29Å; A292-I303 VanDerWaalsContact O-CD1 3.26Å; A292-I303 WeakPolarHBondContact O-CD1 3.31Å; A292-Y305 HydrophobicContact CB-CE1 3.96Å; A292-Y305 PolarHBondContact N-OH 2.79Å; A292-Y305 PolarHBondContact O-OH 3.35Å; A292-A349 HydrophobicContact CB-CB 3.89Å
293	D	84.2	Confident	79	Confident	37 Å²	37	71 Å²	71	20%	0.198	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.3	169.1	-64.4	-73.5	0	0	0	107.8	T280 K282 K291	T280-D293 PolarHBondContact N-O 3.1Å; T280-D293 PolarHBondContact O-N 2.83Å; T280-D293 PolarHBondContact OG1-O 3.12Å; K282-D293 WeakPolarHBondContact CD-OD2 3.47Å; K282-D293 WeakPolarHBondContact CE-OD2 3.23Å; K282-D293 IonicContact NZ-OD1 2.68Å; K282-D293 IonicContact NZ-OD2 3.63Å; K282-D293 PolarHBondContact NZ-OD2 3.18Å; K291-D293 WeakPolarHBondContact CE-OD1 3.46Å; K291-D293 IonicContact NZ-OD1 2.73Å; K291-D293 PolarHBondContact NZ-OD1 3.14Å
294	D	86.8	Confident	79.3	Confident	31 Å²	31	68 Å²	68	17%	0.166	37%	0.365	C	S	.	.			trans	-118.3	155.3	175.3	-138.8	-27.9	0	0	0	108.7	P279 I303 N351	P279-D294 WeakPolarHBondContact CA-OD2 3.33Å; P279-D294 HydrophobicContact CB-CB 4.17Å; P279-D294 WeakPolarHBondContact CB-OD2 2.99Å; P279-D294 WeakPolarHBondContact CD-OD2 3.42Å; P279-D294 WeakPolarHBondContact CG-OD2 3.48Å; D294-I303 HydrophobicContact CB-CD1 4.07Å; D294-I303 HydrophobicContact CB-CG1 4.07Å; D294-N351 PolarHBondContact OD2-ND2 3.02Å
295	E	85.4	Confident	79.6	Confident	130 Å²	130	63.9 Å²	63.9	61%	0.607	34%	0.335	S	S	*	.			trans	-106.2	-26.5	-175.3	-55.9	-163.9	155.5	0	0	112.3	E241 H277	E241-E295 HydrophobicContact CG-CB 4Å; H277-E295 HydrophobicContact CB-CB 4.45Å
296	D	86.3	Confident	79.9	Confident	11 Å²	11	61.3 Å²	61.3	6%	0.059	33%	0.327	C	S	.	.	S	Bend	trans	-53.5	163.8	166	-57.5	-9.9	0	0	0	113.3	N275 H277 N300 G301 N351	N275-D296 WeakPolarHBondContact CA-OD2 3.45Å; H277-D296 VanDerWaalsContact CB-OD1 3.25Å; H277-D296 WeakPolarHBondContact CB-OD1 3.26Å; H277-D296 IonicContact CG-OD1 3.51Å; H277-D296 PolarHBondContact N-OD1 2.63Å; H277-D296 IonicContact ND1-OD1 3.64Å; H277-D296 PolarHBondContact ND1-OD1 3.22Å; D296-N300 HydrophobicContact CB-CB 3.88Å; D296-G301 WeakPolarHBondContact O-CA 3.16Å; D296-N351 PolarHBondContact OD2-ND2 3.03Å
297	A	83.1	Confident	80	Confident	23 Å²	23	62 Å²	62	19%	0.19	33%	0.33	C	S	.	.			trans	-107.9	173.9	178.9	0	0	0	0	0	116	Y240 D273 E299 N300 G301	Y240-A297 HydrophobicContact CE1-CB 3.59Å; D273-A297 WeakPolarHBondContact OD1-CB 3.35Å; D273-A297 PolarHBondContact OD1-N 2.67Å; A297-E299 PolarHBondContact O-N 2.65Å; A297-E299 VanDerWaalsContact O-N 3.13Å; A297-N300 PolarHBondContact O-N 3.26Å; A297-G301 PolarHBondContact O-N 2.94Å
298	D	79.6	Confident	80.2	Confident	152 Å²	152	58.2 Å²	58.2	81%	0.813	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.4	-107.2	173.4	-66.8	-21.9	0	0	0	115
299	E	78.1	Confident	80	Confident	123 Å²	123	57.6 Å²	57.6	58%	0.575	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.1	-179.1	-71.4	-76.6	170.6	0	0	113.3	A297 K302 P352	A297-E299 PolarHBondContact O-N 2.65Å; A297-E299 VanDerWaalsContact O-N 3.13Å; E299-K302 VanDerWaalsContact OE2-CD 3.26Å; E299-K302 WeakPolarHBondContact OE2-CD 3.09Å; E299-P352 WeakPolarHBondContact O-CD 3.47Å; E299-P352 WeakPolarHBondContact O-CG 3.21Å
300	N	78.7	Confident	79.1	Confident	46 Å²	46	60.1 Å²	60.1	25%	0.246	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-50.4	170.4	-66.6	-42.7	0	0	0	109.4	D273 N275 D296 A297 K302 N351	D273-N300 PolarHBondContact O-ND2 3.03Å; D273-N300 VanDerWaalsContact O-ND2 3.09Å; D273-N300 WeakPolarHBondContact OD2-CB 3.41Å; D273-N300 PolarHBondContact OD2-ND2 2.9Å; N275-N300 HydrophobicContact CB-CB 4.29Å; D296-N300 HydrophobicContact CB-CB 3.88Å; A297-N300 PolarHBondContact O-N 3.26Å; N300-K302 PolarHBondContact O-N 3.19Å; N300-N351 WeakPolarHBondContact O-CB 3.32Å; N300-N351 PolarHBondContact O-ND2 2.92Å
301	G	78.8	Confident	77.6	Confident	20 Å²	20	60.8 Å²	60.8	21%	0.206	32%	0.315	C	S	.	.	S	Bend	trans	-67.1	3	172.9	0	0	0	0	0	115	D296 A297 I303	D296-G301 WeakPolarHBondContact O-CA 3.16Å; A297-G301 PolarHBondContact O-N 2.94Å; G301-I303 PolarHBondContact O-N 2.98Å
302	K	80.8	Confident	76	Confident	66 Å²	66	61.7 Å²	61.7	29%	0.287	33%	0.326	S	S	.	.			trans	-75.3	105.3	174.3	-176.6	171.9	-176.1	170	0	110.9	E299 N300 I304 E325 P352	E299-K302 VanDerWaalsContact OE2-CD 3.26Å; E299-K302 WeakPolarHBondContact OE2-CD 3.09Å; N300-K302 PolarHBondContact O-N 3.19Å; K302-I304 PolarHBondContact O-N 3.09Å; K302-E325 WeakPolarHBondContact CE-OE1 3.18Å; K302-E325 IonicContact NZ-OE1 2.72Å; K302-E325 PolarHBondContact NZ-OE1 3.23Å; K302-P352 HydrophobicContact CB-CG 3.98Å; K302-P352 HydrophobicContact CD-CG 4.28Å; K302-P352 HydrophobicContact CG-CG 4.23Å; K302-P352 VanDerWaalsContact O-CD 3.29Å; K302-P352 WeakPolarHBondContact O-CD 3.35Å
303	I	84.9	Confident	74.4	Confident	24 Å²	24	65.3 Å²	65.3	12%	0.123	35%	0.346	C	S	.	.			trans	-77.5	117.7	-179.4	-47	-176.2	0	0	0	111.7	P279 A292 D294 G301 Y305 A349	P279-I303 HydrophobicContact CB-CD1 3.95Å; P279-I303 HydrophobicContact CB-CG1 4.02Å; P279-I303 HydrophobicContact CB-CG2 4.01Å; P279-I303 HydrophobicContact CG-CG2 4.34Å; A292-I303 HydrophobicContact CB-CD1 3.88Å; A292-I303 HydrophobicContact CB-CG2 4.29Å; A292-I303 VanDerWaalsContact O-CD1 3.26Å; A292-I303 WeakPolarHBondContact O-CD1 3.31Å; D294-I303 HydrophobicContact CB-CD1 4.07Å; D294-I303 HydrophobicContact CB-CG1 4.07Å; G301-I303 PolarHBondContact O-N 2.98Å; I303-Y305 HydrophobicContact CB-CE2 3.93Å; I303-Y305 HydrophobicContact CG2-CD1 4.36Å; I303-Y305 HydrophobicContact CG2-CD2 4.01Å; I303-Y305 HydrophobicContact CG2-CE1 4.01Å; I303-Y305 HydrophobicContact CG2-CE2 3.61Å; I303-Y305 HydrophobicContact CG2-CG 4.37Å; I303-A349 HydrophobicContact CG2-CB 3.79Å
304	I	83.5	Confident	72.9	Confident	47 Å²	47	68.7 Å²	68.7	24%	0.241	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	114.1	164.6	-57.6	-175.2	0	0	0	109.3	K302 S324 K350 P352	K302-I304 PolarHBondContact O-N 3.09Å; I304-S324 WeakPolarHBondContact CA-O 3.34Å; I304-K350 WeakPolarHBondContact CA-O 3.35Å; I304-K350 HydrophobicContact CB-CG 4.41Å; I304-K350 WeakPolarHBondContact CB-O 3.44Å; I304-K350 PolarHBondContact N-O 3.44Å; I304-K350 PolarHBondContact O-N 3.05Å; I304-P352 HydrophobicContact CD1-CB 3.88Å; I304-P352 HydrophobicContact CD1-CG 4.02Å; I304-P352 HydrophobicContact CG1-CG 4.28Å
305	Y	85.9	Confident	71.6	Confident	13 Å²	13	71.4 Å²	71.4	5%	0.051	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137	173.5	-61.8	-91.1	0	0	0	111.4	F281 I290 A292 I303 S324 G327	F281-Y305 HydrophobicContact CE1-CD1 4.41Å; F281-Y305 HydrophobicContact CE1-CE1 4.04Å; F281-Y305 HydrophobicContact CZ-CD1 4.29Å; F281-Y305 HydrophobicContact CZ-CE1 4.28Å; I290-Y305 HydrophobicContact CD1-CD1 4.04Å; I290-Y305 HydrophobicContact CD1-CE1 4.46Å; A292-Y305 HydrophobicContact CB-CE1 3.96Å; A292-Y305 PolarHBondContact N-OH 2.79Å; A292-Y305 PolarHBondContact O-OH 3.35Å; I303-Y305 HydrophobicContact CB-CE2 3.93Å; I303-Y305 HydrophobicContact CG2-CD1 4.36Å; I303-Y305 HydrophobicContact CG2-CD2 4.01Å; I303-Y305 HydrophobicContact CG2-CE1 4.01Å; I303-Y305 HydrophobicContact CG2-CE2 3.61Å; I303-Y305 HydrophobicContact CG2-CG 4.37Å; Y305-S324 PolarHBondContact N-O 3.1Å; Y305-G327 VanDerWaalsContact CD2-N 3.35Å
306	S	81.6	Confident	70.4	Confident	48 Å²	48	65.6 Å²	65.6	34%	0.336	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	160.6	175.7	-154.2	0	0	0	0	113	F348	S306-F348 PolarHBondContact N-O 2.74Å; S306-F348 WeakPolarHBondContact O-CD1 3.32Å; S306-F348 PolarHBondContact O-N 3.33Å
307	F	79.3	Confident	69.1	Low	39 Å²	39	67.4 Å²	67.4	17%	0.171	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	135.6	172.1	-62.7	-59.2	0	0	0	110.3	S309 F320 I322 I329 L345 V347 F348	F307-S309 PolarHBondContact O-N 2.77Å; F307-S309 VanDerWaalsContact O-N 3.13Å; F307-F320 HydrophobicContact CE2-CB 4.1Å; F307-F320 WeakPolarHBondContact CE2-O 3.24Å; F307-F320 HydrophobicContact CZ-CB 3.78Å; F307-I322 HydrophobicContact CD2-CB 4.43Å; F307-I322 HydrophobicContact CD2-CG2 3.82Å; F307-I322 HydrophobicContact CE1-CB 4.3Å; F307-I322 HydrophobicContact CE1-CD1 4.45Å; F307-I322 HydrophobicContact CE1-CG2 4.5Å; F307-I322 HydrophobicContact CE2-CB 3.81Å; F307-I322 HydrophobicContact CE2-CG2 3.67Å; F307-I322 HydrophobicContact CG-CG2 4.31Å; F307-I322 HydrophobicContact CZ-CB 3.73Å; F307-I322 HydrophobicContact CZ-CG2 4.04Å; F307-I329 HydrophobicContact CE1-CD1 4.49Å; F307-I329 HydrophobicContact CZ-CG2 4.37Å; F307-L345 HydrophobicContact CD1-CB 4.3Å; F307-L345 HydrophobicContact CE1-CB 3.97Å; F307-L345 HydrophobicContact CE1-CD1 3.99Å; F307-L345 HydrophobicContact CE1-CG 4.4Å; F307-L345 HydrophobicContact CZ-CD1 4.31Å; F307-V347 HydrophobicContact CD1-CG2 3.88Å; F307-V347 HydrophobicContact CE1-CG2 3.85Å; F307-F348 WeakPolarHBondContact O-CE1 3.34Å
308	V	70.3	Confident	68.4	Low	30 Å²	30	68.9 Å²	68.9	18%	0.182	39%	0.386	C	S	.	.			trans	-61.1	118.6	174.6	178.6	0	0	0	0	107.8	Y310 S311 K346 F348 T370	V308-Y310 PolarHBondContact O-N 3.21Å; V308-S311 PolarHBondContact O-N 3.03Å; V308-S311 VanDerWaalsContact O-N 3.13Å; V308-K346 HydrophobicContact CB-CB 4.1Å; V308-K346 HydrophobicContact CG2-CB 4.1Å; V308-K346 WeakPolarHBondContact CG2-O 3.41Å; V308-K346 PolarHBondContact N-O 3.5Å; V308-F348 HydrophobicContact CB-CD1 4.3Å; V308-F348 HydrophobicContact CG2-CB 3.99Å; V308-F348 HydrophobicContact CG2-CD1 3.66Å; V308-F348 HydrophobicContact CG2-CG 4.27Å; V308-T370 HydrophobicContact CG2-CG2 4.12Å
309	S	58.4	Low	68.3	Low	104 Å²	104	64.3 Å²	64.3	73%	0.727	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	16.5	-177	50	0	0	0	0	115.1	F307	F307-S309 PolarHBondContact O-N 2.77Å; F307-S309 VanDerWaalsContact O-N 3.13Å
310	Y	50	Low	68.6	Low	178 Å²	178	59 Å²	59	70%	0.698	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.1	46.3	177.1	-62.8	-88.2	0	0	0	109.2	V308	V308-Y310 PolarHBondContact O-N 3.21Å
311	S	46.3	Very low	68.8	Low	30 Å²	30	60.9 Å²	60.9	21%	0.21	34%	0.337	C	S	.	.			trans	-61.6	138.8	149	47.2	0	0	0	0	108.3	V308 D313	V308-S311 PolarHBondContact O-N 3.03Å; V308-S311 VanDerWaalsContact O-N 3.13Å; S311-D313 WeakPolarHBondContact CB-O 3.38Å; S311-D313 CarbonylContact O-C 3.59Å; S311-D313 PolarHBondContact O-N 2.88Å; S311-D313 PolarHBondContact OG-O 2.61Å
312	D	48.5	Very low	69	Low	144 Å²	144	61 Å²	61	77%	0.77	33%	0.333	S	S	*	.	S	Bend	trans	-63.9	-24.9	-179.6	-49.8	-94.3	0	0	0	111.2	K346	D312-K346 IonicContact OD2-NZ 2.66Å; D312-K346 PolarHBondContact OD2-NZ 3.26Å
313	D	52.1	Low	69.2	Low	75 Å²	75	61.1 Å²	61.1	40%	0.401	33%	0.334	S	S	.	.	S	Bend	trans	-82.2	111.9	160.3	-64.2	-82.4	0	0	0	111.3	S311 D315 K340	S311-D313 WeakPolarHBondContact CB-O 3.38Å; S311-D313 CarbonylContact O-C 3.59Å; S311-D313 PolarHBondContact O-N 2.88Å; S311-D313 PolarHBondContact OG-O 2.61Å; D313-D315 PolarHBondContact O-N 2.74Å; D313-K340 IonicContact OD1-NZ 2.6Å; D313-K340 PolarHBondContact OD1-NZ 2.81Å; D313-K340 IonicContact OD2-NZ 2.81Å; D313-K340 PolarHBondContact OD2-NZ 3.13Å
314	S	53.1	Low	69.1	Low	109 Å²	109	62.8 Å²	62.8	76%	0.762	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-11.9	177.9	49.4	0	0	0	0	115
315	D	58.6	Low	69	Low	88 Å²	88	65.9 Å²	65.9	47%	0.471	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-10.3	-168.8	-82.7	-63.3	0	0	0	115.7	D313 G317 N318 Y319	D313-D315 PolarHBondContact O-N 2.74Å; D315-G317 PolarHBondContact O-N 2.98Å; D315-G317 VanDerWaalsContact O-N 3.15Å; D315-N318 VanDerWaalsContact O-CB 3.28Å; D315-N318 WeakPolarHBondContact O-CB 3.42Å; D315-N318 PolarHBondContact O-N 2.9Å; D315-N318 PolarHBondContact OD1-ND2 3.23Å; D315-Y319 WeakPolarHBondContact O-CD2 3.39Å
316	D	59.7	Low	68.9	Low	7 Å²	7	69.1 Å²	69.1	4%	0.037	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-61.8	-29.3	-175.9	-80.6	-15.4	0	0	0	112.5	N318 Y319 F320 K340 H343 L345	D316-N318 PolarHBondContact O-N 3.13Å; D316-Y319 PolarHBondContact O-N 2.71Å; D316-Y319 VanDerWaalsContact O-N 3.08Å; D316-F320 PolarHBondContact O-N 2.98Å; D316-K340 VanDerWaalsContact CG-NZ 3.26Å; D316-K340 IonicContact OD1-NZ 3.81Å; D316-K340 PolarHBondContact OD1-NZ 3.16Å; D316-K340 IonicContact OD2-NZ 3.19Å; D316-K340 PolarHBondContact OD2-NZ 3.13Å; D316-H343 IonicContact OD1-CE1 2.75Å; D316-H343 IonicContact OD1-CG 3.81Å; D316-H343 IonicContact OD1-ND1 3.29Å; D316-H343 PolarHBondContact OD1-ND1 2.97Å; D316-L345 HydrophobicContact CB-CD2 3.83Å
317	G	59.4	Low	68.9	Low	49 Å²	49	67 Å²	67	51%	0.505	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-68.9	-4.5	171.4	0	0	0	0	0	115.7	D315	D315-G317 PolarHBondContact O-N 2.98Å; D315-G317 VanDerWaalsContact O-N 3.15Å
318	N	69	Low	69	Low	54 Å²	54	69.1 Å²	69.1	29%	0.289	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-87.6	-20.8	167.8	-78.8	-60.3	0	0	0	112.8	D315 D316 R333	D315-N318 VanDerWaalsContact O-CB 3.28Å; D315-N318 WeakPolarHBondContact O-CB 3.42Å; D315-N318 PolarHBondContact O-N 2.9Å; D315-N318 PolarHBondContact OD1-ND2 3.23Å; D316-N318 PolarHBondContact O-N 3.13Å; N318-R333 WeakPolarHBondContact O-CD 3.41Å; N318-R333 VanDerWaalsContact O-CG 3.27Å; N318-R333 WeakPolarHBondContact O-CG 3.37Å; N318-R333 PolarHBondContact O-NE 3.33Å; N318-R333 PolarHBondContact OD1-NH2 3.47Å
319	Y	77.1	Confident	69.7	Low	56 Å²	56	69.8 Å²	69.8	22%	0.22	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-41.6	-172	-71.5	-83.3	0	0	0	113.2	D315 D316 Q332 R333 L335	D315-Y319 WeakPolarHBondContact O-CD2 3.39Å; D316-Y319 PolarHBondContact O-N 2.71Å; D316-Y319 VanDerWaalsContact O-N 3.08Å; Y319-Q332 WeakPolarHBondContact O-CA 3.29Å; Y319-Q332 PolarHBondContact O-N 3.13Å; Y319-R333 HydrophobicContact CD1-CB 4.26Å; Y319-R333 PolarHBondContact O-N 2.9Å; Y319-R333 VanDerWaalsContact O-N 3.11Å; Y319-L335 HydrophobicContact CD1-CD2 3.99Å; Y319-L335 HydrophobicContact CG-CD2 4.3Å
320	F	83.8	Confident	70.8	Confident	11 Å²	11	68.5 Å²	68.5	5%	0.048	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	141.9	-177.1	-56.9	-90.3	0	0	0	110.5	F307 D316 I329 L331 L335 H343 L345 V375	F307-F320 HydrophobicContact CE2-CB 4.1Å; F307-F320 WeakPolarHBondContact CE2-O 3.24Å; F307-F320 HydrophobicContact CZ-CB 3.78Å; D316-F320 PolarHBondContact O-N 2.98Å; F320-I329 HydrophobicContact CB-CG2 4.18Å; F320-I329 HydrophobicContact CD1-CG2 3.95Å; F320-I329 HydrophobicContact CG-CG2 4.42Å; F320-L331 HydrophobicContact CD1-CD1 4.08Å; F320-L331 HydrophobicContact CE1-CD1 3.91Å; F320-L331 HydrophobicContact CZ-CD1 4.45Å; F320-L335 HydrophobicContact CE1-CD1 4.18Å; F320-L335 HydrophobicContact CE1-CD2 4.2Å; F320-L335 HydrophobicContact CE2-CD2 3.9Å; F320-L335 HydrophobicContact CZ-CD1 3.83Å; F320-L335 HydrophobicContact CZ-CD2 3.56Å; F320-L335 HydrophobicContact CZ-CG 4.33Å; F320-H343 HydrophobicContact CE2-CB 3.75Å; F320-H343 AromaticContact CE2-CG 3.63Å; F320-H343 AromaticContact CE2-ND1 3.72Å; F320-H343 HydrophobicContact CZ-CB 4.02Å; F320-H343 AromaticContact CZ-CG 4Å; F320-L345 HydrophobicContact CB-CD1 4.19Å; F320-L345 HydrophobicContact CD1-CD1 3.94Å; F320-L345 HydrophobicContact CD2-CD1 3.82Å; F320-L345 HydrophobicContact CD2-CD2 3.62Å; F320-L345 HydrophobicContact CD2-CG 4.33Å; F320-L345 HydrophobicContact CE1-CD1 4.25Å; F320-L345 HydrophobicContact CE2-CD1 4.15Å; F320-L345 HydrophobicContact CE2-CD2 3.89Å; F320-L345 HydrophobicContact CE2-CG 4.48Å; F320-L345 HydrophobicContact CG-CD1 3.71Å; F320-L345 HydrophobicContact CG-CD2 4.3Å; F320-L345 HydrophobicContact CZ-CD1 4.34Å; F320-V375 HydrophobicContact CE1-CB 4.36Å; F320-V375 HydrophobicContact CE1-CG1 4.04Å; F320-V375 HydrophobicContact CE1-CG2 4.04Å; F320-V375 HydrophobicContact CZ-CB 4.12Å; F320-V375 HydrophobicContact CZ-CG1 3.98Å; F320-V375 HydrophobicContact CZ-CG2 4.17Å
321	Y	83.1	Confident	72.4	Confident	86 Å²	86	64.5 Å²	64.5	34%	0.337	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.4	161.4	94.1	-105.7	0	0	0	109	H323 I329 K330 Q332	Y321-H323 HydrophobicContact CE2-CB 4.06Å; Y321-I329 WeakPolarHBondContact O-CA 3.05Å; Y321-K330 HydrophobicContact CD1-CB 3.78Å; Y321-K330 HydrophobicContact CE1-CB 3.38Å; Y321-K330 HydrophobicContact CE1-CD 4.05Å; Y321-K330 HydrophobicContact CE1-CG 4.13Å; Y321-K330 HydrophobicContact CE2-CB 4.43Å; Y321-K330 HydrophobicContact CG-CB 4.46Å; Y321-K330 PolarHBondContact N-O 2.85Å; Y321-K330 PolarHBondContact O-N 3.01Å; Y321-K330 VanDerWaalsContact O-O 3.11Å; Y321-K330 PolarHBondContact OH-NZ 3.33Å; Y321-Q332 HydrophobicContact CD1-CB 4.42Å
322	I	84.5	Confident	74	Confident	23 Å²	23	68.8 Å²	68.8	12%	0.118	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.2	173.7	-172.7	166.3	0	0	0	108.2	I290 F307 S324 I329 V347	I290-I322 HydrophobicContact CD1-CD1 3.83Å; F307-I322 HydrophobicContact CD2-CB 4.43Å; F307-I322 HydrophobicContact CD2-CG2 3.82Å; F307-I322 HydrophobicContact CE1-CB 4.3Å; F307-I322 HydrophobicContact CE1-CD1 4.45Å; F307-I322 HydrophobicContact CE1-CG2 4.5Å; F307-I322 HydrophobicContact CE2-CB 3.81Å; F307-I322 HydrophobicContact CE2-CG2 3.67Å; F307-I322 HydrophobicContact CG-CG2 4.31Å; F307-I322 HydrophobicContact CZ-CB 3.73Å; F307-I322 HydrophobicContact CZ-CG2 4.04Å; I322-S324 PolarHBondContact O-N 2.74Å; I322-I329 HydrophobicContact CB-CG1 4.36Å; I322-I329 HydrophobicContact CD1-CG1 4.05Å; I322-I329 HydrophobicContact CG1-CG1 4.02Å; I322-V347 HydrophobicContact CD1-CG1 3.58Å; I322-V347 HydrophobicContact CD1-CG2 4.11Å
323	H	83.4	Confident	75.5	Confident	69 Å²	69	68.3 Å²	68.3	32%	0.319	36%	0.356	S	S	.	.			trans	-75	112.7	178.4	-171.7	-93.7	0	0	0	109.4	Y321 E325 T326 G327 E328	Y321-H323 HydrophobicContact CE2-CB 4.06Å; H323-E325 PolarHBondContact O-N 2.9Å; H323-T326 WeakPolarHBondContact CB-OG1 3.32Å; H323-T326 PolarHBondContact ND1-OG1 2.91Å; H323-T326 PolarHBondContact O-N 3.15Å; H323-T326 VanDerWaalsContact O-N 3.12Å; H323-G327 PolarHBondContact O-N 2.92Å; H323-E328 HydrophobicContact CB-CB 4.24Å; H323-E328 PolarHBondContact N-O 3.21Å
324	S	83.4	Confident	76.8	Confident	58 Å²	58	75.7 Å²	75.7	41%	0.406	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-29	-163.4	52.1	0	0	0	0	114.8	I304 Y305 I322	I304-S324 WeakPolarHBondContact CA-O 3.34Å; Y305-S324 PolarHBondContact N-O 3.1Å; I322-S324 PolarHBondContact O-N 2.74Å
325	E	81.5	Confident	78.3	Confident	113 Å²	113	72.6 Å²	72.6	53%	0.528	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-11.6	-177.3	-60	-173.3	133.5	0	0	114.2	K302 H323	K302-E325 WeakPolarHBondContact CE-OE1 3.18Å; K302-E325 IonicContact NZ-OE1 2.72Å; K302-E325 PolarHBondContact NZ-OE1 3.23Å; H323-E325 PolarHBondContact O-N 2.9Å
326	T	83.4	Confident	79.3	Confident	81 Å²	81	70.7 Å²	70.7	50%	0.497	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-9.8	-176.2	61.2	0	0	0	0	114.1	H323 E328	H323-T326 WeakPolarHBondContact CB-OG1 3.32Å; H323-T326 PolarHBondContact ND1-OG1 2.91Å; H323-T326 PolarHBondContact O-N 3.15Å; H323-T326 VanDerWaalsContact O-N 3.12Å; T326-E328 PolarHBondContact O-N 3.07Å; T326-E328 VanDerWaalsContact O-N 3.16Å; T326-E328 WeakPolarHBondContact OG1-CB 3.45Å
327	G	81.3	Confident	80.3	Confident	2 Å²	2	72.5 Å²	72.5	2%	0.021	35%	0.351	C	S	.	.			trans	69.7	2.5	-174.7	0	0	0	0	0	113.9	I290 Y305 H323 I329	I290-G327 WeakPolarHBondContact CD1-O 3.45Å; I290-G327 WeakPolarHBondContact CG1-O 3.21Å; Y305-G327 VanDerWaalsContact CD2-N 3.35Å; H323-G327 PolarHBondContact O-N 2.92Å; G327-I329 PolarHBondContact O-N 2.91Å; G327-I329 VanDerWaalsContact O-N 3.11Å
328	E	82.9	Confident	81.1	Confident	84 Å²	84	74.7 Å²	74.7	39%	0.393	34%	0.344	S	S	.	.			trans	-69.5	110	-177.7	-167	-170.9	178.4	0	0	110.2	H323 T326 K330	H323-E328 HydrophobicContact CB-CB 4.24Å; H323-E328 PolarHBondContact N-O 3.21Å; T326-E328 PolarHBondContact O-N 3.07Å; T326-E328 VanDerWaalsContact O-N 3.16Å; T326-E328 WeakPolarHBondContact OG1-CB 3.45Å; E328-K330 HydrophobicContact CG-CG 4.23Å; E328-K330 PolarHBondContact O-N 2.96Å; E328-K330 WeakPolarHBondContact OE1-CE 3.5Å; E328-K330 IonicContact OE1-NZ 3.77Å; E328-K330 PolarHBondContact OE1-NZ 2.8Å; E328-K330 IonicContact OE2-NZ 2.99Å; E328-K330 PolarHBondContact OE2-NZ 3.41Å
329	I	83.7	Confident	81.4	Confident	45 Å²	45	78.2 Å²	78.2	23%	0.231	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	114.1	174.2	-61.2	171.8	0	0	0	108	I290 F307 F320 Y321 I322 G327 L345 V347 V373	I290-I329 HydrophobicContact CD1-CD1 4.07Å; I290-I329 HydrophobicContact CD1-CG1 4.32Å; I290-I329 HydrophobicContact CG1-CD1 4.42Å; F307-I329 HydrophobicContact CE1-CD1 4.49Å; F307-I329 HydrophobicContact CZ-CG2 4.37Å; F320-I329 HydrophobicContact CB-CG2 4.18Å; F320-I329 HydrophobicContact CD1-CG2 3.95Å; F320-I329 HydrophobicContact CG-CG2 4.42Å; Y321-I329 WeakPolarHBondContact O-CA 3.05Å; I322-I329 HydrophobicContact CB-CG1 4.36Å; I322-I329 HydrophobicContact CD1-CG1 4.05Å; I322-I329 HydrophobicContact CG1-CG1 4.02Å; G327-I329 PolarHBondContact O-N 2.91Å; G327-I329 VanDerWaalsContact O-N 3.11Å; I329-L345 HydrophobicContact CD1-CD1 4.49Å; I329-L345 HydrophobicContact CG2-CD1 4.16Å; I329-V347 HydrophobicContact CD1-CG2 4.13Å; I329-V373 HydrophobicContact CD1-CB 4.22Å; I329-V373 HydrophobicContact CD1-CG1 4.22Å; I329-V373 HydrophobicContact CD1-CG2 3.78Å
330	K	82.2	Confident	81.3	Confident	77 Å²	77	77.6 Å²	77.6	34%	0.335	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	154.7	175	-73.7	-150.8	-173.2	72.8	0	111.3	Y321 E328	Y321-K330 HydrophobicContact CD1-CB 3.78Å; Y321-K330 HydrophobicContact CE1-CB 3.38Å; Y321-K330 HydrophobicContact CE1-CD 4.05Å; Y321-K330 HydrophobicContact CE1-CG 4.13Å; Y321-K330 HydrophobicContact CE2-CB 4.43Å; Y321-K330 HydrophobicContact CG-CB 4.46Å; Y321-K330 PolarHBondContact N-O 2.85Å; Y321-K330 PolarHBondContact O-N 3.01Å; Y321-K330 VanDerWaalsContact O-O 3.11Å; Y321-K330 PolarHBondContact OH-NZ 3.33Å; E328-K330 HydrophobicContact CG-CG 4.23Å; E328-K330 PolarHBondContact O-N 2.96Å; E328-K330 WeakPolarHBondContact OE1-CE 3.5Å; E328-K330 IonicContact OE1-NZ 3.77Å; E328-K330 PolarHBondContact OE1-NZ 2.8Å; E328-K330 IonicContact OE2-NZ 2.99Å; E328-K330 PolarHBondContact OE2-NZ 3.41Å
331	L	84.3	Confident	81	Confident	94 Å²	94	80.2 Å²	80.2	49%	0.492	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122	176.9	-166.5	68	0	0	0	110.9	F320 R333 L335	F320-L331 HydrophobicContact CD1-CD1 4.08Å; F320-L331 HydrophobicContact CE1-CD1 3.91Å; F320-L331 HydrophobicContact CZ-CD1 4.45Å; L331-R333 WeakPolarHBondContact CD1-O 3.41Å; L331-R333 WeakPolarHBondContact CG-O 3.35Å; L331-L335 HydrophobicContact CD1-CD1 4.1Å; L331-L335 HydrophobicContact CD1-CD2 3.46Å; L331-L335 VanDerWaalsContact CD1-CD2 3.46Å; L331-L335 HydrophobicContact CD1-CG 3.56Å; L331-L335 HydrophobicContact CD2-CG 4.27Å
332	Q	79	Confident	80.9	Confident	119 Å²	119	78.2 Å²	78.2	56%	0.556	38%	0.379	S	S	*	.	S	Bend	trans	-96.9	-30.4	178.2	-172.2	175	-4.7	0	0	112.6	Y319 Y321	Y319-Q332 WeakPolarHBondContact O-CA 3.29Å; Y319-Q332 PolarHBondContact O-N 3.13Å; Y321-Q332 HydrophobicContact CD1-CB 4.42Å
333	R	79.6	Confident	80.5	Confident	134 Å²	134	77.3 Å²	77.3	51%	0.506	37%	0.374	S	S	.	.	S	Bend	trans	-134.6	149.9	172.7	-61.6	-174.7	-167.5	167.8	13	110.2	N318 Y319 L331 L335	N318-R333 WeakPolarHBondContact O-CD 3.41Å; N318-R333 VanDerWaalsContact O-CG 3.27Å; N318-R333 WeakPolarHBondContact O-CG 3.37Å; N318-R333 PolarHBondContact O-NE 3.33Å; N318-R333 PolarHBondContact OD1-NH2 3.47Å; Y319-R333 HydrophobicContact CD1-CB 4.26Å; Y319-R333 PolarHBondContact O-N 2.9Å; Y319-R333 VanDerWaalsContact O-N 3.11Å; L331-R333 WeakPolarHBondContact CD1-O 3.41Å; L331-R333 WeakPolarHBondContact CG-O 3.35Å; R333-L335 PolarHBondContact O-N 3.08Å
334	R	80.4	Confident	80.3	Confident	231 Å²	231	75.8 Å²	75.8	87%	0.872	37%	0.371	S	S	*	.			trans	-55	132.7	177.1	-64	-177.7	-179.5	-175.3	-1	110.6
335	L	83.6	Confident	80.1	Confident	44 Å²	44	73.2 Å²	73.2	23%	0.23	35%	0.352	C	S	.	.			trans	-73.3	163.1	170	-55.3	-176.9	0	0	0	110.1	Y319 F320 L331 R333 V375 V377	Y319-L335 HydrophobicContact CD1-CD2 3.99Å; Y319-L335 HydrophobicContact CG-CD2 4.3Å; F320-L335 HydrophobicContact CE1-CD1 4.18Å; F320-L335 HydrophobicContact CE1-CD2 4.2Å; F320-L335 HydrophobicContact CE2-CD2 3.9Å; F320-L335 HydrophobicContact CZ-CD1 3.83Å; F320-L335 HydrophobicContact CZ-CD2 3.56Å; F320-L335 HydrophobicContact CZ-CG 4.33Å; L331-L335 HydrophobicContact CD1-CD1 4.1Å; L331-L335 HydrophobicContact CD1-CD2 3.46Å; L331-L335 VanDerWaalsContact CD1-CD2 3.46Å; L331-L335 HydrophobicContact CD1-CG 3.56Å; L331-L335 HydrophobicContact CD2-CG 4.27Å; R333-L335 PolarHBondContact O-N 3.08Å; L335-V375 HydrophobicContact CD1-CG1 4.19Å; L335-V377 HydrophobicContact CB-CG1 4.11Å; L335-V377 HydrophobicContact CB-CG2 4.35Å; L335-V377 HydrophobicContact CD1-CG1 4.47Å; L335-V377 HydrophobicContact CD1-CG2 3.88Å
336	N	79.3	Confident	80	Confident	47 Å²	47	71.4 Å²	71.4	25%	0.251	34%	0.343	S	S	.	.			trans	-141.2	110.6	173.8	-178.7	-59.5	0	0	0	108.3	R338 L339 K340	N336-R338 PolarHBondContact O-N 3.28Å; N336-R338 WeakPolarHBondContact OD1-CB 3.41Å; N336-R338 PolarHBondContact OD1-N 3.02Å; N336-R338 VanDerWaalsContact OD1-N 3.08Å; N336-L339 HydrophobicContact CB-CB 4.21Å; N336-L339 HydrophobicContact CB-CD1 4.03Å; N336-L339 HydrophobicContact CB-CG 4.1Å; N336-L339 PolarHBondContact O-N 3.11Å; N336-L339 VanDerWaalsContact O-N 3.14Å; N336-L339 PolarHBondContact OD1-N 2.95Å; N336-K340 PolarHBondContact O-N 3.11Å; N336-K340 VanDerWaalsContact O-N 3.11Å
337	H	81.7	Confident	80	Confident	45 Å²	45	67.6 Å²	67.6	21%	0.208	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-36	-174.9	175.4	-119.5	0	0	0	112.7	K340 S341 V377 D379	H337-K340 CarbonylContact O-C 3.54Å; H337-K340 VanDerWaalsContact O-C 3.31Å; H337-S341 WeakPolarHBondContact CD2-CB 3.16Å; H337-S341 VanDerWaalsContact NE2-CB 3.34Å; H337-S341 WeakPolarHBondContact NE2-CB 3.26Å; H337-S341 WeakPolarHBondContact O-CA 3.41Å; H337-S341 PolarHBondContact O-N 2.87Å; H337-S341 VanDerWaalsContact O-N 3.12Å; H337-V377 HydrophobicContact CB-CB 4.35Å; H337-V377 HydrophobicContact CB-CG1 3.9Å; H337-V377 PolarHBondContact CD2-O 3.05Å; H337-D379 IonicContact CE1-OD1 3.92Å; H337-D379 PolarHBondContact CE1-OD1 2.73Å; H337-D379 IonicContact CG-OD1 3.93Å; H337-D379 WeakPolarHBondContact ND1-CB 3.43Å; H337-D379 IonicContact ND1-OD1 2.82Å; H337-D379 PolarHBondContact ND1-OD1 2.9Å
338	R	75.6	Confident	80.2	Confident	96 Å²	96	68.7 Å²	68.7	36%	0.362	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-29.9	-179.6	-166.5	-176.9	-56.6	123.3	12.5	114	N336 H383 G418 D419	N336-R338 PolarHBondContact O-N 3.28Å; N336-R338 WeakPolarHBondContact OD1-CB 3.41Å; N336-R338 PolarHBondContact OD1-N 3.02Å; N336-R338 VanDerWaalsContact OD1-N 3.08Å; R338-H383 PolarHBondContact NH1-CD2 2.78Å; R338-H383 PolarHBondContact NH1-CE1 2.89Å; R338-H383 VanDerWaalsContact NH1-CE1 3.28Å; R338-H383 PolarHBondContact NH1-NE2 3.14Å; R338-H383 PolarHBondContact NH2-CE1 2.98Å; R338-H383 PolarHBondContact NH2-ND1 2.76Å; R338-G418 VanDerWaalsContact CZ-C 3.46Å; R338-G418 VanDerWaalsContact CZ-O 3.32Å; R338-G418 PolarHBondContact NE-O 2.9Å; R338-G418 PolarHBondContact NH2-O 3.12Å; R338-G418 VanDerWaalsContact NH2-O 3.09Å; R338-D419 IonicContact CZ-OD1 3.61Å; R338-D419 IonicContact NH2-OD1 3.47Å; R338-D419 PolarHBondContact NH2-OD1 3.12Å
339	L	76.4	Confident	80.2	Confident	127 Å²	127	64.7 Å²	64.7	67%	0.665	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-43.1	172.1	-68.8	-179.3	0	0	0	111.1	N336	N336-L339 HydrophobicContact CB-CB 4.21Å; N336-L339 HydrophobicContact CB-CD1 4.03Å; N336-L339 HydrophobicContact CB-CG 4.1Å; N336-L339 PolarHBondContact O-N 3.11Å; N336-L339 VanDerWaalsContact O-N 3.14Å; N336-L339 PolarHBondContact OD1-N 2.95Å
340	K	73.6	Confident	80.1	Confident	43 Å²	43	65 Å²	65	19%	0.187	30%	0.304	C	S	.	.			trans	-157.5	107.8	-179.9	-168.7	162	178.3	-174.9	0	110.1	D313 D316 N336 H337 S342 V377	D313-K340 IonicContact OD1-NZ 2.6Å; D313-K340 PolarHBondContact OD1-NZ 2.81Å; D313-K340 IonicContact OD2-NZ 2.81Å; D313-K340 PolarHBondContact OD2-NZ 3.13Å; D316-K340 VanDerWaalsContact CG-NZ 3.26Å; D316-K340 IonicContact OD1-NZ 3.81Å; D316-K340 PolarHBondContact OD1-NZ 3.16Å; D316-K340 IonicContact OD2-NZ 3.19Å; D316-K340 PolarHBondContact OD2-NZ 3.13Å; N336-K340 PolarHBondContact O-N 3.11Å; N336-K340 VanDerWaalsContact O-N 3.11Å; H337-K340 CarbonylContact O-C 3.54Å; H337-K340 VanDerWaalsContact O-C 3.31Å; K340-S342 VanDerWaalsContact C-N 3.34Å; K340-S342 WeakPolarHBondContact CE-O 3.39Å; K340-S342 WeakPolarHBondContact CG-O 3.18Å; K340-V377 WeakPolarHBondContact O-CG2 3.17Å
341	S	77.5	Confident	80	Confident	67 Å²	67	61.6 Å²	61.6	47%	0.469	29%	0.29	S	S	.	.	S	Bend	trans	-78.3	-16.8	-176.1	54.9	0	0	0	0	114.1	H337 V377	H337-S341 WeakPolarHBondContact CD2-CB 3.16Å; H337-S341 VanDerWaalsContact NE2-CB 3.34Å; H337-S341 WeakPolarHBondContact NE2-CB 3.26Å; H337-S341 WeakPolarHBondContact O-CA 3.41Å; H337-S341 PolarHBondContact O-N 2.87Å; H337-S341 VanDerWaalsContact O-N 3.12Å; S341-V377 PolarHBondContact O-N 3.08Å
342	S	80.6	Confident	79.3	Confident	44 Å²	44	58.8 Å²	58.8	31%	0.308	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	124.8	173.2	-166.9	0	0	0	0	110.3	K340 I374 V375 N376	K340-S342 VanDerWaalsContact C-N 3.34Å; K340-S342 WeakPolarHBondContact CE-O 3.39Å; K340-S342 WeakPolarHBondContact CG-O 3.18Å; S342-I374 WeakPolarHBondContact OG-CG2 3.39Å; S342-V375 WeakPolarHBondContact CA-O 3.38Å; S342-N376 PolarHBondContact OG-OD1 2.74Å
343	H	77.4	Confident	78.5	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.019	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.3	173.1	-66.3	-103.9	0	0	0	110.1	D316 F320 L345 V375	D316-H343 IonicContact OD1-CE1 2.75Å; D316-H343 IonicContact OD1-CG 3.81Å; D316-H343 IonicContact OD1-ND1 3.29Å; D316-H343 PolarHBondContact OD1-ND1 2.97Å; F320-H343 HydrophobicContact CE2-CB 3.75Å; F320-H343 AromaticContact CE2-CG 3.63Å; F320-H343 AromaticContact CE2-ND1 3.72Å; F320-H343 HydrophobicContact CZ-CB 4.02Å; F320-H343 AromaticContact CZ-CG 4Å; H343-L345 HydrophobicContact CB-CD2 4.21Å; H343-V375 HydrophobicContact CB-CB 4.35Å; H343-V375 PolarHBondContact N-O 3.38Å; H343-V375 PolarHBondContact O-N 3.09Å
344	S	79.3	Confident	77.2	Confident	36 Å²	36	58.8 Å²	58.8	25%	0.252	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	76.4	-173.4	167.6	0	0	0	0	110.1	K346 Q372	S344-K346 PolarHBondContact O-N 2.82Å; S344-K346 VanDerWaalsContact O-N 3.1Å; S344-Q372 PolarHBondContact OG-NE2 2.89Å
345	L	79.4	Confident	75.5	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	104.1	-172	-49.7	178.4	0	0	0	110.3	F307 D316 F320 I329 H343 V347 V373 V375	F307-L345 HydrophobicContact CD1-CB 4.3Å; F307-L345 HydrophobicContact CE1-CB 3.97Å; F307-L345 HydrophobicContact CE1-CD1 3.99Å; F307-L345 HydrophobicContact CE1-CG 4.4Å; F307-L345 HydrophobicContact CZ-CD1 4.31Å; D316-L345 HydrophobicContact CB-CD2 3.83Å; F320-L345 HydrophobicContact CB-CD1 4.19Å; F320-L345 HydrophobicContact CD1-CD1 3.94Å; F320-L345 HydrophobicContact CD2-CD1 3.82Å; F320-L345 HydrophobicContact CD2-CD2 3.62Å; F320-L345 HydrophobicContact CD2-CG 4.33Å; F320-L345 HydrophobicContact CE1-CD1 4.25Å; F320-L345 HydrophobicContact CE2-CD1 4.15Å; F320-L345 HydrophobicContact CE2-CD2 3.89Å; F320-L345 HydrophobicContact CE2-CG 4.48Å; F320-L345 HydrophobicContact CG-CD1 3.71Å; F320-L345 HydrophobicContact CG-CD2 4.3Å; F320-L345 HydrophobicContact CZ-CD1 4.34Å; I329-L345 HydrophobicContact CD1-CD1 4.49Å; I329-L345 HydrophobicContact CG2-CD1 4.16Å; H343-L345 HydrophobicContact CB-CD2 4.21Å; L345-V347 HydrophobicContact CB-CG2 4.5Å; L345-V347 PolarHBondContact O-N 3.46Å; L345-V347 VanDerWaalsContact O-N 3.15Å; L345-V373 HydrophobicContact CB-CB 4.24Å; L345-V373 PolarHBondContact N-O 3.45Å; L345-V373 PolarHBondContact O-N 3.18Å; L345-V375 HydrophobicContact CD1-CG2 3.98Å
346	K	79.6	Confident	73	Confident	76 Å²	76	56.8 Å²	56.8	33%	0.33	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	98.7	169	-69.4	174.4	178.6	172.9	0	108.4	V308 D312 S344	V308-K346 HydrophobicContact CB-CB 4.1Å; V308-K346 HydrophobicContact CG2-CB 4.1Å; V308-K346 WeakPolarHBondContact CG2-O 3.41Å; V308-K346 PolarHBondContact N-O 3.5Å; D312-K346 IonicContact OD2-NZ 2.66Å; D312-K346 PolarHBondContact OD2-NZ 3.26Å; S344-K346 PolarHBondContact O-N 2.82Å; S344-K346 VanDerWaalsContact O-N 3.1Å
347	V	82.9	Confident	70.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137	176	179.8	0	0	0	0	108.8	F281 I290 F307 I322 I329 L345 T370 T371 V373	F281-V347 HydrophobicContact CZ-CG1 4.12Å; I290-V347 HydrophobicContact CD1-CB 4.48Å; I290-V347 HydrophobicContact CD1-CG1 3.81Å; I290-V347 HydrophobicContact CD1-CG2 4.36Å; F307-V347 HydrophobicContact CD1-CG2 3.88Å; F307-V347 HydrophobicContact CE1-CG2 3.85Å; I322-V347 HydrophobicContact CD1-CG1 3.58Å; I322-V347 HydrophobicContact CD1-CG2 4.11Å; I329-V347 HydrophobicContact CD1-CG2 4.13Å; L345-V347 HydrophobicContact CB-CG2 4.5Å; L345-V347 PolarHBondContact O-N 3.46Å; L345-V347 VanDerWaalsContact O-N 3.15Å; V347-T370 CarbonylContact O-C 3.55Å; V347-T370 VanDerWaalsContact O-CA 3.28Å; V347-T370 WeakPolarHBondContact O-CA 3.43Å; V347-T371 HydrophobicContact CB-CG2 4.35Å; V347-T371 PolarHBondContact N-O 3.14Å; V347-T371 PolarHBondContact O-N 2.7Å; V347-V373 HydrophobicContact CG2-CG2 4Å
348	F	84.7	Confident	68.2	Low	25 Å²	25	67.8 Å²	67.8	11%	0.11	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	149.7	164	73.9	-85.2	0	0	0	111.5	S306 F307 V308 K350 L368 S369 T370	S306-F348 PolarHBondContact N-O 2.74Å; S306-F348 WeakPolarHBondContact O-CD1 3.32Å; S306-F348 PolarHBondContact O-N 3.33Å; F307-F348 WeakPolarHBondContact O-CE1 3.34Å; V308-F348 HydrophobicContact CB-CD1 4.3Å; V308-F348 HydrophobicContact CG2-CB 3.99Å; V308-F348 HydrophobicContact CG2-CD1 3.66Å; V308-F348 HydrophobicContact CG2-CG 4.27Å; F348-K350 HydrophobicContact CD2-CB 4.28Å; F348-K350 HydrophobicContact CD2-CG 4.2Å; F348-K350 HydrophobicContact CE2-CB 4.29Å; F348-K350 HydrophobicContact CE2-CD 3.91Å; F348-K350 HydrophobicContact CE2-CG 3.79Å; F348-L368 HydrophobicContact CB-CB 4.33Å; F348-L368 HydrophobicContact CD2-CD1 4.1Å; F348-L368 HydrophobicContact CD2-CD2 3.96Å; F348-L368 HydrophobicContact CD2-CG 4.47Å; F348-L368 HydrophobicContact CE2-CD1 4.37Å; F348-L368 HydrophobicContact CE2-CD2 4.31Å; F348-L368 HydrophobicContact CG-CD1 4.27Å; F348-S369 VanDerWaalsContact CA-O 3.23Å; F348-S369 WeakPolarHBondContact CA-O 3.49Å; F348-S369 WeakPolarHBondContact CB-O 3.48Å; F348-T370 HydrophobicContact CB-CG2 4.09Å
349	A	83.9	Confident	66.2	Low	0 Å²	0	72 Å²	72	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	143.5	164.7	0	0	0	0	0	108.4	P279 F281 A292 I303 S369	P279-A349 HydrophobicContact CB-CB 3.85Å; P279-A349 HydrophobicContact CG-CB 3.73Å; F281-A349 HydrophobicContact CE2-CB 3.71Å; F281-A349 HydrophobicContact CZ-CB 3.7Å; A292-A349 HydrophobicContact CB-CB 3.89Å; I303-A349 HydrophobicContact CG2-CB 3.79Å; A349-S369 PolarHBondContact N-O 2.85Å; A349-S369 VanDerWaalsContact N-O 3.1Å
350	K	81	Confident	64.3	Low	51 Å²	51	72.3 Å²	72.3	22%	0.222	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	163.2	167.5	67.1	159.9	-173	-179.4	0	110.8	I304 F348 D353 L368	I304-K350 WeakPolarHBondContact CA-O 3.35Å; I304-K350 HydrophobicContact CB-CG 4.41Å; I304-K350 WeakPolarHBondContact CB-O 3.44Å; I304-K350 PolarHBondContact N-O 3.44Å; I304-K350 PolarHBondContact O-N 3.05Å; F348-K350 HydrophobicContact CD2-CB 4.28Å; F348-K350 HydrophobicContact CD2-CG 4.2Å; F348-K350 HydrophobicContact CE2-CB 4.29Å; F348-K350 HydrophobicContact CE2-CD 3.91Å; F348-K350 HydrophobicContact CE2-CG 3.79Å; K350-D353 IonicContact NZ-OD2 3.21Å; K350-D353 PolarHBondContact NZ-OD2 3.22Å; K350-L368 HydrophobicContact CB-CD2 4.35Å
351	N	79.7	Confident	62.4	Low	6 Å²	6	79.3 Å²	79.3	3%	0.032	41%	0.414	C	S	.	.			trans	-74.5	169.2	169.2	-33.6	72.3	0	0	0	110.4	N275 D294 D296 N300 D353	N275-N351 WeakPolarHBondContact ND2-CB 3.23Å; N275-N351 PolarHBondContact ND2-OD1 3.07Å; N275-N351 PolarHBondContact OD1-OD1 2.86Å; D294-N351 PolarHBondContact OD2-ND2 3.02Å; D296-N351 PolarHBondContact OD2-ND2 3.03Å; N300-N351 WeakPolarHBondContact O-CB 3.32Å; N300-N351 PolarHBondContact O-ND2 2.92Å; N351-D353 PolarHBondContact O-N 3.15Å
352	P	69.9	Low	60.4	Low	36 Å²	36	80.8 Å²	80.8	23%	0.234	42%	0.424	C	S	.	.			trans	-72.2	111.5	175.1	-14.6	32.7	0	0	0	111.5	E299 K302 I304 N354	E299-P352 WeakPolarHBondContact O-CD 3.47Å; E299-P352 WeakPolarHBondContact O-CG 3.21Å; K302-P352 HydrophobicContact CB-CG 3.98Å; K302-P352 HydrophobicContact CD-CG 4.28Å; K302-P352 HydrophobicContact CG-CG 4.23Å; K302-P352 VanDerWaalsContact O-CD 3.29Å; K302-P352 WeakPolarHBondContact O-CD 3.35Å; I304-P352 HydrophobicContact CD1-CB 3.88Å; I304-P352 HydrophobicContact CD1-CG 4.02Å; I304-P352 HydrophobicContact CG1-CG 4.28Å; P352-N354 PolarHBondContact O-N 3.25Å
353	D	62.5	Low	58.2	Low	94 Å²	94	87.4 Å²	87.4	50%	0.503	45%	0.448	S	S	.	.			trans	-62.2	98.2	171.7	-67.2	-48.3	0	0	0	110.2	K350 N351 T355	K350-D353 IonicContact NZ-OD2 3.21Å; K350-D353 PolarHBondContact NZ-OD2 3.22Å; N351-D353 PolarHBondContact O-N 3.15Å; D353-T355 PolarHBondContact O-N 3.32Å
354	N	51.4	Low	56.5	Low	158 Å²	158	94.3 Å²	94.3	85%	0.845	48%	0.48	S	S	*	.			trans	-68.7	-2.3	178.5	-151.5	-9.2	0	0	0	112.8	P352 T356	P352-N354 PolarHBondContact O-N 3.25Å; N354-T356 PolarHBondContact O-N 3.11Å; N354-T356 VanDerWaalsContact O-N 3.08Å
355	T	44.5	Very low	54.6	Low	105 Å²	105	97.5 Å²	97.5	64%	0.644	50%	0.498	S	S	*	.			trans	-75.9	90.3	172.1	55.4	0	0	0	0	111.6	D353 S357	D353-T355 PolarHBondContact O-N 3.32Å; T355-S357 PolarHBondContact O-N 2.8Å
356	T	32.9	Very low	52.8	Low	128 Å²	128	102.5 Å²	102.5	79%	0.785	53%	0.533	S	S	*	.			trans	-58.8	134.8	173.4	54	0	0	0	0	112.8	N354	N354-T356 PolarHBondContact O-N 3.11Å; N354-T356 VanDerWaalsContact O-N 3.08Å
357	S	29.1	Very low	51.6	Low	100 Å²	100	106.2 Å²	106.2	70%	0.699	55%	0.549	S	S	*	.	S	Bend	trans	61.9	113.7	166.9	-70.4	0	0	0	0	119.9	T355	T355-S357 PolarHBondContact O-N 2.8Å
358	R	29.7	Very low	50.7	Low	223 Å²	223	108.9 Å²	108.9	84%	0.842	56%	0.563	S	S	*	*	S	Bend	trans	61	64.8	136.2	-52.4	175.6	-178	179.7	0.5	118.3
359	Q	33.3	Very low	50.1	Low	184 Å²	184	108.9 Å²	108.9	86%	0.86	57%	0.566	S	S	*	*			trans	177.4	89.5	132.9	-99.2	156.1	98.5	0	0	113
360	I	36.8	Very low	49.8	Very low	135 Å²	135	113 Å²	113	69%	0.692	59%	0.592	S	S	*	*			trans	-126.6	83	153.7	-55.8	-178.3	0	0	0	107.5
361	K	33.4	Very low	49.9	Very low	189 Å²	189	110.9 Å²	110.9	82%	0.822	58%	0.583	S	S	*	*			trans	-83	116.6	163.9	-77.9	-175	173.8	-177.2	0	107.8
362	S	35.6	Very low	50	Low	98 Å²	98	114 Å²	114	69%	0.685	60%	0.598	S	S	*	*	S	Bend	trans	40.5	83.7	153.4	60	0	0	0	0	117
363	F	35.9	Very low	50.5	Low	183 Å²	183	112.5 Å²	112.5	80%	0.803	59%	0.588	S	S	*	*	S	Bend	trans	-162.5	-16.1	147.1	-120.2	-74.9	0	0	0	116.1
364	H	41.9	Very low	51.3	Low	149 Å²	149	110.3 Å²	110.3	69%	0.69	58%	0.575	S	S	*	*			trans	-112.7	21.8	-175.7	-76.3	-71.3	0	0	0	116.1	S366	H364-S366 PolarHBondContact O-N 3.08Å
365	T	38	Very low	52.6	Low	103 Å²	103	104.3 Å²	104.3	63%	0.632	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-65.9	-14.8	175.6	43.2	0	0	0	0	114.2	K367	T365-K367 VanDerWaalsContact C-N 3.32Å; T365-K367 PolarHBondContact O-N 2.89Å
366	S	41.3	Very low	54.2	Low	109 Å²	109	104.6 Å²	104.6	76%	0.762	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-83.4	6	-174.9	61.4	0	0	0	0	115.7	H364	H364-S366 PolarHBondContact O-N 3.08Å
367	K	55.8	Low	56.5	Low	155 Å²	155	99.6 Å²	99.6	67%	0.674	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-112	-7.8	176.1	-108	-160.3	171.2	-155.6	0	114.2	M278 T365	M278-K367 WeakPolarHBondContact CE-O 3.39Å; M278-K367 HydrophobicContact SD-CB 4.5Å; M278-K367 HydrophobicContact SD-CD 4.29Å; T365-K367 VanDerWaalsContact C-N 3.32Å; T365-K367 PolarHBondContact O-N 2.89Å
368	L	63.2	Low	59	Low	55 Å²	55	101.8 Å²	101.8	29%	0.288	51%	0.514	S	S	.	.			trans	-67.3	134.7	-177.6	-66.9	171.5	0	0	0	111	F348 K350 T370	F348-L368 HydrophobicContact CB-CB 4.33Å; F348-L368 HydrophobicContact CD2-CD1 4.1Å; F348-L368 HydrophobicContact CD2-CD2 3.96Å; F348-L368 HydrophobicContact CD2-CG 4.47Å; F348-L368 HydrophobicContact CE2-CD1 4.37Å; F348-L368 HydrophobicContact CE2-CD2 4.31Å; F348-L368 HydrophobicContact CG-CD1 4.27Å; K350-L368 HydrophobicContact CB-CD2 4.35Å; L368-T370 HydrophobicContact CB-CG2 4.45Å; L368-T370 PolarHBondContact O-N 2.91Å
369	S	72.4	Confident	61.6	Low	26 Å²	26	92.4 Å²	92.4	18%	0.182	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	117.6	170.2	177.9	0	0	0	0	109.2	P279 F348 A349	P279-S369 WeakPolarHBondContact O-CB 3.28Å; P279-S369 PolarHBondContact O-OG 2.9Å; F348-S369 VanDerWaalsContact CA-O 3.23Å; F348-S369 WeakPolarHBondContact CA-O 3.49Å; F348-S369 WeakPolarHBondContact CB-O 3.48Å; A349-S369 PolarHBondContact N-O 2.85Å; A349-S369 VanDerWaalsContact N-O 3.1Å
370	T	78	Confident	64	Low	87 Å²	87	88.3 Å²	88.3	53%	0.534	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.6	-174.9	58	0	0	0	0	112.6	V308 V347 F348 L368	V308-T370 HydrophobicContact CG2-CG2 4.12Å; V347-T370 CarbonylContact O-C 3.55Å; V347-T370 VanDerWaalsContact O-CA 3.28Å; V347-T370 WeakPolarHBondContact O-CA 3.43Å; F348-T370 HydrophobicContact CB-CG2 4.09Å; L368-T370 HydrophobicContact CB-CG2 4.45Å; L368-T370 PolarHBondContact O-N 2.91Å
371	T	83.4	Confident	66.4	Low	6 Å²	6	83 Å²	83	4%	0.037	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	161	167.6	-166.7	0	0	0	0	110.8	F281 Q283 S284 Y286 I290 V347	F281-T371 HydrophobicContact CB-CG2 4.39Å; F281-T371 HydrophobicContact CD1-CG2 3.56Å; F281-T371 HydrophobicContact CD2-CG2 3.82Å; F281-T371 HydrophobicContact CE1-CG2 3.62Å; F281-T371 HydrophobicContact CE2-CG2 3.87Å; F281-T371 HydrophobicContact CG-CG2 3.67Å; F281-T371 HydrophobicContact CZ-CG2 3.77Å; Q283-T371 PolarHBondContact O-OG1 3.04Å; S284-T371 VanDerWaalsContact C-OG1 3.32Å; S284-T371 PolarHBondContact O-OG1 3.21Å; Y286-T371 HydrophobicContact CD2-CG2 3.88Å; Y286-T371 VanDerWaalsContact CD2-OG1 3.31Å; Y286-T371 WeakPolarHBondContact CD2-OG1 3.36Å; Y286-T371 HydrophobicContact CE2-CG2 3.95Å; Y286-T371 WeakPolarHBondContact CE2-OG1 3.48Å; I290-T371 HydrophobicContact CG2-CG2 4.28Å; V347-T371 HydrophobicContact CB-CG2 4.35Å; V347-T371 PolarHBondContact N-O 3.14Å; V347-T371 PolarHBondContact O-N 2.7Å
372	Q	80.5	Confident	68.9	Low	72 Å²	72	78.3 Å²	78.3	34%	0.336	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	113.1	-177.7	-176	-179.5	2.6	0	0	110.3	S284 M285 Y286 S344 I374	S284-Q372 PolarHBondContact O-N 3.5Å; S284-Q372 VanDerWaalsContact O-N 3.12Å; M285-Q372 WeakPolarHBondContact CA-O 3.15Å; M285-Q372 HydrophobicContact CG-CB 4.27Å; Y286-Q372 PolarHBondContact N-O 2.63Å; Y286-Q372 VanDerWaalsContact N-O 3.14Å; S344-Q372 PolarHBondContact OG-NE2 2.89Å; Q372-I374 HydrophobicContact CG-CG1 4.19Å
373	V	81.2	Confident	71.3	Confident	4 Å²	4	76 Å²	76	2%	0.024	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	117.9	173.7	-169.4	0	0	0	0	108.8	Y286 I290 I329 L345 V347 V375	Y286-V373 WeakPolarHBondContact O-CA 3.16Å; I290-V373 HydrophobicContact CG2-CG2 3.4Å; I329-V373 HydrophobicContact CD1-CB 4.22Å; I329-V373 HydrophobicContact CD1-CG1 4.22Å; I329-V373 HydrophobicContact CD1-CG2 3.78Å; L345-V373 HydrophobicContact CB-CB 4.24Å; L345-V373 PolarHBondContact N-O 3.45Å; L345-V373 PolarHBondContact O-N 3.18Å; V347-V373 HydrophobicContact CG2-CG2 4Å; V373-V375 HydrophobicContact CG1-CG2 4.23Å
374	I	79.4	Confident	73.8	Confident	47 Å²	47	72.6 Å²	72.6	24%	0.241	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	101.4	179.4	-61.1	-177.1	0	0	0	108.5	M285 Y286 S342 Q372 N376	M285-I374 HydrophobicContact SD-CD1 3.58Å; M285-I374 VanDerWaalsContact SD-CD1 3.58Å; Y286-I374 PolarHBondContact O-N 2.64Å; Y286-I374 VanDerWaalsContact O-N 3.07Å; S342-I374 WeakPolarHBondContact OG-CG2 3.39Å; Q372-I374 HydrophobicContact CG-CG1 4.19Å; I374-N376 WeakPolarHBondContact CG2-OD1 2.97Å; I374-N376 PolarHBondContact O-N 3.48Å
375	V	78.7	Confident	76.2	Confident	32 Å²	32	65.5 Å²	65.5	19%	0.194	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	93.1	175.1	-175.5	0	0	0	0	108.4	F320 L335 S342 H343 L345 V373 V377	F320-V375 HydrophobicContact CE1-CB 4.36Å; F320-V375 HydrophobicContact CE1-CG1 4.04Å; F320-V375 HydrophobicContact CE1-CG2 4.04Å; F320-V375 HydrophobicContact CZ-CB 4.12Å; F320-V375 HydrophobicContact CZ-CG1 3.98Å; F320-V375 HydrophobicContact CZ-CG2 4.17Å; L335-V375 HydrophobicContact CD1-CG1 4.19Å; S342-V375 WeakPolarHBondContact CA-O 3.38Å; H343-V375 HydrophobicContact CB-CB 4.35Å; H343-V375 PolarHBondContact N-O 3.38Å; H343-V375 PolarHBondContact O-N 3.09Å; L345-V375 HydrophobicContact CD1-CG2 3.98Å; V373-V375 HydrophobicContact CG1-CG2 4.23Å; V375-V377 PolarHBondContact O-N 3.12Å
376	N	78.4	Confident	78.7	Confident	112 Å²	112	68.5 Å²	68.5	60%	0.599	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	117.7	170.5	-68.4	-26.7	0	0	0	109.2	S342 I374 I378	S342-N376 PolarHBondContact OG-OD1 2.74Å; I374-N376 WeakPolarHBondContact CG2-OD1 2.97Å; I374-N376 PolarHBondContact O-N 3.48Å; N376-I378 PolarHBondContact O-N 2.96Å
377	V	81.2	Confident	81.1	Confident	23 Å²	23	64.7 Å²	64.7	14%	0.139	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-79.8	118.1	177.3	-168.4	0	0	0	0	107.5	L335 H337 K340 S341 V375	L335-V377 HydrophobicContact CB-CG1 4.11Å; L335-V377 HydrophobicContact CB-CG2 4.35Å; L335-V377 HydrophobicContact CD1-CG1 4.47Å; L335-V377 HydrophobicContact CD1-CG2 3.88Å; H337-V377 HydrophobicContact CB-CB 4.35Å; H337-V377 HydrophobicContact CB-CG1 3.9Å; H337-V377 PolarHBondContact CD2-O 3.05Å; K340-V377 WeakPolarHBondContact O-CG2 3.17Å; S341-V377 PolarHBondContact O-N 3.08Å; V375-V377 PolarHBondContact O-N 3.12Å
378	I	81.6	Confident	82.8	Confident	146 Å²	146	64.9 Å²	64.9	75%	0.749	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-75.9	130.1	173.9	-60.2	176.4	0	0	0	108.1	N376 V380	N376-I378 PolarHBondContact O-N 2.96Å; I378-V380 PolarHBondContact O-N 2.75Å; I378-V380 VanDerWaalsContact O-N 3.14Å
379	D	83.3	Confident	84	Confident	25 Å²	25	63.4 Å²	63.4	13%	0.134	31%	0.314	C	S	.	.			trans	-62.7	108.6	171.5	-164.5	62.6	0	0	0	110.3	H337 T420 N423	H337-D379 IonicContact CE1-OD1 3.92Å; H337-D379 PolarHBondContact CE1-OD1 2.73Å; H337-D379 IonicContact CG-OD1 3.93Å; H337-D379 WeakPolarHBondContact ND1-CB 3.43Å; H337-D379 IonicContact ND1-OD1 2.82Å; H337-D379 PolarHBondContact ND1-OD1 2.9Å; D379-T420 VanDerWaalsContact CB-OG1 3.32Å; D379-T420 WeakPolarHBondContact CB-OG1 3.32Å; D379-T420 PolarHBondContact OD1-OG1 3.38Å; D379-T420 WeakPolarHBondContact OD2-CA 3.23Å; D379-T420 PolarHBondContact OD2-N 2.81Å; D379-T420 PolarHBondContact OD2-OG1 2.77Å; D379-N423 PolarHBondContact O-ND2 3.49Å; D379-N423 PolarHBondContact OD2-ND2 3.13Å
380	V	84.8	Confident	84.8	Confident	98 Å²	98	65.3 Å²	65.3	59%	0.594	32%	0.321	S	S	*	.			trans	-91.1	141.8	168.6	178.8	0	0	0	0	106.8	I378 D382	I378-V380 PolarHBondContact O-N 2.75Å; I378-V380 VanDerWaalsContact O-N 3.14Å; V380-D382 VanDerWaalsContact C-N 3.26Å; V380-D382 HydrophobicContact CB-CB 4.49Å; V380-D382 HydrophobicContact CG1-CB 4.32Å; V380-D382 PolarHBondContact O-N 3.05Å
381	N	87.5	Confident	85.3	Confident	24 Å²	24	61.8 Å²	61.8	13%	0.128	30%	0.3	C	S	.	.	S	Bend	trans	-68.1	86.3	172.3	-155.2	56.2	0	0	0	108.2	D419 N423 D484 P488 L490	N381-D419 WeakPolarHBondContact CA-OD2 3.29Å; N381-N423 HydrophobicContact CB-CB 4.43Å; N381-N423 WeakPolarHBondContact OD1-CA 3.18Å; N381-N423 WeakPolarHBondContact OD1-CB 3.48Å; N381-N423 PolarHBondContact OD1-OD1 3.26Å; N381-D484 PolarHBondContact ND2-OD2 3.42Å; N381-D484 PolarHBondContact OD1-OD2 2.81Å; N381-P488 PolarHBondContact ND2-O 2.95Å; N381-L490 PolarHBondContact ND2-N 2.85Å; N381-L490 WeakPolarHBondContact O-CD1 2.85Å
382	D	85.9	Confident	85.3	Confident	90 Å²	90	66.1 Å²	66.1	48%	0.481	33%	0.329	S	S	.	.			trans	-127	-5	-169.4	94.7	-36.6	0	0	0	113.7	V380 D419	V380-D382 VanDerWaalsContact C-N 3.26Å; V380-D382 HydrophobicContact CB-CB 4.49Å; V380-D382 HydrophobicContact CG1-CB 4.32Å; V380-D382 PolarHBondContact O-N 3.05Å; D382-D419 PolarHBondContact N-OD2 2.85Å
383	H	84.6	Confident	85.4	Confident	49 Å²	49	68 Å²	68	23%	0.227	35%	0.345	C	S	.	.	S	Bend	trans	-112.3	147.2	165.9	-64.3	73.5	0	0	0	112.1	R338 D419 L490	R338-H383 PolarHBondContact NH1-CD2 2.78Å; R338-H383 PolarHBondContact NH1-CE1 2.89Å; R338-H383 VanDerWaalsContact NH1-CE1 3.28Å; R338-H383 PolarHBondContact NH1-NE2 3.14Å; R338-H383 PolarHBondContact NH2-CE1 2.98Å; R338-H383 PolarHBondContact NH2-ND1 2.76Å; H383-D419 WeakPolarHBondContact CB-OD1 3.48Å; H383-D419 IonicContact CG-OD1 2.58Å; H383-D419 PolarHBondContact N-OD2 2.87Å; H383-D419 IonicContact ND1-OD1 3.41Å; H383-D419 PolarHBondContact ND1-OD1 2.96Å; H383-L490 VanDerWaalsContact O-CD1 3.3Å; H383-L490 WeakPolarHBondContact O-CD1 3.48Å
384	F	88.8	Confident	85.3	Confident	113 Å²	113	71.1 Å²	71.1	50%	0.496	38%	0.378	S	S	.	.			trans	-95	141.7	178.8	-65.2	-110.7	0	0	0	109.2	R386 L490 S492	F384-R386 VanDerWaalsContact O-CG 3.27Å; F384-R386 WeakPolarHBondContact O-CG 3.11Å; F384-R386 PolarHBondContact O-N 2.9Å; F384-R386 VanDerWaalsContact O-N 3.09Å; F384-L490 HydrophobicContact CD1-CB 3.83Å; F384-L490 HydrophobicContact CD1-CD1 4.49Å; F384-L490 HydrophobicContact CD1-CD2 4.46Å; F384-L490 HydrophobicContact CD1-CG 4.48Å; F384-L490 HydrophobicContact CD2-CD1 4.04Å; F384-L490 HydrophobicContact CE1-CB 4.09Å; F384-L490 HydrophobicContact CE1-CD2 3.87Å; F384-L490 HydrophobicContact CE1-CG 4.37Å; F384-L490 HydrophobicContact CE2-CD1 4.05Å; F384-L490 HydrophobicContact CE2-CD2 4.41Å; F384-L490 HydrophobicContact CG-CB 4.19Å; F384-L490 HydrophobicContact CG-CD1 4.26Å; F384-L490 HydrophobicContact CZ-CD1 4.28Å; F384-L490 HydrophobicContact CZ-CD2 3.84Å; F384-L490 HydrophobicContact CZ-CG 4.49Å; F384-S492 WeakPolarHBondContact CB-OG 3.17Å
385	P	91.8	Very high	85.4	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.377	C	S	.	.			trans	-52.9	115.7	-178.6	-30.5	34.2	0	0	0	112.7	I387 V415 D417 V426 C482 D484 S492	P385-I387 PolarHBondContact O-N 3Å; P385-V415 HydrophobicContact CB-CG1 4.17Å; P385-D417 VanDerWaalsContact CA-OD2 3.23Å; P385-D417 WeakPolarHBondContact CA-OD2 3.36Å; P385-D417 WeakPolarHBondContact CD-OD2 3.3Å; P385-D417 VanDerWaalsContact CG-OD2 3.29Å; P385-D417 WeakPolarHBondContact CG-OD2 3.36Å; P385-V426 HydrophobicContact CB-CG1 3.73Å; P385-V426 HydrophobicContact CB-CG2 3.88Å; P385-V426 HydrophobicContact CG-CG1 4.03Å; P385-V426 HydrophobicContact CG-CG2 4.05Å; P385-C482 HydrophobicContact CB-CB 4.16Å; P385-D484 HydrophobicContact CG-CB 4.31Å; P385-S492 WeakPolarHBondContact O-CB 3.31Å; P385-S492 PolarHBondContact O-OG 3.29Å
386	R	90.9	Very high	85.4	Confident	166 Å²	166	78.8 Å²	78.8	63%	0.626	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	100.1	-171.7	-48.9	-172.3	83.4	-176	7.4	110.1	F384 F416	F384-R386 VanDerWaalsContact O-CG 3.27Å; F384-R386 WeakPolarHBondContact O-CG 3.11Å; F384-R386 PolarHBondContact O-N 2.9Å; F384-R386 VanDerWaalsContact O-N 3.09Å; R386-F416 WeakPolarHBondContact CA-O 3.21Å; R386-F416 WeakPolarHBondContact CB-O 3.41Å; R386-F416 WeakPolarHBondContact CG-O 3.27Å; R386-F416 PolarHBondContact N-O 2.79Å; R386-F416 PolarHBondContact O-N 2.89Å
387	I	92.1	Very high	85.6	Confident	29 Å²	29	75.2 Å²	75.2	15%	0.149	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	125.7	-179.8	-48.7	175	0	0	0	109.9	P385 I413 V415 V480 C482 L494	P385-I387 PolarHBondContact O-N 3Å; I387-I413 HydrophobicContact CG2-CG2 4.1Å; I387-V415 HydrophobicContact CG1-CG1 4.25Å; I387-V415 HydrophobicContact CG2-CG2 4.41Å; I387-V480 HydrophobicContact CD1-CB 4.1Å; I387-V480 HydrophobicContact CD1-CG1 3.98Å; I387-V480 WeakPolarHBondContact CD1-O 3.43Å; I387-V480 HydrophobicContact CG2-CB 4.29Å; I387-V480 HydrophobicContact CG2-CG1 4.03Å; I387-C482 HydrophobicContact CD1-CB 3.86Å; I387-C482 HydrophobicContact CG1-CB 4.02Å; I387-L494 HydrophobicContact CB-CB 4.2Å; I387-L494 HydrophobicContact CB-CD2 4.04Å; I387-L494 HydrophobicContact CD1-CB 3.89Å; I387-L494 HydrophobicContact CG2-CB 4.25Å; I387-L494 HydrophobicContact CG2-CD2 3.74Å
388	R	90.1	Very high	86.1	Confident	158 Å²	158	74.1 Å²	74.1	60%	0.596	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	141.2	166.9	179.1	-175.9	-66.9	159.3	-2.2	109.1	I390 I413 D414	R388-I390 HydrophobicContact CG-CG1 4.14Å; R388-I413 WeakPolarHBondContact O-CA 3.23Å; R388-D414 HydrophobicContact CB-CB 4.46Å; R388-D414 WeakPolarHBondContact CB-O 3.42Å; R388-D414 PolarHBondContact N-O 3.01Å; R388-D414 IonicContact NH1-OD2 3.15Å; R388-D414 PolarHBondContact O-N 2.93Å
389	I	90.3	Very high	86.5	Confident	24 Å²	24	70.9 Å²	70.9	12%	0.123	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	134.8	171.1	-48.8	-158.7	0	0	0	108.1	L398 I412 I413 F478 V480 L494 Y496	I389-L398 HydrophobicContact CG2-CD1 3.71Å; I389-L398 HydrophobicContact CG2-CD2 4.16Å; I389-L398 HydrophobicContact CG2-CG 3.94Å; I389-I412 WeakPolarHBondContact CA-O 3.33Å; I389-I413 HydrophobicContact CD1-CD1 4.23Å; I389-I413 HydrophobicContact CD1-CG1 3.98Å; I389-I413 HydrophobicContact CG1-CG1 4.03Å; I389-I413 HydrophobicContact CG2-CG1 4.32Å; I389-F478 HydrophobicContact CD1-CE2 4.14Å; I389-F478 HydrophobicContact CD1-CZ 4.02Å; I389-V480 HydrophobicContact CD1-CG2 4.1Å; I389-L494 HydrophobicContact CD1-CD2 4.21Å; I389-L494 HydrophobicContact CG1-CD2 4.01Å; I389-Y496 HydrophobicContact CB-CD2 4.46Å; I389-Y496 HydrophobicContact CB-CE2 4.24Å; I389-Y496 HydrophobicContact CD1-CD1 3.96Å; I389-Y496 HydrophobicContact CD1-CD2 3.89Å; I389-Y496 HydrophobicContact CD1-CE2 4.49Å; I389-Y496 HydrophobicContact CD1-CG 3.59Å; I389-Y496 HydrophobicContact CG1-CD2 4.26Å; I389-Y496 HydrophobicContact CG1-CG 4.44Å; I389-Y496 HydrophobicContact CG2-CE1 4.39Å
390	I	89.1	Confident	86.8	Confident	66 Å²	66	70 Å²	70	34%	0.338	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.2	-175.2	-55.7	176.7	0	0	0	108	R388 I412 D414	R388-I390 HydrophobicContact CG-CG1 4.14Å; I390-I412 HydrophobicContact CB-CB 4.43Å; I390-I412 PolarHBondContact N-O 3.1Å; I390-I412 PolarHBondContact O-N 3.23Å; I390-D414 HydrophobicContact CD1-CB 3.82Å; I390-D414 HydrophobicContact CG1-CB 4.42Å
391	S	87.8	Confident	87.1	Confident	13 Å²	13	69.7 Å²	69.7	9%	0.091	36%	0.359	C	S	.	.			trans	-73	138.6	172.3	176.8	0	0	0	0	111.4	T393 G394 S395	S391-T393 PolarHBondContact O-N 3.06Å; S391-T393 PolarHBondContact OG-N 3.48Å; S391-T393 PolarHBondContact OG-OG1 3.46Å; S391-G394 PolarHBondContact O-N 3.4Å; S391-G394 VanDerWaalsContact O-N 3.15Å; S391-S395 WeakPolarHBondContact CB-O 3.26Å; S391-S395 WeakPolarHBondContact CB-OG 3.39Å; S391-S395 PolarHBondContact OG-OG 2.79Å
392	P	83.3	Confident	87.3	Confident	98 Å²	98	68.8 Å²	68.8	64%	0.636	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.1	172.2	-21.1	34	0	0	0	113.3	I410	P392-I410 WeakPolarHBondContact CD-O 3.09Å
393	T	81.6	Confident	87.4	Confident	111 Å²	111	70.6 Å²	70.6	68%	0.681	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-7.4	179.1	63.9	0	0	0	0	113.3	S391 S395	S391-T393 PolarHBondContact O-N 3.06Å; S391-T393 PolarHBondContact OG-N 3.48Å; S391-T393 PolarHBondContact OG-OG1 3.46Å; T393-S395 VanDerWaalsContact C-N 3.28Å; T393-S395 WeakPolarHBondContact OG1-CB 3.27Å; T393-S395 PolarHBondContact OG1-N 2.67Å; T393-S395 PolarHBondContact OG1-OG 2.98Å
394	G	80.8	Confident	87.7	Confident	69 Å²	69	69.4 Å²	69.4	71%	0.711	36%	0.356	S	S	*	.			trans	77	7.2	-172.3	0	0	0	0	0	115	S391	S391-G394 PolarHBondContact O-N 3.4Å; S391-G394 VanDerWaalsContact O-N 3.15Å
395	S	80.5	Confident	87.8	Confident	33 Å²	33	68 Å²	68	23%	0.231	36%	0.359	C	S	.	.			trans	-61.1	158.6	170.8	55.3	0	0	0	0	112.5	S391 T393 S397	S391-S395 WeakPolarHBondContact CB-O 3.26Å; S391-S395 WeakPolarHBondContact CB-OG 3.39Å; S391-S395 PolarHBondContact OG-OG 2.79Å; T393-S395 VanDerWaalsContact C-N 3.28Å; T393-S395 WeakPolarHBondContact OG1-CB 3.27Å; T393-S395 PolarHBondContact OG1-N 2.67Å; T393-S395 PolarHBondContact OG1-OG 2.98Å; S395-S397 WeakPolarHBondContact CB-O 3.35Å; S395-S397 PolarHBondContact OG-O 3.23Å
396	K	78.7	Confident	87.8	Confident	207 Å²	207	71.4 Å²	71.4	90%	0.9	38%	0.381	S	S	*	.	S	Bend	trans	-76	-31.3	176.9	-68.8	-179.4	178.3	176.4	0	112.6	Y496	K396-Y496 PolarHBondContact O-OH 3.3Å
397	S	83.7	Confident	87.8	Confident	37 Å²	37	65.7 Å²	65.7	26%	0.259	37%	0.373	S	S	.	.	S	Bend	trans	-94.6	151	174	20.1	0	0	0	0	109.9	S395 E399 Y496	S395-S397 WeakPolarHBondContact CB-O 3.35Å; S395-S397 PolarHBondContact OG-O 3.23Å; S397-E399 WeakPolarHBondContact CB-OE1 3.41Å; S397-E399 PolarHBondContact OG-OE1 3.42Å; S397-Y496 WeakPolarHBondContact CA-OH 3.11Å
398	L	90.4	Very high	87.7	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	134.4	154.4	-67.7	-172	0	0	0	108.2	I389 I410 L462 Y496 V498 N499	I389-L398 HydrophobicContact CG2-CD1 3.71Å; I389-L398 HydrophobicContact CG2-CD2 4.16Å; I389-L398 HydrophobicContact CG2-CG 3.94Å; L398-I410 HydrophobicContact CD1-CD1 4.28Å; L398-L462 HydrophobicContact CD1-CD2 3.68Å; L398-Y496 HydrophobicContact CB-CE1 3.95Å; L398-Y496 HydrophobicContact CD1-CE1 4.16Å; L398-Y496 HydrophobicContact CG-CE1 3.69Å; L398-Y496 PolarHBondContact N-OH 2.78Å; L398-V498 HydrophobicContact CB-CB 4.43Å; L398-V498 HydrophobicContact CB-CG1 3.98Å; L398-V498 HydrophobicContact CB-CG2 4.28Å; L398-V498 HydrophobicContact CD1-CG2 4.47Å; L398-V498 WeakPolarHBondContact O-CA 3.22Å; L398-N499 PolarHBondContact O-N 3.25Å
399	E	89.6	Confident	87.7	Confident	78 Å²	78	64 Å²	64	36%	0.364	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.3	-179.2	-79	144.8	-134.1	0	0	107.6	S397 N499 L501	S397-E399 WeakPolarHBondContact CB-OE1 3.41Å; S397-E399 PolarHBondContact OG-OE1 3.42Å; E399-N499 WeakPolarHBondContact CA-O 3.5Å; E399-L501 HydrophobicContact CB-CD1 3.9Å; E399-L501 HydrophobicContact CB-CG 4.1Å; E399-L501 HydrophobicContact CG-CD1 4.39Å; E399-L501 HydrophobicContact CG-CD2 4.29Å; E399-L501 HydrophobicContact CG-CG 4.39Å
400	L	90.8	Very high	87.7	Confident	6 Å²	6	63.3 Å²	63.3	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	113.2	-176.3	171.1	59	0	0	0	108.6	E402 T404 I410 L464 I468 I476 V498 N499 V500 L501	L400-E402 PolarHBondContact O-N 2.78Å; L400-T404 HydrophobicContact CD1-CG2 3.72Å; L400-I410 HydrophobicContact CD1-CG2 3.81Å; L400-I410 HydrophobicContact CD2-CG2 4.47Å; L400-L464 HydrophobicContact CD1-CD2 4.39Å; L400-L464 HydrophobicContact CD2-CD1 4.08Å; L400-L464 HydrophobicContact CD2-CD2 4.28Å; L400-I468 HydrophobicContact CD2-CG1 4.49Å; L400-I476 HydrophobicContact CD2-CD1 4.02Å; L400-V498 HydrophobicContact CB-CG1 3.61Å; L400-N499 PolarHBondContact N-O 3.07Å; L400-V500 CarbonylContact O-C 3.31Å; L400-V500 VanDerWaalsContact O-CA 3.24Å; L400-V500 WeakPolarHBondContact O-CA 3.24Å; L400-L501 PolarHBondContact O-N 3.01Å
401	I	91.2	Very high	87.8	Confident	91 Å²	91	60.2 Å²	60.2	47%	0.467	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	137.9	171.5	-47.6	176.1	0	0	0	108.4	T404 L501 I503	I401-T404 VanDerWaalsContact O-CB 3.23Å; I401-T404 WeakPolarHBondContact O-CB 3.27Å; I401-T404 PolarHBondContact O-OG1 2.9Å; I401-L501 WeakPolarHBondContact CA-O 3.45Å; I401-L501 HydrophobicContact CG1-CB 4.29Å; I401-L501 HydrophobicContact CG1-CD1 4.35Å; I401-I503 HydrophobicContact CG2-CD1 3.69Å; I401-I503 HydrophobicContact CG2-CG1 3.67Å
402	E	91.4	Very high	87.9	Confident	5 Å²	5	63.1 Å²	63.1	2%	0.023	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	175.9	171.9	72.6	-163.3	122.2	0	0	112.9	L400 T404 R470 V500 L501 D502 I503	L400-E402 PolarHBondContact O-N 2.78Å; E402-T404 PolarHBondContact O-N 3.37Å; E402-R470 WeakPolarHBondContact OE2-CB 3.16Å; E402-R470 PolarHBondContact OE2-N 3.24Å; E402-V500 HydrophobicContact CB-CG1 3.84Å; E402-L501 PolarHBondContact N-O 2.9Å; E402-L501 VanDerWaalsContact N-O 3.09Å; E402-D502 VanDerWaalsContact OE1-CA 3.27Å; E402-D502 WeakPolarHBondContact OE1-CA 3.2Å; E402-I503 HydrophobicContact CG-CB 3.95Å; E402-I503 HydrophobicContact CG-CD1 3.98Å; E402-I503 HydrophobicContact CG-CG1 3.92Å; E402-I503 WeakPolarHBondContact O-CD1 3.37Å; E402-I503 PolarHBondContact OE1-N 2.77Å
403	E	87.8	Confident	88.3	Confident	128 Å²	128	58.4 Å²	58.4	60%	0.598	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	-5.5	-163.8	-63.8	-153.6	111	0	0	115.9	L467 I468 I503	E403-L467 WeakPolarHBondContact O-CD2 3.17Å; E403-I468 PolarHBondContact N-O 3.43Å; E403-I468 VanDerWaalsContact N-O 3.14Å; E403-I503 HydrophobicContact CB-CD1 4.3Å; E403-I503 HydrophobicContact CG-CD1 4.43Å
404	T	90.8	Very high	88.7	Confident	24 Å²	24	54 Å²	54	15%	0.147	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-51.9	126.8	-176	-74.6	0	0	0	0	111.2	L400 I401 E402 Q408 L464	L400-T404 HydrophobicContact CD1-CG2 3.72Å; I401-T404 VanDerWaalsContact O-CB 3.23Å; I401-T404 WeakPolarHBondContact O-CB 3.27Å; I401-T404 PolarHBondContact O-OG1 2.9Å; E402-T404 PolarHBondContact O-N 3.37Å; T404-Q408 HydrophobicContact CG2-CB 3.56Å; T404-Q408 HydrophobicContact CG2-CG 3.69Å; T404-L464 HydrophobicContact CG2-CD2 3.89Å; T404-L464 VanDerWaalsContact O-CD2 3.26Å; T404-L464 WeakPolarHBondContact O-CD2 3.23Å
405	P	91.6	Very high	89.2	Confident	85 Å²	85	50.7 Å²	50.7	55%	0.552	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-66.5	141.1	-171.4	23.5	-34.1	0	0	0	112.8	G407 Q408	P405-G407 PolarHBondContact O-N 3.06Å; P405-Q408 PolarHBondContact O-N 3.26Å
406	P	91.5	Very high	89.5	Confident	71 Å²	71	52.5 Å²	52.5	46%	0.461	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	133.6	172.2	-27.4	35.3	0	0	0	112.2	L467	P406-L467 HydrophobicContact CG-CG 4.32Å
407	G	90.2	Very high	90	Very high	46 Å²	46	42.6 Å²	42.6	47%	0.474	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.4	-9.8	-173.8	0	0	0	0	0	114.5	P405 T463 L464	P405-G407 PolarHBondContact O-N 3.06Å; G407-T463 WeakPolarHBondContact O-CG2 3.46Å; G407-L464 PolarHBondContact N-O 3.28Å
408	Q	90.3	Very high	90	Very high	100 Å²	100	41.4 Å²	41.4	47%	0.467	23%	0.23	S	C	.	.			trans	-66.8	132.4	172.6	-178.5	56.7	33.6	0	0	111.6	T404 P405 T463 L464	T404-Q408 HydrophobicContact CG2-CB 3.56Å; T404-Q408 HydrophobicContact CG2-CG 3.69Å; P405-Q408 PolarHBondContact O-N 3.26Å; Q408-T463 WeakPolarHBondContact O-CA 3.38Å; Q408-T463 WeakPolarHBondContact O-CG2 3.37Å; Q408-L464 PolarHBondContact O-N 3.22Å
409	D	90.4	Very high	89.8	Confident	50 Å²	50	41.6 Å²	41.6	27%	0.267	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124.2	168.4	-74.5	-33.8	0	0	0	109.7	K461 T463	D409-K461 WeakPolarHBondContact OD2-CD 3.21Å; D409-K461 VanDerWaalsContact OD2-CE 3.27Å; D409-K461 WeakPolarHBondContact OD2-CE 3.44Å; D409-K461 IonicContact OD2-NZ 2.82Å; D409-K461 PolarHBondContact OD2-NZ 2.9Å; D409-T463 PolarHBondContact OD1-OG1 2.59Å
410	I	90.6	Very high	89.5	Confident	10 Å²	10	40.9 Å²	40.9	5%	0.051	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-15.6	-176.5	69.2	156.4	0	0	0	113.3	P392 L398 L400 L439 L462 L464 V498	P392-I410 WeakPolarHBondContact CD-O 3.09Å; L398-I410 HydrophobicContact CD1-CD1 4.28Å; L400-I410 HydrophobicContact CD1-CG2 3.81Å; L400-I410 HydrophobicContact CD2-CG2 4.47Å; I410-L439 HydrophobicContact CD1-CD1 4.3Å; I410-L439 HydrophobicContact CD1-CD2 3.53Å; I410-L439 HydrophobicContact CG1-CD2 4.18Å; I410-L462 HydrophobicContact CD1-CD2 3.88Å; I410-L462 HydrophobicContact CD1-CG 4.13Å; I410-L462 HydrophobicContact CG1-CB 4.26Å; I410-L462 HydrophobicContact CG1-CD2 4.01Å; I410-L462 HydrophobicContact CG1-CG 3.91Å; I410-L462 WeakPolarHBondContact CG1-O 3.07Å; I410-L462 PolarHBondContact N-O 3Å; I410-L464 HydrophobicContact CG2-CB 4.41Å; I410-V498 HydrophobicContact CD1-CG1 4.33Å; I410-V498 HydrophobicContact CD1-CG2 3.89Å
411	G	90.1	Very high	89.1	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.8	172.1	-179.7	0	0	0	0	0	113.7	L462	G411-L462 PolarHBondContact O-N 2.85Å
412	I	91.2	Very high	88.8	Confident	73 Å²	73	45.6 Å²	45.6	37%	0.374	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128	176.2	-59.8	175.5	0	0	0	109	I389 I390 Y460	I389-I412 WeakPolarHBondContact CA-O 3.33Å; I390-I412 HydrophobicContact CB-CB 4.43Å; I390-I412 PolarHBondContact N-O 3.1Å; I390-I412 PolarHBondContact O-N 3.23Å; I412-Y460 WeakPolarHBondContact CA-O 3.49Å
413	I	91.6	Very high	88.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.8	171.5	-69	167.9	0	0	0	107.1	I387 R388 I389 V415 L441 Y460 L462 F478 V480	I387-I413 HydrophobicContact CG2-CG2 4.1Å; R388-I413 WeakPolarHBondContact O-CA 3.23Å; I389-I413 HydrophobicContact CD1-CD1 4.23Å; I389-I413 HydrophobicContact CD1-CG1 3.98Å; I389-I413 HydrophobicContact CG1-CG1 4.03Å; I389-I413 HydrophobicContact CG2-CG1 4.32Å; I413-V415 HydrophobicContact CG2-CG2 3.62Å; I413-L441 HydrophobicContact CB-CD2 4.38Å; I413-L441 HydrophobicContact CD1-CD2 3.66Å; I413-Y460 PolarHBondContact N-O 2.9Å; I413-Y460 PolarHBondContact O-N 2.63Å; I413-L462 HydrophobicContact CD1-CB 4.22Å; I413-L462 HydrophobicContact CD1-CD1 4.03Å; I413-L462 HydrophobicContact CD1-CD2 4.22Å; I413-L462 HydrophobicContact CD1-CG 4.39Å; I413-F478 HydrophobicContact CD1-CE2 4.46Å; I413-V480 HydrophobicContact CD1-CG1 4.47Å; I413-V480 HydrophobicContact CD1-CG2 3.91Å; I413-V480 HydrophobicContact CG2-CG1 4.26Å
414	D	90	Very high	88.3	Confident	17 Å²	17	41.1 Å²	41.1	9%	0.091	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	110.6	-175.7	-177.7	40.9	0	0	0	107.3	R388 I390 K459	R388-D414 HydrophobicContact CB-CB 4.46Å; R388-D414 WeakPolarHBondContact CB-O 3.42Å; R388-D414 PolarHBondContact N-O 3.01Å; R388-D414 IonicContact NH1-OD2 3.15Å; R388-D414 PolarHBondContact O-N 2.93Å; I390-D414 HydrophobicContact CD1-CB 3.82Å; I390-D414 HydrophobicContact CG1-CB 4.42Å; D414-K459 WeakPolarHBondContact OD1-CE 3.21Å; D414-K459 WeakPolarHBondContact OD1-CG 3.45Å; D414-K459 IonicContact OD1-NZ 3.95Å
415	V	90.6	Very high	88	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	117	-169.4	-167.5	0	0	0	0	109.7	P385 I387 I413 V426 N457 Q458 Y460 C482	P385-V415 HydrophobicContact CB-CG1 4.17Å; I387-V415 HydrophobicContact CG1-CG1 4.25Å; I387-V415 HydrophobicContact CG2-CG2 4.41Å; I413-V415 HydrophobicContact CG2-CG2 3.62Å; V415-V426 HydrophobicContact CG1-CB 4.47Å; V415-V426 HydrophobicContact CG1-CG1 3.94Å; V415-V426 HydrophobicContact CG1-CG2 4.46Å; V415-N457 WeakPolarHBondContact O-CA 3.48Å; V415-Q458 PolarHBondContact N-O 2.94Å; V415-Q458 PolarHBondContact O-N 2.61Å; V415-Y460 HydrophobicContact CG2-CD2 4.46Å; V415-Y460 HydrophobicContact CG2-CE2 4.48Å; V415-C482 HydrophobicContact CG1-CB 4.28Å
416	F	88.1	Confident	87.8	Confident	71 Å²	71	42 Å²	42	31%	0.311	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	111.1	-179.8	168.2	-118.2	0	0	0	109.9	R386 S456 N457	R386-F416 WeakPolarHBondContact CA-O 3.21Å; R386-F416 WeakPolarHBondContact CB-O 3.41Å; R386-F416 WeakPolarHBondContact CG-O 3.27Å; R386-F416 PolarHBondContact N-O 2.79Å; R386-F416 PolarHBondContact O-N 2.89Å; F416-S456 WeakPolarHBondContact CA-O 3.17Å; F416-N457 WeakPolarHBondContact CD2-OD1 3.41Å
417	D	87.7	Confident	87.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.237	C	C	.	.			trans	-99.1	129.4	156.3	-155.3	-53.7	0	0	0	109.4	P385 D419 V426 S456	P385-D417 VanDerWaalsContact CA-OD2 3.23Å; P385-D417 WeakPolarHBondContact CA-OD2 3.36Å; P385-D417 WeakPolarHBondContact CD-OD2 3.3Å; P385-D417 VanDerWaalsContact CG-OD2 3.29Å; P385-D417 WeakPolarHBondContact CG-OD2 3.36Å; D417-D419 PolarHBondContact OD1-N 3.09Å; D417-V426 HydrophobicContact CB-CG2 3.57Å; D417-S456 PolarHBondContact N-O 2.82Å; D417-S456 VanDerWaalsContact N-O 3.13Å; D417-S456 WeakPolarHBondContact O-CB 3.34Å
418	G	83.3	Confident	87.8	Confident	11 Å²	11	40.9 Å²	40.9	11%	0.113	22%	0.22	C	C	.	.			trans	-93.2	-4.9	-175.4	0	0	0	0	0	114.1	R338	R338-G418 VanDerWaalsContact CZ-C 3.46Å; R338-G418 VanDerWaalsContact CZ-O 3.32Å; R338-G418 PolarHBondContact NE-O 2.9Å; R338-G418 PolarHBondContact NH2-O 3.12Å; R338-G418 VanDerWaalsContact NH2-O 3.09Å
419	D	87.3	Confident	87.9	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.032	22%	0.218	C	C	.	.	S	Bend	trans	-71.5	-166.7	170.9	-65.7	-3.1	0	0	0	108.5	R338 N381 D382 H383 D417 N423 A424	R338-D419 IonicContact CZ-OD1 3.61Å; R338-D419 IonicContact NH2-OD1 3.47Å; R338-D419 PolarHBondContact NH2-OD1 3.12Å; N381-D419 WeakPolarHBondContact CA-OD2 3.29Å; D382-D419 PolarHBondContact N-OD2 2.85Å; H383-D419 WeakPolarHBondContact CB-OD1 3.48Å; H383-D419 IonicContact CG-OD1 2.58Å; H383-D419 PolarHBondContact N-OD2 2.87Å; H383-D419 IonicContact ND1-OD1 3.41Å; H383-D419 PolarHBondContact ND1-OD1 2.96Å; D417-D419 PolarHBondContact OD1-N 3.09Å; D419-N423 HydrophobicContact CB-CB 3.54Å; D419-A424 WeakPolarHBondContact O-CB 3.43Å
420	T	82.9	Confident	88.1	Confident	63 Å²	63	39.9 Å²	39.9	39%	0.387	21%	0.213	S	C	.	.			trans	-135.5	160.8	-169.6	67.2	0	0	0	0	114.8	D379 K422 N423 A424	D379-T420 VanDerWaalsContact CB-OG1 3.32Å; D379-T420 WeakPolarHBondContact CB-OG1 3.32Å; D379-T420 PolarHBondContact OD1-OG1 3.38Å; D379-T420 WeakPolarHBondContact OD2-CA 3.23Å; D379-T420 PolarHBondContact OD2-N 2.81Å; D379-T420 PolarHBondContact OD2-OG1 2.77Å; T420-K422 PolarHBondContact O-N 2.99Å; T420-N423 WeakPolarHBondContact O-CB 3.26Å; T420-N423 PolarHBondContact O-N 2.87Å; T420-A424 PolarHBondContact O-N 2.76Å
421	G	82.1	Confident	88.2	Confident	47 Å²	47	41.1 Å²	41.1	49%	0.485	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	-111.5	177.6	0	0	0	0	0	112.4
422	K	84.9	Confident	88.2	Confident	149 Å²	149	46.4 Å²	46.4	65%	0.648	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-29.3	177.1	-71.3	-171.9	175.7	-175	0	113.5	T420 A424 Q425 G485	T420-K422 PolarHBondContact O-N 2.99Å; K422-A424 VanDerWaalsContact C-N 3.26Å; K422-A424 PolarHBondContact O-N 2.66Å; K422-Q425 WeakPolarHBondContact O-CB 3.35Å; K422-Q425 PolarHBondContact O-N 2.9Å; K422-G485 CarbonylContact O-C 3.4Å; K422-G485 VanDerWaalsContact O-CA 3.22Å; K422-G485 WeakPolarHBondContact O-CA 3.4Å; K422-G485 PolarHBondContact O-N 2.99Å
423	N	85.1	Confident	88.3	Confident	26 Å²	26	44.3 Å²	44.3	14%	0.139	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-39.1	175	-58.2	-14.2	0	0	0	109.2	D379 N381 D419 T420 Q425 D484	D379-N423 PolarHBondContact O-ND2 3.49Å; D379-N423 PolarHBondContact OD2-ND2 3.13Å; N381-N423 HydrophobicContact CB-CB 4.43Å; N381-N423 WeakPolarHBondContact OD1-CA 3.18Å; N381-N423 WeakPolarHBondContact OD1-CB 3.48Å; N381-N423 PolarHBondContact OD1-OD1 3.26Å; D419-N423 HydrophobicContact CB-CB 3.54Å; T420-N423 WeakPolarHBondContact O-CB 3.26Å; T420-N423 PolarHBondContact O-N 2.87Å; N423-Q425 VanDerWaalsContact C-N 3.25Å; N423-Q425 PolarHBondContact O-N 2.98Å; N423-D484 VanDerWaalsContact O-CB 3.23Å; N423-D484 WeakPolarHBondContact O-CB 3.44Å
424	A	83.8	Confident	88.2	Confident	12 Å²	12	47.3 Å²	47.3	10%	0.099	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-13.7	172	0	0	0	0	0	115.9	D419 T420 K422 V426	D419-A424 WeakPolarHBondContact O-CB 3.43Å; T420-A424 PolarHBondContact O-N 2.76Å; K422-A424 VanDerWaalsContact C-N 3.26Å; K422-A424 PolarHBondContact O-N 2.66Å; A424-V426 PolarHBondContact O-N 2.9Å; A424-V426 VanDerWaalsContact O-N 3.1Å
425	Q	84.7	Confident	88.2	Confident	120 Å²	120	47.3 Å²	47.3	56%	0.561	26%	0.256	S	S	*	.			trans	-88.8	84	-165.6	-166.9	-178.4	-4.2	0	0	112.3	K422 N423 D484 G485	K422-Q425 WeakPolarHBondContact O-CB 3.35Å; K422-Q425 PolarHBondContact O-N 2.9Å; N423-Q425 VanDerWaalsContact C-N 3.25Å; N423-Q425 PolarHBondContact O-N 2.98Å; Q425-D484 CarbonylContact O-C 3.6Å; Q425-G485 PolarHBondContact O-N 2.04Å
426	V	88.2	Confident	88.2	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.055	28%	0.284	C	S	.	.			trans	-81.5	130.4	-175.3	-164.9	0	0	0	0	113.7	P385 V415 D417 A424 Y460 C482 W483	P385-V426 HydrophobicContact CB-CG1 3.73Å; P385-V426 HydrophobicContact CB-CG2 3.88Å; P385-V426 HydrophobicContact CG-CG1 4.03Å; P385-V426 HydrophobicContact CG-CG2 4.05Å; V415-V426 HydrophobicContact CG1-CB 4.47Å; V415-V426 HydrophobicContact CG1-CG1 3.94Å; V415-V426 HydrophobicContact CG1-CG2 4.46Å; D417-V426 HydrophobicContact CB-CG2 3.57Å; A424-V426 PolarHBondContact O-N 2.9Å; A424-V426 VanDerWaalsContact O-N 3.1Å; V426-Y460 PolarHBondContact O-OH 2.93Å; V426-C482 HydrophobicContact CG1-CB 3.7Å; V426-W483 CarbonylContact C-O 3.58Å; V426-W483 WeakPolarHBondContact CA-O 3.44Å
427	N	89.5	Confident	88.4	Confident	75 Å²	75	54.4 Å²	54.4	40%	0.401	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.8	162.3	-66.9	-87.5	0	0	0	109.8	C482 W483	N427-C482 CarbonylContact O-C 3.6Å; N427-C482 VanDerWaalsContact O-CA 3.29Å; N427-C482 WeakPolarHBondContact O-CA 3.39Å; N427-W483 HydrophobicContact CB-CD2 4.24Å; N427-W483 HydrophobicContact CB-CH2 4.05Å; N427-W483 HydrophobicContact CB-CZ2 3.59Å; N427-W483 PolarHBondContact N-O 2.72Å; N427-W483 VanDerWaalsContact O-CE3 3.28Å; N427-W483 PolarHBondContact O-N 2.96Å
428	C	92.5	Very high	88.6	Confident	17 Å²	17	54.4 Å²	54.4	12%	0.115	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	146.8	180	-61.6	0	0	0	0	112.3	L441 Y460 V481 C482	C428-L441 HydrophobicContact CB-CD1 4.23Å; C428-Y460 HydrophobicContact CB-CD2 4.39Å; C428-Y460 HydrophobicContact CB-CE2 3.78Å; C428-Y460 PolarHBondContact N-OH 3.45Å; C428-V481 WeakPolarHBondContact CA-O 3.06Å; C428-C482 HydrophobicContact CB-CB 4.16Å; C428-C482 WeakPolarHBondContact CB-SG 3.45Å; C428-C482 WeakPolarHBondContact SG-CB 3.08Å; C428-C482 CovalentContact SG-SG 2.04Å; C428-C482 PolarHBondContact SG-SG 3.17Å
429	K	92.4	Very high	89.1	Confident	100 Å²	100	54.1 Å²	54.1	44%	0.435	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.9	171.5	74.4	-166.1	171	-173.7	0	110.1	T431 V481 W483	K429-T431 HydrophobicContact CD-CG2 4.06Å; K429-T431 HydrophobicContact CG-CG2 3.99Å; K429-V481 HydrophobicContact CG-CB 4.17Å; K429-V481 PolarHBondContact N-O 3.5Å; K429-V481 PolarHBondContact O-N 3.29Å; K429-W483 HydrophobicContact CB-CH2 4.21Å; K429-W483 HydrophobicContact CB-CZ3 3.95Å; K429-W483 HydrophobicContact CD-CH2 4Å; K429-W483 HydrophobicContact CD-CZ3 3.66Å; K429-W483 HydrophobicContact CG-CH2 4.31Å; K429-W483 HydrophobicContact CG-CZ3 3.71Å
430	L	93.8	Very high	89.4	Confident	30 Å²	30	60 Å²	60	16%	0.157	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.5	165	-54.5	177.9	0	0	0	108.5	Q433 L439 L441 L462 F478 N479 V480	L430-Q433 HydrophobicContact CB-CG 4.44Å; L430-Q433 VanDerWaalsContact CB-NE2 3.32Å; L430-Q433 VanDerWaalsContact CD1-NE2 3.33Å; L430-L439 HydrophobicContact CD1-CB 3.83Å; L430-L439 WeakPolarHBondContact CD1-O 3.29Å; L430-L441 HydrophobicContact CD1-CG 4.19Å; L430-L441 HydrophobicContact CD2-CD1 3.79Å; L430-L441 HydrophobicContact CD2-CD2 4.38Å; L430-L441 HydrophobicContact CD2-CG 3.87Å; L430-L441 HydrophobicContact CG-CD1 3.72Å; L430-L441 HydrophobicContact CG-CG 3.76Å; L430-L462 HydrophobicContact CD1-CD1 3.81Å; L430-L462 HydrophobicContact CD2-CD1 4.33Å; L430-F478 HydrophobicContact CD2-CD2 3.89Å; L430-F478 HydrophobicContact CD2-CE2 4.22Å; L430-N479 CarbonylContact C-O 3.49Å; L430-N479 WeakPolarHBondContact CA-O 3.5Å; L430-V480 HydrophobicContact CD2-CG2 4Å
431	T	92.2	Very high	89.8	Confident	36 Å²	36	58.5 Å²	58.5	22%	0.221	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	170.4	166.3	61	0	0	0	0	109.6	K429 Q433 N479 V481	K429-T431 HydrophobicContact CD-CG2 4.06Å; K429-T431 HydrophobicContact CG-CG2 3.99Å; T431-Q433 PolarHBondContact O-N 2.82Å; T431-N479 PolarHBondContact N-O 2.99Å; T431-N479 PolarHBondContact O-N 3.14Å; T431-N479 WeakPolarHBondContact OG1-CB 3.41Å; T431-V481 HydrophobicContact CG2-CG2 4.26Å; T431-V481 WeakPolarHBondContact OG1-CG2 3.48Å
432	D	91.1	Very high	90.2	Very high	113 Å²	113	59.2 Å²	59.2	60%	0.604	30%	0.301	S	S	*	.			trans	53.1	34.6	164.4	-36.5	-50.4	0	0	0	113.9	T434 N479	D432-T434 PolarHBondContact O-N 2.87Å; D432-N479 HydrophobicContact CB-CB 4.18Å; D432-N479 PolarHBondContact OD2-ND2 2.88Å
433	Q	92.4	Very high	90.2	Very high	29 Å²	29	54.1 Å²	54.1	14%	0.136	28%	0.284	C	S	.	.			trans	-66.8	123.2	173	-61.7	-177.5	21.3	0	0	108.6	L430 T431 I435 V438 L439 F478	L430-Q433 HydrophobicContact CB-CG 4.44Å; L430-Q433 VanDerWaalsContact CB-NE2 3.32Å; L430-Q433 VanDerWaalsContact CD1-NE2 3.33Å; T431-Q433 PolarHBondContact O-N 2.82Å; Q433-I435 VanDerWaalsContact CB-O 3.31Å; Q433-I435 WeakPolarHBondContact CB-O 3.43Å; Q433-I435 CarbonylContact O-C 3.56Å; Q433-I435 PolarHBondContact O-N 3.37Å; Q433-I435 PolarHBondContact OE1-O 2.62Å; Q433-V438 HydrophobicContact CB-CG1 4.34Å; Q433-V438 VanDerWaalsContact OE1-CG1 3.32Å; Q433-L439 PolarHBondContact NE2-O 3.29Å; Q433-F478 HydrophobicContact CG-CB 4Å
434	T	90.7	Very high	89.9	Confident	63 Å²	63	56.2 Å²	56.2	39%	0.387	30%	0.298	S	S	.	.	S	Bend	trans	-40	-48.5	170.9	34.5	0	0	0	0	112.8	D432 E477	D432-T434 PolarHBondContact O-N 2.87Å; T434-E477 HydrophobicContact CG2-CB 3.76Å; T434-E477 HydrophobicContact CG2-CG 4.2Å; T434-E477 PolarHBondContact N-O 2.93Å; T434-E477 PolarHBondContact OG1-N 3.37Å; T434-E477 PolarHBondContact OG1-O 2.78Å
435	I	90	Very high	89.1	Confident	16 Å²	16	59.9 Å²	59.9	8%	0.082	32%	0.315	C	S	.	.	S	Bend	trans	-102.2	119.9	170.4	-55.4	164.4	0	0	0	108.4	Q433 N437 V438 K466 I468 F473	Q433-I435 VanDerWaalsContact CB-O 3.31Å; Q433-I435 WeakPolarHBondContact CB-O 3.43Å; Q433-I435 CarbonylContact O-C 3.56Å; Q433-I435 PolarHBondContact O-N 3.37Å; Q433-I435 PolarHBondContact OE1-O 2.62Å; I435-N437 PolarHBondContact O-N 3.29Å; I435-N437 VanDerWaalsContact O-N 3.17Å; I435-V438 HydrophobicContact CB-CB 3.83Å; I435-V438 HydrophobicContact CB-CG1 3.81Å; I435-V438 HydrophobicContact CD1-CB 4.44Å; I435-V438 HydrophobicContact CD1-CG2 4.39Å; I435-V438 HydrophobicContact CG2-CB 3.97Å; I435-V438 HydrophobicContact CG2-CG1 4.47Å; I435-V438 VanDerWaalsContact O-CG1 3.28Å; I435-V438 WeakPolarHBondContact O-CG1 3.37Å; I435-V438 PolarHBondContact O-N 3.25Å; I435-K466 HydrophobicContact CG2-CD 4.14Å; I435-I468 HydrophobicContact CD1-CD1 3.36Å; I435-F473 HydrophobicContact CD1-CB 3.87Å; I435-F473 HydrophobicContact CD1-CD1 4.26Å; I435-F473 HydrophobicContact CD1-CD2 3.45Å; I435-F473 VanDerWaalsContact CD1-CD2 3.45Å; I435-F473 HydrophobicContact CD1-CE2 3.99Å; I435-F473 HydrophobicContact CD1-CG 3.6Å; I435-F473 HydrophobicContact CG1-CB 4.39Å; I435-F473 HydrophobicContact CG1-CD1 3.83Å; I435-F473 HydrophobicContact CG1-CD2 3.59Å; I435-F473 HydrophobicContact CG1-CE1 3.93Å; I435-F473 HydrophobicContact CG1-CE2 3.66Å; I435-F473 HydrophobicContact CG1-CG 3.67Å; I435-F473 HydrophobicContact CG1-CZ 3.85Å
436	P	90.5	Very high	87.6	Confident	91 Å²	91	58.6 Å²	58.6	59%	0.591	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	122.8	-179.9	-27.6	35.9	0	0	0	112.7	K466	P436-K466 WeakPolarHBondContact O-CE 3.2Å; P436-K466 PolarHBondContact O-NZ 2.97Å
437	N	90.4	Very high	85.9	Confident	129 Å²	129	67.1 Å²	67.1	69%	0.69	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	39.2	-178.9	-51.3	-38.6	0	0	0	114.8	I435	I435-N437 PolarHBondContact O-N 3.29Å; I435-N437 VanDerWaalsContact O-N 3.17Å
438	V	93.1	Very high	84	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.379	C	S	.	.			trans	-76.2	-41.6	169.6	55.8	0	0	0	0	112.5	Q433 I435 L464 Q465 I468 I476	Q433-V438 HydrophobicContact CB-CG1 4.34Å; Q433-V438 VanDerWaalsContact OE1-CG1 3.32Å; I435-V438 HydrophobicContact CB-CB 3.83Å; I435-V438 HydrophobicContact CB-CG1 3.81Å; I435-V438 HydrophobicContact CD1-CB 4.44Å; I435-V438 HydrophobicContact CD1-CG2 4.39Å; I435-V438 HydrophobicContact CG2-CB 3.97Å; I435-V438 HydrophobicContact CG2-CG1 4.47Å; I435-V438 VanDerWaalsContact O-CG1 3.28Å; I435-V438 WeakPolarHBondContact O-CG1 3.37Å; I435-V438 PolarHBondContact O-N 3.25Å; V438-L464 HydrophobicContact CG2-CD1 3.7Å; V438-Q465 PolarHBondContact O-N 2.99Å; V438-I468 HydrophobicContact CG2-CD1 3.49Å; V438-I468 VanDerWaalsContact CG2-CD1 3.49Å; V438-I468 HydrophobicContact CG2-CG1 4.14Å; V438-I476 HydrophobicContact CG1-CG2 3.81Å; V438-I476 HydrophobicContact CG2-CD1 4.21Å
439	L	94	Very high	81.2	Confident	6 Å²	6	79.2 Å²	79.2	3%	0.031	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	149	-174.9	-69.3	172.9	0	0	0	111.3	I410 L430 Q433 L462 L464 I476 F478 V498	I410-L439 HydrophobicContact CD1-CD1 4.3Å; I410-L439 HydrophobicContact CD1-CD2 3.53Å; I410-L439 HydrophobicContact CG1-CD2 4.18Å; L430-L439 HydrophobicContact CD1-CB 3.83Å; L430-L439 WeakPolarHBondContact CD1-O 3.29Å; Q433-L439 PolarHBondContact NE2-O 3.29Å; L439-L462 HydrophobicContact CB-CD1 3.97Å; L439-L462 HydrophobicContact CD1-CD1 4.25Å; L439-L462 HydrophobicContact CD1-CD2 4.29Å; L439-L462 HydrophobicContact CD1-CG 4.42Å; L439-L462 HydrophobicContact CD2-CG 4.33Å; L439-L462 HydrophobicContact CG-CD1 4.46Å; L439-L464 HydrophobicContact CD2-CD1 4.14Å; L439-I476 HydrophobicContact CD1-CG2 4.1Å; L439-F478 HydrophobicContact CD1-CD1 3.77Å; L439-F478 HydrophobicContact CD1-CE1 3.95Å; L439-F478 HydrophobicContact CD1-CG 4.21Å; L439-F478 HydrophobicContact CD1-CZ 4.49Å; L439-V498 HydrophobicContact CD1-CG2 4.25Å
440	R	93.1	Very high	78.7	Confident	129 Å²	129	79.3 Å²	79.3	49%	0.487	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.1	179.2	174.2	174.4	175.5	-178.1	-3	111.2	I442 T463 Q465	R440-I442 HydrophobicContact CG-CG1 4.08Å; R440-T463 PolarHBondContact N-O 3.36Å; R440-T463 PolarHBondContact O-N 2.87Å; R440-Q465 HydrophobicContact CB-CG 3.56Å
441	L	91.6	Very high	76	Confident	31 Å²	31	87.7 Å²	87.7	16%	0.162	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	136.3	164.2	-75.2	162.3	0	0	0	110.2	I413 C428 L430 Y460 K461	I413-L441 HydrophobicContact CB-CD2 4.38Å; I413-L441 HydrophobicContact CD1-CD2 3.66Å; C428-L441 HydrophobicContact CB-CD1 4.23Å; L430-L441 HydrophobicContact CD1-CG 4.19Å; L430-L441 HydrophobicContact CD2-CD1 3.79Å; L430-L441 HydrophobicContact CD2-CD2 4.38Å; L430-L441 HydrophobicContact CD2-CG 3.87Å; L430-L441 HydrophobicContact CG-CD1 3.72Å; L430-L441 HydrophobicContact CG-CG 3.76Å; L441-Y460 HydrophobicContact CB-CD1 4.38Å; L441-Y460 VanDerWaalsContact CD2-CB 3.49Å; L441-Y460 HydrophobicContact CD2-CD1 4.32Å; L441-Y460 HydrophobicContact CD2-CG 3.94Å; L441-K461 WeakPolarHBondContact CA-O 3.5Å
442	I	89.6	Confident	73.7	Confident	63 Å²	63	95.3 Å²	95.3	32%	0.323	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119	169.5	-53.6	-178.8	0	0	0	107.7	R440 Y460 K461 T463	R440-I442 HydrophobicContact CG-CG1 4.08Å; I442-Y460 CarbonylContact O-C 3.59Å; I442-Y460 VanDerWaalsContact O-CA 3.26Å; I442-Y460 WeakPolarHBondContact O-CA 3.16Å; I442-K461 HydrophobicContact CB-CB 4.35Å; I442-K461 PolarHBondContact N-O 2.8Å; I442-K461 PolarHBondContact O-N 3.39Å; I442-T463 HydrophobicContact CD1-CG2 4.44Å
443	S	85.3	Confident	71.2	Confident	42 Å²	42	97 Å²	97	29%	0.294	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	135.3	178.1	177.3	0	0	0	0	110.9	Q458	S443-Q458 PolarHBondContact OG-NE2 2.84Å
444	V	79.7	Confident	68.9	Low	69 Å²	69	100.4 Å²	100.4	42%	0.418	53%	0.532	S	S	.	.	S	Bend	trans	-79.1	-33.7	-178.9	178.7	0	0	0	0	111.5	S446 K459 K461	V444-S446 PolarHBondContact O-N 2.97Å; V444-K459 HydrophobicContact CB-CB 4.14Å; V444-K459 HydrophobicContact CG2-CB 4.08Å; V444-K459 PolarHBondContact N-O 2.86Å; V444-K461 HydrophobicContact CG2-CG 4.07Å
445	D	65.8	Low	67.1	Low	89 Å²	89	102.9 Å²	102.9	48%	0.476	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	27.5	-164.2	-52.2	-66	0	0	0	113.7	Q458 K459	D445-Q458 PolarHBondContact OD2-NE2 2.63Å; D445-K459 PolarHBondContact OD2-N 2.72Å
446	S	53.6	Low	65.8	Low	94 Å²	94	103.9 Å²	103.9	66%	0.657	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-11.2	-172	-60.9	0	0	0	0	115.2	V444	V444-S446 PolarHBondContact O-N 2.97Å
447	E	53.5	Low	64.9	Low	187 Å²	187	103 Å²	103	87%	0.874	54%	0.542	S	S	*	.	S	Bend	trans	-117.5	-5.4	-169.6	-67.3	-165.6	133.4	0	0	116.2
448	I	48.3	Very low	64.5	Low	158 Å²	158	99.4 Å²	99.4	81%	0.81	52%	0.521	S	S	*	.			trans	-124.1	119.9	178.5	-63.6	169.7	0	0	0	111.6
449	M	33.7	Very low	64.2	Low	188 Å²	188	103.4 Å²	103.4	93%	0.926	54%	0.538	S	S	*	.			trans	-81.7	120.2	179.8	-72.5	171.3	45.6	0	0	113.4
450	S	40	Very low	64.1	Low	102 Å²	102	104.1 Å²	104.1	71%	0.713	54%	0.541	S	S	*	.			trans	-157.2	106.9	140.9	59.2	0	0	0	0	111.4	E452	S450-E452 PolarHBondContact O-N 3.41Å
451	K	37.8	Very low	64	Low	206 Å²	206	102 Å²	102	90%	0.896	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	110.5	164.7	-69.3	177.7	178.8	177.8	0	108.1
452	E	42.7	Very low	64.1	Low	196 Å²	196	100.5 Å²	100.5	92%	0.916	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	174.2	-18.6	150.6	-101.9	159.6	-153.5	0	0	112.5	S450	S450-E452 PolarHBondContact O-N 3.41Å
453	M	40	Very low	64.2	Low	148 Å²	148	97.8 Å²	97.8	73%	0.729	51%	0.513	S	S	*	.			trans	-89.4	107.3	171.2	-147.1	72.4	71.9	0	0	110.7	N455	M453-N455 WeakPolarHBondContact CG-OD1 3.09Å; M453-N455 PolarHBondContact O-N 3.15Å
454	S	44.4	Very low	64.6	Low	102 Å²	102	95.8 Å²	95.8	71%	0.713	50%	0.499	S	S	*	.			trans	-74.2	71.7	167.8	-69	0	0	0	0	110.1	S456	S454-S456 PolarHBondContact O-N 2.93Å
455	N	52.5	Low	65.2	Low	115 Å²	115	96.2 Å²	96.2	62%	0.615	50%	0.497	S	S	*	.			trans	-64.3	116.5	177.9	-82	-10.2	0	0	0	110.4	M453 N457	M453-N455 WeakPolarHBondContact CG-OD1 3.09Å; M453-N455 PolarHBondContact O-N 3.15Å; N455-N457 PolarHBondContact O-N 3.24Å; N455-N457 VanDerWaalsContact O-N 3.12Å
456	S	61.8	Low	66.4	Low	36 Å²	36	95.9 Å²	95.9	25%	0.252	49%	0.491	S	S	.	.	S	Bend	trans	-57.7	-15.1	170	53.2	0	0	0	0	114.9	F416 D417 S454	F416-S456 WeakPolarHBondContact CA-O 3.17Å; D417-S456 PolarHBondContact N-O 2.82Å; D417-S456 VanDerWaalsContact N-O 3.13Å; D417-S456 WeakPolarHBondContact O-CB 3.34Å; S454-S456 PolarHBondContact O-N 2.93Å
457	N	71.5	Confident	68.2	Low	74 Å²	74	97 Å²	97	40%	0.396	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	106.5	-172	-57.4	2.1	0	0	0	109.3	V415 F416 N455	V415-N457 WeakPolarHBondContact O-CA 3.48Å; F416-N457 WeakPolarHBondContact CD2-OD1 3.41Å; N455-N457 PolarHBondContact O-N 3.24Å; N455-N457 VanDerWaalsContact O-N 3.12Å
458	Q	82.1	Confident	70	Confident	53 Å²	53	88.7 Å²	88.7	25%	0.248	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	129.6	173.8	-177.5	56.1	62	0	0	109.5	V415 S443 D445 Y460	V415-Q458 PolarHBondContact N-O 2.94Å; V415-Q458 PolarHBondContact O-N 2.61Å; S443-Q458 PolarHBondContact OG-NE2 2.84Å; D445-Q458 PolarHBondContact OD2-NE2 2.63Å; Q458-Y460 HydrophobicContact CB-CE2 4.33Å; Q458-Y460 HydrophobicContact CG-CD2 4.41Å; Q458-Y460 HydrophobicContact CG-CE2 3.55Å
459	K	88.2	Confident	72	Confident	84 Å²	84	84.2 Å²	84.2	37%	0.365	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	140.3	-176.7	-74.7	-179.1	175.3	177.5	0	113.4	D414 V444 D445	D414-K459 WeakPolarHBondContact OD1-CE 3.21Å; D414-K459 WeakPolarHBondContact OD1-CG 3.45Å; D414-K459 IonicContact OD1-NZ 3.95Å; V444-K459 HydrophobicContact CB-CB 4.14Å; V444-K459 HydrophobicContact CG2-CB 4.08Å; V444-K459 PolarHBondContact N-O 2.86Å; D445-K459 PolarHBondContact OD2-N 2.72Å
460	Y	90.6	Very high	74.9	Confident	21 Å²	21	76.3 Å²	76.3	8%	0.082	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.1	175.6	-55.3	-95.5	0	0	0	110.4	I412 I413 V415 V426 C428 L441 I442 Q458	I412-Y460 WeakPolarHBondContact CA-O 3.49Å; I413-Y460 PolarHBondContact N-O 2.9Å; I413-Y460 PolarHBondContact O-N 2.63Å; V415-Y460 HydrophobicContact CG2-CD2 4.46Å; V415-Y460 HydrophobicContact CG2-CE2 4.48Å; V426-Y460 PolarHBondContact O-OH 2.93Å; C428-Y460 HydrophobicContact CB-CD2 4.39Å; C428-Y460 HydrophobicContact CB-CE2 3.78Å; C428-Y460 PolarHBondContact N-OH 3.45Å; L441-Y460 HydrophobicContact CB-CD1 4.38Å; L441-Y460 VanDerWaalsContact CD2-CB 3.49Å; L441-Y460 HydrophobicContact CD2-CD1 4.32Å; L441-Y460 HydrophobicContact CD2-CG 3.94Å; I442-Y460 CarbonylContact O-C 3.59Å; I442-Y460 VanDerWaalsContact O-CA 3.26Å; I442-Y460 WeakPolarHBondContact O-CA 3.16Å; Q458-Y460 HydrophobicContact CB-CE2 4.33Å; Q458-Y460 HydrophobicContact CG-CD2 4.41Å; Q458-Y460 HydrophobicContact CG-CE2 3.55Å
461	K	91.6	Very high	77.4	Confident	84 Å²	84	73.3 Å²	73.3	37%	0.365	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	142.8	161.5	-70.7	171.8	162.9	-146.9	0	109.6	D409 L441 I442 V444	D409-K461 WeakPolarHBondContact OD2-CD 3.21Å; D409-K461 VanDerWaalsContact OD2-CE 3.27Å; D409-K461 WeakPolarHBondContact OD2-CE 3.44Å; D409-K461 IonicContact OD2-NZ 2.82Å; D409-K461 PolarHBondContact OD2-NZ 2.9Å; L441-K461 WeakPolarHBondContact CA-O 3.5Å; I442-K461 HydrophobicContact CB-CB 4.35Å; I442-K461 PolarHBondContact N-O 2.8Å; I442-K461 PolarHBondContact O-N 3.39Å; V444-K461 HydrophobicContact CG2-CG 4.07Å
462	L	92.8	Very high	79.9	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	110.3	167.4	-173.3	64.6	0	0	0	107.7	L398 I410 G411 I413 L430 L439 F478	L398-L462 HydrophobicContact CD1-CD2 3.68Å; I410-L462 HydrophobicContact CD1-CD2 3.88Å; I410-L462 HydrophobicContact CD1-CG 4.13Å; I410-L462 HydrophobicContact CG1-CB 4.26Å; I410-L462 HydrophobicContact CG1-CD2 4.01Å; I410-L462 HydrophobicContact CG1-CG 3.91Å; I410-L462 WeakPolarHBondContact CG1-O 3.07Å; I410-L462 PolarHBondContact N-O 3Å; G411-L462 PolarHBondContact O-N 2.85Å; I413-L462 HydrophobicContact CD1-CB 4.22Å; I413-L462 HydrophobicContact CD1-CD1 4.03Å; I413-L462 HydrophobicContact CD1-CD2 4.22Å; I413-L462 HydrophobicContact CD1-CG 4.39Å; L430-L462 HydrophobicContact CD1-CD1 3.81Å; L430-L462 HydrophobicContact CD2-CD1 4.33Å; L439-L462 HydrophobicContact CB-CD1 3.97Å; L439-L462 HydrophobicContact CD1-CD1 4.25Å; L439-L462 HydrophobicContact CD1-CD2 4.29Å; L439-L462 HydrophobicContact CD1-CG 4.42Å; L439-L462 HydrophobicContact CD2-CG 4.33Å; L439-L462 HydrophobicContact CG-CD1 4.46Å; L462-F478 HydrophobicContact CD2-CE1 4.3Å; L462-F478 HydrophobicContact CD2-CE2 4.08Å; L462-F478 HydrophobicContact CD2-CZ 3.59Å
463	T	92.5	Very high	82.2	Confident	6 Å²	6	63.5 Å²	63.5	4%	0.037	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137	-169.5	-44	0	0	0	0	110.5	G407 Q408 D409 R440 I442	G407-T463 WeakPolarHBondContact O-CG2 3.46Å; Q408-T463 WeakPolarHBondContact O-CA 3.38Å; Q408-T463 WeakPolarHBondContact O-CG2 3.37Å; D409-T463 PolarHBondContact OD1-OG1 2.59Å; R440-T463 PolarHBondContact N-O 3.36Å; R440-T463 PolarHBondContact O-N 2.87Å; I442-T463 HydrophobicContact CD1-CG2 4.44Å
464	L	93.7	Very high	84.7	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	142.5	178.3	-170.5	64.4	0	0	0	111.6	L400 T404 G407 Q408 I410 V438 L439 K466 I468	L400-L464 HydrophobicContact CD1-CD2 4.39Å; L400-L464 HydrophobicContact CD2-CD1 4.08Å; L400-L464 HydrophobicContact CD2-CD2 4.28Å; T404-L464 HydrophobicContact CG2-CD2 3.89Å; T404-L464 VanDerWaalsContact O-CD2 3.26Å; T404-L464 WeakPolarHBondContact O-CD2 3.23Å; G407-L464 PolarHBondContact N-O 3.28Å; Q408-L464 PolarHBondContact O-N 3.22Å; I410-L464 HydrophobicContact CG2-CB 4.41Å; V438-L464 HydrophobicContact CG2-CD1 3.7Å; L439-L464 HydrophobicContact CD2-CD1 4.14Å; L464-K466 WeakPolarHBondContact CD1-O 3.43Å; L464-K466 WeakPolarHBondContact CD2-O 3.5Å; L464-K466 WeakPolarHBondContact CG-O 3.26Å; L464-I468 HydrophobicContact CD1-CG1 4.04Å
465	Q	92.5	Very high	87	Confident	77 Å²	77	58 Å²	58	36%	0.36	29%	0.287	S	S	.	.			trans	-125.2	-7.8	179.8	-63	-68.3	-105.2	0	0	114.3	V438 R440	V438-Q465 PolarHBondContact O-N 2.99Å; R440-Q465 HydrophobicContact CB-CG 3.56Å
466	K	91.1	Very high	88.8	Confident	83 Å²	83	52.5 Å²	52.5	36%	0.361	26%	0.258	S	S	.	.	S	Bend	trans	-136.7	154.7	178.1	-69.5	-179.3	169.4	-176.4	0	109.7	I435 P436 L464	I435-K466 HydrophobicContact CG2-CD 4.14Å; P436-K466 WeakPolarHBondContact O-CE 3.2Å; P436-K466 PolarHBondContact O-NZ 2.97Å; L464-K466 WeakPolarHBondContact CD1-O 3.43Å; L464-K466 WeakPolarHBondContact CD2-O 3.5Å; L464-K466 WeakPolarHBondContact CG-O 3.26Å
467	L	90.5	Very high	90.3	Very high	116 Å²	116	53.7 Å²	53.7	61%	0.607	26%	0.26	S	S	*	.			trans	-63.8	156	163.4	-70.3	167.3	0	0	0	109.5	E403 P406	E403-L467 WeakPolarHBondContact O-CD2 3.17Å; P406-L467 HydrophobicContact CG-CG 4.32Å
468	I	90.9	Very high	91.4	Very high	13 Å²	13	50.2 Å²	50.2	7%	0.067	24%	0.241	C	C	.	.			trans	-133.7	143.8	-178.4	-63.7	-65.8	0	0	0	108.9	L400 E403 I435 V438 L464 I476 V500	L400-I468 HydrophobicContact CD2-CG1 4.49Å; E403-I468 PolarHBondContact N-O 3.43Å; E403-I468 VanDerWaalsContact N-O 3.14Å; I435-I468 HydrophobicContact CD1-CD1 3.36Å; V438-I468 HydrophobicContact CG2-CD1 3.49Å; V438-I468 VanDerWaalsContact CG2-CD1 3.49Å; V438-I468 HydrophobicContact CG2-CG1 4.14Å; L464-I468 HydrophobicContact CD1-CG1 4.04Å; I468-I476 HydrophobicContact CD1-CD1 3.89Å; I468-I476 HydrophobicContact CG1-CD1 4.01Å; I468-I476 HydrophobicContact CG2-CD1 4.26Å; I468-V500 HydrophobicContact CG2-CG1 3.88Å; I468-V500 HydrophobicContact CG2-CG2 3.79Å
469	D	92	Very high	91.9	Very high	65 Å²	65	48.8 Å²	48.8	35%	0.348	24%	0.235	S	C	.	.			trans	-128	123.5	-177.9	160.8	-41.1	0	0	0	103.8	E471 E472 F473	D469-E471 VanDerWaalsContact C-N 3.33Å; D469-E471 PolarHBondContact OD1-N 3.01Å; D469-E472 PolarHBondContact OD1-N 2.94Å; D469-F473 PolarHBondContact O-N 3.21Å
470	R	94.2	Very high	92.2	Very high	21 Å²	21	44.8 Å²	44.8	8%	0.079	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-24.1	-172.9	-170.9	-145.7	63.7	109.9	5.5	111.1	E402 F473 P474 V500 D502 K542 D543 E544	E402-R470 WeakPolarHBondContact OE2-CB 3.16Å; E402-R470 PolarHBondContact OE2-N 3.24Å; R470-F473 CarbonylContact O-C 3.58Å; R470-P474 HydrophobicContact CG-CB 4.15Å; R470-P474 VanDerWaalsContact O-CA 3.22Å; R470-P474 WeakPolarHBondContact O-CA 3.44Å; R470-P474 VanDerWaalsContact O-CB 3.32Å; R470-P474 WeakPolarHBondContact O-CB 3.43Å; R470-P474 WeakPolarHBondContact O-CD 3.43Å; R470-V500 HydrophobicContact CB-CB 4.24Å; R470-V500 HydrophobicContact CB-CG1 3.68Å; R470-V500 HydrophobicContact CG-CB 3.89Å; R470-V500 HydrophobicContact CG-CG1 3.82Å; R470-D502 WeakPolarHBondContact CD-OD1 3.3Å; R470-D502 IonicContact CZ-OD1 3.9Å; R470-D502 IonicContact NE-OD1 3.32Å; R470-D502 PolarHBondContact NE-OD1 2.68Å; R470-D502 IonicContact NH1-OD1 3.61Å; R470-D502 IonicContact NH2-OD1 3.22Å; R470-K542 PolarHBondContact NH2-O 2.77Å; R470-D543 PolarHBondContact NH2-O 3.5Å; R470-E544 IonicContact CZ-OE2 2.65Å; R470-E544 IonicContact NH1-OE2 2.73Å; R470-E544 PolarHBondContact NH1-OE2 3.06Å
471	E	92.7	Very high	92.3	Very high	40 Å²	40	44.9 Å²	44.9	19%	0.187	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-32.4	-178.4	-68.7	61.1	-123.3	0	0	112.2	D469 H506 K542	D469-E471 VanDerWaalsContact C-N 3.33Å; D469-E471 PolarHBondContact OD1-N 3.01Å; E471-H506 IonicContact OE2-CE1 3.05Å; E471-H506 IonicContact OE2-ND1 3.32Å; E471-K542 HydrophobicContact CB-CD 3.95Å; E471-K542 HydrophobicContact CG-CB 3.54Å; E471-K542 HydrophobicContact CG-CD 3.6Å; E471-K542 HydrophobicContact CG-CG 4.31Å
472	E	90.4	Very high	92.4	Very high	135 Å²	135	40.9 Å²	40.9	63%	0.631	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-40.9	169.2	-157.7	-174.3	-170.6	0	0	110.9	D469	D469-E472 PolarHBondContact OD1-N 2.94Å
473	F	90.6	Very high	92.4	Very high	60 Å²	60	45 Å²	45	26%	0.263	22%	0.219	S	C	.	.			trans	-142.8	77.8	-174.1	-61.8	-74.7	0	0	0	114.2	I435 D469 R470 I475 V500	I435-F473 HydrophobicContact CD1-CB 3.87Å; I435-F473 HydrophobicContact CD1-CD1 4.26Å; I435-F473 HydrophobicContact CD1-CD2 3.45Å; I435-F473 VanDerWaalsContact CD1-CD2 3.45Å; I435-F473 HydrophobicContact CD1-CE2 3.99Å; I435-F473 HydrophobicContact CD1-CG 3.6Å; I435-F473 HydrophobicContact CG1-CB 4.39Å; I435-F473 HydrophobicContact CG1-CD1 3.83Å; I435-F473 HydrophobicContact CG1-CD2 3.59Å; I435-F473 HydrophobicContact CG1-CE1 3.93Å; I435-F473 HydrophobicContact CG1-CE2 3.66Å; I435-F473 HydrophobicContact CG1-CG 3.67Å; I435-F473 HydrophobicContact CG1-CZ 3.85Å; D469-F473 PolarHBondContact O-N 3.21Å; R470-F473 CarbonylContact O-C 3.58Å; F473-I475 PolarHBondContact O-N 2.9Å; F473-I475 VanDerWaalsContact O-N 3.13Å; F473-V500 VanDerWaalsContact O-CG2 3.3Å; F473-V500 WeakPolarHBondContact O-CG2 3.35Å
474	P	91.8	Very high	92.4	Very high	63 Å²	63	44.9 Å²	44.9	41%	0.409	22%	0.218	S	C	.	.	S	Bend	trans	-69	-17.4	-176.8	27	-34.4	0	0	0	113.4	R470 V500	R470-P474 HydrophobicContact CG-CB 4.15Å; R470-P474 VanDerWaalsContact O-CA 3.22Å; R470-P474 WeakPolarHBondContact O-CA 3.44Å; R470-P474 VanDerWaalsContact O-CB 3.32Å; R470-P474 WeakPolarHBondContact O-CB 3.43Å; R470-P474 WeakPolarHBondContact O-CD 3.43Å; P474-V500 PolarHBondContact O-N 2.7Å
475	I	92.2	Very high	92	Very high	71 Å²	71	46.5 Å²	46.5	36%	0.364	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	114.3	178.5	-56.1	-179.1	0	0	0	109.3	F473 E477 K497 V498	F473-I475 PolarHBondContact O-N 2.9Å; F473-I475 VanDerWaalsContact O-N 3.13Å; I475-E477 HydrophobicContact CG2-CG 3.86Å; I475-E477 PolarHBondContact O-N 2.89Å; I475-K497 HydrophobicContact CG2-CB 3.79Å; I475-K497 HydrophobicContact CG2-CD 3.96Å; I475-K497 HydrophobicContact CG2-CG 4.26Å; I475-V498 WeakPolarHBondContact CA-O 3.15Å
476	I	92.1	Very high	91.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	97	172.4	-53.9	169.9	0	0	0	108.2	L400 V438 L439 I468 V498 V500	L400-I476 HydrophobicContact CD2-CD1 4.02Å; V438-I476 HydrophobicContact CG1-CG2 3.81Å; V438-I476 HydrophobicContact CG2-CD1 4.21Å; L439-I476 HydrophobicContact CD1-CG2 4.1Å; I468-I476 HydrophobicContact CD1-CD1 3.89Å; I468-I476 HydrophobicContact CG1-CD1 4.01Å; I468-I476 HydrophobicContact CG2-CD1 4.26Å; I476-V498 HydrophobicContact CB-CB 4.16Å; I476-V498 HydrophobicContact CB-CG2 4.33Å; I476-V498 PolarHBondContact N-O 2.99Å; I476-V498 PolarHBondContact O-N 3.42Å; I476-V500 HydrophobicContact CD1-CG2 4.09Å; I476-V500 HydrophobicContact CG1-CG2 4Å
477	E	92.6	Very high	91.4	Very high	62 Å²	62	47.3 Å²	47.3	29%	0.29	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	139.9	169.1	-46.1	-162.2	-167.7	0	0	110.9	T434 I475 Y496 K497	T434-E477 HydrophobicContact CG2-CB 3.76Å; T434-E477 HydrophobicContact CG2-CG 4.2Å; T434-E477 PolarHBondContact N-O 2.93Å; T434-E477 PolarHBondContact OG1-N 3.37Å; T434-E477 PolarHBondContact OG1-O 2.78Å; I475-E477 HydrophobicContact CG2-CG 3.86Å; I475-E477 PolarHBondContact O-N 2.89Å; E477-Y496 WeakPolarHBondContact CA-O 3.45Å; E477-K497 HydrophobicContact CG-CD 4.01Å; E477-K497 HydrophobicContact CG-CG 3.97Å; E477-K497 VanDerWaalsContact OE1-CE 3.29Å; E477-K497 WeakPolarHBondContact OE1-CE 3.3Å; E477-K497 IonicContact OE1-NZ 3.33Å; E477-K497 PolarHBondContact OE1-NZ 2.97Å; E477-K497 WeakPolarHBondContact OE2-CE 3.43Å; E477-K497 IonicContact OE2-NZ 2.72Å; E477-K497 PolarHBondContact OE2-NZ 2.79Å
478	F	93.4	Very high	91.3	Very high	1 Å²	1	46.8 Å²	46.8	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	150.2	176.3	63.4	-82.2	0	0	0	111.3	I389 I413 L430 Q433 L439 L462 V480 T495 Y496 V498	I389-F478 HydrophobicContact CD1-CE2 4.14Å; I389-F478 HydrophobicContact CD1-CZ 4.02Å; I413-F478 HydrophobicContact CD1-CE2 4.46Å; L430-F478 HydrophobicContact CD2-CD2 3.89Å; L430-F478 HydrophobicContact CD2-CE2 4.22Å; Q433-F478 HydrophobicContact CG-CB 4Å; L439-F478 HydrophobicContact CD1-CD1 3.77Å; L439-F478 HydrophobicContact CD1-CE1 3.95Å; L439-F478 HydrophobicContact CD1-CG 4.21Å; L439-F478 HydrophobicContact CD1-CZ 4.49Å; L462-F478 HydrophobicContact CD2-CE1 4.3Å; L462-F478 HydrophobicContact CD2-CE2 4.08Å; L462-F478 HydrophobicContact CD2-CZ 3.59Å; F478-V480 HydrophobicContact CD2-CG2 3.78Å; F478-V480 HydrophobicContact CE2-CG2 3.44Å; F478-V480 VanDerWaalsContact CE2-CG2 3.44Å; F478-T495 WeakPolarHBondContact O-CA 3.43Å; F478-Y496 HydrophobicContact CE1-CD1 4.01Å; F478-Y496 AromaticContact CZ-CD1 3.92Å; F478-Y496 HydrophobicContact CZ-CD1 3.92Å; F478-Y496 HydrophobicContact CZ-CG 4.31Å; F478-Y496 PolarHBondContact N-O 3.32Å; F478-Y496 PolarHBondContact O-N 3.48Å; F478-V498 HydrophobicContact CD1-CG2 4.33Å; F478-V498 HydrophobicContact CE1-CG2 3.68Å
479	N	93.6	Very high	91.3	Very high	22 Å²	22	48.9 Å²	48.9	12%	0.118	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.6	173.4	-81.4	-12.8	0	0	0	110.3	L430 T431 D432 V481 N493 T495	L430-N479 CarbonylContact C-O 3.49Å; L430-N479 WeakPolarHBondContact CA-O 3.5Å; T431-N479 PolarHBondContact N-O 2.99Å; T431-N479 PolarHBondContact O-N 3.14Å; T431-N479 WeakPolarHBondContact OG1-CB 3.41Å; D432-N479 HydrophobicContact CB-CB 4.18Å; D432-N479 PolarHBondContact OD2-ND2 2.88Å; N479-V481 HydrophobicContact CB-CG2 4.45Å; N479-N493 VanDerWaalsContact CB-OD1 3.25Å; N479-N493 WeakPolarHBondContact CB-OD1 3.41Å; N479-N493 PolarHBondContact ND2-ND2 3.19Å; N479-T495 VanDerWaalsContact OD1-CA 3.3Å; N479-T495 WeakPolarHBondContact OD1-CA 3.49Å; N479-T495 VanDerWaalsContact OD1-CB 3.28Å; N479-T495 WeakPolarHBondContact OD1-CB 3.28Å; N479-T495 WeakPolarHBondContact OD1-CG2 3.3Å; N479-T495 PolarHBondContact OD1-OG1 3.35Å
480	V	93.4	Very high	91.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.3	165.2	-170.1	0	0	0	0	107.8	I387 I389 I413 L430 F478 N493 L494	I387-V480 HydrophobicContact CD1-CB 4.1Å; I387-V480 HydrophobicContact CD1-CG1 3.98Å; I387-V480 WeakPolarHBondContact CD1-O 3.43Å; I387-V480 HydrophobicContact CG2-CB 4.29Å; I387-V480 HydrophobicContact CG2-CG1 4.03Å; I389-V480 HydrophobicContact CD1-CG2 4.1Å; I413-V480 HydrophobicContact CD1-CG1 4.47Å; I413-V480 HydrophobicContact CD1-CG2 3.91Å; I413-V480 HydrophobicContact CG2-CG1 4.26Å; L430-V480 HydrophobicContact CD2-CG2 4Å; F478-V480 HydrophobicContact CD2-CG2 3.78Å; F478-V480 HydrophobicContact CE2-CG2 3.44Å; F478-V480 VanDerWaalsContact CE2-CG2 3.44Å; V480-N493 WeakPolarHBondContact O-CA 3.27Å; V480-N493 PolarHBondContact O-OD1 3.21Å; V480-L494 PolarHBondContact N-O 3.17Å; V480-L494 PolarHBondContact O-N 2.76Å
481	V	93.5	Very high	91.3	Very high	23 Å²	23	49.4 Å²	49.4	14%	0.139	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	111.7	175.4	-179.8	0	0	0	0	108.7	C428 K429 T431 N479 W483 S492 N493	C428-V481 WeakPolarHBondContact CA-O 3.06Å; K429-V481 HydrophobicContact CG-CB 4.17Å; K429-V481 PolarHBondContact N-O 3.5Å; K429-V481 PolarHBondContact O-N 3.29Å; T431-V481 HydrophobicContact CG2-CG2 4.26Å; T431-V481 WeakPolarHBondContact OG1-CG2 3.48Å; N479-V481 HydrophobicContact CB-CG2 4.45Å; V481-W483 HydrophobicContact CG1-CE3 4.47Å; V481-W483 WeakPolarHBondContact O-CZ3 3.46Å; V481-S492 WeakPolarHBondContact CA-O 3.39Å; V481-N493 HydrophobicContact CG2-CB 4.31Å
482	C	93.5	Very high	91.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.7	176.7	-67.7	0	0	0	0	110.2	P385 I387 V415 V426 N427 C428 S491 S492	P385-C482 HydrophobicContact CB-CB 4.16Å; I387-C482 HydrophobicContact CD1-CB 3.86Å; I387-C482 HydrophobicContact CG1-CB 4.02Å; V415-C482 HydrophobicContact CG1-CB 4.28Å; V426-C482 HydrophobicContact CG1-CB 3.7Å; N427-C482 CarbonylContact O-C 3.6Å; N427-C482 VanDerWaalsContact O-CA 3.29Å; N427-C482 WeakPolarHBondContact O-CA 3.39Å; C428-C482 HydrophobicContact CB-CB 4.16Å; C428-C482 WeakPolarHBondContact CB-SG 3.45Å; C428-C482 WeakPolarHBondContact SG-CB 3.08Å; C428-C482 CovalentContact SG-SG 2.04Å; C428-C482 PolarHBondContact SG-SG 3.17Å; C482-S491 CarbonylContact O-C 3.55Å; C482-S491 WeakPolarHBondContact O-CA 3.24Å; C482-S491 WeakPolarHBondContact O-CB 3.39Å; C482-S492 PolarHBondContact N-O 2.98Å; C482-S492 PolarHBondContact O-N 2.9Å
483	W	93	Very high	91.4	Very high	86 Å²	86	46.5 Å²	46.5	33%	0.326	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.3	179.8	68.6	94.5	0	0	0	110.8	V426 N427 K429 V481 L490	V426-W483 CarbonylContact C-O 3.58Å; V426-W483 WeakPolarHBondContact CA-O 3.44Å; N427-W483 HydrophobicContact CB-CD2 4.24Å; N427-W483 HydrophobicContact CB-CH2 4.05Å; N427-W483 HydrophobicContact CB-CZ2 3.59Å; N427-W483 PolarHBondContact N-O 2.72Å; N427-W483 VanDerWaalsContact O-CE3 3.28Å; N427-W483 PolarHBondContact O-N 2.96Å; K429-W483 HydrophobicContact CB-CH2 4.21Å; K429-W483 HydrophobicContact CB-CZ3 3.95Å; K429-W483 HydrophobicContact CD-CH2 4Å; K429-W483 HydrophobicContact CD-CZ3 3.66Å; K429-W483 HydrophobicContact CG-CH2 4.31Å; K429-W483 HydrophobicContact CG-CZ3 3.71Å; V481-W483 HydrophobicContact CG1-CE3 4.47Å; V481-W483 WeakPolarHBondContact O-CZ3 3.46Å; W483-L490 WeakPolarHBondContact CA-O 3.25Å
484	D	91.6	Very high	91.5	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	27%	0.268	C	S	.	.			trans	-80.8	-171.5	-178.5	59.9	43	0	0	0	113.8	N381 P385 N423 Q425 G486 S489 L490	N381-D484 PolarHBondContact ND2-OD2 3.42Å; N381-D484 PolarHBondContact OD1-OD2 2.81Å; P385-D484 HydrophobicContact CG-CB 4.31Å; N423-D484 VanDerWaalsContact O-CB 3.23Å; N423-D484 WeakPolarHBondContact O-CB 3.44Å; Q425-D484 CarbonylContact O-C 3.6Å; D484-G486 WeakPolarHBondContact OD1-CA 3.38Å; D484-G486 PolarHBondContact OD1-N 2.96Å; D484-S489 PolarHBondContact O-OG 2.66Å; D484-S489 WeakPolarHBondContact OD1-CA 3.4Å; D484-S489 WeakPolarHBondContact OD1-CB 3.28Å; D484-S489 PolarHBondContact OD1-OG 2.79Å; D484-L490 PolarHBondContact N-O 3.36Å; D484-L490 PolarHBondContact OD1-N 3.2Å; D484-L490 VanDerWaalsContact OD2-CA 3.32Å; D484-L490 WeakPolarHBondContact OD2-CA 3.35Å; D484-L490 VanDerWaalsContact OD2-CB 3.26Å; D484-L490 WeakPolarHBondContact OD2-CB 3.39Å; D484-L490 PolarHBondContact OD2-N 3.09Å
485	G	86.9	Confident	91.5	Very high	34 Å²	34	47 Å²	47	35%	0.351	27%	0.271	S	S	.	.	S	Bend	trans	-102.1	17.5	168.9	0	0	0	0	0	114.5	K422 Q425	K422-G485 CarbonylContact O-C 3.4Å; K422-G485 VanDerWaalsContact O-CA 3.22Å; K422-G485 WeakPolarHBondContact O-CA 3.4Å; K422-G485 PolarHBondContact O-N 2.99Å; Q425-G485 PolarHBondContact O-N 2.04Å
486	G	86	Confident	91.5	Very high	9 Å²	9	45.6 Å²	45.6	9%	0.093	26%	0.262	C	S	.	.			trans	-80.8	174.3	-175.2	0	0	0	0	0	114.7	D484 P488 S489	D484-G486 WeakPolarHBondContact OD1-CA 3.38Å; D484-G486 PolarHBondContact OD1-N 2.96Å; G486-P488 CarbonylContact C-O 3.53Å; G486-S489 PolarHBondContact O-N 3.02Å
487	I	85.3	Confident	91.5	Very high	168 Å²	168	50.2 Å²	50.2	86%	0.862	28%	0.282	S	S	*	.	S	Bend	trans	-140.6	106.9	179.2	-53.5	179.2	0	0	0	109.5
488	P	88.3	Confident	91.4	Very high	105 Å²	105	47.2 Å²	47.2	68%	0.682	27%	0.268	S	S	*	.	S	Bend	cis	-62.6	148.9	-8.6	30.4	-36.1	0	0	0	111.2	N381 G486	N381-P488 PolarHBondContact ND2-O 2.95Å; G486-P488 CarbonylContact C-O 3.53Å
489	S	91.2	Very high	91.3	Very high	57 Å²	57	50.4 Å²	50.4	40%	0.399	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-75.6	130.5	174.9	180	0	0	0	0	110	D484 G486	D484-S489 PolarHBondContact O-OG 2.66Å; D484-S489 WeakPolarHBondContact OD1-CA 3.4Å; D484-S489 WeakPolarHBondContact OD1-CB 3.28Å; D484-S489 PolarHBondContact OD1-OG 2.79Å; G486-S489 PolarHBondContact O-N 3.02Å
490	L	91.4	Very high	91.2	Very high	30 Å²	30	49.7 Å²	49.7	16%	0.157	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-88	149	170.4	-58.5	179.2	0	0	0	108.9	N381 H383 F384 W483 D484	N381-L490 PolarHBondContact ND2-N 2.85Å; N381-L490 WeakPolarHBondContact O-CD1 2.85Å; H383-L490 VanDerWaalsContact O-CD1 3.3Å; H383-L490 WeakPolarHBondContact O-CD1 3.48Å; F384-L490 HydrophobicContact CD1-CB 3.83Å; F384-L490 HydrophobicContact CD1-CD1 4.49Å; F384-L490 HydrophobicContact CD1-CD2 4.46Å; F384-L490 HydrophobicContact CD1-CG 4.48Å; F384-L490 HydrophobicContact CD2-CD1 4.04Å; F384-L490 HydrophobicContact CE1-CB 4.09Å; F384-L490 HydrophobicContact CE1-CD2 3.87Å; F384-L490 HydrophobicContact CE1-CG 4.37Å; F384-L490 HydrophobicContact CE2-CD1 4.05Å; F384-L490 HydrophobicContact CE2-CD2 4.41Å; F384-L490 HydrophobicContact CG-CB 4.19Å; F384-L490 HydrophobicContact CG-CD1 4.26Å; F384-L490 HydrophobicContact CZ-CD1 4.28Å; F384-L490 HydrophobicContact CZ-CD2 3.84Å; F384-L490 HydrophobicContact CZ-CG 4.49Å; W483-L490 WeakPolarHBondContact CA-O 3.25Å; D484-L490 PolarHBondContact N-O 3.36Å; D484-L490 PolarHBondContact OD1-N 3.2Å; D484-L490 VanDerWaalsContact OD2-CA 3.32Å; D484-L490 WeakPolarHBondContact OD2-CA 3.35Å; D484-L490 VanDerWaalsContact OD2-CB 3.26Å; D484-L490 WeakPolarHBondContact OD2-CB 3.39Å; D484-L490 PolarHBondContact OD2-N 3.09Å
491	S	92.9	Very high	91.1	Very high	68 Å²	68	53.1 Å²	53.1	48%	0.476	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	137.6	178.4	59.4	0	0	0	0	111.5	C482	C482-S491 CarbonylContact O-C 3.55Å; C482-S491 WeakPolarHBondContact O-CA 3.24Å; C482-S491 WeakPolarHBondContact O-CB 3.39Å
492	S	93.1	Very high	91.1	Very high	26 Å²	26	53.8 Å²	53.8	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.3	172.2	-66	0	0	0	0	109	F384 P385 V481 C482	F384-S492 WeakPolarHBondContact CB-OG 3.17Å; P385-S492 WeakPolarHBondContact O-CB 3.31Å; P385-S492 PolarHBondContact O-OG 3.29Å; V481-S492 WeakPolarHBondContact CA-O 3.39Å; C482-S492 PolarHBondContact N-O 2.98Å; C482-S492 PolarHBondContact O-N 2.9Å
493	N	92.7	Very high	91	Very high	88 Å²	88	56.4 Å²	56.4	47%	0.471	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.5	163.6	-173	7.7	0	0	0	108.4	N479 V480 V481	N479-N493 VanDerWaalsContact CB-OD1 3.25Å; N479-N493 WeakPolarHBondContact CB-OD1 3.41Å; N479-N493 PolarHBondContact ND2-ND2 3.19Å; V480-N493 WeakPolarHBondContact O-CA 3.27Å; V480-N493 PolarHBondContact O-OD1 3.21Å; V481-N493 HydrophobicContact CG2-CB 4.31Å
494	L	92.4	Very high	91	Very high	56 Å²	56	53.2 Å²	53.2	29%	0.293	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	103.8	168.1	177.5	63.4	0	0	0	108.5	I387 I389 V480 Y496	I387-L494 HydrophobicContact CB-CB 4.2Å; I387-L494 HydrophobicContact CB-CD2 4.04Å; I387-L494 HydrophobicContact CD1-CB 3.89Å; I387-L494 HydrophobicContact CG2-CB 4.25Å; I387-L494 HydrophobicContact CG2-CD2 3.74Å; I389-L494 HydrophobicContact CD1-CD2 4.21Å; I389-L494 HydrophobicContact CG1-CD2 4.01Å; V480-L494 PolarHBondContact N-O 3.17Å; V480-L494 PolarHBondContact O-N 2.76Å; L494-Y496 HydrophobicContact CD2-CD2 4.42Å; L494-Y496 PolarHBondContact O-N 3.5Å
495	T	92.3	Very high	91	Very high	76 Å²	76	55.4 Å²	55.4	47%	0.466	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	120.6	161.6	-47.9	0	0	0	0	108	F478 N479	F478-T495 WeakPolarHBondContact O-CA 3.43Å; N479-T495 VanDerWaalsContact OD1-CA 3.3Å; N479-T495 WeakPolarHBondContact OD1-CA 3.49Å; N479-T495 VanDerWaalsContact OD1-CB 3.28Å; N479-T495 WeakPolarHBondContact OD1-CB 3.28Å; N479-T495 WeakPolarHBondContact OD1-CG2 3.3Å; N479-T495 PolarHBondContact OD1-OG1 3.35Å
496	Y	91.7	Very high	91.2	Very high	43 Å²	43	55.6 Å²	55.6	17%	0.169	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.7	176.8	-161.5	-90.6	0	0	0	110.2	I389 K396 S397 L398 E477 F478 L494	I389-Y496 HydrophobicContact CB-CD2 4.46Å; I389-Y496 HydrophobicContact CB-CE2 4.24Å; I389-Y496 HydrophobicContact CD1-CD1 3.96Å; I389-Y496 HydrophobicContact CD1-CD2 3.89Å; I389-Y496 HydrophobicContact CD1-CE2 4.49Å; I389-Y496 HydrophobicContact CD1-CG 3.59Å; I389-Y496 HydrophobicContact CG1-CD2 4.26Å; I389-Y496 HydrophobicContact CG1-CG 4.44Å; I389-Y496 HydrophobicContact CG2-CE1 4.39Å; K396-Y496 PolarHBondContact O-OH 3.3Å; S397-Y496 WeakPolarHBondContact CA-OH 3.11Å; L398-Y496 HydrophobicContact CB-CE1 3.95Å; L398-Y496 HydrophobicContact CD1-CE1 4.16Å; L398-Y496 HydrophobicContact CG-CE1 3.69Å; L398-Y496 PolarHBondContact N-OH 2.78Å; E477-Y496 WeakPolarHBondContact CA-O 3.45Å; F478-Y496 HydrophobicContact CE1-CD1 4.01Å; F478-Y496 AromaticContact CZ-CD1 3.92Å; F478-Y496 HydrophobicContact CZ-CD1 3.92Å; F478-Y496 HydrophobicContact CZ-CG 4.31Å; F478-Y496 PolarHBondContact N-O 3.32Å; F478-Y496 PolarHBondContact O-N 3.48Å; L494-Y496 HydrophobicContact CD2-CD2 4.42Å; L494-Y496 PolarHBondContact O-N 3.5Å
497	K	91.9	Very high	91.5	Very high	96 Å²	96	58.5 Å²	58.5	42%	0.417	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126.3	-174.2	-51.7	-162.3	-178.9	-154.7	0	109.3	I475 E477	I475-K497 HydrophobicContact CG2-CB 3.79Å; I475-K497 HydrophobicContact CG2-CD 3.96Å; I475-K497 HydrophobicContact CG2-CG 4.26Å; E477-K497 HydrophobicContact CG-CD 4.01Å; E477-K497 HydrophobicContact CG-CG 3.97Å; E477-K497 VanDerWaalsContact OE1-CE 3.29Å; E477-K497 WeakPolarHBondContact OE1-CE 3.3Å; E477-K497 IonicContact OE1-NZ 3.33Å; E477-K497 PolarHBondContact OE1-NZ 2.97Å; E477-K497 WeakPolarHBondContact OE2-CE 3.43Å; E477-K497 IonicContact OE2-NZ 2.72Å; E477-K497 PolarHBondContact OE2-NZ 2.79Å
498	V	91.6	Very high	92	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	126.7	162.8	-164.8	0	0	0	0	107	L398 L400 I410 L439 I475 I476 F478	L398-V498 HydrophobicContact CB-CB 4.43Å; L398-V498 HydrophobicContact CB-CG1 3.98Å; L398-V498 HydrophobicContact CB-CG2 4.28Å; L398-V498 HydrophobicContact CD1-CG2 4.47Å; L398-V498 WeakPolarHBondContact O-CA 3.22Å; L400-V498 HydrophobicContact CB-CG1 3.61Å; I410-V498 HydrophobicContact CD1-CG1 4.33Å; I410-V498 HydrophobicContact CD1-CG2 3.89Å; L439-V498 HydrophobicContact CD1-CG2 4.25Å; I475-V498 WeakPolarHBondContact CA-O 3.15Å; I476-V498 HydrophobicContact CB-CB 4.16Å; I476-V498 HydrophobicContact CB-CG2 4.33Å; I476-V498 PolarHBondContact N-O 2.99Å; I476-V498 PolarHBondContact O-N 3.42Å; F478-V498 HydrophobicContact CD1-CG2 4.33Å; F478-V498 HydrophobicContact CE1-CG2 3.68Å
499	N	91.2	Very high	92.1	Very high	68 Å²	68	49.2 Å²	49.2	36%	0.364	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.6	167	-65.5	-0.9	0	0	0	107.3	L398 E399 L400	L398-N499 PolarHBondContact O-N 3.25Å; E399-N499 WeakPolarHBondContact CA-O 3.5Å; L400-N499 PolarHBondContact N-O 3.07Å
500	V	92.3	Very high	92	Very high	7 Å²	7	46.8 Å²	46.8	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.4	170.5	-175	0	0	0	0	107.8	L400 E402 I468 R470 F473 P474 I476	L400-V500 CarbonylContact O-C 3.31Å; L400-V500 VanDerWaalsContact O-CA 3.24Å; L400-V500 WeakPolarHBondContact O-CA 3.24Å; E402-V500 HydrophobicContact CB-CG1 3.84Å; I468-V500 HydrophobicContact CG2-CG1 3.88Å; I468-V500 HydrophobicContact CG2-CG2 3.79Å; R470-V500 HydrophobicContact CB-CB 4.24Å; R470-V500 HydrophobicContact CB-CG1 3.68Å; R470-V500 HydrophobicContact CG-CB 3.89Å; R470-V500 HydrophobicContact CG-CG1 3.82Å; F473-V500 VanDerWaalsContact O-CG2 3.3Å; F473-V500 WeakPolarHBondContact O-CG2 3.35Å; P474-V500 PolarHBondContact O-N 2.7Å; I476-V500 HydrophobicContact CD1-CG2 4.09Å; I476-V500 HydrophobicContact CG1-CG2 4Å
501	L	91.4	Very high	91.9	Very high	72 Å²	72	50.7 Å²	50.7	38%	0.377	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.4	179	-65.8	-176.1	0	0	0	110.5	E399 L400 I401 E402	E399-L501 HydrophobicContact CB-CD1 3.9Å; E399-L501 HydrophobicContact CB-CG 4.1Å; E399-L501 HydrophobicContact CG-CD1 4.39Å; E399-L501 HydrophobicContact CG-CD2 4.29Å; E399-L501 HydrophobicContact CG-CG 4.39Å; L400-L501 PolarHBondContact O-N 3.01Å; I401-L501 WeakPolarHBondContact CA-O 3.45Å; I401-L501 HydrophobicContact CG1-CB 4.29Å; I401-L501 HydrophobicContact CG1-CD1 4.35Å; E402-L501 PolarHBondContact N-O 2.9Å; E402-L501 VanDerWaalsContact N-O 3.09Å
502	D	92.9	Very high	91.6	Very high	37 Å²	37	52.4 Å²	52.4	20%	0.198	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-64.1	129.2	-174.5	-163.4	79.3	0	0	0	114.4	E402 R470 D543 E544 N547	E402-D502 VanDerWaalsContact OE1-CA 3.27Å; E402-D502 WeakPolarHBondContact OE1-CA 3.2Å; R470-D502 WeakPolarHBondContact CD-OD1 3.3Å; R470-D502 IonicContact CZ-OD1 3.9Å; R470-D502 IonicContact NE-OD1 3.32Å; R470-D502 PolarHBondContact NE-OD1 2.68Å; R470-D502 IonicContact NH1-OD1 3.61Å; R470-D502 IonicContact NH2-OD1 3.22Å; D502-D543 VanDerWaalsContact OD1-C 3.26Å; D502-D543 VanDerWaalsContact OD1-CA 3.3Å; D502-D543 WeakPolarHBondContact OD1-CA 3.11Å; D502-E544 HydrophobicContact CB-CB 3.85Å; D502-E544 VanDerWaalsContact CG-CB 3.49Å; D502-E544 WeakPolarHBondContact OD1-CB 3.08Å; D502-E544 PolarHBondContact OD1-N 3.16Å; D502-E544 PolarHBondContact OD2-N 3.01Å; D502-N547 WeakPolarHBondContact OD2-CB 3.33Å; D502-N547 PolarHBondContact OD2-ND2 3.14Å
503	I	91.7	Very high	91.3	Very high	55 Å²	55	57 Å²	57	28%	0.282	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-103.6	153.7	160.6	-69.6	178.7	0	0	0	107.9	I401 E402 E403 D505	I401-I503 HydrophobicContact CG2-CD1 3.69Å; I401-I503 HydrophobicContact CG2-CG1 3.67Å; E402-I503 HydrophobicContact CG-CB 3.95Å; E402-I503 HydrophobicContact CG-CD1 3.98Å; E402-I503 HydrophobicContact CG-CG1 3.92Å; E402-I503 WeakPolarHBondContact O-CD1 3.37Å; E402-I503 PolarHBondContact OE1-N 2.77Å; E403-I503 HydrophobicContact CB-CD1 4.3Å; E403-I503 HydrophobicContact CG-CD1 4.43Å; I503-D505 HydrophobicContact CB-CB 4.31Å; I503-D505 HydrophobicContact CG2-CB 4.04Å; I503-D505 PolarHBondContact O-N 2.75Å
504	N	93	Very high	91.3	Very high	18 Å²	18	56.8 Å²	56.8	10%	0.096	30%	0.299	C	S	.	.	S	Bend	trans	-77.1	73.5	172.8	-163.5	15.6	0	0	0	110.5	D543 N547 D597 P601 R603	N504-D543 VanDerWaalsContact CA-OD2 3.27Å; N504-D543 WeakPolarHBondContact CA-OD2 3.35Å; N504-D543 PolarHBondContact OD1-OD2 2.83Å; N504-N547 HydrophobicContact CB-CB 4.25Å; N504-N547 PolarHBondContact N-ND2 3.46Å; N504-D597 PolarHBondContact ND2-OD2 2.73Å; N504-D597 PolarHBondContact OD1-OD2 3.25Å; N504-P601 PolarHBondContact ND2-O 2.77Å; N504-R603 VanDerWaalsContact O-CD 3.25Å; N504-R603 WeakPolarHBondContact O-CD 3.37Å; N504-R603 PolarHBondContact O-NH1 3.21Å
505	D	91.8	Very high	91.3	Very high	51 Å²	51	55.1 Å²	55.1	27%	0.273	29%	0.29	S	S	.	.			trans	-105.6	-25.4	-161.7	142.1	-72.8	0	0	0	113.2	I503 D543 R603	I503-D505 HydrophobicContact CB-CB 4.31Å; I503-D505 HydrophobicContact CG2-CB 4.04Å; I503-D505 PolarHBondContact O-N 2.75Å; D505-D543 PolarHBondContact N-OD2 3.4Å; D505-R603 PolarHBondContact O-NH1 2.87Å; D505-R603 PolarHBondContact O-NH2 3.45Å
506	H	91.4	Very high	91.3	Very high	38 Å²	38	55.7 Å²	55.7	18%	0.176	29%	0.293	C	S	.	.	S	Bend	trans	-95.6	168	167.7	-68.6	71.8	0	0	0	112.9	E471 K542 D543 R603	E471-H506 IonicContact OE2-CE1 3.05Å; E471-H506 IonicContact OE2-ND1 3.32Å; H506-K542 HydrophobicContact CB-CB 4.36Å; H506-K542 WeakPolarHBondContact NE2-CE 3.36Å; H506-K542 PolarHBondContact NE2-NZ 3.25Å; H506-D543 VanDerWaalsContact CB-OD1 3.27Å; H506-D543 WeakPolarHBondContact CB-OD1 3.28Å; H506-D543 IonicContact CG-OD1 3.65Å; H506-D543 PolarHBondContact N-OD1 2.69Å; H506-D543 PolarHBondContact N-OD2 2.78Å; H506-D543 IonicContact ND1-OD1 2.65Å; H506-D543 PolarHBondContact ND1-OD1 3.37Å; H506-R603 WeakPolarHBondContact O-CD 3.46Å; H506-R603 PolarHBondContact O-NE 2.93Å
507	D	92.3	Very high	91.3	Very high	70 Å²	70	54.9 Å²	54.9	37%	0.374	29%	0.293	S	S	.	.			trans	-107.4	145.5	167.5	-63.5	-77.2	0	0	0	109.3	V509 R603	D507-V509 WeakPolarHBondContact O-CG2 3.37Å; D507-V509 PolarHBondContact O-N 3.42Å; D507-R603 VanDerWaalsContact CG-NH2 3.28Å; D507-R603 WeakPolarHBondContact OD1-CB 3.23Å; D507-R603 IonicContact OD1-CZ 2.75Å; D507-R603 IonicContact OD1-NE 2.77Å; D507-R603 PolarHBondContact OD1-NE 2.81Å; D507-R603 IonicContact OD1-NH2 3.89Å; D507-R603 IonicContact OD2-CZ 3.92Å; D507-R603 IonicContact OD2-NE 3.45Å; D507-R603 IonicContact OD2-NH2 3.47Å; D507-R603 PolarHBondContact OD2-NH2 3.43Å
508	P	94.1	Very high	91.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.297	C	S	.	.			trans	-46.5	109.4	173	-32	33.5	0	0	0	113.9	D541 L550 C595 T605	P508-D541 WeakPolarHBondContact CD-OD2 3.37Å; P508-D541 VanDerWaalsContact CG-OD2 3.28Å; P508-D541 WeakPolarHBondContact CG-OD2 3.28Å; P508-L550 HydrophobicContact CB-CD2 3.68Å; P508-L550 HydrophobicContact CG-CD2 3.96Å; P508-C595 HydrophobicContact CB-CB 4.32Å; P508-T605 WeakPolarHBondContact O-CB 3.31Å; P508-T605 PolarHBondContact O-OG1 3.33Å
509	V	91.9	Very high	91.2	Very high	78 Å²	78	55 Å²	55	47%	0.473	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	131.8	-179	-173.5	0	0	0	0	110.2	D507 A539 T540	D507-V509 WeakPolarHBondContact O-CG2 3.37Å; D507-V509 PolarHBondContact O-N 3.42Å; V509-A539 CarbonylContact O-C 3.55Å; V509-A539 WeakPolarHBondContact O-CA 3.05Å; V509-A539 WeakPolarHBondContact O-CB 3.42Å; V509-T540 WeakPolarHBondContact CB-O 3.38Å; V509-T540 PolarHBondContact N-O 3.17Å; V509-T540 PolarHBondContact O-N 3.24Å
510	C	89.4	Confident	91.1	Very high	6 Å²	6	54.5 Å²	54.5	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	149.9	174.1	-54.1	0	0	0	0	109.9	Q512 I537 A539 V607	C510-Q512 PolarHBondContact O-N 2.99Å; C510-I537 HydrophobicContact CB-CG2 4.46Å; C510-A539 HydrophobicContact CB-CB 4.36Å; C510-A539 VanDerWaalsContact SG-CB 3.58Å; C510-V607 HydrophobicContact CB-CG2 3.62Å; C510-V607 WeakPolarHBondContact SG-CG2 3.41Å
511	D	87.5	Confident	90.9	Very high	111 Å²	111	54.2 Å²	54.2	59%	0.594	29%	0.292	S	S	*	.	S	Bend	trans	-57.2	-28.7	-177	-58.5	-31.2	0	0	0	112.9	H538	D511-H538 PolarHBondContact N-O 3.17Å; D511-H538 WeakPolarHBondContact OD2-CB 3.44Å
512	Q	87.9	Confident	90.6	Very high	104 Å²	104	53.7 Å²	53.7	49%	0.486	29%	0.29	S	S	.	.			trans	-141	136.9	176.1	-54.5	-176.9	-16.6	0	0	111.2	C510 T514 Y515	C510-Q512 PolarHBondContact O-N 2.99Å; Q512-T514 PolarHBondContact O-N 2.92Å; Q512-Y515 HydrophobicContact CB-CD2 4.13Å; Q512-Y515 HydrophobicContact CB-CE1 4.2Å; Q512-Y515 HydrophobicContact CB-CE2 3.74Å; Q512-Y515 HydrophobicContact CG-CE1 4.25Å; Q512-Y515 PolarHBondContact N-OH 3.02Å; Q512-Y515 WeakPolarHBondContact O-CE2 3.42Å
513	N	86.9	Confident	90.1	Very high	122 Å²	122	54.1 Å²	54.1	65%	0.652	30%	0.296	S	S	*	.	S	Bend	trans	-70.7	-22	172.4	-63.2	14.3	0	0	0	112.1	K608	N513-K608 PolarHBondContact O-N 2.9Å
514	T	91.9	Very high	89.5	Confident	84 Å²	84	51.7 Å²	51.7	52%	0.515	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	120.6	179.5	60.6	0	0	0	0	111	Q512 K608	Q512-T514 PolarHBondContact O-N 2.92Å; T514-K608 CarbonylContact C-O 3.52Å; T514-K608 VanDerWaalsContact CA-O 3.23Å; T514-K608 WeakPolarHBondContact CA-O 3.16Å; T514-K608 HydrophobicContact CG2-CB 4.35Å
515	Y	92.2	Very high	88.7	Confident	22 Å²	22	54.3 Å²	54.3	9%	0.086	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	147.8	170.3	-67.1	-102	0	0	0	109.3	Q512 L535 I537 V607 K608 N610	Q512-Y515 HydrophobicContact CB-CD2 4.13Å; Q512-Y515 HydrophobicContact CB-CE1 4.2Å; Q512-Y515 HydrophobicContact CB-CE2 3.74Å; Q512-Y515 HydrophobicContact CG-CE1 4.25Å; Q512-Y515 PolarHBondContact N-OH 3.02Å; Q512-Y515 WeakPolarHBondContact O-CE2 3.42Å; Y515-L535 HydrophobicContact CD1-CD1 4.15Å; Y515-L535 HydrophobicContact CD1-CD2 4.4Å; Y515-L535 HydrophobicContact CG-CD2 4.21Å; Y515-I537 HydrophobicContact CD1-CD1 4.2Å; Y515-I537 HydrophobicContact CD2-CD1 3.5Å; Y515-I537 VanDerWaalsContact CD2-CD1 3.5Å; Y515-I537 HydrophobicContact CE1-CD1 4.14Å; Y515-I537 HydrophobicContact CE2-CD1 3.44Å; Y515-I537 VanDerWaalsContact CE2-CD1 3.44Å; Y515-I537 HydrophobicContact CG-CD1 3.89Å; Y515-V607 HydrophobicContact CD2-CG1 3.53Å; Y515-V607 HydrophobicContact CE2-CG1 3.74Å; Y515-K608 PolarHBondContact N-O 2.6Å; Y515-N610 PolarHBondContact O-N 3.03Å
516	T	92.9	Very high	87.7	Confident	88 Å²	88	59.5 Å²	59.5	54%	0.54	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.8	168	-57.9	0	0	0	0	107.4	N610	T516-N610 WeakPolarHBondContact CA-O 3.14Å; T516-N610 HydrophobicContact CG2-CB 4.44Å
517	V	92.4	Very high	86.9	Confident	26 Å²	26	58.4 Å²	58.4	16%	0.158	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.4	-176.8	-174.9	0	0	0	0	109.5	V519 F534 L535 N610 V611 N612	V517-V519 HydrophobicContact CG1-CG2 3.88Å; V517-F534 HydrophobicContact CG1-CD2 4.32Å; V517-L535 HydrophobicContact CG2-CB 4.37Å; V517-L535 HydrophobicContact CG2-CD1 4.03Å; V517-L535 HydrophobicContact CG2-CD2 3.86Å; V517-L535 HydrophobicContact CG2-CG 4.31Å; V517-N610 PolarHBondContact N-O 3.38Å; V517-V611 WeakPolarHBondContact O-CA 3.09Å; V517-N612 PolarHBondContact O-N 2.93Å
518	D	91.2	Very high	85.4	Confident	94 Å²	94	62 Å²	62	50%	0.503	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124.4	175.7	-56	-30.7	0	0	0	108.5	N612 L614	D518-N612 WeakPolarHBondContact CA-O 2.92Å; D518-N612 WeakPolarHBondContact OD1-CB 3.48Å; D518-N612 PolarHBondContact OD1-ND2 2.75Å; D518-L614 HydrophobicContact CB-CD1 3.77Å; D518-L614 HydrophobicContact CB-CD2 4.02Å; D518-L614 HydrophobicContact CB-CG 3.83Å
519	V	89.6	Confident	83.8	Confident	5 Å²	5	70 Å²	70	3%	0.03	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.2	-172.4	-178.2	0	0	0	0	109.5	V517 F532 F534 L581 V611 N612 V613 L614	V517-V519 HydrophobicContact CG1-CG2 3.88Å; V519-F532 HydrophobicContact CG1-CE1 4.43Å; V519-F534 HydrophobicContact CG1-CB 4.32Å; V519-F534 HydrophobicContact CG2-CB 3.83Å; V519-F534 HydrophobicContact CG2-CD2 3.72Å; V519-F534 HydrophobicContact CG2-CG 3.92Å; V519-L581 HydrophobicContact CG1-CD2 3.95Å; V519-V611 HydrophobicContact CB-CG1 3.98Å; V519-V611 HydrophobicContact CG2-CG1 3.72Å; V519-N612 PolarHBondContact N-O 3.27Å; V519-V613 CarbonylContact O-C 3.57Å; V519-V613 VanDerWaalsContact O-CA 3.3Å; V519-V613 WeakPolarHBondContact O-CA 3.44Å; V519-L614 PolarHBondContact O-N 3.37Å
520	M	88	Confident	82.4	Confident	56 Å²	56	75.2 Å²	75.2	28%	0.276	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	149.8	175.5	-152.6	73.3	98.8	0	0	111.3	S524 R527 L614	M520-S524 VanDerWaalsContact CG-CB 3.45Å; M520-R527 WeakPolarHBondContact O-CD 3.27Å; M520-R527 PolarHBondContact O-NE 2.87Å; M520-R527 PolarHBondContact O-NH1 2.89Å; M520-L614 HydrophobicContact SD-CB 3.5Å; M520-L614 VanDerWaalsContact SD-CB 3.5Å
521	E	88.9	Confident	81.6	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.005	41%	0.41	C	S	.	.			trans	-75	175.4	177.8	70	-158.9	116.7	0	0	114.8	S523 S524 R527 L581 R583 V613 L614 D615 Y616	E521-S523 VanDerWaalsContact C-N 3.31Å; E521-S523 PolarHBondContact O-N 2.98Å; E521-S524 WeakPolarHBondContact O-CB 3.27Å; E521-S524 PolarHBondContact O-N 3.46Å; E521-R527 PolarHBondContact O-NH1 3Å; E521-L581 WeakPolarHBondContact CB-O 3.13Å; E521-R583 WeakPolarHBondContact OE1-CB 3.3Å; E521-R583 WeakPolarHBondContact OE2-CB 3.32Å; E521-R583 PolarHBondContact OE2-N 3.41Å; E521-V613 HydrophobicContact CB-CG1 3.93Å; E521-L614 PolarHBondContact N-O 2.76Å; E521-D615 WeakPolarHBondContact OE1-CA 3.4Å; E521-Y616 PolarHBondContact OE1-N 2.73Å
522	D	85.1	Confident	81.4	Confident	61 Å²	61	77 Å²	77	33%	0.326	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-24.7	-165.3	-94.3	46.5	0	0	0	114.2	S524 R527 G579 N580 L581	D522-S524 VanDerWaalsContact C-N 3.25Å; D522-S524 PolarHBondContact O-N 3.13Å; D522-R527 IonicContact OD1-CZ 3.44Å; D522-R527 IonicContact OD1-NH1 2.7Å; D522-R527 PolarHBondContact OD1-NH1 3.37Å; D522-R527 IonicContact OD1-NH2 3.7Å; D522-R527 PolarHBondContact OD1-NH2 3.46Å; D522-G579 VanDerWaalsContact OD2-C 3.3Å; D522-G579 WeakPolarHBondContact OD2-CA 3.22Å; D522-N580 VanDerWaalsContact CG-N 3.35Å; D522-N580 PolarHBondContact OD2-N 2.97Å; D522-L581 WeakPolarHBondContact CB-O 3.22Å; D522-L581 PolarHBondContact N-O 2.9Å; D522-L581 VanDerWaalsContact OD1-CB 3.31Å; D522-L581 WeakPolarHBondContact OD1-CB 3.2Å; D522-L581 PolarHBondContact OD1-N 3.47Å
523	S	81.3	Confident	81.4	Confident	46 Å²	46	78.5 Å²	78.5	32%	0.322	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-18	178.8	51	0	0	0	0	113.6	E521 P525 Y616 D618	E521-S523 VanDerWaalsContact C-N 3.31Å; E521-S523 PolarHBondContact O-N 2.98Å; S523-P525 WeakPolarHBondContact O-CD 3.25Å; S523-Y616 WeakPolarHBondContact OG-CD1 3.16Å; S523-D618 WeakPolarHBondContact CB-OD2 3.29Å; S523-D618 PolarHBondContact OG-OD2 3.22Å
524	S	80	Confident	81.4	Confident	5 Å²	5	74 Å²	74	4%	0.035	38%	0.376	C	S	.	.	S	Bend	trans	-63.6	127.7	177.4	178.1	0	0	0	0	112.5	M520 E521 D522 E526 R527	M520-S524 VanDerWaalsContact CG-CB 3.45Å; E521-S524 WeakPolarHBondContact O-CB 3.27Å; E521-S524 PolarHBondContact O-N 3.46Å; D522-S524 VanDerWaalsContact C-N 3.25Å; D522-S524 PolarHBondContact O-N 3.13Å; S524-E526 PolarHBondContact O-N 2.64Å; S524-E526 PolarHBondContact OG-N 2.77Å; S524-R527 PolarHBondContact O-N 2.95Å
525	P	76.3	Confident	81.4	Confident	73 Å²	73	71.3 Å²	71.3	47%	0.474	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-56.5	-18.1	174	-28.7	36.2	0	0	0	115.1	S523 R527 I528 Y616	S523-P525 WeakPolarHBondContact O-CD 3.25Å; P525-R527 PolarHBondContact O-N 2.7Å; P525-I528 HydrophobicContact CB-CD1 4.24Å; P525-I528 WeakPolarHBondContact O-CD1 3.22Å; P525-I528 VanDerWaalsContact O-CG1 3.23Å; P525-I528 WeakPolarHBondContact O-CG1 3.13Å; P525-Y616 WeakPolarHBondContact CD-OH 3.43Å; P525-Y616 WeakPolarHBondContact CG-OH 3.32Å
526	E	70.3	Confident	81.4	Confident	160 Å²	160	72.7 Å²	72.7	75%	0.748	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-73	-18.6	175.1	-58.2	-165.1	153.3	0	0	112.3	S524	S524-E526 PolarHBondContact O-N 2.64Å; S524-E526 PolarHBondContact OG-N 2.77Å
527	R	75.7	Confident	81.3	Confident	15 Å²	15	68.5 Å²	68.5	6%	0.057	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-105.9	18.5	-178.3	-65.4	-168.9	58.3	-121.5	-18.6	114.9	M520 E521 D522 S524 P525 K529 F532 T577	M520-R527 WeakPolarHBondContact O-CD 3.27Å; M520-R527 PolarHBondContact O-NE 2.87Å; M520-R527 PolarHBondContact O-NH1 2.89Å; E521-R527 PolarHBondContact O-NH1 3Å; D522-R527 IonicContact OD1-CZ 3.44Å; D522-R527 IonicContact OD1-NH1 2.7Å; D522-R527 PolarHBondContact OD1-NH1 3.37Å; D522-R527 IonicContact OD1-NH2 3.7Å; D522-R527 PolarHBondContact OD1-NH2 3.46Å; S524-R527 PolarHBondContact O-N 2.95Å; P525-R527 PolarHBondContact O-N 2.7Å; R527-K529 CarbonylContact O-C 3.58Å; R527-K529 PolarHBondContact O-N 3.06Å; R527-F532 HydrophobicContact CB-CD2 4.34Å; R527-F532 HydrophobicContact CB-CG 4.4Å; R527-F532 HydrophobicContact CG-CB 4.38Å; R527-F532 HydrophobicContact CG-CD1 4Å; R527-F532 HydrophobicContact CG-CD2 3.72Å; R527-F532 HydrophobicContact CG-CE1 4.17Å; R527-F532 HydrophobicContact CG-CE2 3.89Å; R527-F532 HydrophobicContact CG-CG 3.78Å; R527-F532 HydrophobicContact CG-CZ 4.11Å; R527-T577 PolarHBondContact NH2-OG1 3.37Å
528	I	60.8	Low	81.2	Confident	145 Å²	145	72.9 Å²	72.9	74%	0.744	36%	0.361	S	S	*	.			trans	-49.5	-20.6	176.1	-76.3	169.8	0	0	0	114.8	P525	P525-I528 HydrophobicContact CB-CD1 4.24Å; P525-I528 WeakPolarHBondContact O-CD1 3.22Å; P525-I528 VanDerWaalsContact O-CG1 3.23Å; P525-I528 WeakPolarHBondContact O-CG1 3.13Å
529	K	59.7	Low	81.2	Confident	168 Å²	168	69.2 Å²	69.2	73%	0.73	34%	0.344	S	S	*	.	S	Bend	trans	-87.1	121.1	173.2	-65.5	178.3	-175.8	171.8	0	111.3	R527 F532	R527-K529 CarbonylContact O-C 3.58Å; R527-K529 PolarHBondContact O-N 3.06Å; K529-F532 PolarHBondContact O-N 2.75Å
530	K	62.2	Low	81.3	Confident	188 Å²	188	73.4 Å²	73.4	82%	0.817	37%	0.37	S	S	*	.	S	Bend	trans	-52.8	140.7	156.3	-64.2	-167.4	175.1	-165.2	0	109.4
531	N	72.1	Confident	81.6	Confident	94 Å²	94	71.7 Å²	71.7	50%	0.503	36%	0.362	S	S	.	.	S	Bend	trans	64.6	53.5	-169	-50.8	-1.7	0	0	0	112.1	E533 T577	N531-E533 PolarHBondContact O-N 2.82Å; N531-T577 WeakPolarHBondContact CA-O 3.41Å; N531-T577 PolarHBondContact N-O 2.79Å
532	F	83.2	Confident	81.8	Confident	61 Å²	61	76.8 Å²	76.8	27%	0.268	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	112.5	171.1	175	-91.2	0	0	0	109.7	V519 R527 K529 F534 S576 T577	V519-F532 HydrophobicContact CG1-CE1 4.43Å; R527-F532 HydrophobicContact CB-CD2 4.34Å; R527-F532 HydrophobicContact CB-CG 4.4Å; R527-F532 HydrophobicContact CG-CB 4.38Å; R527-F532 HydrophobicContact CG-CD1 4Å; R527-F532 HydrophobicContact CG-CD2 3.72Å; R527-F532 HydrophobicContact CG-CE1 4.17Å; R527-F532 HydrophobicContact CG-CE2 3.89Å; R527-F532 HydrophobicContact CG-CG 3.78Å; R527-F532 HydrophobicContact CG-CZ 4.11Å; K529-F532 PolarHBondContact O-N 2.75Å; F532-F534 HydrophobicContact CD1-CB 4.17Å; F532-F534 HydrophobicContact CE1-CB 3.94Å; F532-S576 CarbonylContact O-C 3.56Å; F532-S576 VanDerWaalsContact O-CA 3.26Å; F532-S576 WeakPolarHBondContact O-CA 3.32Å; F532-T577 WeakPolarHBondContact CB-OG1 3.45Å; F532-T577 PolarHBondContact N-O 2.91Å; F532-T577 PolarHBondContact O-N 2.9Å; F532-T577 PolarHBondContact O-OG1 3.27Å; F532-T577 VanDerWaalsContact O-OG1 3.09Å
533	E	87.8	Confident	82.3	Confident	135 Å²	135	74.2 Å²	74.2	63%	0.631	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	120.4	177.8	-63.5	173.6	166.2	0	0	109.7	N531 T574 L575	N531-E533 PolarHBondContact O-N 2.82Å; E533-T574 HydrophobicContact CB-CG2 3.87Å; E533-T574 HydrophobicContact CG-CG2 3.72Å; E533-L575 WeakPolarHBondContact CA-O 3.47Å
534	F	88.7	Confident	82.8	Confident	28 Å²	28	77.2 Å²	77.2	12%	0.123	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	-19.8	-171.9	67.5	-90.5	0	0	0	114.3	V517 V519 F532 I566 L575 T577 V611	V517-F534 HydrophobicContact CG1-CD2 4.32Å; V519-F534 HydrophobicContact CG1-CB 4.32Å; V519-F534 HydrophobicContact CG2-CB 3.83Å; V519-F534 HydrophobicContact CG2-CD2 3.72Å; V519-F534 HydrophobicContact CG2-CG 3.92Å; F532-F534 HydrophobicContact CD1-CB 4.17Å; F532-F534 HydrophobicContact CE1-CB 3.94Å; F534-I566 HydrophobicContact CE1-CG2 4.29Å; F534-I566 HydrophobicContact CZ-CD1 4.25Å; F534-I566 HydrophobicContact CZ-CG2 4.36Å; F534-L575 HydrophobicContact CD1-CB 4.43Å; F534-L575 WeakPolarHBondContact CD1-O 3.43Å; F534-L575 HydrophobicContact CE1-CB 3.68Å; F534-L575 HydrophobicContact CE2-CB 4.22Å; F534-L575 HydrophobicContact CZ-CB 3.56Å; F534-L575 HydrophobicContact CZ-CD2 4.31Å; F534-L575 PolarHBondContact N-O 2.83Å; F534-T577 HydrophobicContact CD1-CG2 3.96Å; F534-T577 HydrophobicContact CE1-CG2 4.06Å; F534-V611 HydrophobicContact CE2-CG2 3.91Å; F534-V611 HydrophobicContact CZ-CG2 4.46Å
535	L	91.5	Very high	83.3	Confident	27 Å²	27	80.1 Å²	80.1	14%	0.141	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	142.2	176.6	-178.7	59.1	0	0	0	109.4	Y515 V517 I537 T574 L575 I609	Y515-L535 HydrophobicContact CD1-CD1 4.15Å; Y515-L535 HydrophobicContact CD1-CD2 4.4Å; Y515-L535 HydrophobicContact CG-CD2 4.21Å; V517-L535 HydrophobicContact CG2-CB 4.37Å; V517-L535 HydrophobicContact CG2-CD1 4.03Å; V517-L535 HydrophobicContact CG2-CD2 3.86Å; V517-L535 HydrophobicContact CG2-CG 4.31Å; L535-I537 HydrophobicContact CD1-CD1 4.41Å; L535-I537 HydrophobicContact CD2-CD1 3.53Å; L535-I537 HydrophobicContact CD2-CG1 4.38Å; L535-I537 HydrophobicContact CG-CD1 3.88Å; L535-T574 CarbonylContact O-C 3.54Å; L535-T574 WeakPolarHBondContact O-CA 3.41Å; L535-L575 HydrophobicContact CB-CD1 4.31Å; L535-L575 HydrophobicContact CD2-CD1 4.36Å; L535-L575 HydrophobicContact CG-CD1 4.36Å; L535-L575 PolarHBondContact O-N 2.79Å; L535-I609 HydrophobicContact CD2-CD1 4.11Å; L535-I609 HydrophobicContact CD2-CG1 4.16Å; L535-I609 HydrophobicContact CD2-CG2 3.79Å
536	T	92.1	Very high	84.1	Confident	50 Å²	50	83.8 Å²	83.8	31%	0.307	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.2	162.3	-66.2	0	0	0	0	108.1	H538 T572 T574	T536-H538 PolarHBondContact O-N 3.18Å; T536-T572 VanDerWaalsContact CG2-O 3.32Å; T536-T572 WeakPolarHBondContact CG2-O 3.15Å; T536-T574 WeakPolarHBondContact OG1-CB 3.4Å; T536-T574 WeakPolarHBondContact OG1-CG2 3.4Å; T536-T574 PolarHBondContact OG1-OG1 3.1Å
537	I	91	Very high	85.2	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.005	39%	0.385	C	S	.	.			trans	-82	114.6	174.6	-61.1	-58.9	0	0	0	108.4	C510 Y515 L535 F552 G573 L575 L593 I609	C510-I537 HydrophobicContact CB-CG2 4.46Å; Y515-I537 HydrophobicContact CD1-CD1 4.2Å; Y515-I537 HydrophobicContact CD2-CD1 3.5Å; Y515-I537 VanDerWaalsContact CD2-CD1 3.5Å; Y515-I537 HydrophobicContact CE1-CD1 4.14Å; Y515-I537 HydrophobicContact CE2-CD1 3.44Å; Y515-I537 VanDerWaalsContact CE2-CD1 3.44Å; Y515-I537 HydrophobicContact CG-CD1 3.89Å; L535-I537 HydrophobicContact CD1-CD1 4.41Å; L535-I537 HydrophobicContact CD2-CD1 3.53Å; L535-I537 HydrophobicContact CD2-CG1 4.38Å; L535-I537 HydrophobicContact CG-CD1 3.88Å; I537-F552 HydrophobicContact CG2-CE1 4.35Å; I537-G573 PolarHBondContact N-O 3.46Å; I537-L575 HydrophobicContact CG1-CD1 3.89Å; I537-L593 HydrophobicContact CB-CD2 3.86Å; I537-L593 HydrophobicContact CG1-CD2 3.53Å; I537-L593 HydrophobicContact CG2-CD2 4.19Å; I537-I609 HydrophobicContact CD1-CD1 4.16Å; I537-I609 HydrophobicContact CD1-CG1 4.34Å; I537-I609 HydrophobicContact CG1-CD1 4.18Å
538	H	90.2	Very high	86	Confident	118 Å²	118	78.2 Å²	78.2	55%	0.546	40%	0.395	S	S	.	.			trans	-84.3	129.4	165.5	-67.3	-63.6	0	0	0	109.3	D511 T536	D511-H538 PolarHBondContact N-O 3.17Å; D511-H538 WeakPolarHBondContact OD2-CB 3.44Å; T536-H538 PolarHBondContact O-N 3.18Å
539	A	91	Very high	87.5	Confident	17 Å²	17	76.9 Å²	76.9	14%	0.14	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.5	174.7	0	0	0	0	0	108.4	V509 C510 L550 F552	V509-A539 CarbonylContact O-C 3.55Å; V509-A539 WeakPolarHBondContact O-CA 3.05Å; V509-A539 WeakPolarHBondContact O-CB 3.42Å; C510-A539 HydrophobicContact CB-CB 4.36Å; C510-A539 VanDerWaalsContact SG-CB 3.58Å; A539-L550 HydrophobicContact CB-CD1 3.83Å; A539-L550 VanDerWaalsContact O-CD1 3.23Å; A539-L550 WeakPolarHBondContact O-CD1 3.29Å; A539-F552 HydrophobicContact CB-CE1 4.18Å; A539-F552 HydrophobicContact CB-CZ 4.3Å
540	T	92.5	Very high	89.1	Confident	92 Å²	92	70.4 Å²	70.4	56%	0.564	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	122.2	175.4	54.4	0	0	0	0	107.5	V509	V509-T540 WeakPolarHBondContact CB-O 3.38Å; V509-T540 PolarHBondContact N-O 3.17Å; V509-T540 PolarHBondContact O-N 3.24Å
541	D	94.3	Very high	90.6	Very high	20 Å²	20	64.9 Å²	64.9	11%	0.107	33%	0.334	C	S	.	.			trans	-94.4	151.7	161.5	-156.2	-32.7	0	0	0	108	P508 A548 L550	P508-D541 WeakPolarHBondContact CD-OD2 3.37Å; P508-D541 VanDerWaalsContact CG-OD2 3.28Å; P508-D541 WeakPolarHBondContact CG-OD2 3.28Å; D541-A548 HydrophobicContact CB-CB 3.88Å; D541-L550 HydrophobicContact CB-CD2 4.05Å
542	K	92.7	Very high	91.6	Very high	108 Å²	108	60.9 Å²	60.9	47%	0.47	31%	0.312	S	S	.	.			trans	-92.7	-31.9	-173.6	-69	-162.7	-167	166.2	0	113.5	R470 E471 H506	R470-K542 PolarHBondContact NH2-O 2.77Å; E471-K542 HydrophobicContact CB-CD 3.95Å; E471-K542 HydrophobicContact CG-CB 3.54Å; E471-K542 HydrophobicContact CG-CD 3.6Å; E471-K542 HydrophobicContact CG-CG 4.31Å; H506-K542 HydrophobicContact CB-CB 4.36Å; H506-K542 WeakPolarHBondContact NE2-CE 3.36Å; H506-K542 PolarHBondContact NE2-NZ 3.25Å
543	D	94.5	Very high	92.1	Very high	8 Å²	8	59.7 Å²	59.7	4%	0.043	31%	0.312	C	S	.	.	S	Bend	trans	-61.8	-159.3	-170.7	-59.1	14.4	0	0	0	112.7	R470 D502 N504 D505 H506 N547 A548	R470-D543 PolarHBondContact NH2-O 3.5Å; D502-D543 VanDerWaalsContact OD1-C 3.26Å; D502-D543 VanDerWaalsContact OD1-CA 3.3Å; D502-D543 WeakPolarHBondContact OD1-CA 3.11Å; N504-D543 VanDerWaalsContact CA-OD2 3.27Å; N504-D543 WeakPolarHBondContact CA-OD2 3.35Å; N504-D543 PolarHBondContact OD1-OD2 2.83Å; D505-D543 PolarHBondContact N-OD2 3.4Å; H506-D543 VanDerWaalsContact CB-OD1 3.27Å; H506-D543 WeakPolarHBondContact CB-OD1 3.28Å; H506-D543 IonicContact CG-OD1 3.65Å; H506-D543 PolarHBondContact N-OD1 2.69Å; H506-D543 PolarHBondContact N-OD2 2.78Å; H506-D543 IonicContact ND1-OD1 2.65Å; H506-D543 PolarHBondContact ND1-OD1 3.37Å; D543-N547 HydrophobicContact CB-CB 3.58Å; D543-A548 HydrophobicContact CB-CB 4.26Å; D543-A548 WeakPolarHBondContact O-CB 3.42Å
544	E	91.9	Very high	92.3	Very high	109 Å²	109	54.8 Å²	54.8	51%	0.509	29%	0.289	S	S	.	.			trans	-126.3	144.1	-173.9	-152.7	167.7	141.8	0	0	115	R470 D502 R546 N547	R470-E544 IonicContact CZ-OE2 2.65Å; R470-E544 IonicContact NH1-OE2 2.73Å; R470-E544 PolarHBondContact NH1-OE2 3.06Å; D502-E544 HydrophobicContact CB-CB 3.85Å; D502-E544 VanDerWaalsContact CG-CB 3.49Å; D502-E544 WeakPolarHBondContact OD1-CB 3.08Å; D502-E544 PolarHBondContact OD1-N 3.16Å; D502-E544 PolarHBondContact OD2-N 3.01Å; E544-R546 VanDerWaalsContact C-N 3.32Å; E544-R546 PolarHBondContact O-N 3.31Å; E544-N547 PolarHBondContact O-N 2.96Å
545	G	91.4	Very high	92.4	Very high	66 Å²	66	53.9 Å²	53.9	68%	0.68	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	-73.1	159.1	0	0	0	0	0	116.2
546	R	92.6	Very high	92	Very high	150 Å²	150	61.5 Å²	61.5	57%	0.566	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-29.7	175.1	-84.8	-168.8	60.3	166.5	-7.3	113.3	E544 K549 H598 G599	E544-R546 VanDerWaalsContact C-N 3.32Å; E544-R546 PolarHBondContact O-N 3.31Å; R546-K549 PolarHBondContact O-N 3.13Å; R546-H598 VanDerWaalsContact CZ-O 3.31Å; R546-H598 PolarHBondContact NE-O 2.74Å; R546-H598 PolarHBondContact NH2-O 3.11Å; R546-H598 CarbonylContact O-C 3.53Å; R546-H598 VanDerWaalsContact O-C 3.23Å; R546-H598 WeakPolarHBondContact O-CA 3.03Å; R546-H598 WeakPolarHBondContact O-CB 3.17Å; R546-H598 PolarHBondContact O-N 3.13Å; R546-G599 PolarHBondContact O-N 2.91Å
547	N	92.8	Very high	91.5	Very high	25 Å²	25	66.5 Å²	66.5	13%	0.134	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-56.3	177.7	-61.9	-15.3	0	0	0	107.3	D502 N504 D543 E544 K549 D597 G599	D502-N547 WeakPolarHBondContact OD2-CB 3.33Å; D502-N547 PolarHBondContact OD2-ND2 3.14Å; N504-N547 HydrophobicContact CB-CB 4.25Å; N504-N547 PolarHBondContact N-ND2 3.46Å; D543-N547 HydrophobicContact CB-CB 3.58Å; E544-N547 PolarHBondContact O-N 2.96Å; N547-K549 PolarHBondContact O-N 2.97Å; N547-D597 WeakPolarHBondContact O-CB 3.25Å; N547-G599 WeakPolarHBondContact OD1-CA 3.5Å
548	A	92.5	Very high	91.1	Very high	33 Å²	33	66.9 Å²	66.9	27%	0.273	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	12.3	171.7	0	0	0	0	0	117.2	D541 D543 L550	D541-A548 HydrophobicContact CB-CB 3.88Å; D543-A548 HydrophobicContact CB-CB 4.26Å; D543-A548 WeakPolarHBondContact O-CB 3.42Å; A548-L550 PolarHBondContact O-N 3.46Å
549	K	92.5	Very high	90.9	Very high	116 Å²	116	63.8 Å²	63.8	50%	0.504	33%	0.334	S	S	.	.			trans	-94	96.9	178.8	-166.3	-170.6	165.8	-162.2	0	111.8	R546 N547 D597 H598	R546-K549 PolarHBondContact O-N 3.13Å; N547-K549 PolarHBondContact O-N 2.97Å; K549-D597 CarbonylContact O-C 3.38Å; K549-H598 HydrophobicContact CB-CB 4.49Å; K549-H598 PolarHBondContact O-CD2 3.08Å; K549-H598 PolarHBondContact O-N 2.94Å
550	L	93.2	Very high	90.5	Very high	33 Å²	33	68.5 Å²	68.5	17%	0.173	36%	0.361	C	S	.	.			trans	-64.1	144.6	-178.6	-61.1	174.7	0	0	0	115.3	P508 A539 D541 A548 F552 A596	P508-L550 HydrophobicContact CB-CD2 3.68Å; P508-L550 HydrophobicContact CG-CD2 3.96Å; A539-L550 HydrophobicContact CB-CD1 3.83Å; A539-L550 VanDerWaalsContact O-CD1 3.23Å; A539-L550 WeakPolarHBondContact O-CD1 3.29Å; D541-L550 HydrophobicContact CB-CD2 4.05Å; A548-L550 PolarHBondContact O-N 3.46Å; L550-F552 HydrophobicContact CB-CE2 4.09Å; L550-F552 HydrophobicContact CB-CZ 4.27Å; L550-F552 HydrophobicContact CD1-CZ 4.08Å; L550-A596 CarbonylContact C-O 3.41Å; L550-A596 WeakPolarHBondContact CA-O 3.43Å
551	H	93.3	Very high	90	Very high	72 Å²	72	70.2 Å²	70.2	33%	0.333	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	126.8	171	177.2	55.2	0	0	0	109.6	A570 A596	H551-A570 PolarHBondContact ND1-O 3.2Å; H551-A596 PolarHBondContact N-O 3.09Å; H551-A596 PolarHBondContact O-N 2.9Å
552	F	94.3	Very high	89.6	Confident	10 Å²	10	69.4 Å²	69.4	4%	0.044	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.3	-176.9	-60.1	-88.3	0	0	0	111.2	I537 A539 L550 V568 A570 G573 L593 I594 C595	I537-F552 HydrophobicContact CG2-CE1 4.35Å; A539-F552 HydrophobicContact CB-CE1 4.18Å; A539-F552 HydrophobicContact CB-CZ 4.3Å; L550-F552 HydrophobicContact CB-CE2 4.09Å; L550-F552 HydrophobicContact CB-CZ 4.27Å; L550-F552 HydrophobicContact CD1-CZ 4.08Å; F552-V568 HydrophobicContact CB-CG2 4.08Å; F552-A570 PolarHBondContact N-O 2.66Å; F552-A570 VanDerWaalsContact N-O 3.11Å; F552-A570 WeakPolarHBondContact O-CA 3.41Å; F552-G573 VanDerWaalsContact CD2-N 3.27Å; F552-G573 VanDerWaalsContact CG-CA 3.49Å; F552-L593 HydrophobicContact CD1-CD2 3.96Å; F552-I594 WeakPolarHBondContact CA-O 3.21Å; F552-C595 HydrophobicContact CD1-CB 4.31Å; F552-C595 VanDerWaalsContact CD1-SG 3.57Å; F552-C595 HydrophobicContact CE1-CB 4.26Å; F552-C595 VanDerWaalsContact CE1-SG 3.57Å
553	S	93.4	Very high	89	Confident	36 Å²	36	67.2 Å²	67.2	25%	0.252	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	152	179.7	59.1	0	0	0	0	112.4	L593 I594	S553-L593 VanDerWaalsContact O-CD1 3.31Å; S553-L593 WeakPolarHBondContact O-CD1 3.38Å; S553-I594 PolarHBondContact N-O 2.66Å; S553-I594 PolarHBondContact O-N 3.03Å
554	L	91.8	Very high	88.5	Confident	31 Å²	31	72.7 Å²	72.7	16%	0.162	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	136.3	173.7	-57.7	-172.2	0	0	0	109.9	M563 V568 L575 V591 L593	L554-M563 HydrophobicContact CB-CE 3.9Å; L554-M563 HydrophobicContact CB-SD 3.8Å; L554-M563 HydrophobicContact CD1-SD 3.64Å; L554-M563 HydrophobicContact CG-SD 4.35Å; L554-V568 HydrophobicContact CD2-CB 4.11Å; L554-V568 HydrophobicContact CD2-CG1 3.87Å; L554-V568 HydrophobicContact CG-CG1 4Å; L554-L575 HydrophobicContact CD2-CD2 4.28Å; L554-V591 HydrophobicContact CD2-CG1 3.78Å; L554-L593 HydrophobicContact CD2-CD1 3.91Å
555	D	90.2	Very high	88.1	Confident	9 Å²	9	68.7 Å²	68.7	5%	0.048	36%	0.357	C	S	.	.			trans	-63.4	139.1	179.8	-165.9	-4	0	0	0	111.5	E557 T558 M563 T592 I594 K606	D555-E557 PolarHBondContact O-N 3.23Å; D555-E557 VanDerWaalsContact O-N 3.14Å; D555-T558 WeakPolarHBondContact O-CB 3.37Å; D555-T558 PolarHBondContact O-N 2.99Å; D555-T558 PolarHBondContact O-OG1 3.3Å; D555-M563 WeakPolarHBondContact O-CE 3.36Å; D555-T592 HydrophobicContact CB-CG2 3.94Å; D555-T592 VanDerWaalsContact CB-O 3.29Å; D555-T592 WeakPolarHBondContact CB-O 3.23Å; D555-T592 PolarHBondContact N-O 3.32Å; D555-T592 WeakPolarHBondContact OD2-CG2 3.24Å; D555-I594 HydrophobicContact CB-CD1 4.06Å; D555-I594 HydrophobicContact CB-CG1 4.14Å; D555-K606 IonicContact OD1-NZ 3.02Å; D555-K606 PolarHBondContact OD1-NZ 2.97Å; D555-K606 VanDerWaalsContact OD1-NZ 3.13Å; D555-K606 VanDerWaalsContact OD2-CE 3.24Å; D555-K606 WeakPolarHBondContact OD2-CE 2.92Å; D555-K606 IonicContact OD2-NZ 2.64Å; D555-K606 PolarHBondContact OD2-NZ 3.35Å
556	Q	83.3	Confident	88	Confident	188 Å²	188	65.7 Å²	65.7	88%	0.879	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.6	-177.5	-63.5	-175.2	3.5	0	0	112.8	T558	Q556-T558 PolarHBondContact O-N 2.78Å
557	E	82.9	Confident	87.9	Confident	154 Å²	154	61 Å²	61	72%	0.72	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.7	171.8	-64.6	172.9	-138.7	0	0	113.2	D555 P559 K606	D555-E557 PolarHBondContact O-N 3.23Å; D555-E557 VanDerWaalsContact O-N 3.14Å; E557-P559 WeakPolarHBondContact O-CD 3.5Å; E557-K606 IonicContact OE1-NZ 3.96Å; E557-K606 PolarHBondContact OE1-NZ 2.86Å
558	T	82.5	Confident	87.9	Confident	9 Å²	9	61.1 Å²	61.1	6%	0.055	32%	0.315	C	S	.	.	S	Bend	trans	-68.1	123.5	178.8	-52.4	0	0	0	0	110.4	D555 Q556 T560 I562 M563 V591	D555-T558 WeakPolarHBondContact O-CB 3.37Å; D555-T558 PolarHBondContact O-N 2.99Å; D555-T558 PolarHBondContact O-OG1 3.3Å; Q556-T558 PolarHBondContact O-N 2.78Å; T558-T560 PolarHBondContact O-N 2.94Å; T558-I562 HydrophobicContact CG2-CB 4.17Å; T558-I562 HydrophobicContact CG2-CG2 4.33Å; T558-M563 HydrophobicContact CG2-CG 4.42Å; T558-M563 HydrophobicContact CG2-SD 4.33Å; T558-V591 HydrophobicContact CG2-CG1 4.22Å; T558-V591 HydrophobicContact CG2-CG2 4.13Å
559	P	85	Confident	87.9	Confident	54 Å²	54	62.8 Å²	62.8	35%	0.351	32%	0.319	S	S	.	.			trans	-52.7	137.9	-178.3	-29.4	34	0	0	0	114.3	E557 Y561 I562 M563	E557-P559 WeakPolarHBondContact O-CD 3.5Å; P559-Y561 HydrophobicContact CB-CD1 3.62Å; P559-Y561 HydrophobicContact CB-CE1 3.34Å; P559-Y561 HydrophobicContact CG-CE1 4.11Å; P559-Y561 PolarHBondContact O-N 2.8Å; P559-Y561 VanDerWaalsContact O-N 3.13Å; P559-I562 HydrophobicContact CB-CD1 4.23Å; P559-I562 HydrophobicContact CB-CG1 4.31Å; P559-I562 HydrophobicContact CG-CD1 4.13Å; P559-I562 WeakPolarHBondContact O-CA 3.43Å; P559-I562 WeakPolarHBondContact O-CB 3.07Å; P559-I562 PolarHBondContact O-N 3.47Å; P559-M563 PolarHBondContact O-N 2.8Å; P559-M563 VanDerWaalsContact O-N 3.12Å
560	T	82.7	Confident	87.9	Confident	116 Å²	116	59.1 Å²	59.1	71%	0.712	31%	0.311	S	S	*	.	H	α-helix	trans	-58.6	-29.1	-175	50.9	0	0	0	0	114.2	T558 I562 M563 N564	T558-T560 PolarHBondContact O-N 2.94Å; T560-I562 VanDerWaalsContact C-N 3.31Å; T560-I562 PolarHBondContact O-N 2.95Å; T560-M563 PolarHBondContact O-N 3.08Å; T560-N564 PolarHBondContact O-N 3.22Å; T560-N564 PolarHBondContact O-ND2 3.04Å
561	Y	82.9	Confident	87.7	Confident	127 Å²	127	62.9 Å²	62.9	50%	0.498	34%	0.335	S	S	.	.	H	α-helix	trans	-68.7	-29.3	174.5	71.9	-91.9	0	0	0	112.6	P559 L565 L586	P559-Y561 HydrophobicContact CB-CD1 3.62Å; P559-Y561 HydrophobicContact CB-CE1 3.34Å; P559-Y561 HydrophobicContact CG-CE1 4.11Å; P559-Y561 PolarHBondContact O-N 2.8Å; P559-Y561 VanDerWaalsContact O-N 3.13Å; Y561-L565 WeakPolarHBondContact O-CG 3.34Å; Y561-L586 HydrophobicContact CE2-CD1 4.17Å; Y561-L586 HydrophobicContact CE2-CD2 4.29Å
562	I	85.4	Confident	87.6	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.015	34%	0.337	C	S	.	.	H	α-helix	trans	-81.3	-35.3	175.5	-50.8	174.7	0	0	0	110.7	T558 P559 T560 N564 L565 I566 F589 V591	T558-I562 HydrophobicContact CG2-CB 4.17Å; T558-I562 HydrophobicContact CG2-CG2 4.33Å; P559-I562 HydrophobicContact CB-CD1 4.23Å; P559-I562 HydrophobicContact CB-CG1 4.31Å; P559-I562 HydrophobicContact CG-CD1 4.13Å; P559-I562 WeakPolarHBondContact O-CA 3.43Å; P559-I562 WeakPolarHBondContact O-CB 3.07Å; P559-I562 PolarHBondContact O-N 3.47Å; T560-I562 VanDerWaalsContact C-N 3.31Å; T560-I562 PolarHBondContact O-N 2.95Å; I562-N564 PolarHBondContact O-N 2.85Å; I562-N564 VanDerWaalsContact O-N 3.15Å; I562-L565 PolarHBondContact O-N 2.89Å; I562-I566 HydrophobicContact CG2-CD1 3.97Å; I562-I566 PolarHBondContact O-N 2.98Å; I562-I566 VanDerWaalsContact O-N 3.1Å; I562-F589 HydrophobicContact CD1-CB 3.93Å; I562-F589 HydrophobicContact CD1-CD2 4.39Å; I562-F589 HydrophobicContact CD1-CG 4.45Å; I562-F589 HydrophobicContact CG2-CD2 4Å; I562-F589 HydrophobicContact CG2-CE2 4.27Å; I562-V591 HydrophobicContact CG2-CG2 3.56Å
563	M	80.2	Confident	87.4	Confident	63 Å²	63	61.9 Å²	61.9	31%	0.31	34%	0.335	S	S	.	.	H	α-helix	trans	-58	-23.8	172	-67.5	-70.2	-148.1	0	0	113.2	L554 D555 T558 P559 T560	L554-M563 HydrophobicContact CB-CE 3.9Å; L554-M563 HydrophobicContact CB-SD 3.8Å; L554-M563 HydrophobicContact CD1-SD 3.64Å; L554-M563 HydrophobicContact CG-SD 4.35Å; D555-M563 WeakPolarHBondContact O-CE 3.36Å; T558-M563 HydrophobicContact CG2-CG 4.42Å; T558-M563 HydrophobicContact CG2-SD 4.33Å; P559-M563 PolarHBondContact O-N 2.8Å; P559-M563 VanDerWaalsContact O-N 3.12Å; T560-M563 PolarHBondContact O-N 3.08Å
564	N	83.3	Confident	87.4	Confident	122 Å²	122	60.8 Å²	60.8	65%	0.652	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-12.6	174.2	-67.8	-19.3	0	0	0	113.8	T560 I562	T560-N564 PolarHBondContact O-N 3.22Å; T560-N564 PolarHBondContact O-ND2 3.04Å; I562-N564 PolarHBondContact O-N 2.85Å; I562-N564 VanDerWaalsContact O-N 3.15Å
565	L	85.2	Confident	87.4	Confident	26 Å²	26	59.4 Å²	59.4	14%	0.136	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-24.5	-179.4	-66.6	172.2	0	0	0	112.5	Y561 I562 T577 M578 G579 N580 L586	Y561-L565 WeakPolarHBondContact O-CG 3.34Å; I562-L565 PolarHBondContact O-N 2.89Å; L565-T577 CarbonylContact O-C 3.59Å; L565-T577 WeakPolarHBondContact O-CA 3.49Å; L565-M578 PolarHBondContact O-N 2.87Å; L565-G579 VanDerWaalsContact CD2-O 3.25Å; L565-G579 WeakPolarHBondContact CD2-O 3.47Å; L565-N580 HydrophobicContact CD2-CB 4.18Å; L565-N580 WeakPolarHBondContact CD2-O 3.18Å; L565-L586 HydrophobicContact CD1-CD2 3.84Å
566	I	88.9	Confident	87.4	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.015	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137	-168.5	-62.5	173.5	0	0	0	111.9	F534 I562 L575 S576 F589 V591	F534-I566 HydrophobicContact CE1-CG2 4.29Å; F534-I566 HydrophobicContact CZ-CD1 4.25Å; F534-I566 HydrophobicContact CZ-CG2 4.36Å; I562-I566 HydrophobicContact CG2-CD1 3.97Å; I562-I566 PolarHBondContact O-N 2.98Å; I562-I566 VanDerWaalsContact O-N 3.1Å; I566-L575 HydrophobicContact CG2-CB 4.49Å; I566-L575 HydrophobicContact CG2-CD2 4.17Å; I566-S576 WeakPolarHBondContact CA-O 3.49Å; I566-F589 HydrophobicContact CD1-CD2 4.3Å; I566-F589 HydrophobicContact CD1-CE2 3.24Å; I566-F589 HydrophobicContact CD1-CZ 3.46Å; I566-F589 VanDerWaalsContact CD1-CZ 3.46Å; I566-V591 HydrophobicContact CD1-CG2 4.13Å
567	T	90	Very high	87.6	Confident	51 Å²	51	50.8 Å²	50.8	31%	0.313	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	153.4	167.5	50.2	0	0	0	0	110.9	L575 S576 M578	T567-L575 WeakPolarHBondContact O-CA 3.33Å; T567-S576 PolarHBondContact N-O 2.85Å; T567-S576 PolarHBondContact O-N 3.38Å; T567-S576 PolarHBondContact OG1-O 3.39Å; T567-S576 PolarHBondContact OG1-OG 3.04Å; T567-M578 HydrophobicContact CG2-CE 4.48Å; T567-M578 HydrophobicContact CG2-CG 3.8Å; T567-M578 HydrophobicContact CG2-SD 3.67Å
568	V	92.7	Very high	87.6	Confident	27 Å²	27	48 Å²	48	16%	0.164	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138.5	166	65	0	0	0	0	110.5	F552 L554 A570 T574 L575 L593	F552-V568 HydrophobicContact CB-CG2 4.08Å; L554-V568 HydrophobicContact CD2-CB 4.11Å; L554-V568 HydrophobicContact CD2-CG1 3.87Å; L554-V568 HydrophobicContact CG-CG1 4Å; V568-A570 PolarHBondContact O-N 2.9Å; V568-T574 CarbonylContact C-O 3.55Å; V568-T574 WeakPolarHBondContact CA-O 3.39Å; V568-L575 HydrophobicContact CB-CG 4.27Å; V568-L575 HydrophobicContact CG2-CG 4.13Å; V568-L593 HydrophobicContact CB-CD1 4.12Å; V568-L593 HydrophobicContact CG1-CD1 4Å; V568-L593 HydrophobicContact CG2-CD1 3.81Å
569	N	91.8	Very high	87.4	Confident	69 Å²	69	48.1 Å²	48.1	37%	0.369	27%	0.272	S	S	.	.			trans	-73.4	111.5	167.9	179.8	-29.5	0	0	0	109.3	T571 T572 G573 T574	N569-T571 PolarHBondContact O-N 3.3Å; N569-T571 PolarHBondContact OD1-N 3.3Å; N569-T571 PolarHBondContact OD1-OG1 3.13Å; N569-T572 VanDerWaalsContact CB-OG1 3.28Å; N569-T572 WeakPolarHBondContact CB-OG1 3.31Å; N569-T572 PolarHBondContact ND2-OG1 3.49Å; N569-T572 PolarHBondContact O-N 3.5Å; N569-T572 PolarHBondContact OD1-N 3.49Å; N569-G573 PolarHBondContact O-N 3.34Å; N569-G573 VanDerWaalsContact O-N 3.08Å; N569-T574 PolarHBondContact N-O 2.9Å
570	A	92.4	Very high	87.2	Confident	39 Å²	39	52.4 Å²	52.4	32%	0.322	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-9.5	-174.5	0	0	0	0	0	116.2	H551 F552 V568	H551-A570 PolarHBondContact ND1-O 3.2Å; F552-A570 PolarHBondContact N-O 2.66Å; F552-A570 VanDerWaalsContact N-O 3.11Å; F552-A570 WeakPolarHBondContact O-CA 3.41Å; V568-A570 PolarHBondContact O-N 2.9Å
571	T	90.8	Very high	87.4	Confident	111 Å²	111	47.2 Å²	47.2	68%	0.681	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	-20.9	178.6	54	0	0	0	0	115	N569	N569-T571 PolarHBondContact O-N 3.3Å; N569-T571 PolarHBondContact OD1-N 3.3Å; N569-T571 PolarHBondContact OD1-OG1 3.13Å
572	T	90.2	Very high	87.6	Confident	61 Å²	61	43.2 Å²	43.2	37%	0.374	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-11.3	-177	68.2	0	0	0	0	114.1	T536 N569 T574	T536-T572 VanDerWaalsContact CG2-O 3.32Å; T536-T572 WeakPolarHBondContact CG2-O 3.15Å; N569-T572 VanDerWaalsContact CB-OG1 3.28Å; N569-T572 WeakPolarHBondContact CB-OG1 3.31Å; N569-T572 PolarHBondContact ND2-OG1 3.49Å; N569-T572 PolarHBondContact O-N 3.5Å; N569-T572 PolarHBondContact OD1-N 3.49Å; T572-T574 PolarHBondContact O-N 3.15Å; T572-T574 WeakPolarHBondContact OG1-CB 3.28Å; T572-T574 PolarHBondContact OG1-N 3.12Å; T572-T574 PolarHBondContact OG1-OG1 2.93Å
573	G	91.1	Very high	87.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.			trans	71.4	8.7	-174.7	0	0	0	0	0	113.8	I537 F552 N569	I537-G573 PolarHBondContact N-O 3.46Å; F552-G573 VanDerWaalsContact CD2-N 3.27Å; F552-G573 VanDerWaalsContact CG-CA 3.49Å; N569-G573 PolarHBondContact O-N 3.34Å; N569-G573 VanDerWaalsContact O-N 3.08Å
574	T	92.7	Very high	88.3	Confident	14 Å²	14	42 Å²	42	9%	0.086	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	120.4	179.1	-51.4	0	0	0	0	110.7	E533 L535 T536 V568 N569 T572	E533-T574 HydrophobicContact CB-CG2 3.87Å; E533-T574 HydrophobicContact CG-CG2 3.72Å; L535-T574 CarbonylContact O-C 3.54Å; L535-T574 WeakPolarHBondContact O-CA 3.41Å; T536-T574 WeakPolarHBondContact OG1-CB 3.4Å; T536-T574 WeakPolarHBondContact OG1-CG2 3.4Å; T536-T574 PolarHBondContact OG1-OG1 3.1Å; V568-T574 CarbonylContact C-O 3.55Å; V568-T574 WeakPolarHBondContact CA-O 3.39Å; N569-T574 PolarHBondContact N-O 2.9Å; T572-T574 PolarHBondContact O-N 3.15Å; T572-T574 WeakPolarHBondContact OG1-CB 3.28Å; T572-T574 PolarHBondContact OG1-N 3.12Å; T572-T574 PolarHBondContact OG1-OG1 2.93Å
575	L	92.2	Very high	88.5	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	135	171.9	-61	98.2	0	0	0	110.5	E533 F534 L535 I537 L554 I566 T567 V568 L593 I609	E533-L575 WeakPolarHBondContact CA-O 3.47Å; F534-L575 HydrophobicContact CD1-CB 4.43Å; F534-L575 WeakPolarHBondContact CD1-O 3.43Å; F534-L575 HydrophobicContact CE1-CB 3.68Å; F534-L575 HydrophobicContact CE2-CB 4.22Å; F534-L575 HydrophobicContact CZ-CB 3.56Å; F534-L575 HydrophobicContact CZ-CD2 4.31Å; F534-L575 PolarHBondContact N-O 2.83Å; L535-L575 HydrophobicContact CB-CD1 4.31Å; L535-L575 HydrophobicContact CD2-CD1 4.36Å; L535-L575 HydrophobicContact CG-CD1 4.36Å; L535-L575 PolarHBondContact O-N 2.79Å; I537-L575 HydrophobicContact CG1-CD1 3.89Å; L554-L575 HydrophobicContact CD2-CD2 4.28Å; I566-L575 HydrophobicContact CG2-CB 4.49Å; I566-L575 HydrophobicContact CG2-CD2 4.17Å; T567-L575 WeakPolarHBondContact O-CA 3.33Å; V568-L575 HydrophobicContact CB-CG 4.27Å; V568-L575 HydrophobicContact CG2-CG 4.13Å; L575-L593 HydrophobicContact CD1-CD2 4.46Å; L575-I609 HydrophobicContact CD1-CD1 3.62Å; L575-I609 HydrophobicContact CD2-CD1 3.61Å; L575-I609 HydrophobicContact CG-CD1 4.3Å
576	S	89.7	Confident	88.6	Confident	12 Å²	12	43.8 Å²	43.8	8%	0.084	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	148.4	178.8	64.9	0	0	0	0	111.8	F532 I566 T567	F532-S576 CarbonylContact O-C 3.56Å; F532-S576 VanDerWaalsContact O-CA 3.26Å; F532-S576 WeakPolarHBondContact O-CA 3.32Å; I566-S576 WeakPolarHBondContact CA-O 3.49Å; T567-S576 PolarHBondContact N-O 2.85Å; T567-S576 PolarHBondContact O-N 3.38Å; T567-S576 PolarHBondContact OG1-O 3.39Å; T567-S576 PolarHBondContact OG1-OG 3.04Å
577	T	87.6	Confident	88.6	Confident	4 Å²	4	45 Å²	45	3%	0.025	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.5	176.4	46.3	0	0	0	0	111.2	R527 N531 F532 F534 L565 G579 L581	R527-T577 PolarHBondContact NH2-OG1 3.37Å; N531-T577 WeakPolarHBondContact CA-O 3.41Å; N531-T577 PolarHBondContact N-O 2.79Å; F532-T577 WeakPolarHBondContact CB-OG1 3.45Å; F532-T577 PolarHBondContact N-O 2.91Å; F532-T577 PolarHBondContact O-N 2.9Å; F532-T577 PolarHBondContact O-OG1 3.27Å; F532-T577 VanDerWaalsContact O-OG1 3.09Å; F534-T577 HydrophobicContact CD1-CG2 3.96Å; F534-T577 HydrophobicContact CE1-CG2 4.06Å; L565-T577 CarbonylContact O-C 3.59Å; L565-T577 WeakPolarHBondContact O-CA 3.49Å; T577-G579 VanDerWaalsContact C-N 3.3Å; T577-L581 HydrophobicContact CG2-CD2 4.34Å
578	M	81.7	Confident	88.6	Confident	95 Å²	95	49.1 Å²	49.1	47%	0.468	26%	0.263	S	S	.	.			trans	-72.8	-26.4	175.7	-64	-167.3	74	0	0	112.5	L565 T567	L565-M578 PolarHBondContact O-N 2.87Å; T567-M578 HydrophobicContact CG2-CE 4.48Å; T567-M578 HydrophobicContact CG2-CG 3.8Å; T567-M578 HydrophobicContact CG2-SD 3.67Å
579	G	78.7	Confident	88.5	Confident	12 Å²	12	48.6 Å²	48.6	12%	0.124	26%	0.259	C	S	.	.	S	Bend	trans	125.3	-176.9	-179.3	0	0	0	0	0	111.9	D522 L565 T577 L581	D522-G579 VanDerWaalsContact OD2-C 3.3Å; D522-G579 WeakPolarHBondContact OD2-CA 3.22Å; L565-G579 VanDerWaalsContact CD2-O 3.25Å; L565-G579 WeakPolarHBondContact CD2-O 3.47Å; T577-G579 VanDerWaalsContact C-N 3.3Å; G579-L581 PolarHBondContact O-N 2.86Å
580	N	80.4	Confident	88.5	Confident	144 Å²	144	47.6 Å²	47.6	77%	0.77	26%	0.257	S	S	*	.			trans	59.1	29.3	-172.2	-50.5	-26.7	0	0	0	113.7	D522 L565	D522-N580 VanDerWaalsContact CG-N 3.35Å; D522-N580 PolarHBondContact OD2-N 2.97Å; L565-N580 HydrophobicContact CD2-CB 4.18Å; L565-N580 WeakPolarHBondContact CD2-O 3.18Å
581	L	87.4	Confident	88.4	Confident	8 Å²	8	45.8 Å²	45.8	4%	0.042	24%	0.242	C	C	.	.			trans	-80.2	128.4	167.7	-169.6	65.9	0	0	0	109	V519 E521 D522 T577 G579 F589 V613	V519-L581 HydrophobicContact CG1-CD2 3.95Å; E521-L581 WeakPolarHBondContact CB-O 3.13Å; D522-L581 WeakPolarHBondContact CB-O 3.22Å; D522-L581 PolarHBondContact N-O 2.9Å; D522-L581 VanDerWaalsContact OD1-CB 3.31Å; D522-L581 WeakPolarHBondContact OD1-CB 3.2Å; D522-L581 PolarHBondContact OD1-N 3.47Å; T577-L581 HydrophobicContact CG2-CD2 4.34Å; G579-L581 PolarHBondContact O-N 2.86Å; L581-F589 HydrophobicContact CD1-CE1 3.94Å; L581-V613 HydrophobicContact CD1-CG2 3.78Å; L581-V613 HydrophobicContact CD2-CG1 4.13Å; L581-V613 HydrophobicContact CD2-CG2 4.18Å; L581-V613 HydrophobicContact CG-CG1 4.01Å; L581-V613 HydrophobicContact CG-CG2 4.11Å
582	D	88.2	Confident	88.4	Confident	43 Å²	43	42.2 Å²	42.2	23%	0.23	22%	0.22	C	C	.	.			trans	-154.7	118.2	-160.4	174.6	-67.7	0	0	0	106.6	K585 L586	D582-K585 HydrophobicContact CB-CB 4.5Å; D582-K585 HydrophobicContact CB-CD 4.42Å; D582-K585 WeakPolarHBondContact OD1-CB 3.42Å; D582-K585 WeakPolarHBondContact OD1-CD 3.25Å; D582-K585 WeakPolarHBondContact OD1-CG 3.42Å; D582-K585 PolarHBondContact OD1-N 2.81Å; D582-K585 IonicContact OD1-NZ 3.03Å; D582-K585 PolarHBondContact OD1-NZ 3.05Å; D582-K585 WeakPolarHBondContact OD2-CE 3.36Å; D582-K585 IonicContact OD2-NZ 3.37Å; D582-K585 PolarHBondContact OD2-NZ 3.01Å; D582-L586 PolarHBondContact O-N 2.82Å
583	R	91.3	Very high	88.5	Confident	9 Å²	9	39.3 Å²	39.3	3%	0.034	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-31.4	-162.7	-176.3	-123.6	49.8	117.6	-12.7	111.4	E521 K585 L586 T587 V613 D615 D650 N732	E521-R583 WeakPolarHBondContact OE1-CB 3.3Å; E521-R583 WeakPolarHBondContact OE2-CB 3.32Å; E521-R583 PolarHBondContact OE2-N 3.41Å; R583-K585 PolarHBondContact O-N 2.91Å; R583-L586 CarbonylContact O-C 3.55Å; R583-L586 PolarHBondContact O-N 2.91Å; R583-T587 HydrophobicContact CG-CG2 4.2Å; R583-T587 WeakPolarHBondContact O-CG2 3.32Å; R583-T587 PolarHBondContact O-N 3.01Å; R583-T587 VanDerWaalsContact O-N 3.08Å; R583-V613 HydrophobicContact CB-CB 4.21Å; R583-V613 HydrophobicContact CB-CG1 3.69Å; R583-V613 HydrophobicContact CG-CB 4.08Å; R583-V613 HydrophobicContact CG-CG1 4.04Å; R583-D615 WeakPolarHBondContact CD-OD1 3.23Å; R583-D615 IonicContact CZ-OD1 3.85Å; R583-D615 VanDerWaalsContact CZ-OD1 3.29Å; R583-D615 IonicContact NE-OD1 3.18Å; R583-D615 PolarHBondContact NE-OD1 2.98Å; R583-D615 IonicContact NH1-OD1 3.93Å; R583-D615 IonicContact NH2-OD1 2.82Å; R583-D650 PolarHBondContact NH2-O 3.07Å; R583-N732 PolarHBondContact O-ND2 3.22Å
584	E	88.5	Confident	88.6	Confident	30 Å²	30	40.3 Å²	40.3	14%	0.14	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-36.3	175	-59.8	56.8	-109.7	0	0	109.6	N619 D650 N732	E584-N619 VanDerWaalsContact CD-ND2 3.3Å; E584-N619 WeakPolarHBondContact CG-ND2 3.08Å; E584-D650 HydrophobicContact CG-CB 3.9Å; E584-N732 PolarHBondContact O-ND2 2.77Å
585	K	86.5	Confident	88.7	Confident	155 Å²	155	39.7 Å²	39.7	67%	0.674	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-32.1	174.9	-67.4	162.8	-155.6	69.3	0	112.9	D582 R583	D582-K585 HydrophobicContact CB-CB 4.5Å; D582-K585 HydrophobicContact CB-CD 4.42Å; D582-K585 WeakPolarHBondContact OD1-CB 3.42Å; D582-K585 WeakPolarHBondContact OD1-CD 3.25Å; D582-K585 WeakPolarHBondContact OD1-CG 3.42Å; D582-K585 PolarHBondContact OD1-N 2.81Å; D582-K585 IonicContact OD1-NZ 3.03Å; D582-K585 PolarHBondContact OD1-NZ 3.05Å; D582-K585 WeakPolarHBondContact OD2-CE 3.36Å; D582-K585 IonicContact OD2-NZ 3.37Å; D582-K585 PolarHBondContact OD2-NZ 3.01Å; R583-K585 PolarHBondContact O-N 2.91Å
586	L	87.1	Confident	88.7	Confident	31 Å²	31	40.2 Å²	40.2	16%	0.162	21%	0.208	C	C	.	.			trans	-147.3	77.1	-173.6	-168.3	63.7	0	0	0	113.5	Y561 L565 D582 R583 K588 F589 V613	Y561-L586 HydrophobicContact CE2-CD1 4.17Å; Y561-L586 HydrophobicContact CE2-CD2 4.29Å; L565-L586 HydrophobicContact CD1-CD2 3.84Å; D582-L586 PolarHBondContact O-N 2.82Å; R583-L586 CarbonylContact O-C 3.55Å; R583-L586 PolarHBondContact O-N 2.91Å; L586-K588 PolarHBondContact O-N 3.23Å; L586-K588 VanDerWaalsContact O-N 3.13Å; L586-F589 HydrophobicContact CD1-CB 4.33Å; L586-F589 HydrophobicContact CD2-CB 4.28Å; L586-F589 HydrophobicContact CD2-CD1 3.61Å; L586-F589 HydrophobicContact CD2-CE1 4.35Å; L586-F589 HydrophobicContact CD2-CG 4.19Å; L586-F589 HydrophobicContact CG-CB 4.43Å; L586-F589 HydrophobicContact CG-CD1 3.97Å; L586-V613 WeakPolarHBondContact O-CG2 3.13Å
587	T	89.1	Confident	89	Confident	29 Å²	29	39.8 Å²	39.8	18%	0.178	21%	0.205	C	C	.	.	S	Bend	trans	-59.7	-27.2	-179.6	43.9	0	0	0	0	114.5	R583 V613 N731 N732	R583-T587 HydrophobicContact CG-CG2 4.2Å; R583-T587 WeakPolarHBondContact O-CG2 3.32Å; R583-T587 PolarHBondContact O-N 3.01Å; R583-T587 VanDerWaalsContact O-N 3.08Å; T587-V613 PolarHBondContact O-N 3.46Å; T587-N731 HydrophobicContact CG2-CB 4.39Å; T587-N732 VanDerWaalsContact CG2-OD1 3.23Å; T587-N732 WeakPolarHBondContact CG2-OD1 3.27Å; T587-N732 PolarHBondContact OG1-OD1 3.36Å
588	K	90.5	Very high	89.2	Confident	137 Å²	137	42.1 Å²	42.1	60%	0.596	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-161.4	155.5	176.3	65.6	-171.8	178.4	-171.9	0	111.8	L586 V611	L586-K588 PolarHBondContact O-N 3.23Å; L586-K588 VanDerWaalsContact O-N 3.13Å; K588-V611 VanDerWaalsContact CA-O 3.25Å; K588-V611 WeakPolarHBondContact CA-O 3.17Å; K588-V611 WeakPolarHBondContact CB-O 3.23Å
589	F	90.6	Very high	89.5	Confident	17 Å²	17	37.7 Å²	37.7	8%	0.075	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	172.5	171.4	59.6	-89.5	0	0	0	110.6	I562 I566 L581 L586 V591 V611 V613	I562-F589 HydrophobicContact CD1-CB 3.93Å; I562-F589 HydrophobicContact CD1-CD2 4.39Å; I562-F589 HydrophobicContact CD1-CG 4.45Å; I562-F589 HydrophobicContact CG2-CD2 4Å; I562-F589 HydrophobicContact CG2-CE2 4.27Å; I566-F589 HydrophobicContact CD1-CD2 4.3Å; I566-F589 HydrophobicContact CD1-CE2 3.24Å; I566-F589 HydrophobicContact CD1-CZ 3.46Å; I566-F589 VanDerWaalsContact CD1-CZ 3.46Å; L581-F589 HydrophobicContact CD1-CE1 3.94Å; L586-F589 HydrophobicContact CD1-CB 4.33Å; L586-F589 HydrophobicContact CD2-CB 4.28Å; L586-F589 HydrophobicContact CD2-CD1 3.61Å; L586-F589 HydrophobicContact CD2-CE1 4.35Å; L586-F589 HydrophobicContact CD2-CG 4.19Å; L586-F589 HydrophobicContact CG-CB 4.43Å; L586-F589 HydrophobicContact CG-CD1 3.97Å; F589-V591 HydrophobicContact CD2-CG2 4.03Å; F589-V591 HydrophobicContact CE2-CG2 4.04Å; F589-V611 HydrophobicContact CD1-CB 4.33Å; F589-V611 HydrophobicContact CD2-CB 4.17Å; F589-V611 HydrophobicContact CD2-CG2 4.4Å; F589-V611 HydrophobicContact CE1-CB 3.74Å; F589-V611 HydrophobicContact CE1-CG1 3.72Å; F589-V611 HydrophobicContact CE2-CB 3.54Å; F589-V611 HydrophobicContact CE2-CG1 4.24Å; F589-V611 HydrophobicContact CE2-CG2 3.53Å; F589-V611 HydrophobicContact CZ-CB 3.31Å; F589-V611 HydrophobicContact CZ-CG1 3.48Å; F589-V611 VanDerWaalsContact CZ-CG1 3.48Å; F589-V611 HydrophobicContact CZ-CG2 3.61Å; F589-V611 PolarHBondContact N-O 3.35Å; F589-V611 PolarHBondContact O-N 2.75Å; F589-V613 HydrophobicContact CD1-CG2 4.39Å; F589-V613 HydrophobicContact CE1-CG2 4.04Å
590	S	90.8	Very high	89.9	Confident	47 Å²	47	43.8 Å²	43.8	33%	0.329	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	135.1	171	66.2	0	0	0	0	111.6	K608 I609	S590-K608 WeakPolarHBondContact OG-CE 3.44Å; S590-I609 CarbonylContact C-O 3.59Å; S590-I609 VanDerWaalsContact CA-O 3.22Å; S590-I609 WeakPolarHBondContact CA-O 3.11Å
591	V	91	Very high	90.4	Very high	2 Å²	2	42 Å²	42	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.2	176.4	174.3	0	0	0	0	108.4	L554 T558 I562 I566 F589 I609	L554-V591 HydrophobicContact CD2-CG1 3.78Å; T558-V591 HydrophobicContact CG2-CG1 4.22Å; T558-V591 HydrophobicContact CG2-CG2 4.13Å; I562-V591 HydrophobicContact CG2-CG2 3.56Å; I566-V591 HydrophobicContact CD1-CG2 4.13Å; F589-V591 HydrophobicContact CD2-CG2 4.03Å; F589-V591 HydrophobicContact CE2-CG2 4.04Å; V591-I609 PolarHBondContact N-O 2.75Å; V591-I609 PolarHBondContact O-N 3.21Å
592	T	91.2	Very high	90.5	Very high	35 Å²	35	47.4 Å²	47.4	22%	0.215	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.1	166.7	-56.6	0	0	0	0	108.4	D555 K606 V607	D555-T592 HydrophobicContact CB-CG2 3.94Å; D555-T592 VanDerWaalsContact CB-O 3.29Å; D555-T592 WeakPolarHBondContact CB-O 3.23Å; D555-T592 PolarHBondContact N-O 3.32Å; D555-T592 WeakPolarHBondContact OD2-CG2 3.24Å; T592-K606 HydrophobicContact CG2-CB 3.75Å; T592-K606 HydrophobicContact CG2-CD 4.03Å; T592-K606 HydrophobicContact CG2-CG 4.01Å; T592-V607 CarbonylContact C-O 3.55Å; T592-V607 WeakPolarHBondContact CA-O 3.26Å
593	L	92.4	Very high	90.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.3	169.5	-172	72.5	0	0	0	109.2	I537 F552 S553 L554 V568 L575 K606 V607 I609	I537-L593 HydrophobicContact CB-CD2 3.86Å; I537-L593 HydrophobicContact CG1-CD2 3.53Å; I537-L593 HydrophobicContact CG2-CD2 4.19Å; F552-L593 HydrophobicContact CD1-CD2 3.96Å; S553-L593 VanDerWaalsContact O-CD1 3.31Å; S553-L593 WeakPolarHBondContact O-CD1 3.38Å; L554-L593 HydrophobicContact CD2-CD1 3.91Å; V568-L593 HydrophobicContact CB-CD1 4.12Å; V568-L593 HydrophobicContact CG1-CD1 4Å; V568-L593 HydrophobicContact CG2-CD1 3.81Å; L575-L593 HydrophobicContact CD1-CD2 4.46Å; L593-K606 WeakPolarHBondContact O-CA 3.47Å; L593-V607 PolarHBondContact N-O 3.42Å; L593-V607 PolarHBondContact O-N 3.44Å; L593-I609 HydrophobicContact CB-CD1 3.99Å
594	I	93.2	Very high	90.8	Very high	22 Å²	22	52 Å²	52	11%	0.113	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	120.8	168.1	-66.5	172.6	0	0	0	107.9	F552 S553 D555 A596 M604 K606	F552-I594 WeakPolarHBondContact CA-O 3.21Å; S553-I594 PolarHBondContact N-O 2.66Å; S553-I594 PolarHBondContact O-N 3.03Å; D555-I594 HydrophobicContact CB-CD1 4.06Å; D555-I594 HydrophobicContact CB-CG1 4.14Å; I594-A596 HydrophobicContact CG2-CB 3.98Å; I594-M604 HydrophobicContact CB-CE 4.42Å; I594-M604 HydrophobicContact CD1-CE 3.95Å; I594-M604 HydrophobicContact CG1-CE 3.85Å; I594-M604 HydrophobicContact CG2-CB 4.11Å; I594-M604 HydrophobicContact CG2-CE 3.79Å; I594-M604 HydrophobicContact CG2-SD 4.05Å; I594-K606 HydrophobicContact CG1-CG 4.19Å
595	C	93.9	Very high	91.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	110.6	165.6	-55.7	0	0	0	0	106.6	P508 F552 M604 T605	P508-C595 HydrophobicContact CB-CB 4.32Å; F552-C595 HydrophobicContact CD1-CB 4.31Å; F552-C595 VanDerWaalsContact CD1-SG 3.57Å; F552-C595 HydrophobicContact CE1-CB 4.26Å; F552-C595 VanDerWaalsContact CE1-SG 3.57Å; C595-M604 CarbonylContact O-C 3.49Å; C595-M604 WeakPolarHBondContact O-CA 3.45Å; C595-T605 PolarHBondContact N-O 2.77Å; C595-T605 PolarHBondContact O-N 2.84Å
596	A	93.5	Very high	91.3	Very high	13 Å²	13	49.1 Å²	49.1	11%	0.107	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	158.6	-175.9	0	0	0	0	0	111.4	L550 H551 I594 R603 M604	L550-A596 CarbonylContact C-O 3.41Å; L550-A596 WeakPolarHBondContact CA-O 3.43Å; H551-A596 PolarHBondContact N-O 3.09Å; H551-A596 PolarHBondContact O-N 2.9Å; I594-A596 HydrophobicContact CG2-CB 3.98Å; A596-R603 WeakPolarHBondContact CA-O 3.43Å; A596-M604 HydrophobicContact CB-CB 3.8Å
597	D	94.7	Very high	91.6	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.011	24%	0.24	C	C	.	.			trans	-83.9	-171.5	176.2	65.8	42.3	0	0	0	114.6	N504 N547 K549 G599 K602 R603	N504-D597 PolarHBondContact ND2-OD2 2.73Å; N504-D597 PolarHBondContact OD1-OD2 3.25Å; N547-D597 WeakPolarHBondContact O-CB 3.25Å; K549-D597 CarbonylContact O-C 3.38Å; D597-G599 PolarHBondContact OD1-N 3Å; D597-K602 VanDerWaalsContact OD1-CA 3.3Å; D597-K602 WeakPolarHBondContact OD1-CA 3.45Å; D597-K602 WeakPolarHBondContact OD1-CB 3.34Å; D597-K602 WeakPolarHBondContact OD1-CG 3.19Å; D597-R603 PolarHBondContact N-O 2.86Å; D597-R603 VanDerWaalsContact N-O 3.16Å; D597-R603 WeakPolarHBondContact OD2-CA 3.46Å; D597-R603 VanDerWaalsContact OD2-CB 3.28Å; D597-R603 WeakPolarHBondContact OD2-CB 3.32Å; D597-R603 PolarHBondContact OD2-N 2.75Å
598	H	91.7	Very high	91.7	Very high	54 Å²	54	50.6 Å²	50.6	25%	0.25	25%	0.25	C	S	.	.	S	Bend	trans	-118.9	24.9	162.3	-73.1	-60.1	0	0	0	113.1	R546 K549	R546-H598 VanDerWaalsContact CZ-O 3.31Å; R546-H598 PolarHBondContact NE-O 2.74Å; R546-H598 PolarHBondContact NH2-O 3.11Å; R546-H598 CarbonylContact O-C 3.53Å; R546-H598 VanDerWaalsContact O-C 3.23Å; R546-H598 WeakPolarHBondContact O-CA 3.03Å; R546-H598 WeakPolarHBondContact O-CB 3.17Å; R546-H598 PolarHBondContact O-N 3.13Å; K549-H598 HydrophobicContact CB-CB 4.49Å; K549-H598 PolarHBondContact O-CD2 3.08Å; K549-H598 PolarHBondContact O-N 2.94Å
599	G	89.1	Confident	91.8	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.021	22%	0.222	C	C	.	.	S	Bend	trans	-78.4	-175.9	174	0	0	0	0	0	113.2	R546 N547 D597 K602	R546-G599 PolarHBondContact O-N 2.91Å; N547-G599 WeakPolarHBondContact OD1-CA 3.5Å; D597-G599 PolarHBondContact OD1-N 3Å; G599-K602 WeakPolarHBondContact O-CG 3.05Å
600	E	86.5	Confident	91.9	Very high	140 Å²	140	45.5 Å²	45.5	65%	0.654	23%	0.23	S	C	*	.	S	Bend	trans	-149.5	113.2	175.6	-66.5	-62.1	165.1	0	0	109.8	K602	E600-K602 WeakPolarHBondContact OE1-CE 3.3Å
601	P	90.4	Very high	92	Very high	106 Å²	106	43.3 Å²	43.3	69%	0.688	22%	0.215	S	C	*	.	S	Bend	cis	-64.7	153.5	-2.3	31.7	-36.9	0	0	0	111.4	N504	N504-P601 PolarHBondContact ND2-O 2.77Å
602	K	90.1	Very high	92	Very high	122 Å²	122	46 Å²	46	53%	0.53	23%	0.229	S	C	.	.			trans	-79.4	140.8	177	-62.8	-179.8	-176.7	171.6	0	112.1	D597 G599 E600	D597-K602 VanDerWaalsContact OD1-CA 3.3Å; D597-K602 WeakPolarHBondContact OD1-CA 3.45Å; D597-K602 WeakPolarHBondContact OD1-CB 3.34Å; D597-K602 WeakPolarHBondContact OD1-CG 3.19Å; G599-K602 WeakPolarHBondContact O-CG 3.05Å; E600-K602 WeakPolarHBondContact OE1-CE 3.3Å
603	R	93	Very high	92	Very high	66 Å²	66	44.9 Å²	44.9	25%	0.249	22%	0.222	C	C	.	.			trans	-115.8	153.2	177.4	-60.8	-174.8	71.7	163.3	-16.9	109.5	N504 D505 H506 D507 A596 D597	N504-R603 VanDerWaalsContact O-CD 3.25Å; N504-R603 WeakPolarHBondContact O-CD 3.37Å; N504-R603 PolarHBondContact O-NH1 3.21Å; D505-R603 PolarHBondContact O-NH1 2.87Å; D505-R603 PolarHBondContact O-NH2 3.45Å; H506-R603 WeakPolarHBondContact O-CD 3.46Å; H506-R603 PolarHBondContact O-NE 2.93Å; D507-R603 VanDerWaalsContact CG-NH2 3.28Å; D507-R603 WeakPolarHBondContact OD1-CB 3.23Å; D507-R603 IonicContact OD1-CZ 2.75Å; D507-R603 IonicContact OD1-NE 2.77Å; D507-R603 PolarHBondContact OD1-NE 2.81Å; D507-R603 IonicContact OD1-NH2 3.89Å; D507-R603 IonicContact OD2-CZ 3.92Å; D507-R603 IonicContact OD2-NE 3.45Å; D507-R603 IonicContact OD2-NH2 3.47Å; D507-R603 PolarHBondContact OD2-NH2 3.43Å; A596-R603 WeakPolarHBondContact CA-O 3.43Å; D597-R603 PolarHBondContact N-O 2.86Å; D597-R603 VanDerWaalsContact N-O 3.16Å; D597-R603 WeakPolarHBondContact OD2-CA 3.46Å; D597-R603 VanDerWaalsContact OD2-CB 3.28Å; D597-R603 WeakPolarHBondContact OD2-CB 3.32Å; D597-R603 PolarHBondContact OD2-N 2.75Å
604	M	93.7	Very high	91.8	Very high	82 Å²	82	48.3 Å²	48.3	40%	0.404	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	139.8	-170.7	51.9	166.1	-79.8	0	0	113.9	I594 C595 A596 K606	I594-M604 HydrophobicContact CB-CE 4.42Å; I594-M604 HydrophobicContact CD1-CE 3.95Å; I594-M604 HydrophobicContact CG1-CE 3.85Å; I594-M604 HydrophobicContact CG2-CB 4.11Å; I594-M604 HydrophobicContact CG2-CE 3.79Å; I594-M604 HydrophobicContact CG2-SD 4.05Å; C595-M604 CarbonylContact O-C 3.49Å; C595-M604 WeakPolarHBondContact O-CA 3.45Å; A596-M604 HydrophobicContact CB-CB 3.8Å; M604-K606 HydrophobicContact CE-CD 4.31Å; M604-K606 HydrophobicContact CE-CG 3.73Å
605	T	93.3	Very high	91.7	Very high	33 Å²	33	48.7 Å²	48.7	20%	0.202	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.1	170.3	-69.7	0	0	0	0	110.3	P508 C595 V607	P508-T605 WeakPolarHBondContact O-CB 3.31Å; P508-T605 PolarHBondContact O-OG1 3.33Å; C595-T605 PolarHBondContact N-O 2.77Å; C595-T605 PolarHBondContact O-N 2.84Å; T605-V607 HydrophobicContact CG2-CG2 4.25Å
606	K	92.4	Very high	91.5	Very high	92 Å²	92	50.9 Å²	50.9	40%	0.4	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.9	170.7	-73.5	-169.5	174	-157.6	0	109.6	D555 E557 T592 L593 I594 M604	D555-K606 IonicContact OD1-NZ 3.02Å; D555-K606 PolarHBondContact OD1-NZ 2.97Å; D555-K606 VanDerWaalsContact OD1-NZ 3.13Å; D555-K606 VanDerWaalsContact OD2-CE 3.24Å; D555-K606 WeakPolarHBondContact OD2-CE 2.92Å; D555-K606 IonicContact OD2-NZ 2.64Å; D555-K606 PolarHBondContact OD2-NZ 3.35Å; E557-K606 IonicContact OE1-NZ 3.96Å; E557-K606 PolarHBondContact OE1-NZ 2.86Å; T592-K606 HydrophobicContact CG2-CB 3.75Å; T592-K606 HydrophobicContact CG2-CD 4.03Å; T592-K606 HydrophobicContact CG2-CG 4.01Å; L593-K606 WeakPolarHBondContact O-CA 3.47Å; I594-K606 HydrophobicContact CG1-CG 4.19Å; M604-K606 HydrophobicContact CE-CD 4.31Å; M604-K606 HydrophobicContact CE-CG 3.73Å
607	V	92	Very high	91.4	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.6	174.9	174	0	0	0	0	109.6	C510 Y515 T592 L593 T605 I609	C510-V607 HydrophobicContact CB-CG2 3.62Å; C510-V607 WeakPolarHBondContact SG-CG2 3.41Å; Y515-V607 HydrophobicContact CD2-CG1 3.53Å; Y515-V607 HydrophobicContact CE2-CG1 3.74Å; T592-V607 CarbonylContact C-O 3.55Å; T592-V607 WeakPolarHBondContact CA-O 3.26Å; L593-V607 PolarHBondContact N-O 3.42Å; L593-V607 PolarHBondContact O-N 3.44Å; T605-V607 HydrophobicContact CG2-CG2 4.25Å; V607-I609 HydrophobicContact CG1-CG1 4.36Å
608	K	92.1	Very high	91.1	Very high	91 Å²	91	53.3 Å²	53.3	40%	0.396	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.9	175.9	-172.8	173.2	-177.5	175.2	0	111.4	N513 T514 Y515 S590 N610	N513-K608 PolarHBondContact O-N 2.9Å; T514-K608 CarbonylContact C-O 3.52Å; T514-K608 VanDerWaalsContact CA-O 3.23Å; T514-K608 WeakPolarHBondContact CA-O 3.16Å; T514-K608 HydrophobicContact CG2-CB 4.35Å; Y515-K608 PolarHBondContact N-O 2.6Å; S590-K608 WeakPolarHBondContact OG-CE 3.44Å; K608-N610 VanDerWaalsContact CE-OD1 3.32Å; K608-N610 WeakPolarHBondContact CE-OD1 3.32Å
609	I	92.5	Very high	91	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	112.4	175.9	-55.6	165	0	0	0	107.4	L535 I537 L575 S590 V591 L593 V607 V611	L535-I609 HydrophobicContact CD2-CD1 4.11Å; L535-I609 HydrophobicContact CD2-CG1 4.16Å; L535-I609 HydrophobicContact CD2-CG2 3.79Å; I537-I609 HydrophobicContact CD1-CD1 4.16Å; I537-I609 HydrophobicContact CD1-CG1 4.34Å; I537-I609 HydrophobicContact CG1-CD1 4.18Å; L575-I609 HydrophobicContact CD1-CD1 3.62Å; L575-I609 HydrophobicContact CD2-CD1 3.61Å; L575-I609 HydrophobicContact CG-CD1 4.3Å; S590-I609 CarbonylContact C-O 3.59Å; S590-I609 VanDerWaalsContact CA-O 3.22Å; S590-I609 WeakPolarHBondContact CA-O 3.11Å; V591-I609 PolarHBondContact N-O 2.75Å; V591-I609 PolarHBondContact O-N 3.21Å; L593-I609 HydrophobicContact CB-CD1 3.99Å; V607-I609 HydrophobicContact CG1-CG1 4.36Å; I609-V611 HydrophobicContact CG2-CG2 4Å
610	N	93	Very high	91.1	Very high	45 Å²	45	54.9 Å²	54.9	24%	0.241	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	128.7	168.2	-49	-63.5	0	0	0	107.9	Y515 T516 V517 K608	Y515-N610 PolarHBondContact O-N 3.03Å; T516-N610 WeakPolarHBondContact CA-O 3.14Å; T516-N610 HydrophobicContact CG2-CB 4.44Å; V517-N610 PolarHBondContact N-O 3.38Å; K608-N610 VanDerWaalsContact CE-OD1 3.32Å; K608-N610 WeakPolarHBondContact CE-OD1 3.32Å
611	V	91.4	Very high	91.4	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.3	174.1	-178.7	0	0	0	0	108.6	V517 V519 F534 K588 F589 I609	V517-V611 WeakPolarHBondContact O-CA 3.09Å; V519-V611 HydrophobicContact CB-CG1 3.98Å; V519-V611 HydrophobicContact CG2-CG1 3.72Å; F534-V611 HydrophobicContact CE2-CG2 3.91Å; F534-V611 HydrophobicContact CZ-CG2 4.46Å; K588-V611 VanDerWaalsContact CA-O 3.25Å; K588-V611 WeakPolarHBondContact CA-O 3.17Å; K588-V611 WeakPolarHBondContact CB-O 3.23Å; F589-V611 HydrophobicContact CD1-CB 4.33Å; F589-V611 HydrophobicContact CD2-CB 4.17Å; F589-V611 HydrophobicContact CD2-CG2 4.4Å; F589-V611 HydrophobicContact CE1-CB 3.74Å; F589-V611 HydrophobicContact CE1-CG1 3.72Å; F589-V611 HydrophobicContact CE2-CB 3.54Å; F589-V611 HydrophobicContact CE2-CG1 4.24Å; F589-V611 HydrophobicContact CE2-CG2 3.53Å; F589-V611 HydrophobicContact CZ-CB 3.31Å; F589-V611 HydrophobicContact CZ-CG1 3.48Å; F589-V611 VanDerWaalsContact CZ-CG1 3.48Å; F589-V611 HydrophobicContact CZ-CG2 3.61Å; F589-V611 PolarHBondContact N-O 3.35Å; F589-V611 PolarHBondContact O-N 2.75Å; I609-V611 HydrophobicContact CG2-CG2 4Å
612	N	91.7	Very high	91.4	Very high	57 Å²	57	46.2 Å²	46.2	31%	0.305	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	132.2	165	-51.3	-52.8	0	0	0	107.2	V517 D518 V519	V517-N612 PolarHBondContact O-N 2.93Å; D518-N612 WeakPolarHBondContact CA-O 2.92Å; D518-N612 WeakPolarHBondContact OD1-CB 3.48Å; D518-N612 PolarHBondContact OD1-ND2 2.75Å; V519-N612 PolarHBondContact N-O 3.27Å
613	V	90.4	Very high	91.4	Very high	12 Å²	12	42 Å²	42	7%	0.073	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	129.5	172.9	-170.9	0	0	0	0	108	V519 E521 L581 R583 L586 T587 F589	V519-V613 CarbonylContact O-C 3.57Å; V519-V613 VanDerWaalsContact O-CA 3.3Å; V519-V613 WeakPolarHBondContact O-CA 3.44Å; E521-V613 HydrophobicContact CB-CG1 3.93Å; L581-V613 HydrophobicContact CD1-CG2 3.78Å; L581-V613 HydrophobicContact CD2-CG1 4.13Å; L581-V613 HydrophobicContact CD2-CG2 4.18Å; L581-V613 HydrophobicContact CG-CG1 4.01Å; L581-V613 HydrophobicContact CG-CG2 4.11Å; R583-V613 HydrophobicContact CB-CB 4.21Å; R583-V613 HydrophobicContact CB-CG1 3.69Å; R583-V613 HydrophobicContact CG-CB 4.08Å; R583-V613 HydrophobicContact CG-CG1 4.04Å; L586-V613 WeakPolarHBondContact O-CG2 3.13Å; T587-V613 PolarHBondContact O-N 3.46Å; F589-V613 HydrophobicContact CD1-CG2 4.39Å; F589-V613 HydrophobicContact CE1-CG2 4.04Å
614	L	89.7	Confident	91	Very high	73 Å²	73	42.7 Å²	42.7	38%	0.382	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	140.8	176.9	-64.3	-177.6	0	0	0	111.1	D518 V519 M520 E521	D518-L614 HydrophobicContact CB-CD1 3.77Å; D518-L614 HydrophobicContact CB-CD2 4.02Å; D518-L614 HydrophobicContact CB-CG 3.83Å; V519-L614 PolarHBondContact O-N 3.37Å; M520-L614 HydrophobicContact SD-CB 3.5Å; M520-L614 VanDerWaalsContact SD-CB 3.5Å; E521-L614 PolarHBondContact N-O 2.76Å
615	D	89.8	Confident	90.6	Very high	30 Å²	30	43.6 Å²	43.6	16%	0.16	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-74	121.8	-175.2	-159.8	95.4	0	0	0	111.8	E521 R583 V652 N655	E521-D615 WeakPolarHBondContact OE1-CA 3.4Å; R583-D615 WeakPolarHBondContact CD-OD1 3.23Å; R583-D615 IonicContact CZ-OD1 3.85Å; R583-D615 VanDerWaalsContact CZ-OD1 3.29Å; R583-D615 IonicContact NE-OD1 3.18Å; R583-D615 PolarHBondContact NE-OD1 2.98Å; R583-D615 IonicContact NH1-OD1 3.93Å; R583-D615 IonicContact NH2-OD1 2.82Å; D615-V652 HydrophobicContact CB-CB 4.28Å; D615-V652 WeakPolarHBondContact OD1-CB 3.5Å; D615-V652 VanDerWaalsContact OD1-CG2 3.24Å; D615-V652 WeakPolarHBondContact OD1-CG2 3.48Å; D615-V652 PolarHBondContact OD1-N 2.99Å; D615-V652 PolarHBondContact OD2-N 2.85Å; D615-V652 VanDerWaalsContact OD2-N 3.09Å; D615-N655 WeakPolarHBondContact OD2-CB 3.32Å; D615-N655 PolarHBondContact OD2-ND2 3.03Å
616	Y	89.9	Confident	90.2	Very high	46 Å²	46	47.6 Å²	47.6	18%	0.18	26%	0.256	C	S	.	.			trans	-119.7	128.5	171.5	-175.4	-96.8	0	0	0	110.1	E521 S523 P525 D618 P810	E521-Y616 PolarHBondContact OE1-N 2.73Å; S523-Y616 WeakPolarHBondContact OG-CD1 3.16Å; P525-Y616 WeakPolarHBondContact CD-OH 3.43Å; P525-Y616 WeakPolarHBondContact CG-OH 3.32Å; Y616-D618 PolarHBondContact O-N 3.36Å; Y616-P810 WeakPolarHBondContact OH-CD 3.26Å
617	N	91.5	Very high	90	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.011	25%	0.253	C	S	.	.	S	Bend	trans	-66.9	91.2	-168.2	-162.2	116.3	0	0	0	112.7	D651 N655 D806 G808 P810 L812	N617-D651 VanDerWaalsContact CA-OD2 3.28Å; N617-D651 WeakPolarHBondContact CA-OD2 3.38Å; N617-N655 HydrophobicContact CB-CB 4.05Å; N617-N655 WeakPolarHBondContact OD1-CA 3.24Å; N617-N655 WeakPolarHBondContact OD1-CB 3.28Å; N617-D806 PolarHBondContact ND2-OD2 3.49Å; N617-D806 PolarHBondContact OD1-OD2 2.6Å; N617-G808 VanDerWaalsContact OD1-CA 3.29Å; N617-G808 WeakPolarHBondContact OD1-CA 3.2Å; N617-P810 PolarHBondContact ND2-O 3.02Å; N617-L812 WeakPolarHBondContact ND2-CD1 3.47Å; N617-L812 WeakPolarHBondContact ND2-CG 3.24Å
618	D	89.3	Confident	89.9	Confident	63 Å²	63	47.8 Å²	47.8	34%	0.337	26%	0.255	S	S	.	.			trans	-125.3	-14.3	-177.9	80.7	10.9	0	0	0	114.9	S523 Y616 D651 L812	S523-D618 WeakPolarHBondContact CB-OD2 3.29Å; S523-D618 PolarHBondContact OG-OD2 3.22Å; Y616-D618 PolarHBondContact O-N 3.36Å; D618-D651 PolarHBondContact N-OD2 3Å; D618-L812 VanDerWaalsContact C-CD1 3.47Å; D618-L812 WeakPolarHBondContact O-CD1 3.39Å
619	N	89.5	Confident	89.8	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.23	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-92.1	120.6	173.9	-60.7	-78.1	0	0	0	110.7	E584 D650 D651	E584-N619 VanDerWaalsContact CD-ND2 3.3Å; E584-N619 WeakPolarHBondContact CG-ND2 3.08Å; N619-D650 HydrophobicContact CB-CB 4.45Å; N619-D651 VanDerWaalsContact CB-OD1 3.3Å; N619-D651 WeakPolarHBondContact CB-OD1 3.43Å; N619-D651 PolarHBondContact ND2-OD1 3.37Å
620	S	90.1	Very high	89.8	Confident	46 Å²	46	49.9 Å²	49.9	32%	0.322	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-73.4	149.2	172.4	-66.3	0	0	0	0	111.3	T622	S620-T622 WeakPolarHBondContact O-CG2 3.19Å; S620-T622 PolarHBondContact O-N 2.76Å
621	P	92.7	Very high	89.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-56.2	121.2	176.4	-25.6	34.3	0	0	0	112.5	I647 L658 A804 E814	P621-I647 HydrophobicContact CB-CG2 4.1Å; P621-L658 HydrophobicContact CB-CD1 4.36Å; P621-L658 HydrophobicContact CB-CD2 3.65Å; P621-L658 HydrophobicContact CG-CD2 3.43Å; P621-L658 VanDerWaalsContact CG-CD2 3.43Å; P621-A804 HydrophobicContact CB-CB 4.15Å; P621-E814 WeakPolarHBondContact O-CB 3.45Å
622	T	91.6	Very high	89.7	Confident	65 Å²	65	52 Å²	52	40%	0.399	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140.5	-173.4	71.2	0	0	0	0	113.1	S620 I647 A648	S620-T622 WeakPolarHBondContact O-CG2 3.19Å; S620-T622 PolarHBondContact O-N 2.76Å; T622-I647 CarbonylContact O-C 3.47Å; T622-I647 VanDerWaalsContact O-CA 3.28Å; T622-I647 WeakPolarHBondContact O-CA 3.49Å; T622-I647 WeakPolarHBondContact O-CG2 3.37Å; T622-A648 WeakPolarHBondContact CA-O 3.36Å; T622-A648 WeakPolarHBondContact CB-O 3.44Å; T622-A648 PolarHBondContact N-O 3.48Å; T622-A648 PolarHBondContact O-N 3.16Å; T622-A648 PolarHBondContact OG1-O 2.74Å
623	Y	90.1	Very high	89.7	Confident	33 Å²	33	52.3 Å²	52.3	13%	0.129	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139	173.9	-63.3	-85.6	0	0	0	111.1	Q625 F628 F645 I647 I802 A804 E814 V816	Y623-Q625 WeakPolarHBondContact CB-O 3.46Å; Y623-Q625 PolarHBondContact O-N 2.82Å; Y623-Q625 VanDerWaalsContact O-N 3.17Å; Y623-F628 HydrophobicContact CD1-CE2 4.23Å; Y623-F645 HydrophobicContact CD1-CD2 4.36Å; Y623-F645 HydrophobicContact CD1-CE2 4.31Å; Y623-F645 HydrophobicContact CE1-CE2 4.04Å; Y623-I647 HydrophobicContact CD1-CD1 4.23Å; Y623-I647 HydrophobicContact CD1-CG1 3.9Å; Y623-I647 HydrophobicContact CD1-CG2 4.39Å; Y623-I647 HydrophobicContact CE1-CD1 3.54Å; Y623-I647 HydrophobicContact CE1-CG1 3.75Å; Y623-I647 HydrophobicContact CE1-CG2 4.35Å; Y623-I802 PolarHBondContact OH-O 2.82Å; Y623-A804 VanDerWaalsContact OH-CB 3.26Å; Y623-A804 WeakPolarHBondContact OH-CB 3.27Å; Y623-A804 PolarHBondContact OH-N 2.76Å; Y623-A804 VanDerWaalsContact OH-N 3.1Å; Y623-E814 HydrophobicContact CD2-CB 4.42Å; Y623-E814 HydrophobicContact CD2-CG 3.93Å; Y623-E814 HydrophobicContact CE2-CB 3.94Å; Y623-E814 HydrophobicContact CE2-CG 3.85Å; Y623-E814 PolarHBondContact OH-O 3.22Å; Y623-V816 HydrophobicContact CD1-CB 3.84Å; Y623-V816 HydrophobicContact CD1-CG1 3.54Å; Y623-V816 HydrophobicContact CD1-CG2 4.41Å; Y623-V816 HydrophobicContact CD2-CB 3.86Å; Y623-V816 HydrophobicContact CD2-CG1 4.38Å; Y623-V816 HydrophobicContact CE1-CB 3.86Å; Y623-V816 HydrophobicContact CE1-CG1 3.28Å; Y623-V816 HydrophobicContact CE2-CB 3.9Å; Y623-V816 HydrophobicContact CE2-CG1 4.18Å; Y623-V816 HydrophobicContact CG-CB 3.81Å; Y623-V816 HydrophobicContact CG-CG1 4.07Å; Y623-V816 HydrophobicContact CG-CG2 4.26Å
624	S	84.7	Confident	89.6	Confident	80 Å²	80	51.9 Å²	51.9	56%	0.559	28%	0.281	S	S	*	.	S	Bend	trans	-66.9	-13.2	179.6	48.1	0	0	0	0	115	Q646	S624-Q646 PolarHBondContact OG-O 3.26Å
625	Q	85.7	Confident	89.6	Confident	102 Å²	102	52 Å²	52	48%	0.477	28%	0.283	S	S	.	.	S	Bend	trans	-143.6	150.2	173.7	-59.9	-175.8	-6	0	0	109.6	Y623 Y627 F628	Y623-Q625 WeakPolarHBondContact CB-O 3.46Å; Y623-Q625 PolarHBondContact O-N 2.82Å; Y623-Q625 VanDerWaalsContact O-N 3.17Å; Q625-Y627 VanDerWaalsContact CB-O 3.3Å; Q625-Y627 WeakPolarHBondContact CB-O 3.41Å; Q625-Y627 PolarHBondContact O-N 2.7Å; Q625-Y627 PolarHBondContact OE1-O 3.09Å; Q625-F628 HydrophobicContact CB-CD1 4.01Å; Q625-F628 HydrophobicContact CB-CE1 3.61Å; Q625-F628 HydrophobicContact CB-CZ 3.9Å; Q625-F628 HydrophobicContact CG-CD1 4.2Å; Q625-F628 HydrophobicContact CG-CE1 3.7Å; Q625-F628 HydrophobicContact CG-CZ 4.35Å
626	P	84.2	Confident	89.6	Confident	116 Å²	116	50.8 Å²	50.8	75%	0.753	28%	0.276	S	S	*	.	S	Bend	trans	-71.7	-15.3	-179.7	30.3	-36.6	0	0	0	113.8
627	Y	87.8	Confident	89.6	Confident	88 Å²	88	54.4 Å²	54.4	35%	0.345	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	160.1	168.3	62.9	-90.2	0	0	0	107.4	Q625 E629 S817 H819	Q625-Y627 VanDerWaalsContact CB-O 3.3Å; Q625-Y627 WeakPolarHBondContact CB-O 3.41Å; Q625-Y627 PolarHBondContact O-N 2.7Å; Q625-Y627 PolarHBondContact OE1-O 3.09Å; Y627-E629 HydrophobicContact CD2-CG 4.15Å; Y627-E629 HydrophobicContact CE2-CG 3.85Å; Y627-E629 WeakPolarHBondContact CE2-OE1 3.42Å; Y627-S817 CarbonylContact C-O 3.6Å; Y627-S817 VanDerWaalsContact CA-O 3.24Å; Y627-S817 WeakPolarHBondContact CA-O 3.33Å; Y627-S817 WeakPolarHBondContact CB-O 3.3Å; Y627-S817 WeakPolarHBondContact CB-OG 3.47Å; Y627-H819 AromaticContact CD2-CE1 3.84Å; Y627-H819 AromaticContact CD2-ND1 3.89Å
628	F	89.6	Confident	89.6	Confident	9 Å²	9	58.8 Å²	58.8	4%	0.039	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.7	175.6	-63	-82.6	0	0	0	110.8	Y623 Q625 F630 F645 V816 S817 I818 H819	Y623-F628 HydrophobicContact CD1-CE2 4.23Å; Q625-F628 HydrophobicContact CB-CD1 4.01Å; Q625-F628 HydrophobicContact CB-CE1 3.61Å; Q625-F628 HydrophobicContact CB-CZ 3.9Å; Q625-F628 HydrophobicContact CG-CD1 4.2Å; Q625-F628 HydrophobicContact CG-CE1 3.7Å; Q625-F628 HydrophobicContact CG-CZ 4.35Å; F628-F630 HydrophobicContact CB-CE1 4.42Å; F628-F630 HydrophobicContact CB-CZ 4.16Å; F628-F645 HydrophobicContact CD1-CB 3.88Å; F628-F645 HydrophobicContact CD2-CB 4.05Å; F628-F645 HydrophobicContact CD2-CD2 4.36Å; F628-F645 HydrophobicContact CD2-CG 4.18Å; F628-F645 HydrophobicContact CE1-CB 3.63Å; F628-F645 HydrophobicContact CE2-CB 3.82Å; F628-F645 AromaticContact CE2-CD2 3.87Å; F628-F645 HydrophobicContact CE2-CD2 3.87Å; F628-F645 HydrophobicContact CE2-CG 4.01Å; F628-F645 HydrophobicContact CG-CB 4.09Å; F628-F645 HydrophobicContact CZ-CB 3.61Å; F628-F645 HydrophobicContact CZ-CD2 4.25Å; F628-F645 HydrophobicContact CZ-CG 4.27Å; F628-V816 HydrophobicContact CD2-CG1 4.33Å; F628-V816 HydrophobicContact CD2-CG2 3.88Å; F628-V816 HydrophobicContact CE2-CG1 4.28Å; F628-V816 HydrophobicContact CE2-CG2 3.87Å; F628-S817 PolarHBondContact N-O 2.83Å; F628-I818 HydrophobicContact CB-CD1 4.15Å; F628-I818 HydrophobicContact CB-CG1 4.12Å; F628-I818 HydrophobicContact CB-CG2 4.46Å; F628-I818 HydrophobicContact CD2-CD1 4.14Å; F628-I818 HydrophobicContact CD2-CG1 4.23Å; F628-I818 HydrophobicContact CG-CD1 4.47Å; F628-I818 CarbonylContact O-C 3.31Å; F628-I818 WeakPolarHBondContact O-CA 3.35Å; F628-H819 PolarHBondContact O-N 2.92Å
629	E	90.5	Very high	89.5	Confident	108 Å²	108	58 Å²	58	51%	0.505	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124	173.1	-79.8	170.7	-175.9	0	0	110.2	Y627 H819	Y627-E629 HydrophobicContact CD2-CG 4.15Å; Y627-E629 HydrophobicContact CE2-CG 3.85Å; Y627-E629 WeakPolarHBondContact CE2-OE1 3.42Å; E629-H819 WeakPolarHBondContact CA-O 3.34Å; E629-H819 HydrophobicContact CG-CB 4.11Å
630	F	92.4	Very high	89.7	Confident	28 Å²	28	58.9 Å²	58.9	12%	0.123	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	160.9	173.3	-61.4	-36.1	0	0	0	110.5	F628 V642 F645 L741 I818 H819 I820 H821	F628-F630 HydrophobicContact CB-CE1 4.42Å; F628-F630 HydrophobicContact CB-CZ 4.16Å; F630-V642 HydrophobicContact CB-CG1 4.06Å; F630-V642 HydrophobicContact CD2-CG1 4.33Å; F630-F645 HydrophobicContact CE2-CD1 4.49Å; F630-F645 HydrophobicContact CZ-CD1 4.37Å; F630-L741 HydrophobicContact CD2-CD2 4.06Å; F630-L741 HydrophobicContact CE2-CD2 4.23Å; F630-I818 HydrophobicContact CD2-CG2 3.43Å; F630-I818 VanDerWaalsContact CD2-CG2 3.43Å; F630-I818 HydrophobicContact CE2-CD1 3.82Å; F630-I818 HydrophobicContact CE2-CG2 3.67Å; F630-I818 HydrophobicContact CG-CG2 4.34Å; F630-I818 HydrophobicContact CZ-CD1 4.47Å; F630-H819 PolarHBondContact N-O 2.79Å; F630-I820 WeakPolarHBondContact O-CA 3.28Å; F630-H821 PolarHBondContact O-N 2.72Å
631	T	91.5	Very high	89.8	Confident	90 Å²	90	60.5 Å²	60.5	55%	0.552	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.1	178.3	55.2	0	0	0	0	110.2	H821 L823	T631-H821 WeakPolarHBondContact CA-O 3.36Å; T631-H821 HydrophobicContact CG2-CB 4.34Å; T631-L823 HydrophobicContact CG2-CD1 4.3Å
632	I	91.2	Very high	89.8	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.1	169.6	-158.4	-178.9	0	0	0	108.6	N636 V642 I743 I747 I820 H821 V822 L823	I632-N636 HydrophobicContact CD1-CB 3.8Å; I632-N636 HydrophobicContact CG1-CB 4.1Å; I632-V642 HydrophobicContact CD1-CG2 4.32Å; I632-I743 HydrophobicContact CD1-CB 4.33Å; I632-I743 HydrophobicContact CD1-CD1 3.68Å; I632-I743 HydrophobicContact CD1-CG2 3.9Å; I632-I747 HydrophobicContact CD1-CD1 4.39Å; I632-I747 HydrophobicContact CG2-CD1 3.89Å; I632-I820 HydrophobicContact CB-CG2 4.25Å; I632-I820 HydrophobicContact CG2-CG2 3.82Å; I632-H821 PolarHBondContact N-O 2.97Å; I632-V822 HydrophobicContact CG2-CG2 4.32Å; I632-V822 CarbonylContact O-C 3.58Å; I632-V822 WeakPolarHBondContact O-CA 3.5Å; I632-L823 PolarHBondContact O-N 2.94Å
633	T	91.3	Very high	89.8	Confident	63 Å²	63	58.6 Å²	58.6	39%	0.387	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	154.8	164.5	55.8	0	0	0	0	109	L823	T633-L823 WeakPolarHBondContact CA-O 3.32Å; T633-L823 HydrophobicContact CG2-CB 4.23Å
634	E	88.9	Confident	89.9	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.009	34%	0.344	C	S	.	.	S	Bend	trans	-63.9	178.6	158.9	68.6	-165.9	123.9	0	0	112.2	N636 I747 R749 V822 L823 D824 E825	E634-N636 PolarHBondContact O-N 3.13Å; E634-I747 HydrophobicContact CB-CG2 4.38Å; E634-I747 WeakPolarHBondContact CB-O 3.48Å; E634-R749 HydrophobicContact CB-CB 4.3Å; E634-R749 VanDerWaalsContact CD-CB 3.42Å; E634-R749 HydrophobicContact CG-CB 4.5Å; E634-R749 WeakPolarHBondContact OE1-CB 3.26Å; E634-R749 IonicContact OE1-NE 2.79Å; E634-R749 WeakPolarHBondContact OE2-CB 3.3Å; E634-R749 PolarHBondContact OE2-N 2.99Å; E634-V822 HydrophobicContact CB-CG1 4.42Å; E634-L823 PolarHBondContact N-O 3.35Å; E634-D824 VanDerWaalsContact OE1-CA 3.27Å; E634-D824 WeakPolarHBondContact OE1-CA 3.47Å; E634-E825 HydrophobicContact CG-CB 4.04Å; E634-E825 PolarHBondContact OE1-N 3.41Å
635	N	89.4	Confident	90.2	Very high	76 Å²	76	57.3 Å²	57.3	41%	0.406	32%	0.319	S	S	.	.	S	Bend	trans	51.5	25	-174.2	-71.9	-54.5	0	0	0	113.7	I747 D827	N635-I747 PolarHBondContact N-O 2.7Å; N635-D827 PolarHBondContact ND2-OD2 3.09Å
636	N	89.2	Confident	90.4	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.021	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-61.8	158	-173.9	68.1	-92.5	0	0	0	113.1	I632 E634 I743 S745 I747	I632-N636 HydrophobicContact CD1-CB 3.8Å; I632-N636 HydrophobicContact CG1-CB 4.1Å; E634-N636 PolarHBondContact O-N 3.13Å; N636-I743 WeakPolarHBondContact ND2-CG2 3.37Å; N636-S745 PolarHBondContact ND2-O 3.07Å; N636-I747 PolarHBondContact OD1-N 3.2Å
637	N	91.1	Very high	90.8	Very high	122 Å²	122	50.8 Å²	50.8	65%	0.652	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-74	139.8	172.2	-71.4	-82.8	0	0	0	110.8	G639 Q640	N637-G639 PolarHBondContact O-N 3.46Å; N637-Q640 HydrophobicContact CB-CB 4.36Å; N637-Q640 VanDerWaalsContact N-OE1 3.11Å; N637-Q640 WeakPolarHBondContact O-CB 3.11Å; N637-Q640 PolarHBondContact O-N 2.96Å
638	V	89.8	Confident	90.9	Very high	95 Å²	95	47.5 Å²	47.5	58%	0.576	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	129.8	168.4	175.5	0	0	0	0	109	I746	V638-I746 HydrophobicContact CG2-CD1 4.44Å; V638-I746 HydrophobicContact CG2-CG1 3.78Å
639	G	88.9	Confident	91	Very high	46 Å²	46	47.1 Å²	47.1	47%	0.474	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	8.4	-173.3	0	0	0	0	0	114.5	N637 Y742 I743	N637-G639 PolarHBondContact O-N 3.46Å; G639-Y742 WeakPolarHBondContact O-CD1 3.19Å; G639-I743 WeakPolarHBondContact CA-O 2.98Å; G639-I743 PolarHBondContact N-O 2.83Å
640	Q	92.6	Very high	91	Very high	62 Å²	62	44.8 Å²	44.8	29%	0.29	26%	0.258	S	S	.	.			trans	-66.1	138.8	175.1	-179	167.2	-30.7	0	0	111.4	N637 V642 Y742 I743	N637-Q640 HydrophobicContact CB-CB 4.36Å; N637-Q640 VanDerWaalsContact N-OE1 3.11Å; N637-Q640 WeakPolarHBondContact O-CB 3.11Å; N637-Q640 PolarHBondContact O-N 2.96Å; Q640-V642 PolarHBondContact O-N 3.2Å; Q640-Y742 WeakPolarHBondContact O-CA 3.39Å; Q640-I743 HydrophobicContact CB-CG2 4.1Å; Q640-I743 PolarHBondContact O-N 2.8Å; Q640-I743 VanDerWaalsContact O-N 3.08Å
641	L	93	Very high	90.9	Very high	79 Å²	79	43.5 Å²	43.5	41%	0.414	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	121.9	170.5	-178	71.9	0	0	0	108.8	G643 K740 Y742	L641-G643 WeakPolarHBondContact CD1-O 3.47Å; L641-K740 HydrophobicContact CD1-CB 3.79Å; L641-K740 HydrophobicContact CD1-CD 4.22Å; L641-K740 HydrophobicContact CD1-CG 4.21Å; L641-Y742 HydrophobicContact CB-CD1 4.2Å; L641-Y742 HydrophobicContact CB-CE1 3.97Å; L641-Y742 HydrophobicContact CD1-CD1 4.2Å; L641-Y742 HydrophobicContact CD1-CE1 3.8Å; L641-Y742 HydrophobicContact CD1-CE2 4.24Å; L641-Y742 HydrophobicContact CG-CE1 4.5Å
642	V	92.2	Very high	90.6	Very high	15 Å²	15	41.3 Å²	41.3	9%	0.091	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-38.3	177.7	-173.2	0	0	0	0	110.5	F630 I632 Q640 F715 L741 I743 I820	F630-V642 HydrophobicContact CB-CG1 4.06Å; F630-V642 HydrophobicContact CD2-CG1 4.33Å; I632-V642 HydrophobicContact CD1-CG2 4.32Å; Q640-V642 PolarHBondContact O-N 3.2Å; V642-F715 HydrophobicContact CG2-CD1 4.17Å; V642-F715 HydrophobicContact CG2-CE1 3.99Å; V642-L741 HydrophobicContact CB-CB 4.48Å; V642-L741 HydrophobicContact CB-CD2 4.07Å; V642-L741 HydrophobicContact CB-CG 4.12Å; V642-L741 HydrophobicContact CG1-CD2 4.11Å; V642-L741 HydrophobicContact CG2-CG 4.37Å; V642-L741 PolarHBondContact N-O 3.22Å; V642-I743 HydrophobicContact CG2-CB 3.93Å; V642-I743 HydrophobicContact CG2-CG2 4.32Å; V642-I820 HydrophobicContact CG1-CD1 4.27Å; V642-I820 HydrophobicContact CG1-CG1 4.36Å; V642-I820 HydrophobicContact CG1-CG2 3.81Å
643	G	91.5	Very high	90.4	Very high	11 Å²	11	47.2 Å²	47.2	11%	0.113	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.3	175.7	178.3	0	0	0	0	0	111.7	L641 L741	L641-G643 WeakPolarHBondContact CD1-O 3.47Å; G643-L741 PolarHBondContact O-N 3.04Å
644	N	91.8	Very high	90.1	Very high	80 Å²	80	51.1 Å²	51.1	43%	0.428	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	153	172.3	77.1	-66.6	0	0	0	111	D738 V739 K740	N644-D738 PolarHBondContact ND2-OD1 2.77Å; N644-D738 VanDerWaalsContact ND2-OD1 3.09Å; N644-V739 CarbonylContact C-O 3.54Å; N644-V739 WeakPolarHBondContact CA-O 3.09Å; N644-V739 WeakPolarHBondContact CB-O 3.29Å; N644-K740 HydrophobicContact CB-CG 3.92Å
645	F	91.5	Very high	90.1	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	168.7	-178.8	62.5	-82.9	0	0	0	110.1	Y623 F628 F630 I647 L717 V739 I802 I818	Y623-F645 HydrophobicContact CD1-CD2 4.36Å; Y623-F645 HydrophobicContact CD1-CE2 4.31Å; Y623-F645 HydrophobicContact CE1-CE2 4.04Å; F628-F645 HydrophobicContact CD1-CB 3.88Å; F628-F645 HydrophobicContact CD2-CB 4.05Å; F628-F645 HydrophobicContact CD2-CD2 4.36Å; F628-F645 HydrophobicContact CD2-CG 4.18Å; F628-F645 HydrophobicContact CE1-CB 3.63Å; F628-F645 HydrophobicContact CE2-CB 3.82Å; F628-F645 AromaticContact CE2-CD2 3.87Å; F628-F645 HydrophobicContact CE2-CD2 3.87Å; F628-F645 HydrophobicContact CE2-CG 4.01Å; F628-F645 HydrophobicContact CG-CB 4.09Å; F628-F645 HydrophobicContact CZ-CB 3.61Å; F628-F645 HydrophobicContact CZ-CD2 4.25Å; F628-F645 HydrophobicContact CZ-CG 4.27Å; F630-F645 HydrophobicContact CE2-CD1 4.49Å; F630-F645 HydrophobicContact CZ-CD1 4.37Å; F645-I647 HydrophobicContact CD2-CG1 4.18Å; F645-I647 HydrophobicContact CE2-CD1 3.96Å; F645-I647 HydrophobicContact CE2-CG1 3.91Å; F645-L717 HydrophobicContact CE1-CD2 4.15Å; F645-L717 HydrophobicContact CZ-CD2 4.33Å; F645-V739 HydrophobicContact CD1-CB 4.32Å; F645-V739 HydrophobicContact CD2-CB 4.24Å; F645-V739 HydrophobicContact CE1-CB 3.91Å; F645-V739 HydrophobicContact CE1-CG1 3.72Å; F645-V739 HydrophobicContact CE2-CB 3.82Å; F645-V739 HydrophobicContact CE2-CG1 4.08Å; F645-V739 HydrophobicContact CE2-CG2 4.14Å; F645-V739 HydrophobicContact CG-CB 4.47Å; F645-V739 HydrophobicContact CZ-CB 3.64Å; F645-V739 HydrophobicContact CZ-CG1 3.42Å; F645-V739 VanDerWaalsContact CZ-CG1 3.42Å; F645-V739 HydrophobicContact CZ-CG2 4.34Å; F645-V739 PolarHBondContact N-O 2.78Å; F645-V739 PolarHBondContact O-N 2.89Å; F645-I802 HydrophobicContact CE1-CD1 3.79Å; F645-I802 HydrophobicContact CZ-CD1 3.55Å; F645-I802 HydrophobicContact CZ-CG2 4.26Å; F645-I818 HydrophobicContact CD1-CD1 3.59Å; F645-I818 HydrophobicContact CE1-CD1 3.47Å; F645-I818 VanDerWaalsContact CE1-CD1 3.47Å; F645-I818 HydrophobicContact CG-CD1 4.31Å; F645-I818 HydrophobicContact CZ-CD1 4.1Å
646	Q	90.5	Very high	90.1	Very high	80 Å²	80	48.7 Å²	48.7	37%	0.374	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.7	-177.4	-70	178.9	-9.3	0	0	111.3	S624 L736 Y737	S624-Q646 PolarHBondContact OG-O 3.26Å; Q646-L736 HydrophobicContact CB-CD1 4.06Å; Q646-L736 HydrophobicContact CG-CD1 4.5Å; Q646-Y737 WeakPolarHBondContact CA-O 3.38Å
647	I	91.2	Very high	90	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.3	171.9	-39.8	-176.4	0	0	0	107.2	P621 T622 Y623 F645 L658 V660 Y737 V739 A804	P621-I647 HydrophobicContact CB-CG2 4.1Å; T622-I647 CarbonylContact O-C 3.47Å; T622-I647 VanDerWaalsContact O-CA 3.28Å; T622-I647 WeakPolarHBondContact O-CA 3.49Å; T622-I647 WeakPolarHBondContact O-CG2 3.37Å; Y623-I647 HydrophobicContact CD1-CD1 4.23Å; Y623-I647 HydrophobicContact CD1-CG1 3.9Å; Y623-I647 HydrophobicContact CD1-CG2 4.39Å; Y623-I647 HydrophobicContact CE1-CD1 3.54Å; Y623-I647 HydrophobicContact CE1-CG1 3.75Å; Y623-I647 HydrophobicContact CE1-CG2 4.35Å; F645-I647 HydrophobicContact CD2-CG1 4.18Å; F645-I647 HydrophobicContact CE2-CD1 3.96Å; F645-I647 HydrophobicContact CE2-CG1 3.91Å; I647-L658 HydrophobicContact CB-CD1 3.9Å; I647-L658 HydrophobicContact CG2-CD1 3.6Å; I647-V660 HydrophobicContact CD1-CB 4.45Å; I647-V660 HydrophobicContact CD1-CG1 3.81Å; I647-V660 HydrophobicContact CD1-CG2 3.71Å; I647-Y737 PolarHBondContact N-O 2.93Å; I647-Y737 VanDerWaalsContact N-O 3.1Å; I647-Y737 PolarHBondContact O-N 3.17Å; I647-V739 HydrophobicContact CD1-CG2 3.94Å; I647-V739 HydrophobicContact CG1-CG2 3.97Å; I647-A804 HydrophobicContact CD1-CB 3.67Å; I647-A804 HydrophobicContact CG2-CB 4.32Å
648	A	90.5	Very high	90	Very high	20 Å²	20	46.6 Å²	46.6	17%	0.165	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.4	178.5	0	0	0	0	0	109.9	T622 P734 L736	T622-A648 WeakPolarHBondContact CA-O 3.36Å; T622-A648 WeakPolarHBondContact CB-O 3.44Å; T622-A648 PolarHBondContact N-O 3.48Å; T622-A648 PolarHBondContact O-N 3.16Å; T622-A648 PolarHBondContact OG1-O 2.74Å; A648-P734 HydrophobicContact CB-CB 4.27Å; A648-L736 HydrophobicContact CB-CD1 4.01Å
649	D	92	Very high	90.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.8	178.3	-168.8	-47.3	0	0	0	107.4	D651 A656 L658 P734 T735	D649-D651 PolarHBondContact OD1-N 3.5Å; D649-A656 HydrophobicContact CB-CB 3.92Å; D649-A656 WeakPolarHBondContact OD1-CB 3.42Å; D649-L658 HydrophobicContact CB-CD1 4.43Å; D649-L658 HydrophobicContact CB-CD2 4.08Å; D649-L658 HydrophobicContact CB-CG 4.36Å; D649-L658 WeakPolarHBondContact OD2-CD2 3.41Å; D649-P734 CarbonylContact O-C 3.54Å; D649-P734 WeakPolarHBondContact O-CA 3.25Å; D649-P734 WeakPolarHBondContact O-CB 3.38Å; D649-T735 PolarHBondContact N-O 3.3Å; D649-T735 PolarHBondContact O-N 2.8Å
650	D	89.9	Confident	90.1	Very high	59 Å²	59	43.1 Å²	43.1	32%	0.316	23%	0.226	S	C	.	.			trans	-79.7	-20.3	-169.3	-78.9	-54.8	0	0	0	113	R583 E584 N619 P734	R583-D650 PolarHBondContact NH2-O 3.07Å; E584-D650 HydrophobicContact CG-CB 3.9Å; N619-D650 HydrophobicContact CB-CB 4.45Å; D650-P734 VanDerWaalsContact OD1-CB 3.26Å; D650-P734 WeakPolarHBondContact OD1-CB 3.31Å; D650-P734 WeakPolarHBondContact OD1-CG 3.49Å
651	D	91	Very high	89.9	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.232	C	C	.	.	S	Bend	trans	-68.9	-173.8	-177.4	-68	2	0	0	0	113.3	N617 D618 N619 D649 N655 A656	N617-D651 VanDerWaalsContact CA-OD2 3.28Å; N617-D651 WeakPolarHBondContact CA-OD2 3.38Å; D618-D651 PolarHBondContact N-OD2 3Å; N619-D651 VanDerWaalsContact CB-OD1 3.3Å; N619-D651 WeakPolarHBondContact CB-OD1 3.43Å; N619-D651 PolarHBondContact ND2-OD1 3.37Å; D649-D651 PolarHBondContact OD1-N 3.5Å; D651-N655 HydrophobicContact CB-CB 3.62Å; D651-A656 VanDerWaalsContact C-CB 3.41Å; D651-A656 HydrophobicContact CB-CB 4.1Å; D651-A656 WeakPolarHBondContact O-CB 3.12Å
652	V	86.2	Confident	89.6	Confident	44 Å²	44	43.2 Å²	43.2	27%	0.267	23%	0.225	S	C	.	.			trans	-120.8	149.9	-174.3	176.2	0	0	0	0	114.5	D615 K654 N655 A656	D615-V652 HydrophobicContact CB-CB 4.28Å; D615-V652 WeakPolarHBondContact OD1-CB 3.5Å; D615-V652 VanDerWaalsContact OD1-CG2 3.24Å; D615-V652 WeakPolarHBondContact OD1-CG2 3.48Å; D615-V652 PolarHBondContact OD1-N 2.99Å; D615-V652 PolarHBondContact OD2-N 2.85Å; D615-V652 VanDerWaalsContact OD2-N 3.09Å; V652-K654 PolarHBondContact O-N 2.96Å; V652-N655 WeakPolarHBondContact O-CB 3.21Å; V652-N655 PolarHBondContact O-N 2.88Å; V652-A656 PolarHBondContact O-N 3.38Å
653	D	85.1	Confident	89	Confident	127 Å²	127	45.5 Å²	45.5	68%	0.679	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.2	-91.5	173.8	-71	-21.5	0	0	0	115.2	E657	D653-E657 WeakPolarHBondContact O-CB 3.22Å
654	K	86.4	Confident	87.7	Confident	144 Å²	144	53.2 Å²	53.2	63%	0.626	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-32.3	-179.8	-75.1	-175	178.9	177.5	0	113.6	V652 E657 K807	V652-K654 PolarHBondContact O-N 2.96Å; K654-E657 WeakPolarHBondContact O-CB 3.39Å; K654-E657 PolarHBondContact O-N 3.32Å; K654-E657 VanDerWaalsContact O-N 3.15Å; K654-K807 CarbonylContact O-C 3.56Å; K654-K807 PolarHBondContact O-N 3.39Å
655	N	88.6	Confident	85.8	Confident	28 Å²	28	51.2 Å²	51.2	15%	0.15	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-47.1	178.7	-64.8	-6.7	0	0	0	107.2	D615 N617 D651 V652 E657 D806 G808	D615-N655 WeakPolarHBondContact OD2-CB 3.32Å; D615-N655 PolarHBondContact OD2-ND2 3.03Å; N617-N655 HydrophobicContact CB-CB 4.05Å; N617-N655 WeakPolarHBondContact OD1-CA 3.24Å; N617-N655 WeakPolarHBondContact OD1-CB 3.28Å; D651-N655 HydrophobicContact CB-CB 3.62Å; V652-N655 WeakPolarHBondContact O-CB 3.21Å; V652-N655 PolarHBondContact O-N 2.88Å; N655-E657 VanDerWaalsContact C-N 3.33Å; N655-E657 PolarHBondContact O-N 2.82Å; N655-E657 VanDerWaalsContact O-N 3.16Å; N655-D806 WeakPolarHBondContact O-CB 3.28Å; N655-G808 WeakPolarHBondContact OD1-CA 3.22Å
656	A	88.2	Confident	83.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	38.7	166.2	0	0	0	0	0	115.8	D649 D651 V652 K721 T735	D649-A656 HydrophobicContact CB-CB 3.92Å; D649-A656 WeakPolarHBondContact OD1-CB 3.42Å; D651-A656 VanDerWaalsContact C-CB 3.41Å; D651-A656 HydrophobicContact CB-CB 4.1Å; D651-A656 WeakPolarHBondContact O-CB 3.12Å; V652-A656 PolarHBondContact O-N 3.38Å; A656-K721 PolarHBondContact O-NZ 3.34Å; A656-T735 HydrophobicContact CB-CG2 4.48Å; A656-T735 WeakPolarHBondContact CB-OG1 3.26Å; A656-T735 WeakPolarHBondContact O-CG2 3.37Å
657	E	89.2	Confident	81.7	Confident	73 Å²	73	61.9 Å²	61.9	34%	0.341	32%	0.317	S	S	.	.			trans	-105.8	75.6	173.6	-155.2	-161.5	155.8	0	0	113.2	D653 K654 N655 K807	D653-E657 WeakPolarHBondContact O-CB 3.22Å; K654-E657 WeakPolarHBondContact O-CB 3.39Å; K654-E657 PolarHBondContact O-N 3.32Å; K654-E657 VanDerWaalsContact O-N 3.15Å; N655-E657 VanDerWaalsContact C-N 3.33Å; N655-E657 PolarHBondContact O-N 2.82Å; N655-E657 VanDerWaalsContact O-N 3.16Å; E657-K807 HydrophobicContact CB-CD 4.15Å; E657-K807 HydrophobicContact CG-CD 4.27Å; E657-K807 WeakPolarHBondContact O-CE 3.33Å; E657-K807 WeakPolarHBondContact O-CG 3.38Å; E657-K807 IonicContact OE1-NZ 3.22Å; E657-K807 PolarHBondContact OE1-NZ 3.17Å; E657-K807 WeakPolarHBondContact OE2-CD 3.3Å; E657-K807 IonicContact OE2-NZ 3.93Å; E657-K807 PolarHBondContact OE2-NZ 2.71Å
658	L	90.8	Very high	79.6	Confident	8 Å²	8	67.6 Å²	67.6	4%	0.042	34%	0.343	C	S	.	.			trans	-58.5	138.6	-175.4	-55.4	-173.4	0	0	0	115.2	P621 I647 D649 V660 Y737 H805	P621-L658 HydrophobicContact CB-CD1 4.36Å; P621-L658 HydrophobicContact CB-CD2 3.65Å; P621-L658 HydrophobicContact CG-CD2 3.43Å; P621-L658 VanDerWaalsContact CG-CD2 3.43Å; I647-L658 HydrophobicContact CB-CD1 3.9Å; I647-L658 HydrophobicContact CG2-CD1 3.6Å; D649-L658 HydrophobicContact CB-CD1 4.43Å; D649-L658 HydrophobicContact CB-CD2 4.08Å; D649-L658 HydrophobicContact CB-CG 4.36Å; D649-L658 WeakPolarHBondContact OD2-CD2 3.41Å; L658-V660 HydrophobicContact CB-CG2 4.26Å; L658-Y737 HydrophobicContact CB-CD1 4.42Å; L658-Y737 HydrophobicContact CB-CD2 4Å; L658-Y737 HydrophobicContact CB-CE1 4.1Å; L658-Y737 HydrophobicContact CB-CE2 3.66Å; L658-Y737 HydrophobicContact CB-CG 4.37Å; L658-Y737 HydrophobicContact CD1-CD2 3.61Å; L658-Y737 HydrophobicContact CD1-CE2 4.01Å; L658-Y737 HydrophobicContact CD1-CG 4.11Å; L658-Y737 HydrophobicContact CG-CD2 3.82Å; L658-Y737 HydrophobicContact CG-CE2 3.65Å; L658-Y737 PolarHBondContact N-OH 3.43Å; L658-Y737 PolarHBondContact O-OH 3.31Å; L658-H805 WeakPolarHBondContact CA-O 3.26Å
659	V	90.2	Very high	77.7	Confident	51 Å²	51	72.2 Å²	72.2	31%	0.309	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.5	157	179.9	0	0	0	0	107.5	A804 H805 K807	V659-A804 WeakPolarHBondContact O-CA 3.21Å; V659-H805 WeakPolarHBondContact CB-NE2 3.13Å; V659-H805 PolarHBondContact N-O 2.78Å; V659-H805 PolarHBondContact O-N 3.2Å; V659-K807 HydrophobicContact CG2-CD 4.5Å; V659-K807 HydrophobicContact CG2-CG 4.39Å
660	V	90.5	Very high	76.2	Confident	17 Å²	17	75.8 Å²	75.8	10%	0.103	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.4	-174.7	-170	0	0	0	0	108.8	I647 L658 L717 V739 I802 A804	I647-V660 HydrophobicContact CD1-CB 4.45Å; I647-V660 HydrophobicContact CD1-CG1 3.81Å; I647-V660 HydrophobicContact CD1-CG2 3.71Å; L658-V660 HydrophobicContact CB-CG2 4.26Å; V660-L717 HydrophobicContact CG1-CD1 4.2Å; V660-V739 HydrophobicContact CG1-CG1 4.33Å; V660-I802 HydrophobicContact CG1-CG2 3.72Å; V660-A804 HydrophobicContact CG1-CB 4.46Å; V660-A804 HydrophobicContact CG2-CB 4.19Å
661	Q	88.5	Confident	74.7	Confident	91 Å²	91	73.3 Å²	73.3	43%	0.425	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	150.4	-174	62.5	-172.6	14.5	0	0	111.9	I802 S803	Q661-I802 WeakPolarHBondContact O-CA 3.48Å; Q661-S803 PolarHBondContact N-O 3.37Å; Q661-S803 PolarHBondContact O-N 3.49Å
662	I	86.5	Confident	73	Confident	52 Å²	52	78.6 Å²	78.6	27%	0.267	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	133	164.6	-53	178	0	0	0	106.5	E664 F715 L717	I662-E664 PolarHBondContact O-N 2.82Å; I662-F715 HydrophobicContact CD1-CB 3.85Å; I662-F715 WeakPolarHBondContact CD1-O 3.49Å; I662-L717 HydrophobicContact CD1-CG 4.19Å; I662-L717 HydrophobicContact CG1-CD1 3.58Å; I662-L717 HydrophobicContact CG1-CG 3.7Å
663	E	78.3	Confident	71.4	Confident	63 Å²	63	78 Å²	78	29%	0.294	38%	0.379	S	S	.	.			trans	-86.7	111.5	-179.5	-169.3	164.7	-170.3	0	0	109.8	N665 L801 H815	E663-N665 PolarHBondContact O-N 3.1Å; E663-L801 HydrophobicContact CB-CB 4.3Å; E663-L801 HydrophobicContact CB-CD2 4.43Å; E663-L801 HydrophobicContact CB-CG 4.3Å; E663-L801 HydrophobicContact CG-CD2 4.45Å; E663-L801 PolarHBondContact N-O 2.79Å; E663-L801 WeakPolarHBondContact OE2-CD2 3.43Å; E663-L801 WeakPolarHBondContact OE2-CG 3.47Å; E663-H815 IonicContact OE1-CE1 2.73Å; E663-H815 IonicContact OE1-ND1 3.22Å; E663-H815 IonicContact OE2-CE1 2.83Å; E663-H815 PolarHBondContact OE2-CE1 3.4Å; E663-H815 VanDerWaalsContact OE2-CE1 3.22Å; E663-H815 IonicContact OE2-ND1 2.72Å; E663-H815 PolarHBondContact OE2-ND1 2.98Å
664	E	65.4	Low	69.7	Low	173 Å²	173	73.3 Å²	73.3	81%	0.808	36%	0.358	S	S	*	.			trans	-70.9	71.9	177.1	-70.1	-174.4	-178.6	0	0	110.9	I662 T666	I662-E664 PolarHBondContact O-N 2.82Å; E664-T666 VanDerWaalsContact C-N 3.34Å; E664-T666 PolarHBondContact O-N 2.88Å
665	N	52.4	Low	67.7	Low	39 Å²	39	70.7 Å²	70.7	21%	0.209	36%	0.358	C	S	.	.			trans	-76.4	83.8	-178.3	-163.2	-22.4	0	0	0	110.4	E663 E667 Q668	E663-N665 PolarHBondContact O-N 3.1Å; N665-E667 PolarHBondContact O-N 2.82Å; N665-Q668 HydrophobicContact CB-CB 4.46Å; N665-Q668 VanDerWaalsContact ND2-CD 3.3Å; N665-Q668 PolarHBondContact ND2-OE1 3.09Å; N665-Q668 PolarHBondContact O-N 3.06Å; N665-Q668 PolarHBondContact OD1-N 3.15Å
666	T	50.2	Low	65.6	Low	132 Å²	132	74.8 Å²	74.8	81%	0.81	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20	-175.4	51.1	0	0	0	0	114.4	E664	E664-T666 VanDerWaalsContact C-N 3.34Å; E664-T666 PolarHBondContact O-N 2.88Å
667	E	44.1	Very low	63	Low	178 Å²	178	77.9 Å²	77.9	83%	0.832	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-15.5	-179.7	-60.8	-168.7	167.8	0	0	113.4	N665	N665-E667 PolarHBondContact O-N 2.82Å
668	Q	46.7	Very low	60.2	Low	120 Å²	120	82.4 Å²	82.4	56%	0.561	43%	0.433	S	S	*	.	S	Bend	trans	-111	135.6	-176.4	-64.6	-171.3	10.5	0	0	112.9	N665 Q670	N665-Q668 HydrophobicContact CB-CB 4.46Å; N665-Q668 VanDerWaalsContact ND2-CD 3.3Å; N665-Q668 PolarHBondContact ND2-OE1 3.09Å; N665-Q668 PolarHBondContact O-N 3.06Å; N665-Q668 PolarHBondContact OD1-N 3.15Å; Q668-Q670 PolarHBondContact O-N 2.58Å
669	K	51.9	Low	57.2	Low	117 Å²	117	86.8 Å²	86.8	51%	0.509	46%	0.464	S	S	.	.			trans	-67.9	125	176.2	-70.1	171.5	175.1	175.6	0	109.7	Y672 I759	K669-Y672 WeakPolarHBondContact O-CE2 3.42Å; K669-Y672 PolarHBondContact O-OH 3.41Å; K669-Y672 VanDerWaalsContact O-OH 3.13Å; K669-I759 HydrophobicContact CD-CD1 4.02Å; K669-I759 HydrophobicContact CD-CG2 4.31Å
670	Q	60.2	Low	54.3	Low	74 Å²	74	91.6 Å²	91.6	35%	0.346	49%	0.487	S	S	.	.			trans	-86.8	-5.7	-176.1	-62.3	172.6	-1.9	0	0	113.7	Q668 I798 L799	Q668-Q670 PolarHBondContact O-N 2.58Å; Q670-I798 CarbonylContact O-C 3.23Å; Q670-I798 WeakPolarHBondContact O-CA 3.28Å; Q670-L799 PolarHBondContact O-N 3Å
671	V	57.6	Low	51.2	Low	7 Å²	7	94.9 Å²	94.9	4%	0.042	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.6	-177.5	-171.8	0	0	0	0	110.4	Y756 I798	V671-Y756 HydrophobicContact CB-CD1 4.15Å; V671-Y756 HydrophobicContact CB-CD2 3.96Å; V671-Y756 HydrophobicContact CB-CE1 3.92Å; V671-Y756 HydrophobicContact CB-CE2 3.7Å; V671-Y756 HydrophobicContact CB-CG 4.2Å; V671-Y756 HydrophobicContact CG1-CD2 3.92Å; V671-Y756 HydrophobicContact CG1-CE2 4.03Å; V671-Y756 HydrophobicContact CG1-CG 4.31Å; V671-Y756 HydrophobicContact CG2-CD2 4.42Å; V671-Y756 HydrophobicContact CG2-CE1 4.32Å; V671-Y756 HydrophobicContact CG2-CE2 3.7Å; V671-I798 HydrophobicContact CG2-CG1 4.23Å
672	Y	56.5	Low	48.5	Very low	112 Å²	112	95.9 Å²	95.9	44%	0.439	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	150.4	179.7	-64.2	-102	0	0	0	109.1	K669 I797 L799	K669-Y672 WeakPolarHBondContact O-CE2 3.42Å; K669-Y672 PolarHBondContact O-OH 3.41Å; K669-Y672 VanDerWaalsContact O-OH 3.13Å; Y672-I797 PolarHBondContact N-O 3.37Å; Y672-I797 PolarHBondContact O-N 2.73Å; Y672-L799 HydrophobicContact CD2-CB 4.31Å; Y672-L799 HydrophobicContact CD2-CD1 3.53Å; Y672-L799 HydrophobicContact CD2-CG 3.63Å; Y672-L799 HydrophobicContact CE2-CB 4.23Å; Y672-L799 HydrophobicContact CE2-CD1 3.44Å; Y672-L799 VanDerWaalsContact CE2-CD1 3.44Å; Y672-L799 HydrophobicContact CE2-CG 3.87Å; Y672-L799 HydrophobicContact CG-CD1 4.33Å
673	L	53.1	Low	45.9	Very low	33 Å²	33	102.3 Å²	102.3	17%	0.173	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.7	108.4	-178.1	-66.6	-176.5	0	0	0	109.1	I753 V760 I794 P796	L673-I753 HydrophobicContact CD1-CG2 4.29Å; L673-I753 HydrophobicContact CD2-CG1 4.05Å; L673-V760 HydrophobicContact CB-CG2 3.91Å; L673-V760 HydrophobicContact CD1-CG2 3.61Å; L673-V760 HydrophobicContact CG-CG2 4.24Å; L673-I794 HydrophobicContact CB-CG2 3.79Å; L673-I794 HydrophobicContact CD1-CG2 4.44Å; L673-I794 HydrophobicContact CD2-CG2 3.99Å; L673-I794 HydrophobicContact CG-CG2 4.28Å; L673-P796 HydrophobicContact CD2-CB 3.9Å; L673-P796 HydrophobicContact CD2-CG 4.07Å
674	A	49.2	Very low	43.6	Very low	27 Å²	27	105.3 Å²	105.3	22%	0.223	58%	0.578	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.6	135.4	-177.7	0	0	0	0	0	111.1	F676 I794 T795 I797	A674-F676 HydrophobicContact CB-CE2 4.2Å; A674-I794 CarbonylContact O-C 3.57Å; A674-I794 WeakPolarHBondContact O-CA 3.41Å; A674-T795 PolarHBondContact N-O 2.76Å; A674-T795 PolarHBondContact O-N 3.33Å; A674-I797 HydrophobicContact CB-CD1 3.61Å; A674-I797 HydrophobicContact CB-CG1 4.1Å
675	S	44.1	Very low	42	Very low	90 Å²	90	102 Å²	102	63%	0.629	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.5	106.5	178.9	-171.4	0	0	0	0	110.1	G677 I793	S675-G677 PolarHBondContact O-N 2.82Å; S675-I793 WeakPolarHBondContact CA-O 3.35Å; S675-I793 WeakPolarHBondContact OG-CG2 3.16Å
676	F	43.5	Very low	40.9	Very low	113 Å²	113	106.2 Å²	106.2	50%	0.496	59%	0.586	S	S	.	*			trans	-83.7	95.2	-176.8	-85.3	-82.4	0	0	0	111.9	A674 N678 I793 T795	A674-F676 HydrophobicContact CB-CE2 4.2Å; F676-N678 PolarHBondContact O-N 3.23Å; F676-I793 PolarHBondContact N-O 2.65Å; F676-I793 VanDerWaalsContact N-O 3.09Å; F676-T795 WeakPolarHBondContact CD2-OG1 3.27Å; F676-T795 HydrophobicContact CE2-CG2 4.47Å
677	G	33.6	Very low	40.2	Very low	66 Å²	66	108.8 Å²	108.8	68%	0.68	59%	0.586	S	S	*	*			trans	-72.8	111.7	170.4	0	0	0	0	0	111.8	S675 S679	S675-G677 PolarHBondContact O-N 2.82Å; G677-S679 VanDerWaalsContact C-N 3.31Å; G677-S679 PolarHBondContact O-N 2.83Å
678	N	30.6	Very low	39.6	Very low	168 Å²	168	108.1 Å²	108.1	90%	0.898	58%	0.583	S	S	*	*	S	Bend	trans	-69.8	70.4	-178.2	-78.5	-26.8	0	0	0	114.5	F676	F676-N678 PolarHBondContact O-N 3.23Å
679	S	28.9	Very low	38.9	Very low	99 Å²	99	109.5 Å²	109.5	69%	0.692	59%	0.593	S	S	*	*	S	Bend	trans	-167.7	151	155.3	-142.5	0	0	0	0	114	G677	G677-S679 VanDerWaalsContact C-N 3.31Å; G677-S679 PolarHBondContact O-N 2.83Å
680	L	28.9	Very low	37.8	Very low	152 Å²	152	113.9 Å²	113.9	80%	0.796	61%	0.612	S	S	*	*			trans	60.3	123.6	173.7	-92.9	62.1	0	0	0	116.8
681	G	25.5	Very low	36.1	Very low	86 Å²	86	117.5 Å²	117.5	89%	0.887	63%	0.633	S	S	*	*			trans	-76	129.5	172.3	0	0	0	0	0	112
682	I	31.2	Very low	34.6	Very low	112 Å²	112	123.3 Å²	123.3	57%	0.574	66%	0.66	S	S	*	*			trans	-122.9	89.3	-178.7	-59.7	178.4	0	0	0	109.5	N684 D685	I682-N684 PolarHBondContact O-N 3.43Å; I682-D685 HydrophobicContact CG2-CB 3.72Å; I682-D685 WeakPolarHBondContact CG2-OD2 3.38Å
683	H	31.5	Very low	33.2	Very low	187 Å²	187	124.1 Å²	124.1	87%	0.866	68%	0.682	S	S	*	*	S	Bend	trans	-86.9	33	176.9	-167.7	69.5	0	0	0	112.4
684	N	31.2	Very low	32.1	Very low	126 Å²	126	131 Å²	131	67%	0.674	71%	0.71	S	S	*	*	S	Bend	trans	-146.4	-34.7	-172.8	-89.7	-54.7	0	0	0	117.2	I682 M686	I682-N684 PolarHBondContact O-N 3.43Å; N684-M686 PolarHBondContact O-N 2.94Å
685	D	31.3	Very low	31.2	Very low	104 Å²	104	135.8 Å²	135.8	56%	0.556	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-83.7	-10.1	-164	-64.2	-29	0	0	0	115.8	I682 K687 Q688	I682-D685 HydrophobicContact CG2-CB 3.72Å; I682-D685 WeakPolarHBondContact CG2-OD2 3.38Å; D685-K687 PolarHBondContact O-N 3.49Å; D685-Q688 PolarHBondContact O-N 3.13Å
686	M	30.2	Very low	30.5	Very low	127 Å²	127	138.7 Å²	138.7	63%	0.626	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-56.6	-19.3	172.7	-76	-84	-87.1	0	0	113.5	N684 Q688 L689	N684-M686 PolarHBondContact O-N 2.94Å; M686-Q688 PolarHBondContact O-N 3.41Å; M686-L689 PolarHBondContact O-N 3.25Å
687	K	34.7	Very low	29.6	Very low	186 Å²	186	141.1 Å²	141.1	81%	0.809	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-64.2	-15.2	176.5	-90.2	-179.1	175.2	173.2	0	114.9	D685	D685-K687 PolarHBondContact O-N 3.49Å
688	Q	32.3	Very low	29.4	Very low	165 Å²	165	144.1 Å²	144.1	77%	0.771	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-86.8	-4.5	178.7	-61.1	-158.6	16.4	0	0	114.7	D685 M686	D685-Q688 PolarHBondContact O-N 3.13Å; M686-Q688 PolarHBondContact O-N 3.41Å
689	L	30.8	Very low	29.1	Very low	148 Å²	148	142 Å²	142	78%	0.775	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-86.7	3.4	175.2	-83.3	165.8	0	0	0	114.8	M686 L691	M686-L689 PolarHBondContact O-N 3.25Å; L689-L691 PolarHBondContact O-N 3Å
690	K	28.2	Very low	29.1	Very low	209 Å²	209	142.5 Å²	142.5	91%	0.909	75%	0.753	S	S	*	*			trans	-75.5	53.8	161.3	-87.4	-163.9	170.2	-171.8	0	111.5
691	L	26.3	Very low	29.1	Very low	150 Å²	150	139.2 Å²	139.2	79%	0.785	76%	0.756	S	S	*	*			trans	-108.5	88.6	-179.7	-163.6	75.9	0	0	0	111.9	L689 S693	L689-L691 PolarHBondContact O-N 3Å; L691-S693 PolarHBondContact O-N 3.5Å
692	H	25.1	Very low	29.3	Very low	130 Å²	130	142.7 Å²	142.7	60%	0.602	75%	0.754	S	S	*	*			trans	45.1	67.6	155.2	-120.9	76.1	0	0	0	117.6	K694 D695	H692-K694 PolarHBondContact O-N 2.92Å; H692-D695 IonicContact CD2-OD2 2.86Å; H692-D695 PolarHBondContact CD2-OD2 3.03Å; H692-D695 VanDerWaalsContact CD2-OD2 3.32Å
693	S	28.2	Very low	29.2	Very low	128 Å²	128	146 Å²	146	90%	0.895	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	18.6	169.3	52	0	0	0	0	115.1	L691	L691-S693 PolarHBondContact O-N 3.5Å
694	K	29.3	Very low	29.1	Very low	178 Å²	178	146.2 Å²	146.2	77%	0.774	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-15.4	179.5	-120.6	177.8	-178.1	179.2	0	114.4	H692	H692-K694 PolarHBondContact O-N 2.92Å
695	D	29.1	Very low	29	Very low	127 Å²	127	145.7 Å²	145.7	68%	0.679	77%	0.77	S	S	*	*	S	Bend	trans	-118	3.6	-166.2	-72.1	-30	0	0	0	116.1	H692 L697	H692-D695 IonicContact CD2-OD2 2.86Å; H692-D695 PolarHBondContact CD2-OD2 3.03Å; H692-D695 VanDerWaalsContact CD2-OD2 3.32Å; D695-L697 PolarHBondContact O-N 3Å
696	L	30	Very low	28.9	Very low	152 Å²	152	150.5 Å²	150.5	80%	0.796	79%	0.786	S	S	*	*			trans	-97.3	41	-177.3	-152.3	72.3	0	0	0	115	I698	L696-I698 HydrophobicContact CD1-CD1 4.17Å; L696-I698 PolarHBondContact O-N 3.43Å; L696-I698 VanDerWaalsContact O-N 3.12Å
697	L	24.2	Very low	29.1	Very low	163 Å²	163	152.4 Å²	152.4	85%	0.853	79%	0.793	S	S	*	*			trans	-77.8	84.6	166.4	-89.3	163.7	0	0	0	110.6	D695	D695-L697 PolarHBondContact O-N 3Å
698	I	30.8	Very low	28.9	Very low	129 Å²	129	147.9 Å²	147.9	66%	0.662	78%	0.781	S	S	*	*			trans	-113.9	96	170.3	-56.1	-176.9	0	0	0	109.6	L696 T700	L696-I698 HydrophobicContact CD1-CD1 4.17Å; L696-I698 PolarHBondContact O-N 3.43Å; L696-I698 VanDerWaalsContact O-N 3.12Å; I698-T700 HydrophobicContact CG2-CG2 4.39Å; I698-T700 PolarHBondContact O-N 3.25Å; I698-T700 VanDerWaalsContact O-N 3.14Å
699	S	24	Very low	29.4	Very low	123 Å²	123	145.6 Å²	145.6	86%	0.86	77%	0.774	S	S	*	*			trans	-77.5	91.9	179.5	49.1	0	0	0	0	112.5
700	T	29.5	Very low	30.4	Very low	110 Å²	110	145.5 Å²	145.5	68%	0.675	77%	0.77	S	S	*	*			trans	-95.4	94.9	164.9	54.4	0	0	0	0	110.1	I698 L702	I698-T700 HydrophobicContact CG2-CG2 4.39Å; I698-T700 PolarHBondContact O-N 3.25Å; I698-T700 VanDerWaalsContact O-N 3.14Å; T700-L702 VanDerWaalsContact C-N 3.3Å; T700-L702 PolarHBondContact O-N 3.1Å
701	G	27.7	Very low	31.7	Very low	83 Å²	83	141.1 Å²	141.1	86%	0.856	75%	0.748	S	S	*	*			trans	-70.1	75.9	-177.1	0	0	0	0	0	114.1
702	L	31.1	Very low	33.4	Very low	159 Å²	159	136.8 Å²	136.8	83%	0.832	73%	0.725	S	S	*	*			trans	-81.2	131.6	163.2	-70.9	168.1	0	0	0	108.7	T700	T700-L702 VanDerWaalsContact C-N 3.3Å; T700-L702 PolarHBondContact O-N 3.1Å
703	Q	28.3	Very low	35.8	Very low	182 Å²	182	131.3 Å²	131.3	85%	0.85	70%	0.701	S	S	*	*			trans	-69.2	146.2	-175.9	-64.9	-179.9	-53.5	0	0	111.6	T705	Q703-T705 VanDerWaalsContact C-N 3.31Å; Q703-T705 PolarHBondContact O-N 3.2Å
704	E	28.6	Very low	38.3	Very low	192 Å²	192	130.2 Å²	130.2	90%	0.897	68%	0.682	S	S	*	*			trans	-62.9	86.3	170.9	-63.1	176.9	148.7	0	0	111.1	K706	E704-K706 PolarHBondContact O-N 2.84Å; E704-K706 VanDerWaalsContact O-N 3.14Å
705	T	30.1	Very low	41	Very low	114 Å²	114	123 Å²	123	70%	0.699	65%	0.65	S	S	*	*			trans	-68.1	108.9	163.7	49.5	0	0	0	0	108.1	Q703 H707	Q703-T705 VanDerWaalsContact C-N 3.31Å; Q703-T705 PolarHBondContact O-N 3.2Å; T705-H707 VanDerWaalsContact C-N 3.27Å; T705-H707 PolarHBondContact O-N 2.99Å
706	K	29	Very low	43.8	Very low	206 Å²	206	121.9 Å²	121.9	90%	0.896	64%	0.639	S	S	*	*			trans	-61.3	84.7	174.5	-70.8	-173.1	173.7	-171.9	0	111.7	E704	E704-K706 PolarHBondContact O-N 2.84Å; E704-K706 VanDerWaalsContact O-N 3.14Å
707	H	33.3	Very low	46.6	Very low	166 Å²	166	116.2 Å²	116.2	77%	0.769	61%	0.609	S	S	*	*			trans	-105.3	148.5	158.3	-80.5	-81.1	0	0	0	108.8	T705	T705-H707 VanDerWaalsContact C-N 3.27Å; T705-H707 PolarHBondContact O-N 2.99Å
708	T	30.7	Very low	49.7	Very low	91 Å²	91	113.3 Å²	113.3	56%	0.558	59%	0.591	S	S	*	*			trans	-65	151.4	-163.8	33.6	0	0	0	0	113.5	E710	T708-E710 WeakPolarHBondContact CB-OE2 3.34Å; T708-E710 PolarHBondContact O-N 2.96Å; T708-E710 PolarHBondContact OG1-OE2 2.93Å
709	D	43.4	Very low	52.5	Low	118 Å²	118	109 Å²	109	63%	0.631	57%	0.573	S	S	*	*	S	Bend	trans	-65	2.6	177.5	-51.5	-78.8	0	0	0	114.1	Y711 I712	D709-Y711 PolarHBondContact O-N 2.92Å; D709-I712 PolarHBondContact O-N 2.88Å
710	E	51.7	Low	55.4	Low	146 Å²	146	108.4 Å²	108.4	68%	0.682	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-6	-168.4	-156.5	158.8	-162.1	0	0	115.8	T708	T708-E710 WeakPolarHBondContact CB-OE2 3.34Å; T708-E710 PolarHBondContact O-N 2.96Å; T708-E710 PolarHBondContact OG1-OE2 2.93Å
711	Y	55	Low	58.1	Low	116 Å²	116	107 Å²	107	46%	0.455	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	33.8	177.9	-60.5	-95.6	0	0	0	111.5	D709 K755	D709-Y711 PolarHBondContact O-N 2.92Å; Y711-K755 VanDerWaalsContact C-NZ 3.29Å; Y711-K755 HydrophobicContact CG-CD 4.47Å; Y711-K755 PolarHBondContact O-NZ 3.49Å
712	I	62.9	Low	60.5	Low	60 Å²	60	108.8 Å²	108.8	31%	0.308	53%	0.525	S	S	.	.	S	Bend	trans	-109.5	114.2	166.6	-58.5	-178.6	0	0	0	106.9	D709 H714	D709-I712 PolarHBondContact O-N 2.88Å; I712-H714 PolarHBondContact O-CD2 2.91Å; I712-H714 VanDerWaalsContact O-CD2 3.25Å; I712-H714 PolarHBondContact O-N 3.47Å
713	P	74.1	Confident	62.1	Low	14 Å²	14	105.1 Å²	105.1	9%	0.091	51%	0.511	C	S	.	.			trans	-70.2	115.4	-179.7	26.3	-31.4	0	0	0	110.1	F715 S745 I747 I798	P713-F715 HydrophobicContact CB-CE2 3.68Å; P713-F715 HydrophobicContact CB-CZ 4.07Å; P713-F715 HydrophobicContact CG-CE2 3.9Å; P713-F715 WeakPolarHBondContact O-CD2 3.3Å; P713-F715 WeakPolarHBondContact O-CE2 3.38Å; P713-S745 WeakPolarHBondContact CA-OG 3.2Å; P713-I747 HydrophobicContact CB-CD1 4.04Å; P713-I747 HydrophobicContact CB-CG1 3.92Å; P713-I798 HydrophobicContact CB-CD1 4.22Å; P713-I798 HydrophobicContact CG-CD1 3.64Å; P713-I798 HydrophobicContact CG-CG1 4.24Å; P713-I798 HydrophobicContact CG-CG2 4.49Å
714	H	80.6	Confident	63.7	Low	106 Å²	106	103.5 Å²	103.5	49%	0.491	50%	0.497	S	S	.	.			trans	-82.7	131.2	178.5	-70.7	-82.5	0	0	0	111	I712 I743 E744 S745	I712-H714 PolarHBondContact O-CD2 2.91Å; I712-H714 VanDerWaalsContact O-CD2 3.25Å; I712-H714 PolarHBondContact O-N 3.47Å; H714-I743 WeakPolarHBondContact O-CG1 3.5Å; H714-E744 HydrophobicContact CB-CB 4.45Å; H714-E744 PolarHBondContact O-N 2.98Å; H714-S745 PolarHBondContact N-OG 2.82Å
715	F	87.4	Confident	64.8	Low	25 Å²	25	103.7 Å²	103.7	11%	0.11	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	157.8	179.5	-64.9	-86.9	0	0	0	112	V642 I662 P713 L741 Y742 I743 I747 I798 L800 I820	V642-F715 HydrophobicContact CG2-CD1 4.17Å; V642-F715 HydrophobicContact CG2-CE1 3.99Å; I662-F715 HydrophobicContact CD1-CB 3.85Å; I662-F715 WeakPolarHBondContact CD1-O 3.49Å; P713-F715 HydrophobicContact CB-CE2 3.68Å; P713-F715 HydrophobicContact CB-CZ 4.07Å; P713-F715 HydrophobicContact CG-CE2 3.9Å; P713-F715 WeakPolarHBondContact O-CD2 3.3Å; P713-F715 WeakPolarHBondContact O-CE2 3.38Å; F715-L741 HydrophobicContact CB-CD1 3.96Å; F715-L741 HydrophobicContact CD1-CD1 4.27Å; F715-L741 HydrophobicContact CD1-CG 4.38Å; F715-L741 HydrophobicContact CG-CD1 4.45Å; F715-Y742 CarbonylContact C-O 3.53Å; F715-Y742 WeakPolarHBondContact CA-O 3.34Å; F715-I743 HydrophobicContact CD1-CB 3.97Å; F715-I743 HydrophobicContact CD1-CG1 3.97Å; F715-I743 HydrophobicContact CE1-CB 3.94Å; F715-I743 HydrophobicContact CE1-CD1 3.79Å; F715-I743 HydrophobicContact CE1-CG1 3.74Å; F715-I743 HydrophobicContact CZ-CD1 3.98Å; F715-I743 HydrophobicContact CZ-CG1 4.26Å; F715-I747 HydrophobicContact CZ-CD1 4.48Å; F715-I798 HydrophobicContact CE2-CD1 4.25Å; F715-I798 HydrophobicContact CE2-CG2 4.02Å; F715-I798 HydrophobicContact CZ-CD1 3.97Å; F715-L800 HydrophobicContact CB-CD1 3.87Å; F715-L800 HydrophobicContact CD1-CD1 4.18Å; F715-L800 HydrophobicContact CD2-CD1 3.79Å; F715-L800 HydrophobicContact CD2-CD2 3.84Å; F715-L800 HydrophobicContact CD2-CG 4.34Å; F715-L800 HydrophobicContact CE2-CD1 4.35Å; F715-L800 HydrophobicContact CE2-CD2 4.22Å; F715-L800 HydrophobicContact CG-CD1 3.68Å; F715-I820 HydrophobicContact CD1-CD1 4.18Å; F715-I820 HydrophobicContact CE1-CD1 3.58Å; F715-I820 HydrophobicContact CE2-CD1 4.2Å; F715-I820 HydrophobicContact CZ-CD1 3.6Å
716	K	87.6	Confident	65.7	Low	105 Å²	105	105.4 Å²	105.4	46%	0.457	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	127	-175.8	-178.3	162.3	177.1	170.2	0	111.2	Y742 E744	K716-Y742 PolarHBondContact N-O 2.87Å; K716-Y742 PolarHBondContact O-N 2.89Å; K716-E744 HydrophobicContact CB-CG 4.05Å; K716-E744 HydrophobicContact CD-CG 4.06Å; K716-E744 WeakPolarHBondContact CD-OE1 3.4Å; K716-E744 WeakPolarHBondContact CD-OE2 3.34Å; K716-E744 WeakPolarHBondContact CE-OE1 3.24Å; K716-E744 IonicContact NZ-OE1 3.49Å; K716-E744 PolarHBondContact NZ-OE1 3.18Å; K716-E744 IonicContact NZ-OE2 3.88Å
717	L	88.5	Confident	66.4	Low	32 Å²	32	102.3 Å²	102.3	17%	0.168	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	143.2	171.2	-66.3	174	0	0	0	110.8	F645 V660 I662 V739 K740 L741 I802	F645-L717 HydrophobicContact CE1-CD2 4.15Å; F645-L717 HydrophobicContact CZ-CD2 4.33Å; V660-L717 HydrophobicContact CG1-CD1 4.2Å; I662-L717 HydrophobicContact CD1-CG 4.19Å; I662-L717 HydrophobicContact CG1-CD1 3.58Å; I662-L717 HydrophobicContact CG1-CG 3.7Å; L717-V739 HydrophobicContact CB-CG1 4.49Å; L717-V739 HydrophobicContact CD2-CG1 3.97Å; L717-K740 WeakPolarHBondContact CA-O 3.49Å; L717-L741 HydrophobicContact CD2-CB 4.15Å; L717-L741 HydrophobicContact CD2-CD1 3.65Å; L717-L741 HydrophobicContact CG-CD1 4.37Å; L717-I802 HydrophobicContact CD1-CD1 3.91Å; L717-I802 HydrophobicContact CD1-CG1 4.11Å; L717-I802 HydrophobicContact CD1-CG2 3.84Å; L717-I802 HydrophobicContact CD2-CD1 3.81Å; L717-I802 HydrophobicContact CG-CD1 4.44Å
718	H	88.9	Confident	66.6	Low	102 Å²	102	100.4 Å²	100.4	47%	0.472	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	111	163.8	-176.5	67.2	0	0	0	108.7	K740 Y742	H718-K740 PolarHBondContact N-O 2.73Å; H718-K740 PolarHBondContact O-N 2.92Å; H718-Y742 HydrophobicContact CB-CE2 4.2Å
719	S	89.2	Confident	66.9	Low	40 Å²	40	100.2 Å²	100.2	28%	0.28	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141.7	177	55.1	0	0	0	0	111.2	D738	S719-D738 WeakPolarHBondContact CA-O 3.13Å
720	Q	86.3	Confident	67.1	Low	109 Å²	109	98.1 Å²	98.1	51%	0.509	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	122.6	177.2	-174	177.4	4.1	0	0	110.7	F722 Y737 D738	Q720-F722 PolarHBondContact O-N 2.75Å; Q720-Y737 WeakPolarHBondContact O-CA 3.46Å; Q720-D738 PolarHBondContact N-O 2.92Å; Q720-D738 PolarHBondContact O-N 3.34Å
721	K	84.9	Confident	67.2	Low	82 Å²	82	96.5 Å²	96.5	36%	0.357	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	127	170.9	-174.5	155.7	175.9	147.4	0	109	A656 T735 Y737	A656-K721 PolarHBondContact O-NZ 3.34Å; K721-T735 HydrophobicContact CD-CG2 3.62Å; K721-T735 HydrophobicContact CG-CG2 3.83Å; K721-T735 VanDerWaalsContact NZ-CG2 3.27Å; K721-T735 PolarHBondContact NZ-OG1 3.47Å; K721-Y737 HydrophobicContact CB-CD1 4.13Å; K721-Y737 HydrophobicContact CB-CD2 4.46Å; K721-Y737 HydrophobicContact CB-CE1 3.78Å; K721-Y737 HydrophobicContact CB-CE2 4.12Å; K721-Y737 HydrophobicContact CB-CG 4.47Å; K721-Y737 HydrophobicContact CD-CE2 3.97Å; K721-Y737 HydrophobicContact CG-CE2 4.1Å
722	F	78.3	Confident	67.5	Low	119 Å²	119	93.6 Å²	93.6	52%	0.522	49%	0.489	S	S	.	.			trans	-68.5	126.2	-174.4	-160.1	-87.8	0	0	0	110	Q720 R724 L736	Q720-F722 PolarHBondContact O-N 2.75Å; F722-R724 PolarHBondContact O-N 3.26Å; F722-R724 VanDerWaalsContact O-N 3.07Å; F722-L736 HydrophobicContact CB-CB 4.12Å; F722-L736 VanDerWaalsContact CB-O 3.31Å; F722-L736 WeakPolarHBondContact CB-O 3.43Å; F722-L736 HydrophobicContact CD2-CD2 4.4Å; F722-L736 HydrophobicContact CG-CD2 4.49Å; F722-L736 PolarHBondContact N-O 3.19Å
723	P	65.4	Low	67.8	Low	83 Å²	83	95.3 Å²	95.3	54%	0.539	50%	0.496	S	S	.	.			trans	-73.9	105.5	-174.9	27.9	-33.5	0	0	0	111.1	K725	P723-K725 PolarHBondContact O-N 2.79Å; P723-K725 VanDerWaalsContact O-N 3.09Å
724	R	60.7	Low	67.9	Low	147 Å²	147	97.1 Å²	97.1	56%	0.555	51%	0.507	S	S	*	.			trans	-51.9	114.1	170.8	-76.7	-175.9	175.5	157.4	-1.6	109.6	F722 E733	F722-R724 PolarHBondContact O-N 3.26Å; F722-R724 VanDerWaalsContact O-N 3.07Å; R724-E733 PolarHBondContact NH2-O 2.79Å
725	K	53.1	Low	68.1	Low	196 Å²	196	92.3 Å²	92.3	85%	0.852	49%	0.486	S	S	*	.			trans	-81.1	122.4	179.3	-74.8	-179.4	179.1	172.8	0	110.5	P723 V727	P723-K725 PolarHBondContact O-N 2.79Å; P723-K725 VanDerWaalsContact O-N 3.09Å; K725-V727 PolarHBondContact O-N 2.75Å
726	N	48.1	Very low	68.1	Low	150 Å²	150	93.6 Å²	93.6	80%	0.802	49%	0.493	S	S	*	.	S	Bend	trans	7.6	100.1	170.8	-65.1	-0.1	0	0	0	118.8
727	V	43.2	Very low	68.2	Low	141 Å²	141	89.3 Å²	89.3	86%	0.855	47%	0.474	S	S	*	.	S	Bend	trans	47.6	85.8	132.7	-169.1	0	0	0	0	116.4	K725	K725-V727 PolarHBondContact O-N 2.75Å
728	S	37.5	Very low	68.3	Low	127 Å²	127	89 Å²	89	89%	0.888	47%	0.473	S	S	*	.			trans	-179	5.1	144.5	36.1	0	0	0	0	116.2
729	S	37.9	Very low	68.4	Low	87 Å²	87	84.2 Å²	84.2	61%	0.608	45%	0.451	S	S	*	.	S	Bend	trans	-117.8	168.8	174.2	54.9	0	0	0	0	113.2	E733	S729-E733 PolarHBondContact OG-OE1 2.79Å
730	S	47.6	Very low	68.6	Low	74 Å²	74	84.8 Å²	84.8	52%	0.517	45%	0.448	S	S	.	.			trans	-54.1	144.4	-168.3	40.5	0	0	0	0	116.5	N732	S730-N732 PolarHBondContact O-N 3.43Å
731	N	53.4	Low	68.9	Low	112 Å²	112	79.6 Å²	79.6	60%	0.599	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	0.9	171	-72	13.6	0	0	0	114.3	T587	T587-N731 HydrophobicContact CG2-CB 4.39Å
732	N	60.8	Low	69.2	Low	54 Å²	54	79 Å²	79	29%	0.289	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	16.8	-173.7	-65.7	65.6	0	0	0	112.8	R583 E584 T587 S730	R583-N732 PolarHBondContact O-ND2 3.22Å; E584-N732 PolarHBondContact O-ND2 2.77Å; T587-N732 VanDerWaalsContact CG2-OD1 3.23Å; T587-N732 WeakPolarHBondContact CG2-OD1 3.27Å; T587-N732 PolarHBondContact OG1-OD1 3.36Å; S730-N732 PolarHBondContact O-N 3.43Å
733	E	69.5	Low	69.8	Low	96 Å²	96	73.4 Å²	73.4	45%	0.449	40%	0.395	S	S	.	.	S	Bend	trans	-87.3	127.1	170	-71.5	179	-166.2	0	0	110	R724 S729	R724-E733 PolarHBondContact NH2-O 2.79Å; S729-E733 PolarHBondContact OG-OE1 2.79Å
734	P	77.6	Confident	70.8	Confident	52 Å²	52	74 Å²	74	34%	0.338	39%	0.391	S	S	.	.			trans	-52.2	154.6	178.7	7.8	-22.5	0	0	0	114.3	A648 D649 D650 L736	A648-P734 HydrophobicContact CB-CB 4.27Å; D649-P734 CarbonylContact O-C 3.54Å; D649-P734 WeakPolarHBondContact O-CA 3.25Å; D649-P734 WeakPolarHBondContact O-CB 3.38Å; D650-P734 VanDerWaalsContact OD1-CB 3.26Å; D650-P734 WeakPolarHBondContact OD1-CB 3.31Å; D650-P734 WeakPolarHBondContact OD1-CG 3.49Å; P734-L736 PolarHBondContact O-N 3.38Å; P734-L736 VanDerWaalsContact O-N 3.13Å
735	T	84	Confident	72	Confident	6 Å²	6	68 Å²	68	4%	0.037	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	103.2	161.6	-64	0	0	0	0	110	D649 A656 K721 Y737	D649-T735 PolarHBondContact N-O 3.3Å; D649-T735 PolarHBondContact O-N 2.8Å; A656-T735 HydrophobicContact CB-CG2 4.48Å; A656-T735 WeakPolarHBondContact CB-OG1 3.26Å; A656-T735 WeakPolarHBondContact O-CG2 3.37Å; K721-T735 HydrophobicContact CD-CG2 3.62Å; K721-T735 HydrophobicContact CG-CG2 3.83Å; K721-T735 VanDerWaalsContact NZ-CG2 3.27Å; K721-T735 PolarHBondContact NZ-OG1 3.47Å; T735-Y737 HydrophobicContact CG2-CD2 3.74Å; T735-Y737 HydrophobicContact CG2-CE2 3.4Å
736	L	87.6	Confident	73.6	Confident	51 Å²	51	63.8 Å²	63.8	27%	0.267	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.3	171	-164.5	69.8	0	0	0	111.6	Q646 A648 F722 P734	Q646-L736 HydrophobicContact CB-CD1 4.06Å; Q646-L736 HydrophobicContact CG-CD1 4.5Å; A648-L736 HydrophobicContact CB-CD1 4.01Å; F722-L736 HydrophobicContact CB-CB 4.12Å; F722-L736 VanDerWaalsContact CB-O 3.31Å; F722-L736 WeakPolarHBondContact CB-O 3.43Å; F722-L736 HydrophobicContact CD2-CD2 4.4Å; F722-L736 HydrophobicContact CG-CD2 4.49Å; F722-L736 PolarHBondContact N-O 3.19Å; P734-L736 PolarHBondContact O-N 3.38Å; P734-L736 VanDerWaalsContact O-N 3.13Å
737	Y	90	Very high	75.4	Confident	15 Å²	15	57 Å²	57	6%	0.059	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.4	165.5	-79.2	-110.9	0	0	0	109.8	Q646 I647 L658 Q720 K721 T735	Q646-Y737 WeakPolarHBondContact CA-O 3.38Å; I647-Y737 PolarHBondContact N-O 2.93Å; I647-Y737 VanDerWaalsContact N-O 3.1Å; I647-Y737 PolarHBondContact O-N 3.17Å; L658-Y737 HydrophobicContact CB-CD1 4.42Å; L658-Y737 HydrophobicContact CB-CD2 4Å; L658-Y737 HydrophobicContact CB-CE1 4.1Å; L658-Y737 HydrophobicContact CB-CE2 3.66Å; L658-Y737 HydrophobicContact CB-CG 4.37Å; L658-Y737 HydrophobicContact CD1-CD2 3.61Å; L658-Y737 HydrophobicContact CD1-CE2 4.01Å; L658-Y737 HydrophobicContact CD1-CG 4.11Å; L658-Y737 HydrophobicContact CG-CD2 3.82Å; L658-Y737 HydrophobicContact CG-CE2 3.65Å; L658-Y737 PolarHBondContact N-OH 3.43Å; L658-Y737 PolarHBondContact O-OH 3.31Å; Q720-Y737 WeakPolarHBondContact O-CA 3.46Å; K721-Y737 HydrophobicContact CB-CD1 4.13Å; K721-Y737 HydrophobicContact CB-CD2 4.46Å; K721-Y737 HydrophobicContact CB-CE1 3.78Å; K721-Y737 HydrophobicContact CB-CE2 4.12Å; K721-Y737 HydrophobicContact CB-CG 4.47Å; K721-Y737 HydrophobicContact CD-CE2 3.97Å; K721-Y737 HydrophobicContact CG-CE2 4.1Å; T735-Y737 HydrophobicContact CG2-CD2 3.74Å; T735-Y737 HydrophobicContact CG2-CE2 3.4Å
738	D	90.3	Very high	77.5	Confident	27 Å²	27	53.2 Å²	53.2	14%	0.144	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.7	166.1	176.2	55.6	0	0	0	108.6	N644 S719 Q720 K740	N644-D738 PolarHBondContact ND2-OD1 2.77Å; N644-D738 VanDerWaalsContact ND2-OD1 3.09Å; S719-D738 WeakPolarHBondContact CA-O 3.13Å; Q720-D738 PolarHBondContact N-O 2.92Å; Q720-D738 PolarHBondContact O-N 3.34Å; D738-K740 IonicContact OD2-NZ 2.91Å; D738-K740 PolarHBondContact OD2-NZ 3Å
739	V	91.3	Very high	79.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.2	-174.6	-170.1	0	0	0	0	109.5	N644 F645 I647 V660 L717	N644-V739 CarbonylContact C-O 3.54Å; N644-V739 WeakPolarHBondContact CA-O 3.09Å; N644-V739 WeakPolarHBondContact CB-O 3.29Å; F645-V739 HydrophobicContact CD1-CB 4.32Å; F645-V739 HydrophobicContact CD2-CB 4.24Å; F645-V739 HydrophobicContact CE1-CB 3.91Å; F645-V739 HydrophobicContact CE1-CG1 3.72Å; F645-V739 HydrophobicContact CE2-CB 3.82Å; F645-V739 HydrophobicContact CE2-CG1 4.08Å; F645-V739 HydrophobicContact CE2-CG2 4.14Å; F645-V739 HydrophobicContact CG-CB 4.47Å; F645-V739 HydrophobicContact CZ-CB 3.64Å; F645-V739 HydrophobicContact CZ-CG1 3.42Å; F645-V739 VanDerWaalsContact CZ-CG1 3.42Å; F645-V739 HydrophobicContact CZ-CG2 4.34Å; F645-V739 PolarHBondContact N-O 2.78Å; F645-V739 PolarHBondContact O-N 2.89Å; I647-V739 HydrophobicContact CD1-CG2 3.94Å; I647-V739 HydrophobicContact CG1-CG2 3.97Å; V660-V739 HydrophobicContact CG1-CG1 4.33Å; L717-V739 HydrophobicContact CB-CG1 4.49Å; L717-V739 HydrophobicContact CD2-CG1 3.97Å
740	K	92.2	Very high	82	Confident	53 Å²	53	43.5 Å²	43.5	23%	0.23	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.8	-179.4	-64.9	-171.1	179	67.2	0	110.5	L641 N644 L717 H718 D738 Y742	L641-K740 HydrophobicContact CD1-CB 3.79Å; L641-K740 HydrophobicContact CD1-CD 4.22Å; L641-K740 HydrophobicContact CD1-CG 4.21Å; N644-K740 HydrophobicContact CB-CG 3.92Å; L717-K740 WeakPolarHBondContact CA-O 3.49Å; H718-K740 PolarHBondContact N-O 2.73Å; H718-K740 PolarHBondContact O-N 2.92Å; D738-K740 IonicContact OD2-NZ 2.91Å; D738-K740 PolarHBondContact OD2-NZ 3Å; K740-Y742 HydrophobicContact CB-CD2 4.26Å; K740-Y742 HydrophobicContact CB-CE2 3.52Å; K740-Y742 HydrophobicContact CD-CE2 4.35Å; K740-Y742 WeakPolarHBondContact CD-OH 3.44Å
741	L	92.7	Very high	83.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.3	176.3	179.9	68.5	0	0	0	109.6	F630 V642 G643 F715 L717 L800 I818 I820	F630-L741 HydrophobicContact CD2-CD2 4.06Å; F630-L741 HydrophobicContact CE2-CD2 4.23Å; V642-L741 HydrophobicContact CB-CB 4.48Å; V642-L741 HydrophobicContact CB-CD2 4.07Å; V642-L741 HydrophobicContact CB-CG 4.12Å; V642-L741 HydrophobicContact CG1-CD2 4.11Å; V642-L741 HydrophobicContact CG2-CG 4.37Å; V642-L741 PolarHBondContact N-O 3.22Å; G643-L741 PolarHBondContact O-N 3.04Å; F715-L741 HydrophobicContact CB-CD1 3.96Å; F715-L741 HydrophobicContact CD1-CD1 4.27Å; F715-L741 HydrophobicContact CD1-CG 4.38Å; F715-L741 HydrophobicContact CG-CD1 4.45Å; L717-L741 HydrophobicContact CD2-CB 4.15Å; L717-L741 HydrophobicContact CD2-CD1 3.65Å; L717-L741 HydrophobicContact CG-CD1 4.37Å; L741-L800 HydrophobicContact CD1-CD1 3.83Å; L741-L800 HydrophobicContact CD2-CD1 3.99Å; L741-I818 HydrophobicContact CD2-CG2 4.19Å; L741-I820 HydrophobicContact CD2-CD1 3.86Å
742	Y	92.2	Very high	84.7	Confident	70 Å²	70	35.4 Å²	35.4	28%	0.275	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	152.9	175.5	-63.2	-88.5	0	0	0	110.5	G639 Q640 L641 F715 K716 H718 K740	G639-Y742 WeakPolarHBondContact O-CD1 3.19Å; Q640-Y742 WeakPolarHBondContact O-CA 3.39Å; L641-Y742 HydrophobicContact CB-CD1 4.2Å; L641-Y742 HydrophobicContact CB-CE1 3.97Å; L641-Y742 HydrophobicContact CD1-CD1 4.2Å; L641-Y742 HydrophobicContact CD1-CE1 3.8Å; L641-Y742 HydrophobicContact CD1-CE2 4.24Å; L641-Y742 HydrophobicContact CG-CE1 4.5Å; F715-Y742 CarbonylContact C-O 3.53Å; F715-Y742 WeakPolarHBondContact CA-O 3.34Å; K716-Y742 PolarHBondContact N-O 2.87Å; K716-Y742 PolarHBondContact O-N 2.89Å; H718-Y742 HydrophobicContact CB-CE2 4.2Å; K740-Y742 HydrophobicContact CB-CD2 4.26Å; K740-Y742 HydrophobicContact CB-CE2 3.52Å; K740-Y742 HydrophobicContact CD-CE2 4.35Å; K740-Y742 WeakPolarHBondContact CD-OH 3.44Å
743	I	90.6	Very high	85.4	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	136.2	170.2	-164.1	172.8	0	0	0	110.4	I632 N636 G639 Q640 V642 H714 F715 S745 I747	I632-I743 HydrophobicContact CD1-CB 4.33Å; I632-I743 HydrophobicContact CD1-CD1 3.68Å; I632-I743 HydrophobicContact CD1-CG2 3.9Å; N636-I743 WeakPolarHBondContact ND2-CG2 3.37Å; G639-I743 WeakPolarHBondContact CA-O 2.98Å; G639-I743 PolarHBondContact N-O 2.83Å; Q640-I743 HydrophobicContact CB-CG2 4.1Å; Q640-I743 PolarHBondContact O-N 2.8Å; Q640-I743 VanDerWaalsContact O-N 3.08Å; V642-I743 HydrophobicContact CG2-CB 3.93Å; V642-I743 HydrophobicContact CG2-CG2 4.32Å; H714-I743 WeakPolarHBondContact O-CG1 3.5Å; F715-I743 HydrophobicContact CD1-CB 3.97Å; F715-I743 HydrophobicContact CD1-CG1 3.97Å; F715-I743 HydrophobicContact CE1-CB 3.94Å; F715-I743 HydrophobicContact CE1-CD1 3.79Å; F715-I743 HydrophobicContact CE1-CG1 3.74Å; F715-I743 HydrophobicContact CZ-CD1 3.98Å; F715-I743 HydrophobicContact CZ-CG1 4.26Å; I743-S745 WeakPolarHBondContact CG1-O 3.35Å; I743-I747 HydrophobicContact CD1-CD1 3.48Å; I743-I747 VanDerWaalsContact CD1-CD1 3.48Å; I743-I747 HydrophobicContact CD1-CG1 3.77Å
744	E	86.1	Confident	85.5	Confident	97 Å²	97	33.1 Å²	33.1	45%	0.453	17%	0.169	S	C	.	.			trans	-108.3	8	179.3	-64.3	-159	125.3	0	0	113.2	H714 K716	H714-E744 HydrophobicContact CB-CB 4.45Å; H714-E744 PolarHBondContact O-N 2.98Å; K716-E744 HydrophobicContact CB-CG 4.05Å; K716-E744 HydrophobicContact CD-CG 4.06Å; K716-E744 WeakPolarHBondContact CD-OE1 3.4Å; K716-E744 WeakPolarHBondContact CD-OE2 3.34Å; K716-E744 WeakPolarHBondContact CE-OE1 3.24Å; K716-E744 IonicContact NZ-OE1 3.49Å; K716-E744 PolarHBondContact NZ-OE1 3.18Å; K716-E744 IonicContact NZ-OE2 3.88Å
745	S	85.3	Confident	85	Confident	21 Å²	21	34.5 Å²	34.5	15%	0.147	17%	0.17	C	C	.	.	S	Bend	trans	-131.8	169.6	178.4	56	0	0	0	0	110.9	N636 P713 H714 I743	N636-S745 PolarHBondContact ND2-O 3.07Å; P713-S745 WeakPolarHBondContact CA-OG 3.2Å; H714-S745 PolarHBondContact N-OG 2.82Å; I743-S745 WeakPolarHBondContact CG1-O 3.35Å
746	I	87.5	Confident	84.1	Confident	107 Å²	107	35.8 Å²	35.8	55%	0.549	17%	0.174	S	C	.	.			trans	-98.1	138.8	168.9	-52.8	-178.8	0	0	0	107.5	V638	V638-I746 HydrophobicContact CG2-CD1 4.44Å; V638-I746 HydrophobicContact CG2-CG1 3.78Å
747	I	87	Confident	82.6	Confident	6 Å²	6	36 Å²	36	3%	0.031	17%	0.173	C	C	.	.			trans	-97.5	141.3	173.5	-70.4	171.6	0	0	0	110.6	I632 E634 N635 N636 P713 F715 I743 L752 I798 V822	I632-I747 HydrophobicContact CD1-CD1 4.39Å; I632-I747 HydrophobicContact CG2-CD1 3.89Å; E634-I747 HydrophobicContact CB-CG2 4.38Å; E634-I747 WeakPolarHBondContact CB-O 3.48Å; N635-I747 PolarHBondContact N-O 2.7Å; N636-I747 PolarHBondContact OD1-N 3.2Å; P713-I747 HydrophobicContact CB-CD1 4.04Å; P713-I747 HydrophobicContact CB-CG1 3.92Å; F715-I747 HydrophobicContact CZ-CD1 4.48Å; I743-I747 HydrophobicContact CD1-CD1 3.48Å; I743-I747 VanDerWaalsContact CD1-CD1 3.48Å; I743-I747 HydrophobicContact CD1-CG1 3.77Å; I747-L752 HydrophobicContact CG2-CD1 3.69Å; I747-I798 HydrophobicContact CD1-CD1 3.73Å; I747-V822 HydrophobicContact CD1-CG2 4.34Å; I747-V822 HydrophobicContact CG2-CG1 3.62Å; I747-V822 HydrophobicContact CG2-CG2 4.17Å
748	D	87	Confident	80.8	Confident	62 Å²	62	41.7 Å²	41.7	33%	0.332	20%	0.204	S	C	.	.			trans	-119.5	117.7	169	152	19.7	0	0	0	106.2	E750 G751 L752	D748-E750 PolarHBondContact OD1-N 2.75Å; D748-G751 VanDerWaalsContact CG-N 3.3Å; D748-G751 PolarHBondContact OD1-N 3.4Å; D748-G751 VanDerWaalsContact OD2-CA 3.27Å; D748-G751 WeakPolarHBondContact OD2-CA 3.29Å; D748-G751 PolarHBondContact OD2-N 2.8Å; D748-L752 WeakPolarHBondContact O-CG 3.5Å; D748-L752 PolarHBondContact O-N 2.8Å; D748-L752 VanDerWaalsContact O-N 3.11Å
749	R	86.7	Confident	78.8	Confident	3 Å²	3	44.4 Å²	44.4	1%	0.011	22%	0.218	C	C	.	.	H	α-helix	trans	-72.6	-42.8	-173.3	-169.9	-165.9	73.4	102.1	-2.3	110.6	E634 L752 I753 Y791 I794 P796 V822 D824 I865	E634-R749 HydrophobicContact CB-CB 4.3Å; E634-R749 VanDerWaalsContact CD-CB 3.42Å; E634-R749 HydrophobicContact CG-CB 4.5Å; E634-R749 WeakPolarHBondContact OE1-CB 3.26Å; E634-R749 IonicContact OE1-NE 2.79Å; E634-R749 WeakPolarHBondContact OE2-CB 3.3Å; E634-R749 PolarHBondContact OE2-N 2.99Å; R749-L752 PolarHBondContact O-N 2.83Å; R749-I753 HydrophobicContact CG-CD1 4.18Å; R749-I753 VanDerWaalsContact NH1-CD1 3.31Å; R749-I753 WeakPolarHBondContact O-CG1 3.19Å; R749-I753 PolarHBondContact O-N 2.91Å; R749-Y791 PolarHBondContact NH1-O 2.77Å; R749-I794 PolarHBondContact NH1-O 2.77Å; R749-P796 HydrophobicContact CG-CG 3.74Å; R749-V822 HydrophobicContact CB-CG1 3.99Å; R749-V822 HydrophobicContact CG-CG1 3.94Å; R749-D824 IonicContact CZ-OD1 2.71Å; R749-D824 IonicContact NE-OD1 3.47Å; R749-D824 PolarHBondContact NE-OD1 3.48Å; R749-D824 IonicContact NH1-OD1 3.49Å; R749-D824 IonicContact NH2-OD1 3.46Å; R749-D824 PolarHBondContact NH2-OD1 2.87Å; R749-I865 PolarHBondContact NH2-O 2.91Å
750	E	83.7	Confident	76.5	Confident	7 Å²	7	48.2 Å²	48.2	3%	0.033	24%	0.241	C	C	.	.	H	α-helix	trans	-58.7	-50	176.2	-80.7	45.1	-110	0	0	110.5	D748 L752 I753 M754 I865	D748-E750 PolarHBondContact OD1-N 2.75Å; E750-L752 VanDerWaalsContact C-N 3.35Å; E750-L752 PolarHBondContact O-N 3.29Å; E750-I753 CarbonylContact O-C 3.6Å; E750-I753 PolarHBondContact O-N 2.78Å; E750-I753 VanDerWaalsContact O-N 3.13Å; E750-M754 HydrophobicContact CB-CE 4.38Å; E750-M754 WeakPolarHBondContact O-CB 3.24Å; E750-M754 VanDerWaalsContact O-CG 3.27Å; E750-M754 WeakPolarHBondContact O-CG 3.16Å; E750-M754 PolarHBondContact O-N 2.79Å; E750-I865 HydrophobicContact CB-CD1 4.34Å; E750-I865 HydrophobicContact CG-CB 4.07Å; E750-I865 HydrophobicContact CG-CD1 3.46Å; E750-I865 VanDerWaalsContact CG-CD1 3.46Å; E750-I865 HydrophobicContact CG-CG1 3.58Å
751	G	79.9	Confident	73.6	Confident	10 Å²	10	49.7 Å²	49.7	10%	0.103	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-40.6	177.5	0	0	0	0	0	112.5	D748 K755	D748-G751 VanDerWaalsContact CG-N 3.3Å; D748-G751 PolarHBondContact OD1-N 3.4Å; D748-G751 VanDerWaalsContact OD2-CA 3.27Å; D748-G751 WeakPolarHBondContact OD2-CA 3.29Å; D748-G751 PolarHBondContact OD2-N 2.8Å; G751-K755 WeakPolarHBondContact O-CB 3.4Å; G751-K755 PolarHBondContact O-N 3.33Å
752	L	77.6	Confident	70.6	Confident	6 Å²	6	57 Å²	57	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-50.6	169.3	-75.2	177.8	0	0	0	111.4	I747 D748 R749 E750 M754 K755 Y756 P796 I798 V822	I747-L752 HydrophobicContact CG2-CD1 3.69Å; D748-L752 WeakPolarHBondContact O-CG 3.5Å; D748-L752 PolarHBondContact O-N 2.8Å; D748-L752 VanDerWaalsContact O-N 3.11Å; R749-L752 PolarHBondContact O-N 2.83Å; E750-L752 VanDerWaalsContact C-N 3.35Å; E750-L752 PolarHBondContact O-N 3.29Å; L752-M754 VanDerWaalsContact C-N 3.29Å; L752-M754 PolarHBondContact O-N 2.79Å; L752-K755 PolarHBondContact O-N 3.33Å; L752-Y756 HydrophobicContact CD2-CD2 4.36Å; L752-Y756 HydrophobicContact CD2-CE2 3.96Å; L752-Y756 VanDerWaalsContact O-CD2 3.3Å; L752-Y756 WeakPolarHBondContact O-CD2 3.24Å; L752-Y756 PolarHBondContact O-N 3.32Å; L752-P796 HydrophobicContact CD1-CB 4.4Å; L752-I798 HydrophobicContact CD1-CD1 4.45Å; L752-V822 HydrophobicContact CD1-CG2 4.03Å
753	I	74.6	Confident	67.6	Low	3 Å²	3	59.2 Å²	59.2	2%	0.015	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-37.7	-179.3	-62.9	167.9	0	0	0	111	L673 R749 E750 K757 Y791 I794 P796	L673-I753 HydrophobicContact CD1-CG2 4.29Å; L673-I753 HydrophobicContact CD2-CG1 4.05Å; R749-I753 HydrophobicContact CG-CD1 4.18Å; R749-I753 VanDerWaalsContact NH1-CD1 3.31Å; R749-I753 WeakPolarHBondContact O-CG1 3.19Å; R749-I753 PolarHBondContact O-N 2.91Å; E750-I753 CarbonylContact O-C 3.6Å; E750-I753 PolarHBondContact O-N 2.78Å; E750-I753 VanDerWaalsContact O-N 3.13Å; I753-K757 WeakPolarHBondContact O-CA 3.43Å; I753-K757 VanDerWaalsContact O-CB 3.28Å; I753-K757 WeakPolarHBondContact O-CB 3.17Å; I753-K757 PolarHBondContact O-N 3.41Å; I753-Y791 HydrophobicContact CB-CD1 4.08Å; I753-Y791 HydrophobicContact CB-CE1 4.23Å; I753-Y791 HydrophobicContact CD1-CD1 4.42Å; I753-Y791 HydrophobicContact CG2-CD1 3.48Å; I753-Y791 VanDerWaalsContact CG2-CD1 3.48Å; I753-Y791 HydrophobicContact CG2-CE1 3.6Å; I753-I794 HydrophobicContact CD1-CB 4.25Å; I753-I794 HydrophobicContact CD1-CG2 4.11Å; I753-I794 HydrophobicContact CG1-CG2 4.14Å; I753-I794 HydrophobicContact CG2-CG2 4.48Å; I753-P796 HydrophobicContact CD1-CG 4.14Å; I753-P796 HydrophobicContact CG1-CG 3.77Å
754	M	70.9	Confident	64.6	Low	99 Å²	99	67.7 Å²	67.7	49%	0.488	36%	0.357	S	S	.	.	H	α-helix	trans	-69.3	-46.3	176.5	-67.3	-156.2	-143.5	0	0	112.1	E750 L752 Y756 K757 Y791 I865	E750-M754 HydrophobicContact CB-CE 4.38Å; E750-M754 WeakPolarHBondContact O-CB 3.24Å; E750-M754 VanDerWaalsContact O-CG 3.27Å; E750-M754 WeakPolarHBondContact O-CG 3.16Å; E750-M754 PolarHBondContact O-N 2.79Å; L752-M754 VanDerWaalsContact C-N 3.29Å; L752-M754 PolarHBondContact O-N 2.79Å; M754-Y756 VanDerWaalsContact C-N 3.3Å; M754-Y756 PolarHBondContact O-N 2.79Å; M754-K757 VanDerWaalsContact O-CB 3.24Å; M754-K757 WeakPolarHBondContact O-CB 3.27Å; M754-K757 PolarHBondContact O-N 3.48Å; M754-Y791 HydrophobicContact CG-CE1 4.1Å; M754-I865 HydrophobicContact CE-CD1 4.35Å
755	K	67.5	Low	61.9	Low	82 Å²	82	69.1 Å²	69.1	36%	0.357	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-36.8	177.9	175.7	169.1	173.4	177	0	112.8	Y711 G751 L752	Y711-K755 VanDerWaalsContact C-NZ 3.29Å; Y711-K755 HydrophobicContact CG-CD 4.47Å; Y711-K755 PolarHBondContact O-NZ 3.49Å; G751-K755 WeakPolarHBondContact O-CB 3.4Å; G751-K755 PolarHBondContact O-N 3.33Å; L752-K755 PolarHBondContact O-N 3.33Å
756	Y	65	Low	59.4	Low	32 Å²	32	76.5 Å²	76.5	13%	0.125	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	7.1	179.4	-64.6	-85.6	0	0	0	113.4	V671 L752 M754 D758 I759	V671-Y756 HydrophobicContact CB-CD1 4.15Å; V671-Y756 HydrophobicContact CB-CD2 3.96Å; V671-Y756 HydrophobicContact CB-CE1 3.92Å; V671-Y756 HydrophobicContact CB-CE2 3.7Å; V671-Y756 HydrophobicContact CB-CG 4.2Å; V671-Y756 HydrophobicContact CG1-CD2 3.92Å; V671-Y756 HydrophobicContact CG1-CE2 4.03Å; V671-Y756 HydrophobicContact CG1-CG 4.31Å; V671-Y756 HydrophobicContact CG2-CD2 4.42Å; V671-Y756 HydrophobicContact CG2-CE1 4.32Å; V671-Y756 HydrophobicContact CG2-CE2 3.7Å; L752-Y756 HydrophobicContact CD2-CD2 4.36Å; L752-Y756 HydrophobicContact CD2-CE2 3.96Å; L752-Y756 VanDerWaalsContact O-CD2 3.3Å; L752-Y756 WeakPolarHBondContact O-CD2 3.24Å; L752-Y756 PolarHBondContact O-N 3.32Å; M754-Y756 VanDerWaalsContact C-N 3.3Å; M754-Y756 PolarHBondContact O-N 2.79Å; Y756-D758 PolarHBondContact O-N 2.78Å; Y756-I759 HydrophobicContact CD1-CD1 3.7Å; Y756-I759 HydrophobicContact CE1-CD1 4.47Å; Y756-I759 WeakPolarHBondContact O-CB 3.31Å; Y756-I759 PolarHBondContact O-N 3.46Å; Y756-I759 VanDerWaalsContact O-N 3.14Å
757	K	57.4	Low	56.7	Low	56 Å²	56	82.6 Å²	82.6	24%	0.243	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-59.2	-44.6	-175.9	-177.8	156.5	169.9	154.1	0	113.7	I753 M754 I759 V760 S787 T789 Y791	I753-K757 WeakPolarHBondContact O-CA 3.43Å; I753-K757 VanDerWaalsContact O-CB 3.28Å; I753-K757 WeakPolarHBondContact O-CB 3.17Å; I753-K757 PolarHBondContact O-N 3.41Å; M754-K757 VanDerWaalsContact O-CB 3.24Å; M754-K757 WeakPolarHBondContact O-CB 3.27Å; M754-K757 PolarHBondContact O-N 3.48Å; K757-I759 PolarHBondContact O-N 2.77Å; K757-I759 VanDerWaalsContact O-N 3.09Å; K757-V760 PolarHBondContact O-N 3.24Å; K757-V760 VanDerWaalsContact O-N 3.1Å; K757-S787 PolarHBondContact NZ-O 2.78Å; K757-T789 HydrophobicContact CD-CG2 4.33Å; K757-T789 HydrophobicContact CG-CG2 4.41Å; K757-T789 PolarHBondContact NZ-OG1 2.83Å; K757-Y791 PolarHBondContact NZ-OH 3.43Å
758	D	50.4	Low	53.9	Low	135 Å²	135	85.2 Å²	85.2	72%	0.722	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-63.2	-18.7	-178.4	-67.7	-23	0	0	0	112.8	Y756 S761	Y756-D758 PolarHBondContact O-N 2.78Å; D758-S761 WeakPolarHBondContact O-CB 3.37Å; D758-S761 PolarHBondContact O-OG 3.44Å
759	I	49.5	Very low	51.1	Low	83 Å²	83	88.5 Å²	88.5	43%	0.426	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-84.9	-15.3	-177.8	-59.9	162.1	0	0	0	111.3	K669 Y756 K757 S761	K669-I759 HydrophobicContact CD-CD1 4.02Å; K669-I759 HydrophobicContact CD-CG2 4.31Å; Y756-I759 HydrophobicContact CD1-CD1 3.7Å; Y756-I759 HydrophobicContact CE1-CD1 4.47Å; Y756-I759 WeakPolarHBondContact O-CB 3.31Å; Y756-I759 PolarHBondContact O-N 3.46Å; Y756-I759 VanDerWaalsContact O-N 3.14Å; K757-I759 PolarHBondContact O-N 2.77Å; K757-I759 VanDerWaalsContact O-N 3.09Å; I759-S761 VanDerWaalsContact C-N 3.26Å; I759-S761 PolarHBondContact O-N 3.32Å
760	V	42.6	Very low	48.3	Very low	80 Å²	80	95.6 Å²	95.6	49%	0.485	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-94.1	33.4	176.4	-161.7	0	0	0	0	111.4	L673 K757	L673-V760 HydrophobicContact CB-CG2 3.91Å; L673-V760 HydrophobicContact CD1-CG2 3.61Å; L673-V760 HydrophobicContact CG-CG2 4.24Å; K757-V760 PolarHBondContact O-N 3.24Å; K757-V760 VanDerWaalsContact O-N 3.1Å
761	S	31.3	Very low	45.6	Very low	85 Å²	85	103 Å²	103	59%	0.594	55%	0.547	S	S	*	.			trans	-101.5	30.5	-175	59.8	0	0	0	0	114.5	D758 I759	D758-S761 WeakPolarHBondContact O-CB 3.37Å; D758-S761 PolarHBondContact O-OG 3.44Å; I759-S761 VanDerWaalsContact C-N 3.26Å; I759-S761 PolarHBondContact O-N 3.32Å
762	N	29.3	Very low	43.2	Very low	152 Å²	152	110.4 Å²	110.4	81%	0.813	58%	0.578	S	S	*	*			trans	-157	96.1	167.2	-100.1	-40.8	0	0	0	113.6	F764	N762-F764 PolarHBondContact O-N 2.87Å
763	P	29.4	Very low	41	Very low	117 Å²	117	118.3 Å²	118.3	76%	0.76	62%	0.619	S	S	*	*			trans	-80.9	94	171.5	32.3	-32.7	0	0	0	111.4
764	F	27.6	Very low	38.7	Very low	178 Å²	178	124.7 Å²	124.7	78%	0.781	65%	0.653	S	S	*	*			trans	62.2	130.6	174.9	-68.6	-96.1	0	0	0	117.3	N762 H766	N762-F764 PolarHBondContact O-N 2.87Å; F764-H766 VanDerWaalsContact C-N 3.33Å; F764-H766 PolarHBondContact O-N 2.83Å
765	P	30.4	Very low	36.6	Very low	128 Å²	128	126.9 Å²	126.9	83%	0.831	66%	0.662	S	S	*	*			trans	-71.2	88.5	164.6	30.5	-32.9	0	0	0	110	Y767	P765-Y767 PolarHBondContact O-N 3.35Å
766	H	32.2	Very low	34.8	Very low	176 Å²	176	133 Å²	133	82%	0.815	69%	0.688	S	S	*	*			trans	-68.2	123.6	-178	-139	75.9	0	0	0	110.8	F764 G768	F764-H766 VanDerWaalsContact C-N 3.33Å; F764-H766 PolarHBondContact O-N 2.83Å; H766-G768 PolarHBondContact O-N 3.2Å
767	Y	31.2	Very low	33	Very low	235 Å²	235	140.2 Å²	140.2	92%	0.922	72%	0.717	S	S	*	*			trans	-80.5	66.2	-171.7	-138.3	-81.5	0	0	0	113.1	P765	P765-Y767 PolarHBondContact O-N 3.35Å
768	G	27.4	Very low	31.5	Very low	60 Å²	60	146.9 Å²	146.9	62%	0.619	74%	0.742	S	S	*	*			trans	75.3	129.3	159.9	0	0	0	0	0	118.1	H766	H766-G768 PolarHBondContact O-N 3.2Å
769	V	28.1	Very low	30.3	Very low	131 Å²	131	144.8 Å²	144.8	79%	0.794	73%	0.731	S	S	*	*				170.9	125.4	129.1	151.1	0	0	0	0	108.1
770	L	28.9	Very low	29.4	Very low	152 Å²	152	147.8 Å²	147.8	80%	0.796	75%	0.748	S	S	*	*			trans	63.7	114.4	179.6	-60.3	164.3	0	0	0	113.5
771	E	27.3	Very low	28.8	Very low	163 Å²	163	153 Å²	153	76%	0.762	76%	0.759	S	S	*	*			cis	56.9	132.6	25.5	-87.4	-161.4	154.4	0	0	116.2
772	H	28.4	Very low	28.6	Very low	165 Å²	165	155.4 Å²	155.4	76%	0.764	76%	0.763	S	S	*	*			trans	63.2	105.5	-171	-50.1	-79.6	0	0	0	113.8
773	I	32.4	Very low	28.6	Very low	172 Å²	172	153.4 Å²	153.4	88%	0.882	76%	0.757	S	S	*	*				-139.6	135.4	68.7	-81.8	162.6	0	0	0	111.7
774	N	25.6	Very low	28.6	Very low	137 Å²	137	154.4 Å²	154.4	73%	0.733	75%	0.752	S	S	*	*			trans	-95	163.7	175.6	-109.2	-51.9	0	0	0	111.5
775	H	27.7	Very low	28.6	Very low	145 Å²	145	152.5 Å²	152.5	67%	0.671	75%	0.749	S	S	*	*			trans	61.2	90.2	152.3	-88	56.9	0	0	0	119.3
776	F	28.4	Very low	28.5	Very low	210 Å²	210	151.5 Å²	151.5	92%	0.921	74%	0.744	S	S	*	*			trans	-156.5	91.5	135.5	-83.9	-68.1	0	0	0	106.3
777	Y	28	Very low	28.5	Very low	184 Å²	184	146.7 Å²	146.7	72%	0.722	73%	0.731	S	S	*	*				62.3	97.1	68.8	-132.7	-99	0	0	0	112.8
778	Y	25.9	Very low	29	Very low	196 Å²	196	142 Å²	142	77%	0.769	72%	0.715	S	S	*	*			trans	59.6	87.8	170.3	-74.7	-104.8	0	0	0	118.9
779	D	25.9	Very low	29.9	Very low	91 Å²	91	141.5 Å²	141.5	49%	0.487	70%	0.7	S	S	.	*				-151.4	130.5	125.3	-154	-30.6	0	0	0	111.1	R781	D779-R781 VanDerWaalsContact CG-NE 3.33Å; D779-R781 PolarHBondContact O-N 3.38Å; D779-R781 IonicContact OD1-CZ 3.37Å; D779-R781 IonicContact OD1-NE 2.69Å; D779-R781 PolarHBondContact OD1-NE 2.92Å; D779-R781 IonicContact OD1-NH2 2.8Å; D779-R781 PolarHBondContact OD1-NH2 2.84Å; D779-R781 IonicContact OD2-CZ 2.69Å; D779-R781 VanDerWaalsContact OD2-CZ 3.32Å; D779-R781 IonicContact OD2-NE 3.5Å; D779-R781 PolarHBondContact OD2-NE 2.96Å; D779-R781 VanDerWaalsContact OD2-NE 3.16Å; D779-R781 IonicContact OD2-NH2 3.16Å; D779-R781 PolarHBondContact OD2-NH2 2.89Å
780	N	29.5	Very low	31.1	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	41.2	-178.5	-74.2	-1.1	0	0	0	111.8
781	R	29.5	Very low	32.5	Very low	190 Å²	190	134.1 Å²	134.1	72%	0.717	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.5	13.2	-170.6	-72.8	-176.2	-77	-166.7	-0.3	114.7	D779	D779-R781 VanDerWaalsContact CG-NE 3.33Å; D779-R781 PolarHBondContact O-N 3.38Å; D779-R781 IonicContact OD1-CZ 3.37Å; D779-R781 IonicContact OD1-NE 2.69Å; D779-R781 PolarHBondContact OD1-NE 2.92Å; D779-R781 IonicContact OD1-NH2 2.8Å; D779-R781 PolarHBondContact OD1-NH2 2.84Å; D779-R781 IonicContact OD2-CZ 2.69Å; D779-R781 VanDerWaalsContact OD2-CZ 3.32Å; D779-R781 IonicContact OD2-NE 3.5Å; D779-R781 PolarHBondContact OD2-NE 2.96Å; D779-R781 VanDerWaalsContact OD2-NE 3.16Å; D779-R781 IonicContact OD2-NH2 3.16Å; D779-R781 PolarHBondContact OD2-NH2 2.89Å
782	I	28.6	Very low	33.9	Very low	135 Å²	135	127.8 Å²	127.8	69%	0.692	63%	0.628	S	S	*	*	S	Bend	trans	-115.3	-19.1	176.6	-61.9	-178.6	0	0	0	112	E784 L785	I782-E784 PolarHBondContact O-N 3.5Å; I782-L785 PolarHBondContact O-N 2.93Å
783	T	27.6	Very low	35.6	Very low	111 Å²	111	123.1 Å²	123.1	68%	0.681	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-11.3	175.5	39	0	0	0	0	114.9
784	E	30.4	Very low	37.2	Very low	138 Å²	138	115.9 Å²	115.9	65%	0.645	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-5.3	174.4	-64.9	-167.1	150	0	0	113.9	I782 R842	I782-E784 PolarHBondContact O-N 3.5Å; E784-R842 IonicContact OE2-NH2 3.32Å
785	L	27.5	Very low	39.4	Very low	138 Å²	138	110.9 Å²	110.9	72%	0.723	55%	0.546	S	S	*	.	S	Bend	trans	-107.4	-7.4	-175.2	-129.7	72.5	0	0	0	115	I782	I782-L785 PolarHBondContact O-N 2.93Å
786	S	27.7	Very low	41.9	Very low	106 Å²	106	104 Å²	104	74%	0.741	51%	0.514	S	S	*	.	S	Bend	trans	-100.2	10.8	-171.1	59.6	0	0	0	0	115.5
787	S	32.5	Very low	44.5	Very low	75 Å²	75	95.1 Å²	95.1	52%	0.524	48%	0.476	S	S	.	.			trans	-117.2	11.7	-178.8	62.1	0	0	0	0	114.6	K757 T789	K757-S787 PolarHBondContact NZ-O 2.78Å; S787-T789 PolarHBondContact O-N 3.08Å
788	K	42.1	Very low	47.1	Very low	138 Å²	138	86.5 Å²	86.5	60%	0.6	44%	0.442	S	S	*	.			trans	-70.2	64.8	171.4	-72.2	-167.7	174.1	-170.6	0	112.1	N790	K788-N790 PolarHBondContact O-N 3.19Å
789	T	45.6	Very low	49.8	Very low	48 Å²	48	79.5 Å²	79.5	29%	0.294	42%	0.418	S	S	.	.			trans	-58.7	122.4	155.8	49.8	0	0	0	0	107.4	K757 S787 Y791	K757-T789 HydrophobicContact CD-CG2 4.33Å; K757-T789 HydrophobicContact CG-CG2 4.41Å; K757-T789 PolarHBondContact NZ-OG1 2.83Å; S787-T789 PolarHBondContact O-N 3.08Å; T789-Y791 VanDerWaalsContact C-N 3.29Å; T789-Y791 WeakPolarHBondContact O-CD2 3.48Å; T789-Y791 PolarHBondContact O-N 2.65Å; T789-Y791 WeakPolarHBondContact OG1-CE2 3.41Å
790	N	53.5	Low	52.5	Low	93 Å²	93	75.7 Å²	75.7	50%	0.497	40%	0.397	S	S	.	.			trans	-81.6	80.2	-177.6	-157.5	2.3	0	0	0	109.1	K788 S792 I793	K788-N790 PolarHBondContact O-N 3.19Å; N790-S792 PolarHBondContact O-N 3.46Å; N790-I793 HydrophobicContact CB-CD1 4.29Å; N790-I793 HydrophobicContact CB-CG1 4.31Å; N790-I793 WeakPolarHBondContact ND2-CD1 3.47Å; N790-I793 PolarHBondContact O-N 3.45Å
791	Y	58.2	Low	55.1	Low	35 Å²	35	71.3 Å²	71.3	14%	0.137	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-47.9	-35.5	-177.3	-70.4	-96.9	0	0	0	111.9	R749 I753 M754 K757 T789 I793 I794 I865	R749-Y791 PolarHBondContact NH1-O 2.77Å; I753-Y791 HydrophobicContact CB-CD1 4.08Å; I753-Y791 HydrophobicContact CB-CE1 4.23Å; I753-Y791 HydrophobicContact CD1-CD1 4.42Å; I753-Y791 HydrophobicContact CG2-CD1 3.48Å; I753-Y791 VanDerWaalsContact CG2-CD1 3.48Å; I753-Y791 HydrophobicContact CG2-CE1 3.6Å; M754-Y791 HydrophobicContact CG-CE1 4.1Å; K757-Y791 PolarHBondContact NZ-OH 3.43Å; T789-Y791 VanDerWaalsContact C-N 3.29Å; T789-Y791 WeakPolarHBondContact O-CD2 3.48Å; T789-Y791 PolarHBondContact O-N 2.65Å; T789-Y791 WeakPolarHBondContact OG1-CE2 3.41Å; Y791-I793 PolarHBondContact O-N 2.89Å; Y791-I793 VanDerWaalsContact O-N 3.16Å; Y791-I794 PolarHBondContact O-N 2.8Å; Y791-I865 VanDerWaalsContact CB-O 3.23Å; Y791-I865 WeakPolarHBondContact CB-O 3.32Å
792	S	57	Low	57.9	Low	31 Å²	31	62.3 Å²	62.3	22%	0.217	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-71.9	-1.4	-179.2	-38	0	0	0	0	116.3	N790 D866	N790-S792 PolarHBondContact O-N 3.46Å; S792-D866 WeakPolarHBondContact CB-O 3.34Å; S792-D866 PolarHBondContact OG-O 2.7Å
793	I	63.8	Low	60.8	Low	67 Å²	67	56.2 Å²	56.2	34%	0.344	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-110.1	-9.5	171.6	-54.2	-174.4	0	0	0	111	S675 F676 N790 Y791	S675-I793 WeakPolarHBondContact CA-O 3.35Å; S675-I793 WeakPolarHBondContact OG-CG2 3.16Å; F676-I793 PolarHBondContact N-O 2.65Å; F676-I793 VanDerWaalsContact N-O 3.09Å; N790-I793 HydrophobicContact CB-CD1 4.29Å; N790-I793 HydrophobicContact CB-CG1 4.31Å; N790-I793 WeakPolarHBondContact ND2-CD1 3.47Å; N790-I793 PolarHBondContact O-N 3.45Å; Y791-I793 PolarHBondContact O-N 2.89Å; Y791-I793 VanDerWaalsContact O-N 3.16Å
794	I	66.2	Low	63.8	Low	19 Å²	19	50.9 Å²	50.9	10%	0.097	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.2	-171.9	-60.8	174.1	0	0	0	110.4	L673 A674 R749 I753 Y791	L673-I794 HydrophobicContact CB-CG2 3.79Å; L673-I794 HydrophobicContact CD1-CG2 4.44Å; L673-I794 HydrophobicContact CD2-CG2 3.99Å; L673-I794 HydrophobicContact CG-CG2 4.28Å; A674-I794 CarbonylContact O-C 3.57Å; A674-I794 WeakPolarHBondContact O-CA 3.41Å; R749-I794 PolarHBondContact NH1-O 2.77Å; I753-I794 HydrophobicContact CD1-CB 4.25Å; I753-I794 HydrophobicContact CD1-CG2 4.11Å; I753-I794 HydrophobicContact CG1-CG2 4.14Å; I753-I794 HydrophobicContact CG2-CG2 4.48Å; Y791-I794 PolarHBondContact O-N 2.8Å
795	T	72.9	Confident	66.7	Low	33 Å²	33	45.4 Å²	45.4	20%	0.202	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.7	169	-53.6	0	0	0	0	108.5	A674 F676 H821 V822	A674-T795 PolarHBondContact N-O 2.76Å; A674-T795 PolarHBondContact O-N 3.33Å; F676-T795 WeakPolarHBondContact CD2-OG1 3.27Å; F676-T795 HydrophobicContact CE2-CG2 4.47Å; T795-H821 HydrophobicContact CG2-CB 4.31Å; T795-V822 WeakPolarHBondContact CG2-O 3.37Å
796	P	79.8	Confident	69.8	Low	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	136.8	169.8	-17.7	31.3	0	0	0	110.9	L673 R749 L752 I753 V822	L673-P796 HydrophobicContact CD2-CB 3.9Å; L673-P796 HydrophobicContact CD2-CG 4.07Å; R749-P796 HydrophobicContact CG-CG 3.74Å; L752-P796 HydrophobicContact CD1-CB 4.4Å; I753-P796 HydrophobicContact CD1-CG 4.14Å; I753-P796 HydrophobicContact CG1-CG 3.77Å; P796-V822 HydrophobicContact CB-CB 4.02Å; P796-V822 HydrophobicContact CB-CG2 4.06Å; P796-V822 HydrophobicContact CG-CB 4.14Å; P796-V822 PolarHBondContact O-N 2.9Å
797	I	82.3	Confident	72.8	Confident	24 Å²	24	38.2 Å²	38.2	12%	0.123	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.7	171	-53.2	-179.6	0	0	0	107.4	Y672 A674 L799 H819 I820 H821	Y672-I797 PolarHBondContact N-O 3.37Å; Y672-I797 PolarHBondContact O-N 2.73Å; A674-I797 HydrophobicContact CB-CD1 3.61Å; A674-I797 HydrophobicContact CB-CG1 4.1Å; I797-L799 HydrophobicContact CG2-CD2 3.82Å; I797-H819 HydrophobicContact CG2-CB 4.02Å; I797-I820 WeakPolarHBondContact CA-O 3.46Å; I797-H821 VanDerWaalsContact CD1-CE1 3.41Å; I797-H821 WeakPolarHBondContact CD1-CE1 3.12Å
798	I	82.7	Confident	75.3	Confident	2 Å²	2	35 Å²	35	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126	171.2	-55.5	157	0	0	0	107.1	Q670 V671 P713 F715 I747 L752 L800 I820 V822	Q670-I798 CarbonylContact O-C 3.23Å; Q670-I798 WeakPolarHBondContact O-CA 3.28Å; V671-I798 HydrophobicContact CG2-CG1 4.23Å; P713-I798 HydrophobicContact CB-CD1 4.22Å; P713-I798 HydrophobicContact CG-CD1 3.64Å; P713-I798 HydrophobicContact CG-CG1 4.24Å; P713-I798 HydrophobicContact CG-CG2 4.49Å; F715-I798 HydrophobicContact CE2-CD1 4.25Å; F715-I798 HydrophobicContact CE2-CG2 4.02Å; F715-I798 HydrophobicContact CZ-CD1 3.97Å; I747-I798 HydrophobicContact CD1-CD1 3.73Å; L752-I798 HydrophobicContact CD1-CD1 4.45Å; I798-L800 HydrophobicContact CG2-CD2 4.09Å; I798-I820 HydrophobicContact CB-CB 4.25Å; I798-I820 PolarHBondContact N-O 2.98Å; I798-I820 PolarHBondContact O-N 3.03Å; I798-V822 HydrophobicContact CD1-CG2 3.9Å; I798-V822 HydrophobicContact CG1-CG2 4.39Å
799	L	81.8	Confident	77.3	Confident	49 Å²	49	35.6 Å²	35.6	26%	0.257	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112.8	174.7	-62.1	-168	0	0	0	109.4	Q670 Y672 I797 I818 H819	Q670-L799 PolarHBondContact O-N 3Å; Y672-L799 HydrophobicContact CD2-CB 4.31Å; Y672-L799 HydrophobicContact CD2-CD1 3.53Å; Y672-L799 HydrophobicContact CD2-CG 3.63Å; Y672-L799 HydrophobicContact CE2-CB 4.23Å; Y672-L799 HydrophobicContact CE2-CD1 3.44Å; Y672-L799 VanDerWaalsContact CE2-CD1 3.44Å; Y672-L799 HydrophobicContact CE2-CG 3.87Å; Y672-L799 HydrophobicContact CG-CD1 4.33Å; I797-L799 HydrophobicContact CG2-CD2 3.82Å; L799-I818 WeakPolarHBondContact CA-O 3.47Å; L799-H819 HydrophobicContact CD2-CB 4.05Å; L799-H819 WeakPolarHBondContact CD2-CD2 3.49Å
800	L	83.5	Confident	79.2	Confident	11 Å²	11	36 Å²	36	6%	0.058	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127	167.5	-56.7	-176.2	0	0	0	108.9	F715 L741 I798 S817 I818 I820	F715-L800 HydrophobicContact CB-CD1 3.87Å; F715-L800 HydrophobicContact CD1-CD1 4.18Å; F715-L800 HydrophobicContact CD2-CD1 3.79Å; F715-L800 HydrophobicContact CD2-CD2 3.84Å; F715-L800 HydrophobicContact CD2-CG 4.34Å; F715-L800 HydrophobicContact CE2-CD1 4.35Å; F715-L800 HydrophobicContact CE2-CD2 4.22Å; F715-L800 HydrophobicContact CG-CD1 3.68Å; L741-L800 HydrophobicContact CD1-CD1 3.83Å; L741-L800 HydrophobicContact CD2-CD1 3.99Å; I798-L800 HydrophobicContact CG2-CD2 4.09Å; L800-S817 WeakPolarHBondContact O-CA 3.45Å; L800-I818 PolarHBondContact N-O 3.36Å; L800-I818 PolarHBondContact O-N 2.8Å; L800-I820 HydrophobicContact CD1-CD1 3.68Å; L800-I820 HydrophobicContact CG-CD1 3.95Å
801	L	85	Confident	80.9	Confident	55 Å²	55	37.2 Å²	37.2	29%	0.288	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.2	167.1	-171.6	61.2	0	0	0	108	E663 H815	E663-L801 HydrophobicContact CB-CB 4.3Å; E663-L801 HydrophobicContact CB-CD2 4.43Å; E663-L801 HydrophobicContact CB-CG 4.3Å; E663-L801 HydrophobicContact CG-CD2 4.45Å; E663-L801 PolarHBondContact N-O 2.79Å; E663-L801 WeakPolarHBondContact OE2-CD2 3.43Å; E663-L801 WeakPolarHBondContact OE2-CG 3.47Å; L801-H815 HydrophobicContact CD1-CB 4.03Å
802	I	87.6	Confident	82.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.5	178.5	-60.8	-178.6	0	0	0	107.8	Y623 F645 V660 Q661 L717 H815 V816 I818	Y623-I802 PolarHBondContact OH-O 2.82Å; F645-I802 HydrophobicContact CE1-CD1 3.79Å; F645-I802 HydrophobicContact CZ-CD1 3.55Å; F645-I802 HydrophobicContact CZ-CG2 4.26Å; V660-I802 HydrophobicContact CG1-CG2 3.72Å; Q661-I802 WeakPolarHBondContact O-CA 3.48Å; L717-I802 HydrophobicContact CD1-CD1 3.91Å; L717-I802 HydrophobicContact CD1-CG1 4.11Å; L717-I802 HydrophobicContact CD1-CG2 3.84Å; L717-I802 HydrophobicContact CD2-CD1 3.81Å; L717-I802 HydrophobicContact CG-CD1 4.44Å; I802-H815 CarbonylContact O-C 3.58Å; I802-H815 VanDerWaalsContact O-CA 3.27Å; I802-H815 WeakPolarHBondContact O-CA 3.5Å; I802-V816 HydrophobicContact CB-CG1 4.09Å; I802-V816 PolarHBondContact N-O 2.88Å; I802-V816 PolarHBondContact O-N 2.88Å; I802-I818 HydrophobicContact CD1-CD1 3.45Å; I802-I818 VanDerWaalsContact CD1-CD1 3.45Å; I802-I818 HydrophobicContact CD1-CG1 3.79Å; I802-I818 HydrophobicContact CG1-CG1 4.48Å
803	S	89.6	Confident	84	Confident	7 Å²	7	38.7 Å²	38.7	5%	0.049	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.6	172.4	177.8	0	0	0	0	109.2	Q661	Q661-S803 PolarHBondContact N-O 3.37Å; Q661-S803 PolarHBondContact O-N 3.49Å
804	A	91.1	Very high	85.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.2	167.1	0	0	0	0	0	109.1	P621 Y623 I647 V659 V660 S813 E814	P621-A804 HydrophobicContact CB-CB 4.15Å; Y623-A804 VanDerWaalsContact OH-CB 3.26Å; Y623-A804 WeakPolarHBondContact OH-CB 3.27Å; Y623-A804 PolarHBondContact OH-N 2.76Å; Y623-A804 VanDerWaalsContact OH-N 3.1Å; I647-A804 HydrophobicContact CD1-CB 3.67Å; I647-A804 HydrophobicContact CG2-CB 4.32Å; V659-A804 WeakPolarHBondContact O-CA 3.21Å; V660-A804 HydrophobicContact CG1-CB 4.46Å; V660-A804 HydrophobicContact CG2-CB 4.19Å; A804-S813 VanDerWaalsContact O-CA 3.25Å; A804-S813 WeakPolarHBondContact O-CA 3.41Å; A804-E814 PolarHBondContact N-O 3.05Å; A804-E814 PolarHBondContact O-N 3.27Å
805	H	91.4	Very high	86.4	Confident	22 Å²	22	42.6 Å²	42.6	10%	0.102	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.7	-178.8	60.1	-116.9	0	0	0	111.5	L658 V659 K811 L812	L658-H805 WeakPolarHBondContact CA-O 3.26Å; V659-H805 WeakPolarHBondContact CB-NE2 3.13Å; V659-H805 PolarHBondContact N-O 2.78Å; V659-H805 PolarHBondContact O-N 3.2Å; H805-K811 WeakPolarHBondContact CD2-CE 3.3Å; H805-K811 PolarHBondContact CD2-NZ 3.12Å; H805-K811 PolarHBondContact NE2-NZ 3.39Å; H805-L812 WeakPolarHBondContact CA-O 3.32Å; H805-L812 WeakPolarHBondContact CB-O 3.14Å
806	D	92	Very high	87.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.			trans	-77.8	-172.8	177.9	63.4	54.7	0	0	0	113.8	N617 N655 G808 K811 L812	N617-D806 PolarHBondContact ND2-OD2 3.49Å; N617-D806 PolarHBondContact OD1-OD2 2.6Å; N655-D806 WeakPolarHBondContact O-CB 3.28Å; D806-G808 PolarHBondContact OD1-N 3.44Å; D806-K811 WeakPolarHBondContact O-CE 3.37Å; D806-K811 VanDerWaalsContact OD1-CA 3.28Å; D806-K811 WeakPolarHBondContact OD1-CA 3.32Å; D806-K811 WeakPolarHBondContact OD1-CG 3.2Å; D806-L812 PolarHBondContact N-O 3.48Å; D806-L812 PolarHBondContact OD1-N 3.09Å; D806-L812 VanDerWaalsContact OD2-CA 3.24Å; D806-L812 WeakPolarHBondContact OD2-CA 3.28Å; D806-L812 WeakPolarHBondContact OD2-CB 3.35Å; D806-L812 PolarHBondContact OD2-N 3.13Å
807	K	89.8	Confident	87.4	Confident	94 Å²	94	42.9 Å²	42.9	41%	0.409	22%	0.223	S	C	.	.	S	Bend	trans	-121.8	22.3	167.7	-61.1	175.6	-161.9	-180	0	112.3	K654 E657 V659	K654-K807 CarbonylContact O-C 3.56Å; K654-K807 PolarHBondContact O-N 3.39Å; E657-K807 HydrophobicContact CB-CD 4.15Å; E657-K807 HydrophobicContact CG-CD 4.27Å; E657-K807 WeakPolarHBondContact O-CE 3.33Å; E657-K807 WeakPolarHBondContact O-CG 3.38Å; E657-K807 IonicContact OE1-NZ 3.22Å; E657-K807 PolarHBondContact OE1-NZ 3.17Å; E657-K807 WeakPolarHBondContact OE2-CD 3.3Å; E657-K807 IonicContact OE2-NZ 3.93Å; E657-K807 PolarHBondContact OE2-NZ 2.71Å; V659-K807 HydrophobicContact CG2-CD 4.5Å; V659-K807 HydrophobicContact CG2-CG 4.39Å
808	G	85.3	Confident	87.7	Confident	8 Å²	8	41.8 Å²	41.8	8%	0.082	22%	0.217	C	C	.	.	S	Bend	trans	-84.6	-171.7	178.8	0	0	0	0	0	114	N617 N655 D806 P810	N617-G808 VanDerWaalsContact OD1-CA 3.29Å; N617-G808 WeakPolarHBondContact OD1-CA 3.2Å; N655-G808 WeakPolarHBondContact OD1-CA 3.22Å; D806-G808 PolarHBondContact OD1-N 3.44Å; G808-P810 CarbonylContact C-O 3.53Å
809	I	83.4	Confident	87.9	Confident	150 Å²	150	43.2 Å²	43.2	77%	0.769	22%	0.224	S	C	*	.	S	Bend	trans	-143.7	107.5	-178.3	-54.2	-179	0	0	0	108.6
810	P	87.5	Confident	88.3	Confident	56 Å²	56	40.9 Å²	40.9	36%	0.364	21%	0.212	S	C	.	.	S	Bend	cis	-62.9	155.9	-0.1	31.2	-38.4	0	0	0	111.8	Y616 N617 G808	Y616-P810 WeakPolarHBondContact OH-CD 3.26Å; N617-P810 PolarHBondContact ND2-O 3.02Å; G808-P810 CarbonylContact C-O 3.53Å
811	K	88.1	Confident	88.4	Confident	119 Å²	119	41.7 Å²	41.7	52%	0.517	22%	0.215	S	C	.	.			trans	-85.4	123.5	173.2	177.2	178.5	-178.9	178.1	0	109.7	H805 D806	H805-K811 WeakPolarHBondContact CD2-CE 3.3Å; H805-K811 PolarHBondContact CD2-NZ 3.12Å; H805-K811 PolarHBondContact NE2-NZ 3.39Å; D806-K811 WeakPolarHBondContact O-CE 3.37Å; D806-K811 VanDerWaalsContact OD1-CA 3.28Å; D806-K811 WeakPolarHBondContact OD1-CA 3.32Å; D806-K811 WeakPolarHBondContact OD1-CG 3.2Å
812	L	90.7	Very high	88.6	Confident	41 Å²	41	39.1 Å²	39.1	22%	0.215	20%	0.202	C	C	.	.			trans	-104.3	162	174.8	-54.3	177	0	0	0	111	N617 D618 H805 D806	N617-L812 WeakPolarHBondContact ND2-CD1 3.47Å; N617-L812 WeakPolarHBondContact ND2-CG 3.24Å; D618-L812 VanDerWaalsContact C-CD1 3.47Å; D618-L812 WeakPolarHBondContact O-CD1 3.39Å; H805-L812 WeakPolarHBondContact CA-O 3.32Å; H805-L812 WeakPolarHBondContact CB-O 3.14Å; D806-L812 PolarHBondContact N-O 3.48Å; D806-L812 PolarHBondContact OD1-N 3.09Å; D806-L812 VanDerWaalsContact OD2-CA 3.24Å; D806-L812 WeakPolarHBondContact OD2-CA 3.28Å; D806-L812 WeakPolarHBondContact OD2-CB 3.35Å; D806-L812 PolarHBondContact OD2-N 3.13Å
813	S	90.3	Very high	88.6	Confident	55 Å²	55	42.5 Å²	42.5	39%	0.385	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	139.5	-174.5	59.2	0	0	0	0	111.2	A804	A804-S813 VanDerWaalsContact O-CA 3.25Å; A804-S813 WeakPolarHBondContact O-CA 3.41Å
814	E	90.3	Very high	88.6	Confident	93 Å²	93	44 Å²	44	44%	0.435	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	161.5	174.6	-169.9	58.4	-154.7	0	0	109.4	P621 Y623 A804	P621-E814 WeakPolarHBondContact O-CB 3.45Å; Y623-E814 HydrophobicContact CD2-CB 4.42Å; Y623-E814 HydrophobicContact CD2-CG 3.93Å; Y623-E814 HydrophobicContact CE2-CB 3.94Å; Y623-E814 HydrophobicContact CE2-CG 3.85Å; Y623-E814 PolarHBondContact OH-O 3.22Å; A804-E814 PolarHBondContact N-O 3.05Å; A804-E814 PolarHBondContact O-N 3.27Å
815	H	88.5	Confident	88.5	Confident	76 Å²	76	48.7 Å²	48.7	35%	0.352	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.9	-177.3	-55.7	-120.6	0	0	0	111.1	E663 L801 I802	E663-H815 IonicContact OE1-CE1 2.73Å; E663-H815 IonicContact OE1-ND1 3.22Å; E663-H815 IonicContact OE2-CE1 2.83Å; E663-H815 PolarHBondContact OE2-CE1 3.4Å; E663-H815 VanDerWaalsContact OE2-CE1 3.22Å; E663-H815 IonicContact OE2-ND1 2.72Å; E663-H815 PolarHBondContact OE2-ND1 2.98Å; L801-H815 HydrophobicContact CD1-CB 4.03Å; I802-H815 CarbonylContact O-C 3.58Å; I802-H815 VanDerWaalsContact O-CA 3.27Å; I802-H815 WeakPolarHBondContact O-CA 3.5Å
816	V	88	Confident	88.4	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.8	174.7	73.9	0	0	0	0	111.5	Y623 F628 I802	Y623-V816 HydrophobicContact CD1-CB 3.84Å; Y623-V816 HydrophobicContact CD1-CG1 3.54Å; Y623-V816 HydrophobicContact CD1-CG2 4.41Å; Y623-V816 HydrophobicContact CD2-CB 3.86Å; Y623-V816 HydrophobicContact CD2-CG1 4.38Å; Y623-V816 HydrophobicContact CE1-CB 3.86Å; Y623-V816 HydrophobicContact CE1-CG1 3.28Å; Y623-V816 HydrophobicContact CE2-CB 3.9Å; Y623-V816 HydrophobicContact CE2-CG1 4.18Å; Y623-V816 HydrophobicContact CG-CB 3.81Å; Y623-V816 HydrophobicContact CG-CG1 4.07Å; Y623-V816 HydrophobicContact CG-CG2 4.26Å; F628-V816 HydrophobicContact CD2-CG1 4.33Å; F628-V816 HydrophobicContact CD2-CG2 3.88Å; F628-V816 HydrophobicContact CE2-CG1 4.28Å; F628-V816 HydrophobicContact CE2-CG2 3.87Å; I802-V816 HydrophobicContact CB-CG1 4.09Å; I802-V816 PolarHBondContact N-O 2.88Å; I802-V816 PolarHBondContact O-N 2.88Å
817	S	86.8	Confident	88.3	Confident	36 Å²	36	50.7 Å²	50.7	25%	0.252	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	135.7	169.9	60.7	0	0	0	0	111.3	Y627 F628 L800 H819	Y627-S817 CarbonylContact C-O 3.6Å; Y627-S817 VanDerWaalsContact CA-O 3.24Å; Y627-S817 WeakPolarHBondContact CA-O 3.33Å; Y627-S817 WeakPolarHBondContact CB-O 3.3Å; Y627-S817 WeakPolarHBondContact CB-OG 3.47Å; F628-S817 PolarHBondContact N-O 2.83Å; L800-S817 WeakPolarHBondContact O-CA 3.45Å; S817-H819 PolarHBondContact OG-NE2 3.12Å
818	I	88.4	Confident	88.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.4	169.2	-57.7	-154	0	0	0	108.7	F628 F630 F645 L741 L799 L800 I802 I820	F628-I818 HydrophobicContact CB-CD1 4.15Å; F628-I818 HydrophobicContact CB-CG1 4.12Å; F628-I818 HydrophobicContact CB-CG2 4.46Å; F628-I818 HydrophobicContact CD2-CD1 4.14Å; F628-I818 HydrophobicContact CD2-CG1 4.23Å; F628-I818 HydrophobicContact CG-CD1 4.47Å; F628-I818 CarbonylContact O-C 3.31Å; F628-I818 WeakPolarHBondContact O-CA 3.35Å; F630-I818 HydrophobicContact CD2-CG2 3.43Å; F630-I818 VanDerWaalsContact CD2-CG2 3.43Å; F630-I818 HydrophobicContact CE2-CD1 3.82Å; F630-I818 HydrophobicContact CE2-CG2 3.67Å; F630-I818 HydrophobicContact CG-CG2 4.34Å; F630-I818 HydrophobicContact CZ-CD1 4.47Å; F645-I818 HydrophobicContact CD1-CD1 3.59Å; F645-I818 HydrophobicContact CE1-CD1 3.47Å; F645-I818 VanDerWaalsContact CE1-CD1 3.47Å; F645-I818 HydrophobicContact CG-CD1 4.31Å; F645-I818 HydrophobicContact CZ-CD1 4.1Å; L741-I818 HydrophobicContact CD2-CG2 4.19Å; L799-I818 WeakPolarHBondContact CA-O 3.47Å; L800-I818 PolarHBondContact N-O 3.36Å; L800-I818 PolarHBondContact O-N 2.8Å; I802-I818 HydrophobicContact CD1-CD1 3.45Å; I802-I818 VanDerWaalsContact CD1-CD1 3.45Å; I802-I818 HydrophobicContact CD1-CG1 3.79Å; I802-I818 HydrophobicContact CG1-CG1 4.48Å; I818-I820 HydrophobicContact CG2-CG1 4.05Å
819	H	88	Confident	88.5	Confident	32 Å²	32	50.2 Å²	50.2	15%	0.148	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	107.6	-174.6	-58.8	-175.6	0	0	0	108	Y627 F628 E629 F630 I797 L799 S817	Y627-H819 AromaticContact CD2-CE1 3.84Å; Y627-H819 AromaticContact CD2-ND1 3.89Å; F628-H819 PolarHBondContact O-N 2.92Å; E629-H819 WeakPolarHBondContact CA-O 3.34Å; E629-H819 HydrophobicContact CG-CB 4.11Å; F630-H819 PolarHBondContact N-O 2.79Å; I797-H819 HydrophobicContact CG2-CB 4.02Å; L799-H819 HydrophobicContact CD2-CB 4.05Å; L799-H819 WeakPolarHBondContact CD2-CD2 3.49Å; S817-H819 PolarHBondContact OG-NE2 3.12Å
820	I	88.2	Confident	88.9	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	105.8	-175.6	-48	168.8	0	0	0	108.5	F630 I632 V642 F715 L741 I797 I798 L800 I818	F630-I820 WeakPolarHBondContact O-CA 3.28Å; I632-I820 HydrophobicContact CB-CG2 4.25Å; I632-I820 HydrophobicContact CG2-CG2 3.82Å; V642-I820 HydrophobicContact CG1-CD1 4.27Å; V642-I820 HydrophobicContact CG1-CG1 4.36Å; V642-I820 HydrophobicContact CG1-CG2 3.81Å; F715-I820 HydrophobicContact CD1-CD1 4.18Å; F715-I820 HydrophobicContact CE1-CD1 3.58Å; F715-I820 HydrophobicContact CE2-CD1 4.2Å; F715-I820 HydrophobicContact CZ-CD1 3.6Å; L741-I820 HydrophobicContact CD2-CD1 3.86Å; I797-I820 WeakPolarHBondContact CA-O 3.46Å; I798-I820 HydrophobicContact CB-CB 4.25Å; I798-I820 PolarHBondContact N-O 2.98Å; I798-I820 PolarHBondContact O-N 3.03Å; L800-I820 HydrophobicContact CD1-CD1 3.68Å; L800-I820 HydrophobicContact CG-CD1 3.95Å; I818-I820 HydrophobicContact CG2-CG1 4.05Å
821	H	87.2	Confident	89	Confident	28 Å²	28	48.2 Å²	48.2	13%	0.13	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.5	177.1	-66.5	-108.5	0	0	0	109.9	F630 T631 I632 T795 I797	F630-H821 PolarHBondContact O-N 2.72Å; T631-H821 WeakPolarHBondContact CA-O 3.36Å; T631-H821 HydrophobicContact CG2-CB 4.34Å; I632-H821 PolarHBondContact N-O 2.97Å; T795-H821 HydrophobicContact CG2-CB 4.31Å; I797-H821 VanDerWaalsContact CD1-CE1 3.41Å; I797-H821 WeakPolarHBondContact CD1-CE1 3.12Å
822	V	87.7	Confident	89.1	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.5	173.5	-175.9	0	0	0	0	109	I632 E634 I747 R749 L752 T795 P796 I798	I632-V822 HydrophobicContact CG2-CG2 4.32Å; I632-V822 CarbonylContact O-C 3.58Å; I632-V822 WeakPolarHBondContact O-CA 3.5Å; E634-V822 HydrophobicContact CB-CG1 4.42Å; I747-V822 HydrophobicContact CD1-CG2 4.34Å; I747-V822 HydrophobicContact CG2-CG1 3.62Å; I747-V822 HydrophobicContact CG2-CG2 4.17Å; R749-V822 HydrophobicContact CB-CG1 3.99Å; R749-V822 HydrophobicContact CG-CG1 3.94Å; L752-V822 HydrophobicContact CD1-CG2 4.03Å; T795-V822 WeakPolarHBondContact CG2-O 3.37Å; P796-V822 HydrophobicContact CB-CB 4.02Å; P796-V822 HydrophobicContact CB-CG2 4.06Å; P796-V822 HydrophobicContact CG-CB 4.14Å; P796-V822 PolarHBondContact O-N 2.9Å; I798-V822 HydrophobicContact CD1-CG2 3.9Å; I798-V822 HydrophobicContact CG1-CG2 4.39Å
823	L	88.3	Confident	88.9	Confident	72 Å²	72	44.2 Å²	44.2	38%	0.377	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	146.5	178.1	-56.1	-178.1	0	0	0	110.9	T631 I632 T633 E634	T631-L823 HydrophobicContact CG2-CD1 4.3Å; I632-L823 PolarHBondContact O-N 2.94Å; T633-L823 WeakPolarHBondContact CA-O 3.32Å; T633-L823 HydrophobicContact CG2-CB 4.23Å; E634-L823 PolarHBondContact N-O 3.35Å
824	D	88.9	Confident	88.7	Confident	37 Å²	37	44 Å²	44	20%	0.198	21%	0.214	C	C	.	.			trans	-82.5	138.5	-173.5	-177.1	92.5	0	0	0	112.8	E634 R749 D866 A867 N870	E634-D824 VanDerWaalsContact OE1-CA 3.27Å; E634-D824 WeakPolarHBondContact OE1-CA 3.47Å; R749-D824 IonicContact CZ-OD1 2.71Å; R749-D824 IonicContact NE-OD1 3.47Å; R749-D824 PolarHBondContact NE-OD1 3.48Å; R749-D824 IonicContact NH1-OD1 3.49Å; R749-D824 IonicContact NH2-OD1 3.46Å; R749-D824 PolarHBondContact NH2-OD1 2.87Å; D824-D866 WeakPolarHBondContact OD1-CA 3.37Å; D824-A867 HydrophobicContact CB-CB 3.84Å; D824-A867 VanDerWaalsContact CG-CB 3.48Å; D824-A867 VanDerWaalsContact OD1-CB 3.29Å; D824-A867 WeakPolarHBondContact OD1-CB 3.41Å; D824-A867 PolarHBondContact OD1-N 3.13Å; D824-A867 PolarHBondContact OD2-N 3.34Å; D824-N870 WeakPolarHBondContact OD2-CB 3.08Å; D824-N870 PolarHBondContact OD2-ND2 3.42Å
825	E	89.1	Confident	88.6	Confident	99 Å²	99	39.6 Å²	39.6	46%	0.463	19%	0.193	S	C	.	.			trans	-115.1	151.1	167.7	-172.8	167.4	-162.9	0	0	110.2	E634 D827	E634-E825 HydrophobicContact CG-CB 4.04Å; E634-E825 PolarHBondContact OE1-N 3.41Å; E825-D827 PolarHBondContact O-N 2.72Å
826	N	90.7	Very high	88.3	Confident	14 Å²	14	37.3 Å²	37.3	8%	0.075	18%	0.183	C	C	.	.	S	Bend	trans	-75.7	80.1	176.9	-157.6	47.5	0	0	0	109.2	D866 N870 D917 P921 R923	N826-D866 WeakPolarHBondContact CA-OD2 3.11Å; N826-D866 PolarHBondContact OD1-OD2 2.91Å; N826-N870 HydrophobicContact CB-CB 4.13Å; N826-N870 PolarHBondContact N-ND2 2.81Å; N826-N870 WeakPolarHBondContact OD1-CA 3.4Å; N826-N870 WeakPolarHBondContact OD1-CB 3.45Å; N826-D917 PolarHBondContact ND2-OD2 3.17Å; N826-D917 PolarHBondContact OD1-OD2 2.92Å; N826-P921 PolarHBondContact ND2-O 3.13Å; N826-R923 PolarHBondContact O-NE 2.98Å; N826-R923 PolarHBondContact O-NH2 3.02Å
827	D	89.4	Confident	87.8	Confident	50 Å²	50	41.1 Å²	41.1	27%	0.267	21%	0.208	S	C	.	.			trans	-106.8	-33.1	-163.2	167	-77.7	0	0	0	111.8	N635 E825 D866 R923	N635-D827 PolarHBondContact ND2-OD2 3.09Å; E825-D827 PolarHBondContact O-N 2.72Å; D827-D866 PolarHBondContact N-OD2 3.32Å; D827-R923 VanDerWaalsContact CA-NH2 3.34Å; D827-R923 PolarHBondContact O-NH1 2.82Å; D827-R923 PolarHBondContact O-NH2 2.96Å; D827-R923 VanDerWaalsContact O-NH2 3.13Å
828	N	88.3	Confident	87.4	Confident	46 Å²	46	45.3 Å²	45.3	25%	0.246	23%	0.232	C	C	.	.	S	Bend	trans	-96.4	-152.7	179.3	-66.5	-84.2	0	0	0	111.9	I865 D866 R923	N828-I865 HydrophobicContact CB-CD1 4.2Å; N828-I865 HydrophobicContact CB-CG1 3.77Å; N828-D866 WeakPolarHBondContact CB-OD1 3Å; N828-D866 PolarHBondContact N-OD1 2.87Å; N828-D866 PolarHBondContact N-OD2 2.89Å; N828-D866 PolarHBondContact ND2-OD1 3.02Å; N828-R923 WeakPolarHBondContact O-CD 3.48Å; N828-R923 PolarHBondContact O-NE 3.45Å; N828-R923 PolarHBondContact O-NH1 2.78Å
829	S	90.3	Very high	86.9	Confident	46 Å²	46	47.8 Å²	47.8	32%	0.322	25%	0.246	S	C	.	.			trans	-165.1	147.2	179.5	-71.3	0	0	0	0	110.9	R831	S829-R831 PolarHBondContact O-N 2.85Å
830	P	92	Very high	86	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.271	C	S	.	.			trans	-61.4	125.6	-171.8	-29.1	35.7	0	0	0	112.6	D864 I873 A915 D917 T925	P830-D864 VanDerWaalsContact CA-OD2 3.24Å; P830-D864 WeakPolarHBondContact CA-OD2 3.5Å; P830-D864 WeakPolarHBondContact CD-OD2 3.49Å; P830-D864 WeakPolarHBondContact CG-OD2 3.37Å; P830-I873 HydrophobicContact CB-CD1 3.97Å; P830-I873 HydrophobicContact CB-CG1 3.96Å; P830-I873 HydrophobicContact CG-CG1 4.08Å; P830-A915 HydrophobicContact CB-CB 3.97Å; P830-D917 HydrophobicContact CG-CB 4.28Å; P830-T925 WeakPolarHBondContact O-CB 3.38Å; P830-T925 WeakPolarHBondContact O-CG2 3.24Å; P830-T925 PolarHBondContact O-OG1 2.88Å
831	R	90.1	Very high	85	Confident	165 Å²	165	58.1 Å²	58.1	62%	0.623	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.1	179.1	-169	179.4	72.5	-152.4	2.4	111.7	S829 I833 A862 I863	S829-R831 PolarHBondContact O-N 2.85Å; R831-I833 PolarHBondContact O-N 2.83Å; R831-A862 CarbonylContact O-C 3.51Å; R831-A862 WeakPolarHBondContact O-CA 3.18Å; R831-A862 WeakPolarHBondContact O-CB 3.24Å; R831-I863 PolarHBondContact N-O 3.06Å; R831-I863 PolarHBondContact O-N 2.75Å
832	F	89.9	Confident	84.3	Confident	13 Å²	13	61.2 Å²	61.2	6%	0.057	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	132.5	172.4	-71.1	-84.3	0	0	0	112.3	V860 A862 L913 A915 T925 T927	F832-V860 HydrophobicContact CD1-CG1 3.97Å; F832-V860 HydrophobicContact CE1-CG1 3.59Å; F832-A862 HydrophobicContact CD1-CB 4.13Å; F832-A862 HydrophobicContact CG-CB 4.34Å; F832-L913 HydrophobicContact CE1-CB 4.44Å; F832-L913 HydrophobicContact CZ-CB 4.26Å; F832-A915 HydrophobicContact CD2-CB 4.42Å; F832-A915 HydrophobicContact CE1-CB 3.82Å; F832-A915 HydrophobicContact CE2-CB 3.69Å; F832-A915 HydrophobicContact CZ-CB 3.36Å; F832-T925 WeakPolarHBondContact CE2-OG1 3.5Å; F832-T927 HydrophobicContact CB-CG2 4.45Å; F832-T927 HydrophobicContact CD1-CG2 3.69Å; F832-T927 HydrophobicContact CD2-CG2 3.55Å; F832-T927 HydrophobicContact CE1-CG2 3.65Å; F832-T927 HydrophobicContact CE2-CG2 3.51Å; F832-T927 HydrophobicContact CG-CG2 3.63Å; F832-T927 HydrophobicContact CZ-CG2 3.54Å
833	I	87	Confident	83.9	Confident	62 Å²	62	62 Å²	62	32%	0.318	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-35.7	164.8	-61.3	-177.9	0	0	0	109.5	R831 L861 I863	R831-I833 PolarHBondContact O-N 2.83Å; I833-L861 HydrophobicContact CB-CD2 4.21Å; I833-L861 HydrophobicContact CB-CG 4.27Å; I833-L861 HydrophobicContact CD1-CD2 4.27Å; I833-L861 HydrophobicContact CG2-CD2 4.3Å; I833-L861 PolarHBondContact N-O 3.26Å; I833-I863 HydrophobicContact CD1-CB 4.32Å; I833-I863 HydrophobicContact CD1-CD1 4.01Å; I833-I863 HydrophobicContact CD1-CG1 3.87Å; I833-I863 HydrophobicContact CD1-CG2 3.57Å; I833-I863 HydrophobicContact CG1-CD1 4.47Å; I833-I863 HydrophobicContact CG1-CG1 4.07Å; I833-I863 HydrophobicContact CG1-CG2 4.43Å
834	Y	86.8	Confident	83.8	Confident	52 Å²	52	61.9 Å²	61.9	20%	0.204	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	127.1	174	-175.9	-88.9	0	0	0	111.2	R842 T858 Q859 V860 L861 F929	Y834-R842 HydrophobicContact CD2-CB 4.46Å; Y834-R842 HydrophobicContact CE2-CB 4.4Å; Y834-R842 WeakPolarHBondContact CE2-O 3.21Å; Y834-T858 HydrophobicContact CE1-CG2 4.36Å; Y834-T858 WeakPolarHBondContact CE1-OG1 3.45Å; Y834-T858 PolarHBondContact OH-OG1 2.66Å; Y834-Q859 WeakPolarHBondContact CD1-O 3.27Å; Y834-V860 WeakPolarHBondContact O-CA 3.49Å; Y834-V860 WeakPolarHBondContact O-CG1 3.34Å; Y834-L861 PolarHBondContact N-O 3.47Å; Y834-L861 PolarHBondContact O-N 3.08Å; Y834-F929 HydrophobicContact CE1-CE2 4.12Å; Y834-F929 HydrophobicContact CE1-CZ 4.22Å; Y834-F929 AromaticContact CZ-CE2 3.95Å; Y834-F929 WeakPolarHBondContact OH-CE2 3.35Å
835	P	87.4	Confident	83.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.315	C	S	.	.	S	Bend	cis	-63.6	142.1	-6.2	29.5	-35.9	0	0	0	111.8	P837 R842 T843 L913 T927 F929	P835-P837 WeakPolarHBondContact O-CD 3.3Å; P835-R842 WeakPolarHBondContact CB-O 3.11Å; P835-T843 HydrophobicContact CB-CG2 4.31Å; P835-L913 HydrophobicContact CG-CD1 4.23Å; P835-T927 HydrophobicContact CG-CG2 3.65Å; P835-F929 HydrophobicContact CB-CD2 3.55Å; P835-F929 HydrophobicContact CB-CE2 4.04Å; P835-F929 HydrophobicContact CG-CB 4.13Å; P835-F929 HydrophobicContact CG-CD2 3.69Å; P835-F929 HydrophobicContact CG-CE2 4.48Å; P835-F929 HydrophobicContact CG-CG 4.2Å
836	D	82.6	Confident	83.9	Confident	28 Å²	28	60.2 Å²	60.2	15%	0.15	31%	0.312	C	S	.	.			trans	-79.4	112.6	179.4	-176.5	-23.4	0	0	0	108.3	T838 D839 R842 T843	D836-T838 PolarHBondContact O-N 2.83Å; D836-T838 WeakPolarHBondContact OD1-CB 3.24Å; D836-T838 PolarHBondContact OD1-N 3.46Å; D836-T838 PolarHBondContact OD1-OG1 3.39Å; D836-D839 HydrophobicContact CB-CB 4.41Å; D836-D839 PolarHBondContact O-N 2.8Å; D836-R842 HydrophobicContact CB-CB 3.82Å; D836-R842 IonicContact OD2-NH1 3.59Å; D836-R842 PolarHBondContact OD2-NH1 2.82Å; D836-T843 WeakPolarHBondContact O-CG2 3.17Å
837	P	76.1	Confident	83.9	Confident	83 Å²	83	59.6 Å²	59.6	54%	0.539	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-6.1	-177.6	30.2	-36.1	0	0	0	113.3	P835	P835-P837 WeakPolarHBondContact O-CD 3.3Å
838	T	80	Confident	84	Confident	123 Å²	123	57.2 Å²	57.2	76%	0.755	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-16.8	177.8	73.2	0	0	0	0	114.1	D836	D836-T838 PolarHBondContact O-N 2.83Å; D836-T838 WeakPolarHBondContact OD1-CB 3.24Å; D836-T838 PolarHBondContact OD1-N 3.46Å; D836-T838 PolarHBondContact OD1-OG1 3.39Å
839	D	77.3	Confident	84.2	Confident	53 Å²	53	57.7 Å²	57.7	28%	0.283	30%	0.295	S	S	.	.			trans	-117.2	105.6	175.9	-179	8.8	0	0	0	111.8	D836 N841 R842 T843	D836-D839 HydrophobicContact CB-CB 4.41Å; D836-D839 PolarHBondContact O-N 2.8Å; D839-N841 PolarHBondContact O-N 2.76Å; D839-N841 VanDerWaalsContact OD1-CB 3.32Å; D839-N841 WeakPolarHBondContact OD1-CB 3.31Å; D839-N841 PolarHBondContact OD1-N 3.02Å; D839-N841 PolarHBondContact OD1-ND2 3.4Å; D839-R842 HydrophobicContact CB-CB 4.22Å; D839-R842 HydrophobicContact CB-CG 4.23Å; D839-R842 WeakPolarHBondContact O-CA 3.21Å; D839-R842 WeakPolarHBondContact O-CB 3.16Å; D839-R842 PolarHBondContact O-N 2.82Å; D839-R842 WeakPolarHBondContact OD2-CD 3.39Å; D839-R842 WeakPolarHBondContact OD2-CG 3.28Å; D839-T843 PolarHBondContact O-N 3.42Å
840	V	69.8	Low	84.2	Confident	111 Å²	111	59.7 Å²	59.7	67%	0.673	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.8	178.2	-170.6	0	0	0	0	113	R842 T843	V840-R842 VanDerWaalsContact C-N 3.34Å; V840-T843 PolarHBondContact O-OG1 3.49Å; V840-T843 VanDerWaalsContact O-OG1 3.13Å
841	N	66.5	Low	84.1	Confident	137 Å²	137	59.8 Å²	59.8	73%	0.733	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-22.9	174.2	-54.2	-78.8	0	0	0	112.4	D839	D839-N841 PolarHBondContact O-N 2.76Å; D839-N841 VanDerWaalsContact OD1-CB 3.32Å; D839-N841 WeakPolarHBondContact OD1-CB 3.31Å; D839-N841 PolarHBondContact OD1-N 3.02Å; D839-N841 PolarHBondContact OD1-ND2 3.4Å
842	R	72.3	Confident	84	Confident	93 Å²	93	55 Å²	55	35%	0.351	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-14.1	177.4	-68.4	173.2	111.6	171.7	12	112.6	E784 Y834 P835 D836 D839 V840 K844	E784-R842 IonicContact OE2-NH2 3.32Å; Y834-R842 HydrophobicContact CD2-CB 4.46Å; Y834-R842 HydrophobicContact CE2-CB 4.4Å; Y834-R842 WeakPolarHBondContact CE2-O 3.21Å; P835-R842 WeakPolarHBondContact CB-O 3.11Å; D836-R842 HydrophobicContact CB-CB 3.82Å; D836-R842 IonicContact OD2-NH1 3.59Å; D836-R842 PolarHBondContact OD2-NH1 2.82Å; D839-R842 HydrophobicContact CB-CB 4.22Å; D839-R842 HydrophobicContact CB-CG 4.23Å; D839-R842 WeakPolarHBondContact O-CA 3.21Å; D839-R842 WeakPolarHBondContact O-CB 3.16Å; D839-R842 PolarHBondContact O-N 2.82Å; D839-R842 WeakPolarHBondContact OD2-CD 3.39Å; D839-R842 WeakPolarHBondContact OD2-CG 3.28Å; V840-R842 VanDerWaalsContact C-N 3.34Å; R842-K844 VanDerWaalsContact C-N 3.33Å
843	T	80.3	Confident	83.9	Confident	18 Å²	18	58 Å²	58	11%	0.11	31%	0.311	C	S	.	.	S	Bend	trans	-81.5	-3.7	170.4	65.6	0	0	0	0	114.5	P835 D836 D839 V840 F929 I930	P835-T843 HydrophobicContact CB-CG2 4.31Å; D836-T843 WeakPolarHBondContact O-CG2 3.17Å; D839-T843 PolarHBondContact O-N 3.42Å; V840-T843 PolarHBondContact O-OG1 3.49Å; V840-T843 VanDerWaalsContact O-OG1 3.13Å; T843-F929 WeakPolarHBondContact O-CD2 3.5Å; T843-I930 PolarHBondContact O-N 3.22Å
844	K	86.1	Confident	83.9	Confident	69 Å²	69	57.8 Å²	57.8	30%	0.3	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.8	-178	-172.9	162.4	178.4	171.2	0	114.2	R842 E908 I930 E932	R842-K844 VanDerWaalsContact C-N 3.33Å; K844-E908 WeakPolarHBondContact CE-OE2 3.48Å; K844-E908 IonicContact NZ-OE2 3.63Å; K844-E908 PolarHBondContact NZ-OE2 2.83Å; K844-I930 CarbonylContact C-O 3.44Å; K844-I930 VanDerWaalsContact CA-O 3.31Å; K844-I930 WeakPolarHBondContact CA-O 3.49Å; K844-I930 HydrophobicContact CB-CB 4.1Å; K844-I930 HydrophobicContact CD-CB 4.32Å; K844-I930 HydrophobicContact CD-CG2 3.81Å; K844-I930 HydrophobicContact CG-CB 4.01Å; K844-I930 HydrophobicContact CG-CG2 3.9Å; K844-E932 WeakPolarHBondContact CE-OE2 3.42Å; K844-E932 IonicContact NZ-OE2 2.67Å; K844-E932 PolarHBondContact NZ-OE2 2.95Å
845	T	89.1	Confident	84.1	Confident	25 Å²	25	57.7 Å²	57.7	15%	0.153	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	160	171	-166	0	0	0	0	112.8	V847 F857 F929 I930 I931 E932	T845-V847 HydrophobicContact CG2-CG2 4.44Å; T845-F857 HydrophobicContact CG2-CD2 3.97Å; T845-F857 HydrophobicContact CG2-CE2 3.86Å; T845-F929 HydrophobicContact CG2-CE1 3.61Å; T845-F929 HydrophobicContact CG2-CE2 4.47Å; T845-F929 HydrophobicContact CG2-CZ 3.42Å; T845-F929 VanDerWaalsContact CG2-CZ 3.42Å; T845-I930 PolarHBondContact N-O 2.77Å; T845-I931 HydrophobicContact CG2-CB 4.5Å; T845-I931 HydrophobicContact CG2-CG1 4.12Å; T845-I931 HydrophobicContact CG2-CG2 4.3Å; T845-E932 PolarHBondContact O-N 2.77Å
846	I	89.2	Confident	84.2	Confident	77 Å²	77	60.1 Å²	60.1	40%	0.395	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.4	-175.9	-51.2	177.4	0	0	0	111	E932 D934 K939	I846-E932 WeakPolarHBondContact CA-O 3.35Å; I846-E932 HydrophobicContact CG1-CB 4.32Å; I846-D934 HydrophobicContact CG2-CB 3.92Å; I846-K939 PolarHBondContact O-NZ 2.88Å
847	V	91.2	Very high	84.5	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.6	-174.4	-167.2	0	0	0	0	110.5	T845 E851 F857 I897 I931 E932 I933 D934	T845-V847 HydrophobicContact CG2-CG2 4.44Å; V847-E851 HydrophobicContact CG1-CG 3.77Å; V847-F857 HydrophobicContact CG1-CB 4.28Å; V847-F857 HydrophobicContact CG1-CG 4.35Å; V847-F857 HydrophobicContact CG2-CB 3.94Å; V847-F857 HydrophobicContact CG2-CD1 4.3Å; V847-F857 HydrophobicContact CG2-CD2 3.39Å; V847-F857 HydrophobicContact CG2-CE2 3.86Å; V847-F857 HydrophobicContact CG2-CG 3.63Å; V847-F857 HydrophobicContact CG2-CZ 4.49Å; V847-I897 HydrophobicContact CG1-CD1 4.13Å; V847-I897 HydrophobicContact CG1-CG1 4.48Å; V847-I931 HydrophobicContact CG2-CG2 3.92Å; V847-E932 PolarHBondContact N-O 3.14Å; V847-I933 CarbonylContact O-C 3.55Å; V847-I933 VanDerWaalsContact O-CA 3.28Å; V847-I933 WeakPolarHBondContact O-CA 3.36Å; V847-D934 PolarHBondContact O-N 2.84Å
848	S	91.1	Very high	85.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	139.6	176.5	-175.7	0	0	0	0	111.3	K850 E851 S936	S848-K850 PolarHBondContact O-N 2.86Å; S848-K850 WeakPolarHBondContact OG-CB 3.47Å; S848-K850 PolarHBondContact OG-N 3.38Å; S848-K850 VanDerWaalsContact OG-N 3.14Å; S848-E851 WeakPolarHBondContact O-CG 3.28Å; S848-E851 PolarHBondContact O-N 3.16Å; S848-S936 WeakPolarHBondContact CB-OG 3.38Å; S848-S936 PolarHBondContact OG-O 3.47Å
849	Y	92.8	Very high	85.7	Confident	55 Å²	55	56.8 Å²	56.8	22%	0.216	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-13.6	167.6	81.1	-98.1	0	0	0	113.1	Y903 I906 D934 Q935	Y849-Y903 HydrophobicContact CE1-CD2 4.09Å; Y849-Y903 HydrophobicContact CE1-CE2 4.36Å; Y849-Y903 HydrophobicContact CE2-CD2 4.3Å; Y849-Y903 AromaticContact CZ-CD2 3.87Å; Y849-I906 HydrophobicContact CD1-CD1 3.59Å; Y849-I906 HydrophobicContact CD1-CG1 3.8Å; Y849-I906 HydrophobicContact CE1-CD1 3.89Å; Y849-I906 HydrophobicContact CG-CD1 4.19Å; Y849-I906 HydrophobicContact CG-CG1 4.09Å; Y849-D934 WeakPolarHBondContact CD1-O 3.03Å; Y849-D934 PolarHBondContact N-O 2.89Å; Y849-Q935 HydrophobicContact CD1-CG 4.34Å; Y849-Q935 HydrophobicContact CE1-CB 4.24Å; Y849-Q935 HydrophobicContact CE1-CG 4.07Å
850	K	90	Very high	86.4	Confident	88 Å²	88	54.3 Å²	54.3	38%	0.383	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-5.1	-177.7	-54.1	169.1	-164	147.1	0	113.7	S848 Q935 S936	S848-K850 PolarHBondContact O-N 2.86Å; S848-K850 WeakPolarHBondContact OG-CB 3.47Å; S848-K850 PolarHBondContact OG-N 3.38Å; S848-K850 VanDerWaalsContact OG-N 3.14Å; K850-Q935 PolarHBondContact NZ-O 3.19Å; K850-S936 PolarHBondContact NZ-O 3.1Å
851	E	89.5	Confident	87.4	Confident	3 Å²	3	51.7 Å²	51.7	1%	0.014	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-64.2	144.8	177.7	-56.8	-58.9	173.9	0	0	111.4	V847 S848 Y855 I897 S938 K939 A940	V847-E851 HydrophobicContact CG1-CG 3.77Å; S848-E851 WeakPolarHBondContact O-CG 3.28Å; S848-E851 PolarHBondContact O-N 3.16Å; E851-Y855 HydrophobicContact CB-CD1 3.65Å; E851-Y855 HydrophobicContact CB-CE1 4.37Å; E851-Y855 HydrophobicContact CB-CG 3.9Å; E851-Y855 HydrophobicContact CG-CD1 3.52Å; E851-Y855 HydrophobicContact CG-CE1 3.73Å; E851-Y855 HydrophobicContact CG-CG 4.15Å; E851-I897 HydrophobicContact CB-CG1 4.32Å; E851-S938 WeakPolarHBondContact OE1-CA 3.48Å; E851-S938 WeakPolarHBondContact OE2-CA 3.44Å; E851-S938 VanDerWaalsContact OE2-CB 3.25Å; E851-S938 WeakPolarHBondContact OE2-CB 3.48Å; E851-S938 PolarHBondContact OE2-OG 2.88Å; E851-K939 WeakPolarHBondContact OE1-CB 3.21Å; E851-K939 PolarHBondContact OE1-N 2.86Å; E851-K939 PolarHBondContact OE2-N 3.05Å; E851-A940 WeakPolarHBondContact OE2-CB 3.35Å; E851-A940 PolarHBondContact OE2-N 3.24Å; E851-A940 VanDerWaalsContact OE2-N 3.07Å
852	P	88.8	Confident	88.5	Confident	64 Å²	64	45.4 Å²	45.4	42%	0.416	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-72.2	156.5	178.8	29.3	-34	0	0	0	112.4	G854 Y855 A940	P852-G854 PolarHBondContact O-N 2.97Å; P852-Y855 WeakPolarHBondContact O-CB 3.2Å; P852-Y855 PolarHBondContact O-N 3.2Å; P852-A940 HydrophobicContact CG-CB 3.89Å
853	S	88.8	Confident	89.3	Confident	76 Å²	76	43.6 Å²	43.6	53%	0.531	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	137.1	163.5	171.1	0	0	0	0	109.5	I897 N898	S853-I897 CarbonylContact C-O 3.58Å; S853-I897 WeakPolarHBondContact CA-O 3.29Å; S853-N898 PolarHBondContact OG-O 2.79Å
854	G	86.9	Confident	89.7	Confident	57 Å²	57	43.5 Å²	43.5	59%	0.588	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.8	-8	-169.9	0	0	0	0	0	114.8	P852 A856 I897	P852-G854 PolarHBondContact O-N 2.97Å; G854-A856 PolarHBondContact O-N 3.05Å; G854-A856 VanDerWaalsContact O-N 3.12Å; G854-I897 PolarHBondContact N-O 3.26Å
855	Y	89.7	Confident	89.6	Confident	51 Å²	51	41.9 Å²	41.9	20%	0.2	24%	0.239	C	C	.	.			trans	-66.9	111.8	176.2	-177.3	-107.8	0	0	0	111.3	E851 P852 F857 S896 I897 K939 A940	E851-Y855 HydrophobicContact CB-CD1 3.65Å; E851-Y855 HydrophobicContact CB-CE1 4.37Å; E851-Y855 HydrophobicContact CB-CG 3.9Å; E851-Y855 HydrophobicContact CG-CD1 3.52Å; E851-Y855 HydrophobicContact CG-CE1 3.73Å; E851-Y855 HydrophobicContact CG-CG 4.15Å; P852-Y855 WeakPolarHBondContact O-CB 3.2Å; P852-Y855 PolarHBondContact O-N 3.2Å; Y855-F857 HydrophobicContact CD1-CB 3.92Å; Y855-F857 HydrophobicContact CE1-CB 3.59Å; Y855-S896 CarbonylContact O-C 3.59Å; Y855-S896 VanDerWaalsContact O-CA 3.22Å; Y855-S896 WeakPolarHBondContact O-CA 3.24Å; Y855-I897 HydrophobicContact CD1-CG1 4.5Å; Y855-I897 PolarHBondContact O-N 3.4Å; Y855-K939 WeakPolarHBondContact OH-CB 3.02Å; Y855-A940 HydrophobicContact CD2-CB 3.71Å; Y855-A940 HydrophobicContact CE2-CB 3.95Å
856	A	90	Very high	89.6	Confident	51 Å²	51	40.7 Å²	40.7	42%	0.421	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	121.6	169.6	0	0	0	0	0	109.6	G854 I894	G854-A856 PolarHBondContact O-N 3.05Å; G854-A856 VanDerWaalsContact O-N 3.12Å; A856-I894 HydrophobicContact CB-CG2 3.53Å
857	F	89.7	Confident	89.3	Confident	29 Å²	29	37.9 Å²	37.9	13%	0.127	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-17.6	-174	62.3	-91.7	0	0	0	113.9	T845 V847 Y855 F886 L895 I897 F929 I931	T845-F857 HydrophobicContact CG2-CD2 3.97Å; T845-F857 HydrophobicContact CG2-CE2 3.86Å; V847-F857 HydrophobicContact CG1-CB 4.28Å; V847-F857 HydrophobicContact CG1-CG 4.35Å; V847-F857 HydrophobicContact CG2-CB 3.94Å; V847-F857 HydrophobicContact CG2-CD1 4.3Å; V847-F857 HydrophobicContact CG2-CD2 3.39Å; V847-F857 HydrophobicContact CG2-CE2 3.86Å; V847-F857 HydrophobicContact CG2-CG 3.63Å; V847-F857 HydrophobicContact CG2-CZ 4.49Å; Y855-F857 HydrophobicContact CD1-CB 3.92Å; Y855-F857 HydrophobicContact CE1-CB 3.59Å; F857-F886 AromaticContact CE1-CD1 3.83Å; F857-F886 HydrophobicContact CE1-CD1 3.83Å; F857-F886 HydrophobicContact CE1-CE1 4.36Å; F857-F886 AromaticContact CZ-CD1 3.7Å; F857-F886 HydrophobicContact CZ-CD1 3.7Å; F857-F886 HydrophobicContact CZ-CE1 4.07Å; F857-L895 WeakPolarHBondContact CD1-O 3.2Å; F857-L895 HydrophobicContact CE1-CG 4.01Å; F857-L895 HydrophobicContact CE2-CD2 3.83Å; F857-L895 HydrophobicContact CE2-CG 4.14Å; F857-L895 HydrophobicContact CZ-CB 4.27Å; F857-L895 HydrophobicContact CZ-CD2 3.57Å; F857-L895 HydrophobicContact CZ-CG 3.52Å; F857-L895 PolarHBondContact N-O 2.95Å; F857-I897 HydrophobicContact CD1-CD1 3.97Å; F857-I897 HydrophobicContact CD1-CG1 4.27Å; F857-I897 HydrophobicContact CE1-CD1 3.84Å; F857-F929 HydrophobicContact CE2-CE1 4.46Å; F857-I931 HydrophobicContact CE2-CD1 4.06Å; F857-I931 HydrophobicContact CE2-CG1 4.22Å; F857-I931 HydrophobicContact CE2-CG2 4.24Å; F857-I931 HydrophobicContact CZ-CD1 3.85Å; F857-I931 HydrophobicContact CZ-CG1 4.49Å; F857-I931 HydrophobicContact CZ-CG2 4.49Å
858	T	90.1	Very high	88.9	Confident	29 Å²	29	39.9 Å²	39.9	18%	0.178	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	173.2	169.5	-163.1	0	0	0	0	110.9	Y834 L895 F929	Y834-T858 HydrophobicContact CE1-CG2 4.36Å; Y834-T858 WeakPolarHBondContact CE1-OG1 3.45Å; Y834-T858 PolarHBondContact OH-OG1 2.66Å; T858-L895 HydrophobicContact CG2-CB 3.94Å; T858-L895 HydrophobicContact CG2-CD2 4.07Å; T858-L895 PolarHBondContact O-N 3.31Å; T858-F929 HydrophobicContact CG2-CE1 3.79Å; T858-F929 HydrophobicContact CG2-CZ 3.81Å
859	Q	90.2	Very high	88.7	Confident	106 Å²	106	46.5 Å²	46.5	50%	0.495	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	118.2	175.5	-174.2	179	6.7	0	0	109.7	Y834 N892 G893 I894	Y834-Q859 WeakPolarHBondContact CD1-O 3.27Å; Q859-N892 WeakPolarHBondContact CG-O 3.41Å; Q859-N892 PolarHBondContact NE2-O 3.43Å; Q859-G893 WeakPolarHBondContact CA-O 3.03Å; Q859-I894 HydrophobicContact CB-CG1 4.46Å; Q859-I894 HydrophobicContact CG-CG1 4.04Å
860	V	91.2	Very high	88.5	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	27%	0.268	C	S	.	.			trans	-71	139.5	173.1	-174.2	0	0	0	0	109.1	F832 Y834 Y875 L888 G893 L913	F832-V860 HydrophobicContact CD1-CG1 3.97Å; F832-V860 HydrophobicContact CE1-CG1 3.59Å; Y834-V860 WeakPolarHBondContact O-CA 3.49Å; Y834-V860 WeakPolarHBondContact O-CG1 3.34Å; V860-Y875 HydrophobicContact CB-CD1 4.35Å; V860-Y875 HydrophobicContact CG1-CD1 3.8Å; V860-Y875 HydrophobicContact CG1-CE1 4Å; V860-L888 HydrophobicContact CB-CD1 4.26Å; V860-L888 HydrophobicContact CG2-CD1 3.74Å; V860-G893 WeakPolarHBondContact CB-O 3.43Å; V860-G893 PolarHBondContact N-O 2.67Å; V860-G893 WeakPolarHBondContact O-CA 3.48Å; V860-L913 HydrophobicContact CG1-CD1 4.14Å; V860-L913 HydrophobicContact CG2-CD1 3.76Å
861	L	91.3	Very high	88.2	Confident	55 Å²	55	41.7 Å²	41.7	29%	0.288	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	125.6	179.6	178.9	65.6	0	0	0	110.4	I833 Y834	I833-L861 HydrophobicContact CB-CD2 4.21Å; I833-L861 HydrophobicContact CB-CG 4.27Å; I833-L861 HydrophobicContact CD1-CD2 4.27Å; I833-L861 HydrophobicContact CG2-CD2 4.3Å; I833-L861 PolarHBondContact N-O 3.26Å; Y834-L861 PolarHBondContact N-O 3.47Å; Y834-L861 PolarHBondContact O-N 3.08Å
862	A	89.7	Confident	88.2	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	165	163.1	0	0	0	0	0	109.6	R831 F832 I873 Y875 A915	R831-A862 CarbonylContact O-C 3.51Å; R831-A862 WeakPolarHBondContact O-CA 3.18Å; R831-A862 WeakPolarHBondContact O-CB 3.24Å; F832-A862 HydrophobicContact CD1-CB 4.13Å; F832-A862 HydrophobicContact CG-CB 4.34Å; A862-I873 HydrophobicContact CB-CD1 3.85Å; A862-I873 HydrophobicContact CB-CG2 4.44Å; A862-Y875 HydrophobicContact CB-CE1 3.94Å; A862-Y875 PolarHBondContact N-OH 3.21Å; A862-Y875 PolarHBondContact O-OH 2.81Å; A862-A915 HydrophobicContact CB-CB 3.82Å
863	I	88.8	Confident	88.2	Confident	55 Å²	55	42.9 Å²	42.9	28%	0.282	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.8	167.8	53.7	165.8	0	0	0	109.2	R831 I833	R831-I863 PolarHBondContact N-O 3.06Å; R831-I863 PolarHBondContact O-N 2.75Å; I833-I863 HydrophobicContact CD1-CB 4.32Å; I833-I863 HydrophobicContact CD1-CD1 4.01Å; I833-I863 HydrophobicContact CD1-CG1 3.87Å; I833-I863 HydrophobicContact CD1-CG2 3.57Å; I833-I863 HydrophobicContact CG1-CD1 4.47Å; I833-I863 HydrophobicContact CG1-CG1 4.07Å; I833-I863 HydrophobicContact CG1-CG2 4.43Å
864	D	88.8	Confident	88.4	Confident	16 Å²	16	41.2 Å²	41.2	9%	0.086	25%	0.246	C	C	.	.			trans	-115	165.2	158.9	-140.1	-46.8	0	0	0	108.1	P830 I873	P830-D864 VanDerWaalsContact CA-OD2 3.24Å; P830-D864 WeakPolarHBondContact CA-OD2 3.5Å; P830-D864 WeakPolarHBondContact CD-OD2 3.49Å; P830-D864 WeakPolarHBondContact CG-OD2 3.37Å; D864-I873 HydrophobicContact CB-CD1 4.08Å; D864-I873 HydrophobicContact CB-CG1 4.24Å; D864-I873 VanDerWaalsContact N-CD1 3.3Å
865	I	85.6	Confident	88.8	Confident	36 Å²	36	39.3 Å²	39.3	19%	0.185	22%	0.222	C	C	.	.			trans	-109.2	-23.2	179.8	58.2	-175.4	0	0	0	112.7	R749 E750 M754 Y791 N828	R749-I865 PolarHBondContact NH2-O 2.91Å; E750-I865 HydrophobicContact CB-CD1 4.34Å; E750-I865 HydrophobicContact CG-CB 4.07Å; E750-I865 HydrophobicContact CG-CD1 3.46Å; E750-I865 VanDerWaalsContact CG-CD1 3.46Å; E750-I865 HydrophobicContact CG-CG1 3.58Å; M754-I865 HydrophobicContact CE-CD1 4.35Å; Y791-I865 VanDerWaalsContact CB-O 3.23Å; Y791-I865 WeakPolarHBondContact CB-O 3.32Å; N828-I865 HydrophobicContact CB-CD1 4.2Å; N828-I865 HydrophobicContact CB-CG1 3.77Å
866	D	88.5	Confident	89.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-60.6	171.8	173.2	-58.4	4.2	0	0	0	112.2	S792 D824 N826 D827 N828 N870 G871	S792-D866 WeakPolarHBondContact CB-O 3.34Å; S792-D866 PolarHBondContact OG-O 2.7Å; D824-D866 WeakPolarHBondContact OD1-CA 3.37Å; N826-D866 WeakPolarHBondContact CA-OD2 3.11Å; N826-D866 PolarHBondContact OD1-OD2 2.91Å; D827-D866 PolarHBondContact N-OD2 3.32Å; N828-D866 WeakPolarHBondContact CB-OD1 3Å; N828-D866 PolarHBondContact N-OD1 2.87Å; N828-D866 PolarHBondContact N-OD2 2.89Å; N828-D866 PolarHBondContact ND2-OD1 3.02Å; D866-N870 HydrophobicContact CB-CB 3.63Å; D866-G871 WeakPolarHBondContact O-CA 3.47Å
867	A	83.3	Confident	89.3	Confident	17 Å²	17	39.4 Å²	39.4	14%	0.14	22%	0.215	C	C	.	.			trans	-110.9	163.8	-169.6	0	0	0	0	0	115.8	D824 E869 N870 G871	D824-A867 HydrophobicContact CB-CB 3.84Å; D824-A867 VanDerWaalsContact CG-CB 3.48Å; D824-A867 VanDerWaalsContact OD1-CB 3.29Å; D824-A867 WeakPolarHBondContact OD1-CB 3.41Å; D824-A867 PolarHBondContact OD1-N 3.13Å; D824-A867 PolarHBondContact OD2-N 3.34Å; A867-E869 PolarHBondContact O-N 3.17Å; A867-E869 VanDerWaalsContact O-N 3.12Å; A867-N870 WeakPolarHBondContact O-CA 3.22Å; A867-N870 VanDerWaalsContact O-CB 3.28Å; A867-N870 WeakPolarHBondContact O-CB 3.37Å; A867-N870 PolarHBondContact O-N 3.34Å; A867-G871 PolarHBondContact O-N 2.8Å
868	G	82.9	Confident	89.5	Confident	43 Å²	43	42.8 Å²	42.8	44%	0.443	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	-120.5	178.1	0	0	0	0	0	112.9	T872	G868-T872 PolarHBondContact O-N 3.03Å; G868-T872 PolarHBondContact O-OG1 2.95Å
869	E	85.7	Confident	89.7	Confident	140 Å²	140	43.9 Å²	43.9	65%	0.654	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-29.5	179.1	-61.3	-163.8	136.3	0	0	113.2	A867 G871 T872 C918 G919	A867-E869 PolarHBondContact O-N 3.17Å; A867-E869 VanDerWaalsContact O-N 3.12Å; E869-G871 VanDerWaalsContact C-N 3.32Å; E869-T872 PolarHBondContact O-N 3.49Å; E869-T872 VanDerWaalsContact O-N 3.08Å; E869-C918 HydrophobicContact CB-CB 4Å; E869-C918 CarbonylContact O-C 3.51Å; E869-C918 WeakPolarHBondContact O-CA 3.2Å; E869-C918 WeakPolarHBondContact O-CB 3.24Å; E869-C918 PolarHBondContact O-N 2.92Å; E869-G919 PolarHBondContact O-N 2.66Å
870	N	88.3	Confident	89.7	Confident	29 Å²	29	39.8 Å²	39.8	16%	0.155	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-43.1	171.5	-58.2	-17.8	0	0	0	109.9	D824 N826 D866 A867 T872 D917 G919	D824-N870 WeakPolarHBondContact OD2-CB 3.08Å; D824-N870 PolarHBondContact OD2-ND2 3.42Å; N826-N870 HydrophobicContact CB-CB 4.13Å; N826-N870 PolarHBondContact N-ND2 2.81Å; N826-N870 WeakPolarHBondContact OD1-CA 3.4Å; N826-N870 WeakPolarHBondContact OD1-CB 3.45Å; D866-N870 HydrophobicContact CB-CB 3.63Å; A867-N870 WeakPolarHBondContact O-CA 3.22Å; A867-N870 VanDerWaalsContact O-CB 3.28Å; A867-N870 WeakPolarHBondContact O-CB 3.37Å; A867-N870 PolarHBondContact O-N 3.34Å; N870-T872 VanDerWaalsContact C-N 3.27Å; N870-T872 PolarHBondContact O-N 2.99Å; N870-D917 WeakPolarHBondContact O-CB 3.03Å; N870-G919 WeakPolarHBondContact OD1-CA 3.18Å
871	G	85.3	Confident	89.8	Confident	12 Å²	12	41 Å²	41	12%	0.124	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-9.1	172.3	0	0	0	0	0	116.6	D866 A867 E869 I873	D866-G871 WeakPolarHBondContact O-CA 3.47Å; A867-G871 PolarHBondContact O-N 2.8Å; E869-G871 VanDerWaalsContact C-N 3.32Å; G871-I873 PolarHBondContact O-N 3.13Å
872	T	88	Confident	89.7	Confident	69 Å²	69	44.4 Å²	44.4	42%	0.423	25%	0.251	S	S	.	.			trans	-96	101.6	-166.2	-68.8	0	0	0	0	112.8	G868 E869 N870 D917 C918	G868-T872 PolarHBondContact O-N 3.03Å; G868-T872 PolarHBondContact O-OG1 2.95Å; E869-T872 PolarHBondContact O-N 3.49Å; E869-T872 VanDerWaalsContact O-N 3.08Å; N870-T872 VanDerWaalsContact C-N 3.27Å; N870-T872 PolarHBondContact O-N 2.99Å; T872-D917 CarbonylContact O-C 3.6Å; T872-D917 VanDerWaalsContact O-C 3.31Å; T872-D917 WeakPolarHBondContact O-CA 3.2Å; T872-C918 PolarHBondContact O-N 3.22Å; T872-C918 VanDerWaalsContact O-N 3.13Å; T872-C918 PolarHBondContact O-SG 2.91Å
873	I	89.9	Confident	89.7	Confident	23 Å²	23	48.7 Å²	48.7	12%	0.118	27%	0.27	C	S	.	.			trans	-80.9	136.8	-176.9	-61.9	163.2	0	0	0	113.7	P830 A862 D864 G871 Y875 A915 R916	P830-I873 HydrophobicContact CB-CD1 3.97Å; P830-I873 HydrophobicContact CB-CG1 3.96Å; P830-I873 HydrophobicContact CG-CG1 4.08Å; A862-I873 HydrophobicContact CB-CD1 3.85Å; A862-I873 HydrophobicContact CB-CG2 4.44Å; D864-I873 HydrophobicContact CB-CD1 4.08Å; D864-I873 HydrophobicContact CB-CG1 4.24Å; D864-I873 VanDerWaalsContact N-CD1 3.3Å; G871-I873 PolarHBondContact O-N 3.13Å; I873-Y875 HydrophobicContact CG2-CD1 4.39Å; I873-Y875 HydrophobicContact CG2-CD2 4.33Å; I873-Y875 HydrophobicContact CG2-CE1 4Å; I873-Y875 HydrophobicContact CG2-CE2 3.92Å; I873-A915 HydrophobicContact CG2-CB 3.95Å; I873-R916 CarbonylContact C-O 3.5Å; I873-R916 VanDerWaalsContact CA-O 3.3Å; I873-R916 WeakPolarHBondContact CA-O 3.43Å
874	L	93.5	Very high	89.9	Confident	41 Å²	41	51.5 Å²	51.5	22%	0.215	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.4	164.6	-63.5	175.6	0	0	0	111.5	F876 P890 K891 R916	L874-F876 HydrophobicContact CB-CE2 3.57Å; L874-F876 HydrophobicContact CB-CZ 3.94Å; L874-F876 HydrophobicContact CD1-CZ 4.45Å; L874-P890 WeakPolarHBondContact CA-O 3.13Å; L874-K891 HydrophobicContact CD2-CG 4.33Å; L874-R916 HydrophobicContact CB-CG 4.47Å; L874-R916 PolarHBondContact N-O 2.83Å; L874-R916 PolarHBondContact O-N 3.45Å
875	Y	95.1	Very high	90.1	Very high	18 Å²	18	51.7 Å²	51.7	7%	0.071	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.8	-173.7	-59	-90.2	0	0	0	113.3	V860 A862 I873 P890 E914 A915	V860-Y875 HydrophobicContact CB-CD1 4.35Å; V860-Y875 HydrophobicContact CG1-CD1 3.8Å; V860-Y875 HydrophobicContact CG1-CE1 4Å; A862-Y875 HydrophobicContact CB-CE1 3.94Å; A862-Y875 PolarHBondContact N-OH 3.21Å; A862-Y875 PolarHBondContact O-OH 2.81Å; I873-Y875 HydrophobicContact CG2-CD1 4.39Å; I873-Y875 HydrophobicContact CG2-CD2 4.33Å; I873-Y875 HydrophobicContact CG2-CE1 4Å; I873-Y875 HydrophobicContact CG2-CE2 3.92Å; Y875-P890 PolarHBondContact N-O 2.91Å; Y875-P890 VanDerWaalsContact O-CA 3.23Å; Y875-P890 WeakPolarHBondContact O-CA 3.34Å; Y875-P890 WeakPolarHBondContact O-CB 3.4Å; Y875-E914 CarbonylContact C-O 3.59Å; Y875-E914 WeakPolarHBondContact CA-O 3.18Å; Y875-A915 HydrophobicContact CD1-CB 4.38Å; Y875-A915 HydrophobicContact CE1-CB 4.44Å
876	F	94.8	Very high	90.5	Very high	59 Å²	59	50.1 Å²	50.1	26%	0.259	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	157.3	178.2	-56.1	-87.5	0	0	0	112	L874 P890 E914 R916	L874-F876 HydrophobicContact CB-CE2 3.57Å; L874-F876 HydrophobicContact CB-CZ 3.94Å; L874-F876 HydrophobicContact CD1-CZ 4.45Å; F876-P890 HydrophobicContact CE1-CB 4.31Å; F876-P890 HydrophobicContact CZ-CB 4.43Å; F876-E914 HydrophobicContact CB-CB 4.18Å; F876-E914 PolarHBondContact N-O 2.94Å; F876-E914 PolarHBondContact O-N 3.25Å; F876-R916 HydrophobicContact CD2-CG 4.33Å; F876-R916 HydrophobicContact CE2-CG 3.95Å; F876-R916 VanDerWaalsContact CZ-CZ 3.46Å
877	I	94.9	Very high	90.8	Very high	44 Å²	44	56 Å²	56	23%	0.226	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	112.2	165	-56.5	172	0	0	0	105.9	S879 N881 F886 L888 L895 L911 L913	I877-S879 WeakPolarHBondContact CG2-O 3.4Å; I877-N881 HydrophobicContact CD1-CB 4.38Å; I877-N881 HydrophobicContact CG2-CB 3.83Å; I877-F886 HydrophobicContact CD1-CB 4.43Å; I877-L888 HydrophobicContact CD1-CB 3.91Å; I877-L888 HydrophobicContact CG1-CB 3.74Å; I877-L888 HydrophobicContact CG1-CD2 3.99Å; I877-L895 HydrophobicContact CD1-CD1 4.05Å; I877-L911 HydrophobicContact CD1-CD1 4.36Å; I877-L911 HydrophobicContact CG2-CD1 4.41Å; I877-L911 HydrophobicContact CG2-CD2 4.49Å; I877-L913 HydrophobicContact CG1-CD2 4.07Å
878	H	93.1	Very high	91.3	Very high	101 Å²	101	56 Å²	56	47%	0.468	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-38.4	-175.8	-165.8	93.1	0	0	0	111.5	T912 E914 L926	H878-T912 HydrophobicContact CB-CG2 4.13Å; H878-T912 WeakPolarHBondContact CB-O 3.23Å; H878-T912 PolarHBondContact N-O 3.46Å; H878-E914 HydrophobicContact CB-CB 4.18Å; H878-E914 IonicContact CE1-OE2 3.44Å; H878-E914 IonicContact CG-OE2 3.8Å; H878-E914 IonicContact ND1-OE2 3.7Å; H878-E914 PolarHBondContact ND1-OE2 3.05Å; H878-L926 HydrophobicContact CB-CD2 4.2Å
879	S	94	Very high	91.8	Very high	52 Å²	52	57 Å²	57	36%	0.364	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	176.6	179.2	77.8	0	0	0	0	112.7	I877 N881 T912	I877-S879 WeakPolarHBondContact CG2-O 3.4Å; S879-N881 VanDerWaalsContact C-N 3.31Å; S879-N881 PolarHBondContact O-N 3.44Å; S879-T912 PolarHBondContact N-O 2.85Å; S879-T912 PolarHBondContact O-N 3.05Å; S879-T912 VanDerWaalsContact OG-CB 3.24Å; S879-T912 WeakPolarHBondContact OG-CB 3.33Å; S879-T912 PolarHBondContact OG-OG1 2.85Å
880	G	91.3	Very high	92.1	Very high	20 Å²	20	53 Å²	53	21%	0.206	28%	0.278	C	S	.	.	S	Bend	trans	85.3	-12.6	170.7	0	0	0	0	0	116	D882 L910 L911	G880-D882 VanDerWaalsContact C-N 3.35Å; G880-D882 PolarHBondContact O-N 3.22Å; G880-L910 WeakPolarHBondContact CA-O 3.38Å; G880-L911 VanDerWaalsContact C-CD2 3.4Å
881	N	92.8	Very high	92.1	Very high	26 Å²	26	60 Å²	60	14%	0.139	31%	0.307	C	S	.	.			trans	-97.8	36.4	178	-171.9	32.5	0	0	0	112.6	I877 S879 H883 H884 Y885 F886 L911	I877-N881 HydrophobicContact CD1-CB 4.38Å; I877-N881 HydrophobicContact CG2-CB 3.83Å; S879-N881 VanDerWaalsContact C-N 3.31Å; S879-N881 PolarHBondContact O-N 3.44Å; N881-H883 PolarHBondContact O-N 2.95Å; N881-H884 WeakPolarHBondContact O-CA 3.3Å; N881-H884 PolarHBondContact O-N 2.8Å; N881-H884 PolarHBondContact O-ND1 2.89Å; N881-H884 WeakPolarHBondContact OD1-CA 3.11Å; N881-Y885 PolarHBondContact OD1-N 3.37Å; N881-Y885 VanDerWaalsContact OD1-N 3.15Å; N881-F886 PolarHBondContact ND2-O 3.24Å; N881-F886 PolarHBondContact OD1-N 2.99Å; N881-F886 VanDerWaalsContact OD1-N 3.09Å; N881-L911 HydrophobicContact CB-CD2 3.87Å
882	D	90.1	Very high	92.3	Very high	127 Å²	127	62.3 Å²	62.3	68%	0.679	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-33.9	-177.9	-47.1	-27	0	0	0	112	G880 H884	G880-D882 VanDerWaalsContact C-N 3.35Å; G880-D882 PolarHBondContact O-N 3.22Å; D882-H884 PolarHBondContact O-N 2.84Å; D882-H884 PolarHBondContact O-ND1 3.29Å
883	H	90	Very high	92.4	Very high	95 Å²	95	59 Å²	59	44%	0.44	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-11	176	-67.4	88.3	0	0	0	113.5	N881 Y885 K899 Y909	N881-H883 PolarHBondContact O-N 2.95Å; H883-Y885 VanDerWaalsContact C-N 3.26Å; H883-Y885 HydrophobicContact CB-CD2 3.48Å; H883-Y885 VanDerWaalsContact CB-CD2 3.48Å; H883-Y885 HydrophobicContact CB-CE1 4.42Å; H883-Y885 HydrophobicContact CB-CE2 3.35Å; H883-Y885 HydrophobicContact CB-CG 4.07Å; H883-Y885 AromaticContact CD2-CE2 3.98Å; H883-Y885 AromaticContact CG-CE2 3.71Å; H883-Y885 PolarHBondContact O-N 2.83Å; H883-K899 WeakPolarHBondContact O-CE 3.47Å; H883-K899 PolarHBondContact O-NZ 2.97Å; H883-Y909 AromaticContact ND1-CE1 3.92Å
884	H	92.1	Very high	92.5	Very high	114 Å²	114	60.5 Å²	60.5	53%	0.528	30%	0.304	S	S	.	.			trans	52.8	37.6	-175.9	-49.5	-25.9	0	0	0	113.7	N881 D882 N898 K899	N881-H884 WeakPolarHBondContact O-CA 3.3Å; N881-H884 PolarHBondContact O-N 2.8Å; N881-H884 PolarHBondContact O-ND1 2.89Å; N881-H884 WeakPolarHBondContact OD1-CA 3.11Å; D882-H884 PolarHBondContact O-N 2.84Å; D882-H884 PolarHBondContact O-ND1 3.29Å; H884-N898 PolarHBondContact O-ND2 2.91Å; H884-K899 WeakPolarHBondContact O-CE 3.34Å
885	Y	93.4	Very high	92.5	Very high	19 Å²	19	58.6 Å²	58.6	8%	0.075	29%	0.294	C	S	.	.			trans	-76.3	-29.7	174.8	-67	-45.9	0	0	0	112.1	N881 H883 N898 K899 I901 P902 Y909	N881-Y885 PolarHBondContact OD1-N 3.37Å; N881-Y885 VanDerWaalsContact OD1-N 3.15Å; H883-Y885 VanDerWaalsContact C-N 3.26Å; H883-Y885 HydrophobicContact CB-CD2 3.48Å; H883-Y885 VanDerWaalsContact CB-CD2 3.48Å; H883-Y885 HydrophobicContact CB-CE1 4.42Å; H883-Y885 HydrophobicContact CB-CE2 3.35Å; H883-Y885 HydrophobicContact CB-CG 4.07Å; H883-Y885 AromaticContact CD2-CE2 3.98Å; H883-Y885 AromaticContact CG-CE2 3.71Å; H883-Y885 PolarHBondContact O-N 2.83Å; Y885-N898 WeakPolarHBondContact O-CB 3.23Å; Y885-N898 PolarHBondContact O-N 3.17Å; Y885-K899 HydrophobicContact CD1-CG 4.2Å; Y885-I901 HydrophobicContact CD1-CG1 4.05Å; Y885-I901 HydrophobicContact CG-CG1 4.21Å; Y885-P902 VanDerWaalsContact CE1-CD 3.49Å; Y885-P902 HydrophobicContact CE1-CG 4.33Å; Y885-P902 WeakPolarHBondContact OH-CD 3.12Å; Y885-P902 WeakPolarHBondContact OH-CG 3.18Å; Y885-Y909 AromaticContact CD2-CE1 3.99Å; Y885-Y909 HydrophobicContact CD2-CE1 3.99Å; Y885-Y909 HydrophobicContact CE2-CE1 4.05Å; Y885-Y909 AromaticContact CE2-CZ 3.92Å; Y885-Y909 WeakPolarHBondContact CE2-OH 3.34Å
886	F	94.5	Very high	92.4	Very high	3 Å²	3	58.7 Å²	58.7	1%	0.013	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	152.9	-176.4	-46.9	-67	0	0	0	111.7	F857 I877 N881 L895 S896 I897 Y909 L911 I931 I933	F857-F886 AromaticContact CE1-CD1 3.83Å; F857-F886 HydrophobicContact CE1-CD1 3.83Å; F857-F886 HydrophobicContact CE1-CE1 4.36Å; F857-F886 AromaticContact CZ-CD1 3.7Å; F857-F886 HydrophobicContact CZ-CD1 3.7Å; F857-F886 HydrophobicContact CZ-CE1 4.07Å; I877-F886 HydrophobicContact CD1-CB 4.43Å; N881-F886 PolarHBondContact ND2-O 3.24Å; N881-F886 PolarHBondContact OD1-N 2.99Å; N881-F886 VanDerWaalsContact OD1-N 3.09Å; F886-L895 HydrophobicContact CB-CD1 4.18Å; F886-S896 CarbonylContact C-O 3.46Å; F886-S896 WeakPolarHBondContact CA-O 3.11Å; F886-I897 HydrophobicContact CD1-CD1 4.08Å; F886-I897 HydrophobicContact CE1-CD1 4.13Å; F886-Y909 HydrophobicContact CE2-CD1 4.32Å; F886-Y909 AromaticContact CE2-CG 3.99Å; F886-Y909 HydrophobicContact CE2-CG 3.99Å; F886-Y909 HydrophobicContact CZ-CD2 4.37Å; F886-Y909 HydrophobicContact CZ-CG 4.24Å; F886-L911 HydrophobicContact CB-CD1 4.37Å; F886-L911 HydrophobicContact CD2-CD1 3.89Å; F886-L911 HydrophobicContact CD2-CD2 4.05Å; F886-L911 HydrophobicContact CD2-CG 4.38Å; F886-L911 HydrophobicContact CE2-CD2 4.35Å; F886-L911 HydrophobicContact CG-CD1 4.3Å; F886-I931 HydrophobicContact CD1-CD1 3.91Å; F886-I931 HydrophobicContact CD2-CD1 3.89Å; F886-I931 HydrophobicContact CE1-CB 4.39Å; F886-I931 HydrophobicContact CE1-CD1 3.75Å; F886-I931 HydrophobicContact CE1-CG2 3.75Å; F886-I931 HydrophobicContact CE2-CD1 3.72Å; F886-I931 HydrophobicContact CG-CD1 3.96Å; F886-I931 HydrophobicContact CZ-CB 3.95Å; F886-I931 HydrophobicContact CZ-CD1 3.63Å; F886-I931 HydrophobicContact CZ-CG1 4.42Å; F886-I931 HydrophobicContact CZ-CG2 3.69Å; F886-I933 HydrophobicContact CE1-CD1 4.15Å; F886-I933 HydrophobicContact CZ-CD1 3.78Å; F886-I933 HydrophobicContact CZ-CG1 4.29Å
887	K	93.9	Very high	92.3	Very high	123 Å²	123	55.9 Å²	55.9	54%	0.535	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	118.8	172.4	176.3	176.8	179.6	-179.9	0	109	S896 N898	K887-S896 PolarHBondContact N-O 3.09Å; K887-S896 PolarHBondContact O-N 2.82Å; K887-S896 PolarHBondContact O-OG 3.14Å; K887-N898 HydrophobicContact CB-CB 3.84Å
888	L	94.5	Very high	92.2	Very high	18 Å²	18	56.9 Å²	56.9	9%	0.094	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	138.7	171.4	-171.9	59.5	0	0	0	109.2	V860 I877 G893 I894 L895 L913	V860-L888 HydrophobicContact CB-CD1 4.26Å; V860-L888 HydrophobicContact CG2-CD1 3.74Å; I877-L888 HydrophobicContact CD1-CB 3.91Å; I877-L888 HydrophobicContact CG1-CB 3.74Å; I877-L888 HydrophobicContact CG1-CD2 3.99Å; L888-G893 WeakPolarHBondContact CD1-O 3.42Å; L888-I894 WeakPolarHBondContact CA-O 3.33Å; L888-L895 HydrophobicContact CB-CD1 3.84Å; L888-L895 HydrophobicContact CD1-CB 4.08Å; L888-L895 HydrophobicContact CD1-CD1 4.02Å; L888-L895 HydrophobicContact CG-CD1 4.48Å; L888-L913 HydrophobicContact CD2-CD2 4.34Å
889	N	92.3	Very high	92.1	Very high	64 Å²	64	56.3 Å²	56.3	34%	0.342	29%	0.287	S	S	.	.			trans	-90.7	120.3	170.3	177.3	-27.5	0	0	0	109.4	K891 N892 G893 I894	N889-K891 PolarHBondContact O-N 3.28Å; N889-K891 PolarHBondContact OD1-N 3.41Å; N889-N892 WeakPolarHBondContact CB-OD1 3.41Å; N889-N892 PolarHBondContact ND2-OD1 3.26Å; N889-G893 WeakPolarHBondContact O-CA 3.42Å; N889-G893 PolarHBondContact O-N 3.07Å; N889-I894 PolarHBondContact N-O 3.14Å
890	P	92.8	Very high	91.8	Very high	55 Å²	55	62.4 Å²	62.4	36%	0.357	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-15	-170.1	28.8	-36.5	0	0	0	114.8	L874 Y875 F876	L874-P890 WeakPolarHBondContact CA-O 3.13Å; Y875-P890 PolarHBondContact N-O 2.91Å; Y875-P890 VanDerWaalsContact O-CA 3.23Å; Y875-P890 WeakPolarHBondContact O-CA 3.34Å; Y875-P890 WeakPolarHBondContact O-CB 3.4Å; F876-P890 HydrophobicContact CE1-CB 4.31Å; F876-P890 HydrophobicContact CZ-CB 4.43Å
891	K	88.6	Confident	91.8	Very high	176 Å²	176	61.5 Å²	61.5	77%	0.765	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-21.8	-178.7	-68.5	-160.8	173.9	-160.8	0	114.9	L874 N889	L874-K891 HydrophobicContact CD2-CG 4.33Å; N889-K891 PolarHBondContact O-N 3.28Å; N889-K891 PolarHBondContact OD1-N 3.41Å
892	N	88.1	Confident	91.7	Very high	61 Å²	61	62.7 Å²	62.7	33%	0.326	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132	5	-176.6	72.8	7.9	0	0	0	114.2	Q859 N889 I894	Q859-N892 WeakPolarHBondContact CG-O 3.41Å; Q859-N892 PolarHBondContact NE2-O 3.43Å; N889-N892 WeakPolarHBondContact CB-OD1 3.41Å; N889-N892 PolarHBondContact ND2-OD1 3.26Å; N892-I894 WeakPolarHBondContact ND2-CD1 3.14Å; N892-I894 PolarHBondContact O-N 2.84Å; N892-I894 WeakPolarHBondContact OD1-CB 3.36Å; N892-I894 WeakPolarHBondContact OD1-CG1 3.39Å; N892-I894 PolarHBondContact OD1-N 2.79Å
893	G	90.1	Very high	91.6	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.3	C	S	.	.			trans	68	3.6	175.1	0	0	0	0	0	115.2	Q859 V860 L888 N889 L895	Q859-G893 WeakPolarHBondContact CA-O 3.03Å; V860-G893 WeakPolarHBondContact CB-O 3.43Å; V860-G893 PolarHBondContact N-O 2.67Å; V860-G893 WeakPolarHBondContact O-CA 3.48Å; L888-G893 WeakPolarHBondContact CD1-O 3.42Å; N889-G893 WeakPolarHBondContact O-CA 3.42Å; N889-G893 PolarHBondContact O-N 3.07Å; G893-L895 PolarHBondContact O-N 3.35Å
894	I	92.5	Very high	91.6	Very high	55 Å²	55	64.8 Å²	64.8	28%	0.282	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	122.8	-179.3	-65.8	178.5	0	0	0	109.7	A856 Q859 L888 N889 N892	A856-I894 HydrophobicContact CB-CG2 3.53Å; Q859-I894 HydrophobicContact CB-CG1 4.46Å; Q859-I894 HydrophobicContact CG-CG1 4.04Å; L888-I894 WeakPolarHBondContact CA-O 3.33Å; N889-I894 PolarHBondContact N-O 3.14Å; N892-I894 WeakPolarHBondContact ND2-CD1 3.14Å; N892-I894 PolarHBondContact O-N 2.84Å; N892-I894 WeakPolarHBondContact OD1-CB 3.36Å; N892-I894 WeakPolarHBondContact OD1-CG1 3.39Å; N892-I894 PolarHBondContact OD1-N 2.79Å
895	L	93.3	Very high	91.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.4	178.2	-169.2	66.1	0	0	0	109.4	F857 T858 I877 F886 L888 G893 L911 F929 I931	F857-L895 WeakPolarHBondContact CD1-O 3.2Å; F857-L895 HydrophobicContact CE1-CG 4.01Å; F857-L895 HydrophobicContact CE2-CD2 3.83Å; F857-L895 HydrophobicContact CE2-CG 4.14Å; F857-L895 HydrophobicContact CZ-CB 4.27Å; F857-L895 HydrophobicContact CZ-CD2 3.57Å; F857-L895 HydrophobicContact CZ-CG 3.52Å; F857-L895 PolarHBondContact N-O 2.95Å; T858-L895 HydrophobicContact CG2-CB 3.94Å; T858-L895 HydrophobicContact CG2-CD2 4.07Å; T858-L895 PolarHBondContact O-N 3.31Å; I877-L895 HydrophobicContact CD1-CD1 4.05Å; F886-L895 HydrophobicContact CB-CD1 4.18Å; L888-L895 HydrophobicContact CB-CD1 3.84Å; L888-L895 HydrophobicContact CD1-CB 4.08Å; L888-L895 HydrophobicContact CD1-CD1 4.02Å; L888-L895 HydrophobicContact CG-CD1 4.48Å; G893-L895 PolarHBondContact O-N 3.35Å; L895-L911 HydrophobicContact CD2-CD1 4.44Å; L895-F929 HydrophobicContact CD2-CD1 3.93Å; L895-F929 HydrophobicContact CD2-CE1 3.83Å; L895-I931 HydrophobicContact CD2-CD1 4.03Å
896	S	93.2	Very high	91.2	Very high	20 Å²	20	61 Å²	61	14%	0.14	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157.2	-165.4	62.3	0	0	0	0	113.1	Y855 F886 K887 N898	Y855-S896 CarbonylContact O-C 3.59Å; Y855-S896 VanDerWaalsContact O-CA 3.22Å; Y855-S896 WeakPolarHBondContact O-CA 3.24Å; F886-S896 CarbonylContact C-O 3.46Å; F886-S896 WeakPolarHBondContact CA-O 3.11Å; K887-S896 PolarHBondContact N-O 3.09Å; K887-S896 PolarHBondContact O-N 2.82Å; K887-S896 PolarHBondContact O-OG 3.14Å; S896-N898 PolarHBondContact O-N 3.05Å
897	I	93.4	Very high	91.1	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	110.1	172.5	-60.2	-50.4	0	0	0	109.3	V847 E851 S853 G854 Y855 F857 F886 K899 I901	V847-I897 HydrophobicContact CG1-CD1 4.13Å; V847-I897 HydrophobicContact CG1-CG1 4.48Å; E851-I897 HydrophobicContact CB-CG1 4.32Å; S853-I897 CarbonylContact C-O 3.58Å; S853-I897 WeakPolarHBondContact CA-O 3.29Å; G854-I897 PolarHBondContact N-O 3.26Å; Y855-I897 HydrophobicContact CD1-CG1 4.5Å; Y855-I897 PolarHBondContact O-N 3.4Å; F857-I897 HydrophobicContact CD1-CD1 3.97Å; F857-I897 HydrophobicContact CD1-CG1 4.27Å; F857-I897 HydrophobicContact CE1-CD1 3.84Å; F886-I897 HydrophobicContact CD1-CD1 4.08Å; F886-I897 HydrophobicContact CE1-CD1 4.13Å; I897-K899 WeakPolarHBondContact CG2-O 3.43Å; I897-I901 HydrophobicContact CD1-CD1 3.77Å; I897-I901 HydrophobicContact CG1-CD1 4.46Å; I897-I901 HydrophobicContact CG2-CD1 4.29Å
898	N	92.6	Very high	91	Very high	64 Å²	64	62 Å²	62	34%	0.342	32%	0.315	S	S	.	.			trans	-68.3	-48.8	-179.7	-173.3	42.7	0	0	0	111.3	S853 H884 Y885 K887 S896	S853-N898 PolarHBondContact OG-O 2.79Å; H884-N898 PolarHBondContact O-ND2 2.91Å; Y885-N898 WeakPolarHBondContact O-CB 3.23Å; Y885-N898 PolarHBondContact O-N 3.17Å; K887-N898 HydrophobicContact CB-CB 3.84Å; S896-N898 PolarHBondContact O-N 3.05Å
899	K	90.3	Very high	90.9	Very high	90 Å²	90	62.7 Å²	62.7	39%	0.391	32%	0.317	S	S	.	.	S	Bend	trans	-140	156.9	-177.8	67.7	-175.1	178.1	-176	0	110.7	H883 H884 Y885 I897 I901	H883-K899 WeakPolarHBondContact O-CE 3.47Å; H883-K899 PolarHBondContact O-NZ 2.97Å; H884-K899 WeakPolarHBondContact O-CE 3.34Å; Y885-K899 HydrophobicContact CD1-CG 4.2Å; I897-K899 WeakPolarHBondContact CG2-O 3.43Å; K899-I901 PolarHBondContact O-N 3.2Å
900	K	88.4	Confident	90.9	Very high	179 Å²	179	63.7 Å²	63.7	78%	0.778	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-54	123.7	177.2	-177.6	177.2	-179.5	177.8	0	110.6
901	I	91	Very high	90.9	Very high	2 Å²	2	61 Å²	61	1%	0.01	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-77.2	129.9	178.1	-62.9	153.3	0	0	0	108.9	Y885 I897 K899 I933	Y885-I901 HydrophobicContact CD1-CG1 4.05Å; Y885-I901 HydrophobicContact CG-CG1 4.21Å; I897-I901 HydrophobicContact CD1-CD1 3.77Å; I897-I901 HydrophobicContact CG1-CD1 4.46Å; I897-I901 HydrophobicContact CG2-CD1 4.29Å; K899-I901 PolarHBondContact O-N 3.2Å; I901-I933 HydrophobicContact CD1-CD1 3.78Å; I901-I933 HydrophobicContact CD1-CG2 4.47Å; I901-I933 HydrophobicContact CG1-CD1 4.3Å; I901-I933 HydrophobicContact CG2-CD1 4.23Å; I901-I933 HydrophobicContact CG2-CG2 4.13Å
902	P	91.3	Very high	91.2	Very high	51 Å²	51	54 Å²	54	33%	0.331	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-75.6	161.9	171.4	32.8	-34.4	0	0	0	110.6	Y885 T904 G905	Y885-P902 VanDerWaalsContact CE1-CD 3.49Å; Y885-P902 HydrophobicContact CE1-CG 4.33Å; Y885-P902 WeakPolarHBondContact OH-CD 3.12Å; Y885-P902 WeakPolarHBondContact OH-CG 3.18Å; P902-T904 WeakPolarHBondContact CG-OG1 3.42Å; P902-T904 PolarHBondContact O-N 3.37Å; P902-T904 VanDerWaalsContact O-N 3.13Å; P902-G905 WeakPolarHBondContact O-CA 3.12Å; P902-G905 PolarHBondContact O-N 3Å
903	Y	87.9	Confident	91.5	Very high	140 Å²	140	51.1 Å²	51.1	55%	0.549	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-59.4	-25.6	174.4	-173.4	-90.8	0	0	0	112.7	Y849 G905 I906 Q935	Y849-Y903 HydrophobicContact CE1-CD2 4.09Å; Y849-Y903 HydrophobicContact CE1-CE2 4.36Å; Y849-Y903 HydrophobicContact CE2-CD2 4.3Å; Y849-Y903 AromaticContact CZ-CD2 3.87Å; Y903-G905 PolarHBondContact O-N 3.19Å; Y903-I906 HydrophobicContact CD1-CD1 4.3Å; Y903-I906 HydrophobicContact CD2-CD1 3.46Å; Y903-I906 VanDerWaalsContact CD2-CD1 3.46Å; Y903-I906 HydrophobicContact CE1-CD1 4.35Å; Y903-I906 HydrophobicContact CE2-CD1 3.52Å; Y903-I906 HydrophobicContact CG-CD1 3.87Å; Y903-I906 WeakPolarHBondContact O-CD1 3.33Å; Y903-I906 WeakPolarHBondContact O-CG1 3.28Å; Y903-I906 PolarHBondContact O-N 2.79Å; Y903-Q935 PolarHBondContact OH-NE2 2.91Å
904	T	89.8	Confident	91.7	Very high	126 Å²	126	52.3 Å²	52.3	77%	0.773	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-74.9	-2.2	171.9	56.8	0	0	0	0	114.2	P902	P902-T904 WeakPolarHBondContact CG-OG1 3.42Å; P902-T904 PolarHBondContact O-N 3.37Å; P902-T904 VanDerWaalsContact O-N 3.13Å
905	G	85.6	Confident	91.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-99	7.3	173.7	0	0	0	0	0	113.7	P902 Y903 Y909	P902-G905 WeakPolarHBondContact O-CA 3.12Å; P902-G905 PolarHBondContact O-N 3Å; Y903-G905 PolarHBondContact O-N 3.19Å; G905-Y909 WeakPolarHBondContact CA-OH 3.23Å; G905-Y909 VanDerWaalsContact O-CE2 3.3Å; G905-Y909 WeakPolarHBondContact O-CE2 3.24Å; G905-Y909 PolarHBondContact O-OH 2.99Å; G905-Y909 VanDerWaalsContact O-OH 3.07Å
906	I	91.8	Very high	91.8	Very high	53 Å²	53	53.3 Å²	53.3	27%	0.272	27%	0.266	S	S	.	.			trans	-69.6	131.4	168.7	-66.5	166.9	0	0	0	108.6	Y849 Y903 I933 Q935	Y849-I906 HydrophobicContact CD1-CD1 3.59Å; Y849-I906 HydrophobicContact CD1-CG1 3.8Å; Y849-I906 HydrophobicContact CE1-CD1 3.89Å; Y849-I906 HydrophobicContact CG-CD1 4.19Å; Y849-I906 HydrophobicContact CG-CG1 4.09Å; Y903-I906 HydrophobicContact CD1-CD1 4.3Å; Y903-I906 HydrophobicContact CD2-CD1 3.46Å; Y903-I906 VanDerWaalsContact CD2-CD1 3.46Å; Y903-I906 HydrophobicContact CE1-CD1 4.35Å; Y903-I906 HydrophobicContact CE2-CD1 3.52Å; Y903-I906 HydrophobicContact CG-CD1 3.87Å; Y903-I906 WeakPolarHBondContact O-CD1 3.33Å; Y903-I906 WeakPolarHBondContact O-CG1 3.28Å; Y903-I906 PolarHBondContact O-N 2.79Å; I906-I933 WeakPolarHBondContact CG2-O 3.4Å; I906-Q935 HydrophobicContact CD1-CG 3.86Å
907	G	91.2	Very high	91.7	Very high	30 Å²	30	52.4 Å²	52.4	31%	0.309	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	150.3	-178.2	-174.5	0	0	0	0	0	112.6	I933	G907-I933 PolarHBondContact N-O 3.27Å; G907-I933 VanDerWaalsContact N-O 3.12Å; G907-I933 PolarHBondContact O-N 2.75Å
908	E	91.4	Very high	91.6	Very high	117 Å²	117	53.9 Å²	53.9	55%	0.547	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	132.8	178.2	-170.1	166.5	89.8	0	0	111	K844 I930	K844-E908 WeakPolarHBondContact CE-OE2 3.48Å; K844-E908 IonicContact NZ-OE2 3.63Å; K844-E908 PolarHBondContact NZ-OE2 2.83Å; E908-I930 HydrophobicContact CG-CG2 3.39Å; E908-I930 WeakPolarHBondContact OE2-CG2 3.5Å
909	Y	92.5	Very high	91.3	Very high	33 Å²	33	50.9 Å²	50.9	13%	0.129	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	112.5	-179.7	-66.7	-97.1	0	0	0	109.6	H883 Y885 F886 G905 I931 I933	H883-Y909 AromaticContact ND1-CE1 3.92Å; Y885-Y909 AromaticContact CD2-CE1 3.99Å; Y885-Y909 HydrophobicContact CD2-CE1 3.99Å; Y885-Y909 HydrophobicContact CE2-CE1 4.05Å; Y885-Y909 AromaticContact CE2-CZ 3.92Å; Y885-Y909 WeakPolarHBondContact CE2-OH 3.34Å; F886-Y909 HydrophobicContact CE2-CD1 4.32Å; F886-Y909 AromaticContact CE2-CG 3.99Å; F886-Y909 HydrophobicContact CE2-CG 3.99Å; F886-Y909 HydrophobicContact CZ-CD2 4.37Å; F886-Y909 HydrophobicContact CZ-CG 4.24Å; G905-Y909 WeakPolarHBondContact CA-OH 3.23Å; G905-Y909 VanDerWaalsContact O-CE2 3.3Å; G905-Y909 WeakPolarHBondContact O-CE2 3.24Å; G905-Y909 PolarHBondContact O-OH 2.99Å; G905-Y909 VanDerWaalsContact O-OH 3.07Å; Y909-I931 PolarHBondContact N-O 2.97Å; Y909-I931 PolarHBondContact O-N 2.81Å; Y909-I933 HydrophobicContact CD2-CD1 3.87Å; Y909-I933 HydrophobicContact CD2-CG1 4.11Å; Y909-I933 HydrophobicContact CE2-CB 4.44Å; Y909-I933 HydrophobicContact CE2-CD1 3.66Å; Y909-I933 HydrophobicContact CE2-CG1 4.15Å
910	L	92.3	Very high	91	Very high	84 Å²	84	54.2 Å²	54.2	44%	0.44	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	114.3	169.9	-175.6	67.8	0	0	0	108.8	G880 E928 I930	G880-L910 WeakPolarHBondContact CA-O 3.38Å; L910-E928 HydrophobicContact CD1-CB 3.98Å; L910-E928 HydrophobicContact CD1-CG 4.33Å; L910-I930 HydrophobicContact CD1-CG1 3.82Å
911	L	93.7	Very high	91.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	134.4	169.3	-58.2	-168.6	0	0	0	109.6	I877 G880 N881 F886 L895 L913 F929 I931	I877-L911 HydrophobicContact CD1-CD1 4.36Å; I877-L911 HydrophobicContact CG2-CD1 4.41Å; I877-L911 HydrophobicContact CG2-CD2 4.49Å; G880-L911 VanDerWaalsContact C-CD2 3.4Å; N881-L911 HydrophobicContact CB-CD2 3.87Å; F886-L911 HydrophobicContact CB-CD1 4.37Å; F886-L911 HydrophobicContact CD2-CD1 3.89Å; F886-L911 HydrophobicContact CD2-CD2 4.05Å; F886-L911 HydrophobicContact CD2-CG 4.38Å; F886-L911 HydrophobicContact CE2-CD2 4.35Å; F886-L911 HydrophobicContact CG-CD1 4.3Å; L895-L911 HydrophobicContact CD2-CD1 4.44Å; L911-L913 HydrophobicContact CB-CD2 4.13Å; L911-L913 HydrophobicContact CD1-CD2 4.35Å; L911-F929 PolarHBondContact N-O 3.21Å; L911-F929 PolarHBondContact O-N 3.06Å; L911-I931 HydrophobicContact CD1-CD1 3.52Å; L911-I931 HydrophobicContact CG-CD1 3.93Å
912	T	93.9	Very high	91.1	Very high	27 Å²	27	56.8 Å²	56.8	17%	0.166	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	124.5	158.5	-50.4	0	0	0	0	108.2	H878 S879 L926 T927	H878-T912 HydrophobicContact CB-CG2 4.13Å; H878-T912 WeakPolarHBondContact CB-O 3.23Å; H878-T912 PolarHBondContact N-O 3.46Å; S879-T912 PolarHBondContact N-O 2.85Å; S879-T912 PolarHBondContact O-N 3.05Å; S879-T912 VanDerWaalsContact OG-CB 3.24Å; S879-T912 WeakPolarHBondContact OG-CB 3.33Å; S879-T912 PolarHBondContact OG-OG1 2.85Å; T912-L926 HydrophobicContact CG2-CB 4.04Å; T912-L926 HydrophobicContact CG2-CD1 4.43Å; T912-L926 HydrophobicContact CG2-CD2 4.4Å; T912-T927 CarbonylContact C-O 3.54Å; T912-T927 WeakPolarHBondContact CA-O 3.17Å
913	L	94.3	Very high	91.1	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	143.4	177.3	-55.3	177.8	0	0	0	109.6	F832 P835 V860 I877 L888 L911 L926 T927 F929	F832-L913 HydrophobicContact CE1-CB 4.44Å; F832-L913 HydrophobicContact CZ-CB 4.26Å; P835-L913 HydrophobicContact CG-CD1 4.23Å; V860-L913 HydrophobicContact CG1-CD1 4.14Å; V860-L913 HydrophobicContact CG2-CD1 3.76Å; I877-L913 HydrophobicContact CG1-CD2 4.07Å; L888-L913 HydrophobicContact CD2-CD2 4.34Å; L911-L913 HydrophobicContact CB-CD2 4.13Å; L911-L913 HydrophobicContact CD1-CD2 4.35Å; L913-L926 CarbonylContact O-C 3.51Å; L913-L926 VanDerWaalsContact O-CA 3.29Å; L913-L926 WeakPolarHBondContact O-CA 3.3Å; L913-T927 HydrophobicContact CB-CG2 3.96Å; L913-T927 HydrophobicContact CD1-CG2 4.45Å; L913-T927 PolarHBondContact N-O 3.11Å; L913-T927 PolarHBondContact O-N 2.93Å; L913-F929 HydrophobicContact CD1-CB 3.65Å; L913-F929 HydrophobicContact CD1-CD1 4.37Å; L913-F929 HydrophobicContact CD1-CG 4.09Å; L913-F929 HydrophobicContact CG-CB 4.08Å
914	E	94.7	Very high	91.4	Very high	26 Å²	26	56.5 Å²	56.5	12%	0.121	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130.9	178.6	172	-174.1	128.9	0	0	109.1	Y875 F876 H878 R916 T925 L926	Y875-E914 CarbonylContact C-O 3.59Å; Y875-E914 WeakPolarHBondContact CA-O 3.18Å; F876-E914 HydrophobicContact CB-CB 4.18Å; F876-E914 PolarHBondContact N-O 2.94Å; F876-E914 PolarHBondContact O-N 3.25Å; H878-E914 HydrophobicContact CB-CB 4.18Å; H878-E914 IonicContact CE1-OE2 3.44Å; H878-E914 IonicContact CG-OE2 3.8Å; H878-E914 IonicContact ND1-OE2 3.7Å; H878-E914 PolarHBondContact ND1-OE2 3.05Å; E914-R916 IonicContact OE1-NH1 3.18Å; E914-R916 PolarHBondContact OE1-NH1 2.75Å; E914-T925 WeakPolarHBondContact CA-O 3.27Å; E914-L926 HydrophobicContact CB-CD2 3.69Å; E914-L926 HydrophobicContact CG-CD2 4.07Å
915	A	93.9	Very high	91.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.9	165.8	0	0	0	0	0	107.1	P830 F832 A862 I873 Y875 F924 T925	P830-A915 HydrophobicContact CB-CB 3.97Å; F832-A915 HydrophobicContact CD2-CB 4.42Å; F832-A915 HydrophobicContact CE1-CB 3.82Å; F832-A915 HydrophobicContact CE2-CB 3.69Å; F832-A915 HydrophobicContact CZ-CB 3.36Å; A862-A915 HydrophobicContact CB-CB 3.82Å; I873-A915 HydrophobicContact CG2-CB 3.95Å; Y875-A915 HydrophobicContact CD1-CB 4.38Å; Y875-A915 HydrophobicContact CE1-CB 4.44Å; A915-F924 CarbonylContact O-C 3.42Å; A915-F924 WeakPolarHBondContact O-CA 3.44Å; A915-F924 WeakPolarHBondContact O-CB 3.17Å; A915-T925 PolarHBondContact N-O 3.06Å; A915-T925 PolarHBondContact O-N 2.78Å
916	R	93.9	Very high	92	Very high	75 Å²	75	56.4 Å²	56.4	28%	0.283	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	151.1	177.8	72.1	176	-166.3	-127.3	6.8	110.8	I873 L874 F876 E914 Y922 R923 F924	I873-R916 CarbonylContact C-O 3.5Å; I873-R916 VanDerWaalsContact CA-O 3.3Å; I873-R916 WeakPolarHBondContact CA-O 3.43Å; L874-R916 HydrophobicContact CB-CG 4.47Å; L874-R916 PolarHBondContact N-O 2.83Å; L874-R916 PolarHBondContact O-N 3.45Å; F876-R916 HydrophobicContact CD2-CG 4.33Å; F876-R916 HydrophobicContact CE2-CG 3.95Å; F876-R916 VanDerWaalsContact CZ-CZ 3.46Å; E914-R916 IonicContact OE1-NH1 3.18Å; E914-R916 PolarHBondContact OE1-NH1 2.75Å; R916-Y922 HydrophobicContact CB-CD2 4.43Å; R916-R923 VanDerWaalsContact CA-O 3.24Å; R916-R923 WeakPolarHBondContact CA-O 3.27Å; R916-R923 WeakPolarHBondContact CB-O 3.24Å; R916-F924 HydrophobicContact CB-CB 3.53Å
917	D	92.6	Very high	91.9	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.011	27%	0.27	C	S	.	.			trans	-74.3	-172.2	172.5	62	49.7	0	0	0	112.1	N826 P830 N870 T872 G919 Y922 R923	N826-D917 PolarHBondContact ND2-OD2 3.17Å; N826-D917 PolarHBondContact OD1-OD2 2.92Å; P830-D917 HydrophobicContact CG-CB 4.28Å; N870-D917 WeakPolarHBondContact O-CB 3.03Å; T872-D917 CarbonylContact O-C 3.6Å; T872-D917 VanDerWaalsContact O-C 3.31Å; T872-D917 WeakPolarHBondContact O-CA 3.2Å; D917-G919 PolarHBondContact OD1-N 3.47Å; D917-Y922 WeakPolarHBondContact OD1-CA 3.21Å; D917-Y922 WeakPolarHBondContact OD1-CB 3.22Å; D917-R923 VanDerWaalsContact CG-N 3.32Å; D917-R923 PolarHBondContact N-O 3.38Å; D917-R923 PolarHBondContact OD1-N 2.85Å; D917-R923 VanDerWaalsContact OD2-CA 3.29Å; D917-R923 WeakPolarHBondContact OD2-CA 2.83Å; D917-R923 WeakPolarHBondContact OD2-CB 3.37Å; D917-R923 PolarHBondContact OD2-N 2.8Å
918	C	90.8	Very high	91.9	Very high	31 Å²	31	58.3 Å²	58.3	21%	0.209	28%	0.281	C	S	.	.	S	Bend	trans	-111.5	7.2	166.8	-61.7	0	0	0	0	112.9	E869 T872 Q920	E869-C918 HydrophobicContact CB-CB 4Å; E869-C918 CarbonylContact O-C 3.51Å; E869-C918 WeakPolarHBondContact O-CA 3.2Å; E869-C918 WeakPolarHBondContact O-CB 3.24Å; E869-C918 PolarHBondContact O-N 2.92Å; T872-C918 PolarHBondContact O-N 3.22Å; T872-C918 VanDerWaalsContact O-N 3.13Å; T872-C918 PolarHBondContact O-SG 2.91Å; C918-Q920 PolarHBondContact O-NE2 2.74Å
919	G	85.6	Confident	92	Very high	2 Å²	2	52.7 Å²	52.7	2%	0.021	26%	0.255	C	S	.	.			trans	-64.8	170.1	-177.8	0	0	0	0	0	113.6	E869 N870 D917 P921 Y922	E869-G919 PolarHBondContact O-N 2.66Å; N870-G919 WeakPolarHBondContact OD1-CA 3.18Å; D917-G919 PolarHBondContact OD1-N 3.47Å; G919-P921 CarbonylContact O-C 3.53Å; G919-Y922 VanDerWaalsContact O-CA 3.24Å; G919-Y922 WeakPolarHBondContact O-CA 3.36Å; G919-Y922 WeakPolarHBondContact O-CB 3.29Å; G919-Y922 PolarHBondContact O-N 3Å
920	Q	84.6	Confident	91.9	Very high	159 Å²	159	52.9 Å²	52.9	74%	0.743	26%	0.257	S	S	*	.	S	Bend	trans	-133.5	103.8	-176.3	-61.4	-59.5	-49.8	0	0	110.9	C918	C918-Q920 PolarHBondContact O-NE2 2.74Å
921	P	89.1	Confident	91.9	Very high	105 Å²	105	48.9 Å²	48.9	68%	0.682	24%	0.237	S	C	*	.	S	Bend	cis	-68.9	148	-0.3	31.2	-36.3	0	0	0	112.3	N826 G919	N826-P921 PolarHBondContact ND2-O 3.13Å; G919-P921 CarbonylContact O-C 3.53Å
922	Y	91.4	Very high	91.8	Very high	131 Å²	131	52.1 Å²	52.1	51%	0.514	25%	0.252	S	S	.	.			trans	-75.3	149.9	177.1	74.6	-91.9	0	0	0	111.3	R916 D917 G919 F924	R916-Y922 HydrophobicContact CB-CD2 4.43Å; D917-Y922 WeakPolarHBondContact OD1-CA 3.21Å; D917-Y922 WeakPolarHBondContact OD1-CB 3.22Å; G919-Y922 VanDerWaalsContact O-CA 3.24Å; G919-Y922 WeakPolarHBondContact O-CA 3.36Å; G919-Y922 WeakPolarHBondContact O-CB 3.29Å; G919-Y922 PolarHBondContact O-N 3Å; Y922-F924 HydrophobicContact CD2-CD1 4.34Å; Y922-F924 AromaticContact CE2-CD1 3.9Å; Y922-F924 HydrophobicContact CE2-CD1 3.9Å; Y922-F924 HydrophobicContact CE2-CE1 4.44Å
923	R	92.4	Very high	91.7	Very high	89 Å²	89	50.9 Å²	50.9	34%	0.336	24%	0.244	S	C	.	.			trans	-122.3	161.7	174	-54.9	172.3	171.5	-141.3	11.2	109.9	N826 D827 N828 R916 D917	N826-R923 PolarHBondContact O-NE 2.98Å; N826-R923 PolarHBondContact O-NH2 3.02Å; D827-R923 VanDerWaalsContact CA-NH2 3.34Å; D827-R923 PolarHBondContact O-NH1 2.82Å; D827-R923 PolarHBondContact O-NH2 2.96Å; D827-R923 VanDerWaalsContact O-NH2 3.13Å; N828-R923 WeakPolarHBondContact O-CD 3.48Å; N828-R923 PolarHBondContact O-NE 3.45Å; N828-R923 PolarHBondContact O-NH1 2.78Å; R916-R923 VanDerWaalsContact CA-O 3.24Å; R916-R923 WeakPolarHBondContact CA-O 3.27Å; R916-R923 WeakPolarHBondContact CB-O 3.24Å; D917-R923 VanDerWaalsContact CG-N 3.32Å; D917-R923 PolarHBondContact N-O 3.38Å; D917-R923 PolarHBondContact OD1-N 2.85Å; D917-R923 VanDerWaalsContact OD2-CA 3.29Å; D917-R923 WeakPolarHBondContact OD2-CA 2.83Å; D917-R923 WeakPolarHBondContact OD2-CB 3.37Å; D917-R923 PolarHBondContact OD2-N 2.8Å
924	F	94.1	Very high	91.6	Very high	95 Å²	95	52.7 Å²	52.7	42%	0.417	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	156.7	-172.3	69.8	-81.3	0	0	0	112.4	A915 R916 Y922 L926	A915-F924 CarbonylContact O-C 3.42Å; A915-F924 WeakPolarHBondContact O-CA 3.44Å; A915-F924 WeakPolarHBondContact O-CB 3.17Å; R916-F924 HydrophobicContact CB-CB 3.53Å; Y922-F924 HydrophobicContact CD2-CD1 4.34Å; Y922-F924 AromaticContact CE2-CD1 3.9Å; Y922-F924 HydrophobicContact CE2-CD1 3.9Å; Y922-F924 HydrophobicContact CE2-CE1 4.44Å; F924-L926 HydrophobicContact CD2-CD2 4.19Å; F924-L926 HydrophobicContact CD2-CG 4.31Å; F924-L926 HydrophobicContact CE2-CD1 4.49Å; F924-L926 HydrophobicContact CE2-CD2 4.34Å; F924-L926 HydrophobicContact CE2-CG 4.23Å
925	T	93.8	Very high	91.5	Very high	42 Å²	42	56.2 Å²	56.2	26%	0.258	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	159.8	165.4	66.5	0	0	0	0	111.4	P830 F832 E914 A915	P830-T925 WeakPolarHBondContact O-CB 3.38Å; P830-T925 WeakPolarHBondContact O-CG2 3.24Å; P830-T925 PolarHBondContact O-OG1 2.88Å; F832-T925 WeakPolarHBondContact CE2-OG1 3.5Å; E914-T925 WeakPolarHBondContact CA-O 3.27Å; A915-T925 PolarHBondContact N-O 3.06Å; A915-T925 PolarHBondContact O-N 2.78Å
926	L	93.7	Very high	91.1	Very high	82 Å²	82	57.5 Å²	57.5	43%	0.429	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143.8	176.4	-58.2	179	0	0	0	109.4	H878 T912 L913 E914 F924	H878-L926 HydrophobicContact CB-CD2 4.2Å; T912-L926 HydrophobicContact CG2-CB 4.04Å; T912-L926 HydrophobicContact CG2-CD1 4.43Å; T912-L926 HydrophobicContact CG2-CD2 4.4Å; L913-L926 CarbonylContact O-C 3.51Å; L913-L926 VanDerWaalsContact O-CA 3.29Å; L913-L926 WeakPolarHBondContact O-CA 3.3Å; E914-L926 HydrophobicContact CB-CD2 3.69Å; E914-L926 HydrophobicContact CG-CD2 4.07Å; F924-L926 HydrophobicContact CD2-CD2 4.19Å; F924-L926 HydrophobicContact CD2-CG 4.31Å; F924-L926 HydrophobicContact CE2-CD1 4.49Å; F924-L926 HydrophobicContact CE2-CD2 4.34Å; F924-L926 HydrophobicContact CE2-CG 4.23Å
927	T	90.9	Very high	90.7	Very high	9 Å²	9	59 Å²	59	6%	0.055	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	158.8	172.8	-166.9	0	0	0	0	110.9	F832 P835 T912 L913	F832-T927 HydrophobicContact CB-CG2 4.45Å; F832-T927 HydrophobicContact CD1-CG2 3.69Å; F832-T927 HydrophobicContact CD2-CG2 3.55Å; F832-T927 HydrophobicContact CE1-CG2 3.65Å; F832-T927 HydrophobicContact CE2-CG2 3.51Å; F832-T927 HydrophobicContact CG-CG2 3.63Å; F832-T927 HydrophobicContact CZ-CG2 3.54Å; P835-T927 HydrophobicContact CG-CG2 3.65Å; T912-T927 CarbonylContact C-O 3.54Å; T912-T927 WeakPolarHBondContact CA-O 3.17Å; L913-T927 HydrophobicContact CB-CG2 3.96Å; L913-T927 HydrophobicContact CD1-CG2 4.45Å; L913-T927 PolarHBondContact N-O 3.11Å; L913-T927 PolarHBondContact O-N 2.93Å
928	E	90.7	Very high	90.3	Very high	114 Å²	114	59.4 Å²	59.4	53%	0.533	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	137.6	178.7	-71.6	-168.9	156.6	0	0	111.4	L910	L910-E928 HydrophobicContact CD1-CB 3.98Å; L910-E928 HydrophobicContact CD1-CG 4.33Å
929	F	92.4	Very high	89.8	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	120.9	179.5	-165.8	-122.3	0	0	0	112.4	Y834 P835 T843 T845 F857 T858 L895 L911 L913 I931	Y834-F929 HydrophobicContact CE1-CE2 4.12Å; Y834-F929 HydrophobicContact CE1-CZ 4.22Å; Y834-F929 AromaticContact CZ-CE2 3.95Å; Y834-F929 WeakPolarHBondContact OH-CE2 3.35Å; P835-F929 HydrophobicContact CB-CD2 3.55Å; P835-F929 HydrophobicContact CB-CE2 4.04Å; P835-F929 HydrophobicContact CG-CB 4.13Å; P835-F929 HydrophobicContact CG-CD2 3.69Å; P835-F929 HydrophobicContact CG-CE2 4.48Å; P835-F929 HydrophobicContact CG-CG 4.2Å; T843-F929 WeakPolarHBondContact O-CD2 3.5Å; T845-F929 HydrophobicContact CG2-CE1 3.61Å; T845-F929 HydrophobicContact CG2-CE2 4.47Å; T845-F929 HydrophobicContact CG2-CZ 3.42Å; T845-F929 VanDerWaalsContact CG2-CZ 3.42Å; F857-F929 HydrophobicContact CE2-CE1 4.46Å; T858-F929 HydrophobicContact CG2-CE1 3.79Å; T858-F929 HydrophobicContact CG2-CZ 3.81Å; L895-F929 HydrophobicContact CD2-CD1 3.93Å; L895-F929 HydrophobicContact CD2-CE1 3.83Å; L911-F929 PolarHBondContact N-O 3.21Å; L911-F929 PolarHBondContact O-N 3.06Å; L913-F929 HydrophobicContact CD1-CB 3.65Å; L913-F929 HydrophobicContact CD1-CD1 4.37Å; L913-F929 HydrophobicContact CD1-CG 4.09Å; L913-F929 HydrophobicContact CG-CB 4.08Å; F929-I931 HydrophobicContact CD1-CD1 4.15Å; F929-I931 HydrophobicContact CD1-CG1 3.79Å; F929-I931 HydrophobicContact CE1-CD1 4.32Å; F929-I931 HydrophobicContact CE1-CG1 3.8Å
930	I	91.3	Very high	89.2	Confident	36 Å²	36	62.8 Å²	62.8	19%	0.185	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	120.1	-175.3	-57.8	173.3	0	0	0	109.5	T843 K844 T845 E908 L910	T843-I930 PolarHBondContact O-N 3.22Å; K844-I930 CarbonylContact C-O 3.44Å; K844-I930 VanDerWaalsContact CA-O 3.31Å; K844-I930 WeakPolarHBondContact CA-O 3.49Å; K844-I930 HydrophobicContact CB-CB 4.1Å; K844-I930 HydrophobicContact CD-CB 4.32Å; K844-I930 HydrophobicContact CD-CG2 3.81Å; K844-I930 HydrophobicContact CG-CB 4.01Å; K844-I930 HydrophobicContact CG-CG2 3.9Å; T845-I930 PolarHBondContact N-O 2.77Å; E908-I930 HydrophobicContact CG-CG2 3.39Å; E908-I930 WeakPolarHBondContact OE2-CG2 3.5Å; L910-I930 HydrophobicContact CD1-CG1 3.82Å
931	I	91.9	Very high	88	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	110.4	175.5	-53.1	164.6	0	0	0	108.8	T845 V847 F857 F886 L895 Y909 L911 F929 I933	T845-I931 HydrophobicContact CG2-CB 4.5Å; T845-I931 HydrophobicContact CG2-CG1 4.12Å; T845-I931 HydrophobicContact CG2-CG2 4.3Å; V847-I931 HydrophobicContact CG2-CG2 3.92Å; F857-I931 HydrophobicContact CE2-CD1 4.06Å; F857-I931 HydrophobicContact CE2-CG1 4.22Å; F857-I931 HydrophobicContact CE2-CG2 4.24Å; F857-I931 HydrophobicContact CZ-CD1 3.85Å; F857-I931 HydrophobicContact CZ-CG1 4.49Å; F857-I931 HydrophobicContact CZ-CG2 4.49Å; F886-I931 HydrophobicContact CD1-CD1 3.91Å; F886-I931 HydrophobicContact CD2-CD1 3.89Å; F886-I931 HydrophobicContact CE1-CB 4.39Å; F886-I931 HydrophobicContact CE1-CD1 3.75Å; F886-I931 HydrophobicContact CE1-CG2 3.75Å; F886-I931 HydrophobicContact CE2-CD1 3.72Å; F886-I931 HydrophobicContact CG-CD1 3.96Å; F886-I931 HydrophobicContact CZ-CB 3.95Å; F886-I931 HydrophobicContact CZ-CD1 3.63Å; F886-I931 HydrophobicContact CZ-CG1 4.42Å; F886-I931 HydrophobicContact CZ-CG2 3.69Å; L895-I931 HydrophobicContact CD2-CD1 4.03Å; Y909-I931 PolarHBondContact N-O 2.97Å; Y909-I931 PolarHBondContact O-N 2.81Å; L911-I931 HydrophobicContact CD1-CD1 3.52Å; L911-I931 HydrophobicContact CG-CD1 3.93Å; F929-I931 HydrophobicContact CD1-CD1 4.15Å; F929-I931 HydrophobicContact CD1-CG1 3.79Å; F929-I931 HydrophobicContact CE1-CD1 4.32Å; F929-I931 HydrophobicContact CE1-CG1 3.8Å; I931-I933 HydrophobicContact CG2-CG1 4.39Å
932	E	91.9	Very high	86.5	Confident	68 Å²	68	65.8 Å²	65.8	32%	0.318	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	114.6	171.3	-173.2	175.5	157.1	0	0	109.4	K844 T845 I846 V847	K844-E932 WeakPolarHBondContact CE-OE2 3.42Å; K844-E932 IonicContact NZ-OE2 2.67Å; K844-E932 PolarHBondContact NZ-OE2 2.95Å; T845-E932 PolarHBondContact O-N 2.77Å; I846-E932 WeakPolarHBondContact CA-O 3.35Å; I846-E932 HydrophobicContact CG1-CB 4.32Å; V847-E932 PolarHBondContact N-O 3.14Å
933	I	92.4	Very high	84.6	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	113.7	172.6	-63.3	-178.6	0	0	0	108.6	V847 F886 I901 I906 G907 Y909 I931	V847-I933 CarbonylContact O-C 3.55Å; V847-I933 VanDerWaalsContact O-CA 3.28Å; V847-I933 WeakPolarHBondContact O-CA 3.36Å; F886-I933 HydrophobicContact CE1-CD1 4.15Å; F886-I933 HydrophobicContact CZ-CD1 3.78Å; F886-I933 HydrophobicContact CZ-CG1 4.29Å; I901-I933 HydrophobicContact CD1-CD1 3.78Å; I901-I933 HydrophobicContact CD1-CG2 4.47Å; I901-I933 HydrophobicContact CG1-CD1 4.3Å; I901-I933 HydrophobicContact CG2-CD1 4.23Å; I901-I933 HydrophobicContact CG2-CG2 4.13Å; I906-I933 WeakPolarHBondContact CG2-O 3.4Å; G907-I933 PolarHBondContact N-O 3.27Å; G907-I933 VanDerWaalsContact N-O 3.12Å; G907-I933 PolarHBondContact O-N 2.75Å; Y909-I933 HydrophobicContact CD2-CD1 3.87Å; Y909-I933 HydrophobicContact CD2-CG1 4.11Å; Y909-I933 HydrophobicContact CE2-CB 4.44Å; Y909-I933 HydrophobicContact CE2-CD1 3.66Å; Y909-I933 HydrophobicContact CE2-CG1 4.15Å; I931-I933 HydrophobicContact CG2-CG1 4.39Å
934	D	91.7	Very high	82.4	Confident	39 Å²	39	61.6 Å²	61.6	21%	0.209	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	179.6	-169.6	101.4	-56.8	0	0	0	113.5	I846 V847 Y849 S936	I846-D934 HydrophobicContact CG2-CB 3.92Å; V847-D934 PolarHBondContact O-N 2.84Å; Y849-D934 WeakPolarHBondContact CD1-O 3.03Å; Y849-D934 PolarHBondContact N-O 2.89Å; D934-S936 VanDerWaalsContact CG-N 3.29Å; D934-S936 VanDerWaalsContact OD1-CB 3.22Å; D934-S936 WeakPolarHBondContact OD1-CB 3.19Å; D934-S936 PolarHBondContact OD1-N 2.88Å; D934-S936 PolarHBondContact OD1-OG 3.45Å; D934-S936 WeakPolarHBondContact OD2-CB 3.47Å; D934-S936 PolarHBondContact OD2-N 2.78Å; D934-S936 PolarHBondContact OD2-OG 2.77Å
935	Q	91.4	Very high	79.6	Confident	100 Å²	100	64.2 Å²	64.2	47%	0.467	34%	0.335	S	S	.	.			trans	-94.8	10.5	-179	-57.4	-156.7	18.7	0	0	115.1	Y849 K850 Y903 I906	Y849-Q935 HydrophobicContact CD1-CG 4.34Å; Y849-Q935 HydrophobicContact CE1-CB 4.24Å; Y849-Q935 HydrophobicContact CE1-CG 4.07Å; K850-Q935 PolarHBondContact NZ-O 3.19Å; Y903-Q935 PolarHBondContact OH-NE2 2.91Å; I906-Q935 HydrophobicContact CD1-CG 3.86Å
936	S	87.1	Confident	77.3	Confident	26 Å²	26	69.2 Å²	69.2	18%	0.182	36%	0.358	C	S	.	.	S	Bend	trans	-55.7	164.6	179.7	62.4	0	0	0	0	113.9	S848 K850 D934	S848-S936 WeakPolarHBondContact CB-OG 3.38Å; S848-S936 PolarHBondContact OG-O 3.47Å; K850-S936 PolarHBondContact NZ-O 3.1Å; D934-S936 VanDerWaalsContact CG-N 3.29Å; D934-S936 VanDerWaalsContact OD1-CB 3.22Å; D934-S936 WeakPolarHBondContact OD1-CB 3.19Å; D934-S936 PolarHBondContact OD1-N 2.88Å; D934-S936 PolarHBondContact OD1-OG 3.45Å; D934-S936 WeakPolarHBondContact OD2-CB 3.47Å; D934-S936 PolarHBondContact OD2-N 2.78Å; D934-S936 PolarHBondContact OD2-OG 2.77Å
937	P	84.3	Confident	74.6	Confident	108 Å²	108	71.2 Å²	71.2	70%	0.701	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-60.9	142.1	165.5	-19.7	33.4	0	0	0	110.8	K939	P937-K939 PolarHBondContact O-N 2.59Å
938	S	85.7	Confident	71.9	Confident	9 Å²	9	79.5 Å²	79.5	6%	0.063	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-65.7	122.4	175.9	154.6	0	0	0	0	110.4	E851 A940 Y941	E851-S938 WeakPolarHBondContact OE1-CA 3.48Å; E851-S938 WeakPolarHBondContact OE2-CA 3.44Å; E851-S938 VanDerWaalsContact OE2-CB 3.25Å; E851-S938 WeakPolarHBondContact OE2-CB 3.48Å; E851-S938 PolarHBondContact OE2-OG 2.88Å; S938-A940 PolarHBondContact O-N 2.65Å; S938-A940 PolarHBondContact OG-N 2.83Å; S938-Y941 PolarHBondContact O-N 3.02Å; S938-Y941 WeakPolarHBondContact OG-CD2 3.44Å
939	K	80.4	Confident	69.2	Low	89 Å²	89	80.1 Å²	80.1	39%	0.387	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-28.8	178.9	-63.8	165.9	-176.6	173.1	0	110.7	I846 E851 Y855 P937 Y941 L942	I846-K939 PolarHBondContact O-NZ 2.88Å; E851-K939 WeakPolarHBondContact OE1-CB 3.21Å; E851-K939 PolarHBondContact OE1-N 2.86Å; E851-K939 PolarHBondContact OE2-N 3.05Å; Y855-K939 WeakPolarHBondContact OH-CB 3.02Å; P937-K939 PolarHBondContact O-N 2.59Å; K939-Y941 PolarHBondContact O-N 3.11Å; K939-L942 PolarHBondContact O-N 3.15Å
940	A	71	Confident	66.3	Low	15 Å²	15	83.1 Å²	83.1	12%	0.124	42%	0.419	C	S	.	.	H	α-helix	trans	-56	-30.7	175.4	0	0	0	0	0	113.8	E851 P852 Y855 S938 L942 T943 T944	E851-A940 WeakPolarHBondContact OE2-CB 3.35Å; E851-A940 PolarHBondContact OE2-N 3.24Å; E851-A940 VanDerWaalsContact OE2-N 3.07Å; P852-A940 HydrophobicContact CG-CB 3.89Å; Y855-A940 HydrophobicContact CD2-CB 3.71Å; Y855-A940 HydrophobicContact CE2-CB 3.95Å; S938-A940 PolarHBondContact O-N 2.65Å; S938-A940 PolarHBondContact OG-N 2.83Å; A940-L942 PolarHBondContact O-N 3.05Å; A940-T943 PolarHBondContact O-OG1 3.18Å; A940-T943 VanDerWaalsContact O-OG1 3.05Å; A940-T944 WeakPolarHBondContact O-CG2 3.33Å
941	Y	61.5	Low	63.3	Low	171 Å²	171	89.6 Å²	89.6	67%	0.671	45%	0.454	S	S	*	.	H	α-helix	trans	-68.2	-33.3	177	-75.4	-87.4	0	0	0	113	S938 K939 T943 T944	S938-Y941 PolarHBondContact O-N 3.02Å; S938-Y941 WeakPolarHBondContact OG-CD2 3.44Å; K939-Y941 PolarHBondContact O-N 3.11Å; Y941-T943 PolarHBondContact O-N 3.19Å; Y941-T944 PolarHBondContact O-N 3.04Å; Y941-T944 PolarHBondContact O-OG1 3.12Å
942	L	56	Low	60.7	Low	156 Å²	156	94.2 Å²	94.2	82%	0.817	49%	0.487	S	S	*	.	H	α-helix	trans	-67.1	-21.2	-178	-68.4	170.1	0	0	0	113	K939 A940	K939-L942 PolarHBondContact O-N 3.15Å; A940-L942 PolarHBondContact O-N 3.05Å
943	T	52	Low	57.8	Low	69 Å²	69	98.9 Å²	98.9	42%	0.423	51%	0.514	S	S	.	.	H	α-helix	trans	-91.3	-11.9	178.2	63.8	0	0	0	0	113.5	A940 Y941 N945 I946 Y947	A940-T943 PolarHBondContact O-OG1 3.18Å; A940-T943 VanDerWaalsContact O-OG1 3.05Å; Y941-T943 PolarHBondContact O-N 3.19Å; T943-N945 VanDerWaalsContact C-N 3.29Å; T943-N945 PolarHBondContact O-N 3.47Å; T943-N945 VanDerWaalsContact O-N 3.15Å; T943-I946 PolarHBondContact O-N 3.06Å; T943-I946 VanDerWaalsContact O-N 3.15Å; T943-Y947 WeakPolarHBondContact O-CD2 3.16Å
944	T	45.6	Very low	54.8	Low	64 Å²	64	106.3 Å²	106.3	39%	0.393	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-62.9	-25	-169.3	54.4	0	0	0	0	115.7	A940 Y941 I946 Y947	A940-T944 WeakPolarHBondContact O-CG2 3.33Å; Y941-T944 PolarHBondContact O-N 3.04Å; Y941-T944 PolarHBondContact O-OG1 3.12Å; T944-I946 PolarHBondContact O-N 3.22Å; T944-I946 VanDerWaalsContact O-N 3.11Å; T944-Y947 PolarHBondContact O-N 3.25Å
945	N	36.1	Very low	51.9	Low	150 Å²	150	111.9 Å²	111.9	80%	0.802	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-67.1	-7.9	177	-82.1	-10	0	0	0	114.3	T943	T943-N945 VanDerWaalsContact C-N 3.29Å; T943-N945 PolarHBondContact O-N 3.47Å; T943-N945 VanDerWaalsContact O-N 3.15Å
946	I	44.5	Very low	49.2	Very low	147 Å²	147	114.6 Å²	114.6	75%	0.754	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-99.4	-11	173.7	-63.2	176.2	0	0	0	111.5	T943 T944	T943-I946 PolarHBondContact O-N 3.06Å; T943-I946 VanDerWaalsContact O-N 3.15Å; T944-I946 PolarHBondContact O-N 3.22Å; T944-I946 VanDerWaalsContact O-N 3.11Å
947	Y	37.4	Very low	46.5	Very low	124 Å²	124	118.6 Å²	118.6	49%	0.486	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.8	-1.3	-166.9	-73.4	-61	0	0	0	116.8	T943 T944 L949 Y958	T943-Y947 WeakPolarHBondContact O-CD2 3.16Å; T944-Y947 PolarHBondContact O-N 3.25Å; Y947-L949 PolarHBondContact O-N 2.79Å; Y947-Y958 AromaticContact CD1-CD1 3.87Å; Y947-Y958 HydrophobicContact CD1-CD1 3.87Å; Y947-Y958 AromaticContact CD1-CE1 3.55Å; Y947-Y958 HydrophobicContact CD1-CE1 3.55Å; Y947-Y958 AromaticContact CE1-CD1 3.7Å; Y947-Y958 HydrophobicContact CE1-CD1 3.7Å; Y947-Y958 AromaticContact CE1-CE1 3.63Å; Y947-Y958 HydrophobicContact CE1-CE1 3.63Å; Y947-Y958 HydrophobicContact CG-CE1 4.31Å
948	Q	35.7	Very low	44	Very low	182 Å²	182	122.1 Å²	122.1	85%	0.85	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	9.6	-179	-70	-163.4	-10.4	0	0	115.8
949	L	33.4	Very low	41.8	Very low	128 Å²	128	123.5 Å²	123.5	67%	0.67	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	13.5	-177.5	-114.5	168.5	0	0	0	114.5	Y947	Y947-L949 PolarHBondContact O-N 2.79Å
950	H	30.6	Very low	39.7	Very low	63 Å²	63	121 Å²	121	29%	0.292	62%	0.623	S	S	.	*			trans	-137.7	109.6	178.5	-124.9	-107.8	0	0	0	113.8	N957 A960	H950-N957 PolarHBondContact CE1-O 2.89Å; H950-N957 VanDerWaalsContact CE1-O 3.28Å; H950-N957 PolarHBondContact ND1-O 2.81Å; H950-A960 PolarHBondContact CD2-N 2.82Å; H950-A960 WeakPolarHBondContact NE2-CA 3.22Å; H950-A960 WeakPolarHBondContact NE2-CB 3.43Å; H950-A960 PolarHBondContact NE2-N 2.82Å
951	N	29.2	Very low	37.9	Very low	171 Å²	171	122.3 Å²	122.3	91%	0.914	63%	0.631	S	S	*	*			trans	-162.2	91.1	169.5	-118.7	-19	0	0	0	110.7
952	S	36.2	Very low	36.9	Very low	98 Å²	98	115.5 Å²	115.5	69%	0.685	61%	0.613	S	S	*	*	S	Bend	trans	-151.5	150.8	164.3	64.8	0	0	0	0	109.8	E954	S952-E954 PolarHBondContact O-N 2.88Å
953	N	31.3	Very low	36.4	Very low	166 Å²	166	113.3 Å²	113.3	89%	0.888	60%	0.602	S	S	*	*	S	Bend	trans	-77.6	73.1	-155.9	-65.6	-22.9	0	0	0	115
954	E	30.6	Very low	36.2	Very low	158 Å²	158	113.6 Å²	113.6	74%	0.738	60%	0.604	S	S	*	*	S	Bend	trans	-149.3	102.9	146.3	-118.3	173.3	-148.7	0	0	109.6	S952	S952-E954 PolarHBondContact O-N 2.88Å
955	I	30.8	Very low	36.7	Very low	155 Å²	155	115.6 Å²	115.6	80%	0.795	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	123.7	-178.8	-57.7	175.4	0	0	0	106.7
956	M	34.7	Very low	37.9	Very low	158 Å²	158	112.5 Å²	112.5	78%	0.778	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	cis	-142.2	47.9	40.8	-152.8	163	-84	0	0	113.8	Y958	M956-Y958 PolarHBondContact O-N 2.93Å; M956-Y958 VanDerWaalsContact O-N 3.07Å
957	N	29.7	Very low	39	Very low	109 Å²	109	110.3 Å²	110.3	58%	0.583	58%	0.584	S	S	*	*			trans	-68.3	99.7	179.8	-81.4	-56.1	0	0	0	113.4	H950	H950-N957 PolarHBondContact CE1-O 2.89Å; H950-N957 VanDerWaalsContact CE1-O 3.28Å; H950-N957 PolarHBondContact ND1-O 2.81Å
958	Y	31	Very low	40.8	Very low	182 Å²	182	112 Å²	112	71%	0.714	59%	0.591	S	S	*	*			trans	-97	127.9	155	-86.4	-78.7	0	0	0	109	Y947 M956	Y947-Y958 AromaticContact CD1-CD1 3.87Å; Y947-Y958 HydrophobicContact CD1-CD1 3.87Å; Y947-Y958 AromaticContact CD1-CE1 3.55Å; Y947-Y958 HydrophobicContact CD1-CE1 3.55Å; Y947-Y958 AromaticContact CE1-CD1 3.7Å; Y947-Y958 HydrophobicContact CE1-CD1 3.7Å; Y947-Y958 AromaticContact CE1-CE1 3.63Å; Y947-Y958 HydrophobicContact CE1-CE1 3.63Å; Y947-Y958 HydrophobicContact CG-CE1 4.31Å; M956-Y958 PolarHBondContact O-N 2.93Å; M956-Y958 VanDerWaalsContact O-N 3.07Å
959	G	41	Very low	42.8	Very low	38 Å²	38	107.2 Å²	107.2	39%	0.392	57%	0.57	S	S	.	*			cis	-148.9	89.1	-11.4	0	0	0	0	0	108.6	S961 G962	G959-S961 PolarHBondContact O-N 2.8Å; G959-G962 PolarHBondContact O-N 2.81Å
960	A	34.7	Very low	44.8	Very low	38 Å²	38	105.4 Å²	105.4	31%	0.314	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77	17.5	-158.7	0	0	0	0	0	116.5	H950 G962 N963 T964	H950-A960 PolarHBondContact CD2-N 2.82Å; H950-A960 WeakPolarHBondContact NE2-CA 3.22Å; H950-A960 WeakPolarHBondContact NE2-CB 3.43Å; H950-A960 PolarHBondContact NE2-N 2.82Å; A960-G962 VanDerWaalsContact C-N 3.33Å; A960-N963 HydrophobicContact CB-CB 4.23Å; A960-N963 PolarHBondContact O-N 2.66Å; A960-T964 PolarHBondContact O-N 3.29Å
961	S	34.9	Very low	47.3	Very low	41 Å²	41	106 Å²	106	29%	0.287	56%	0.564	S	S	.	*	H	α-helix	trans	-69.1	-37.4	158.6	60.5	0	0	0	0	110.9	G959 N963 T964 L965	G959-S961 PolarHBondContact O-N 2.8Å; S961-N963 VanDerWaalsContact C-N 3.25Å; S961-N963 PolarHBondContact O-N 3.09Å; S961-T964 PolarHBondContact O-N 2.92Å; S961-T964 PolarHBondContact O-OG1 3.49Å; S961-L965 PolarHBondContact O-N 2.83Å
962	G	40.7	Very low	50	Low	28 Å²	28	100.5 Å²	100.5	29%	0.289	54%	0.543	S	S	.	.	H	α-helix	trans	-61.8	-31.3	171.8	0	0	0	0	0	112.7	G959 A960 L965 N966	G959-G962 PolarHBondContact O-N 2.81Å; A960-G962 VanDerWaalsContact C-N 3.33Å; G962-L965 PolarHBondContact O-N 3.39Å; G962-N966 WeakPolarHBondContact O-CB 3.35Å; G962-N966 PolarHBondContact O-N 3.2Å; G962-N966 PolarHBondContact O-ND2 3.34Å
963	N	45.4	Very low	52.3	Low	111 Å²	111	101 Å²	101	59%	0.594	54%	0.537	S	S	*	.	H	α-helix	trans	-75.2	-34.3	176.9	-76.6	4	0	0	0	112.7	A960 S961 L967	A960-N963 HydrophobicContact CB-CB 4.23Å; A960-N963 PolarHBondContact O-N 2.66Å; S961-N963 VanDerWaalsContact C-N 3.25Å; S961-N963 PolarHBondContact O-N 3.09Å; N963-L967 WeakPolarHBondContact O-CB 3.47Å; N963-L967 PolarHBondContact O-N 2.82Å
964	T	48	Very low	54.9	Low	75 Å²	75	97.7 Å²	97.7	46%	0.46	52%	0.518	S	S	.	.	H	α-helix	trans	-66.9	-39.9	167.8	44	0	0	0	0	112	A960 S961 L967 Y968	A960-T964 PolarHBondContact O-N 3.29Å; S961-T964 PolarHBondContact O-N 2.92Å; S961-T964 PolarHBondContact O-OG1 3.49Å; T964-L967 PolarHBondContact O-N 3.15Å; T964-Y968 WeakPolarHBondContact O-CB 3.21Å; T964-Y968 WeakPolarHBondContact O-CD2 3.37Å; T964-Y968 PolarHBondContact O-N 2.91Å
965	L	55.3	Low	57.8	Low	106 Å²	106	93.4 Å²	93.4	56%	0.555	50%	0.503	S	S	*	.	H	α-helix	trans	-66.8	-45	177.4	-161.6	80.5	0	0	0	111.4	S961 G962 L967 Y968 I969	S961-L965 PolarHBondContact O-N 2.83Å; G962-L965 PolarHBondContact O-N 3.39Å; L965-L967 VanDerWaalsContact C-N 3.35Å; L965-L967 PolarHBondContact O-N 2.94Å; L965-Y968 CarbonylContact O-C 3.52Å; L965-Y968 PolarHBondContact O-N 3.34Å; L965-I969 HydrophobicContact CD2-CD1 4.13Å; L965-I969 HydrophobicContact CG-CD1 3.97Å; L965-I969 WeakPolarHBondContact O-CB 3.49Å; L965-I969 VanDerWaalsContact O-CG1 3.23Å; L965-I969 WeakPolarHBondContact O-CG1 2.97Å; L965-I969 PolarHBondContact O-N 2.94Å
966	N	60.5	Low	60.7	Low	85 Å²	85	87.2 Å²	87.2	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-35.8	176	-71.2	-14.1	0	0	0	111.7	G962 I969 I970	G962-N966 WeakPolarHBondContact O-CB 3.35Å; G962-N966 PolarHBondContact O-N 3.2Å; G962-N966 PolarHBondContact O-ND2 3.34Å; N966-I969 PolarHBondContact O-N 3.15Å; N966-I970 VanDerWaalsContact O-CB 3.28Å; N966-I970 WeakPolarHBondContact O-CB 3.35Å; N966-I970 WeakPolarHBondContact O-CD1 3.38Å; N966-I970 WeakPolarHBondContact O-CG1 3.22Å; N966-I970 PolarHBondContact O-N 2.83Å
967	L	67.2	Low	63.3	Low	100 Å²	100	82.5 Å²	82.5	52%	0.524	46%	0.463	S	S	.	.	H	α-helix	trans	-67.9	-40.2	172	-171.2	74.2	0	0	0	111.1	N963 T964 L965 I969 I970 I971	N963-L967 WeakPolarHBondContact O-CB 3.47Å; N963-L967 PolarHBondContact O-N 2.82Å; T964-L967 PolarHBondContact O-N 3.15Å; L965-L967 VanDerWaalsContact C-N 3.35Å; L965-L967 PolarHBondContact O-N 2.94Å; L967-I969 VanDerWaalsContact C-N 3.34Å; L967-I970 PolarHBondContact O-N 3.29Å; L967-I971 HydrophobicContact CD1-CD1 4.47Å; L967-I971 HydrophobicContact CD2-CD1 4.32Å; L967-I971 HydrophobicContact CG-CD1 3.87Å; L967-I971 HydrophobicContact CG-CG1 4.45Å; L967-I971 VanDerWaalsContact O-CB 3.24Å; L967-I971 WeakPolarHBondContact O-CB 3.34Å; L967-I971 WeakPolarHBondContact O-CG1 3.5Å; L967-I971 PolarHBondContact O-N 2.74Å
968	Y	76.9	Confident	66.2	Low	161 Å²	161	80.4 Å²	80.4	63%	0.631	46%	0.457	S	S	*	.	H	α-helix	trans	-68.3	-31	173.2	-73.8	-53.4	0	0	0	112.8	T964 L965 A972	T964-Y968 WeakPolarHBondContact O-CB 3.21Å; T964-Y968 WeakPolarHBondContact O-CD2 3.37Å; T964-Y968 PolarHBondContact O-N 2.91Å; L965-Y968 CarbonylContact O-C 3.52Å; L965-Y968 PolarHBondContact O-N 3.34Å; Y968-A972 WeakPolarHBondContact O-CB 3.41Å; Y968-A972 PolarHBondContact O-N 3.21Å
969	I	77.4	Confident	69.2	Low	80 Å²	80	76.3 Å²	76.3	41%	0.41	45%	0.446	S	S	.	.	H	α-helix	trans	-72.1	-44.5	172.7	-72	163.4	0	0	0	110.2	L965 N966 L967 A972 I973	L965-I969 HydrophobicContact CD2-CD1 4.13Å; L965-I969 HydrophobicContact CG-CD1 3.97Å; L965-I969 WeakPolarHBondContact O-CB 3.49Å; L965-I969 VanDerWaalsContact O-CG1 3.23Å; L965-I969 WeakPolarHBondContact O-CG1 2.97Å; L965-I969 PolarHBondContact O-N 2.94Å; N966-I969 PolarHBondContact O-N 3.15Å; L967-I969 VanDerWaalsContact C-N 3.34Å; I969-A972 CarbonylContact O-C 3.35Å; I969-A972 PolarHBondContact O-N 3.25Å; I969-I973 HydrophobicContact CG2-CD1 3.73Å; I969-I973 HydrophobicContact CG2-CG1 4.39Å; I969-I973 WeakPolarHBondContact O-CB 3.41Å; I969-I973 WeakPolarHBondContact O-CG1 3.29Å; I969-I973 PolarHBondContact O-N 3.49Å
970	I	75.9	Confident	71.6	Confident	90 Å²	90	79.5 Å²	79.5	46%	0.462	45%	0.453	S	S	.	.	H	α-helix	trans	-63.4	-42.9	174.3	-72.6	164.4	0	0	0	110.3	N966 L967 I973 I974	N966-I970 VanDerWaalsContact O-CB 3.28Å; N966-I970 WeakPolarHBondContact O-CB 3.35Å; N966-I970 WeakPolarHBondContact O-CD1 3.38Å; N966-I970 WeakPolarHBondContact O-CG1 3.22Å; N966-I970 PolarHBondContact O-N 2.83Å; L967-I970 PolarHBondContact O-N 3.29Å; I970-I973 PolarHBondContact O-N 3.06Å; I970-I974 HydrophobicContact CG2-CD1 3.64Å; I970-I974 HydrophobicContact CG2-CG1 4.38Å; I970-I974 VanDerWaalsContact O-CB 3.31Å; I970-I974 WeakPolarHBondContact O-CB 3.24Å; I970-I974 WeakPolarHBondContact O-CG1 3.41Å; I970-I974 PolarHBondContact O-N 3.19Å
971	I	83.1	Confident	74.2	Confident	75 Å²	75	80.6 Å²	80.6	39%	0.385	46%	0.458	S	S	.	.	H	α-helix	trans	-64	-41.6	172.6	-71	168	0	0	0	110.3	L967 I973 I974 T975	L967-I971 HydrophobicContact CD1-CD1 4.47Å; L967-I971 HydrophobicContact CD2-CD1 4.32Å; L967-I971 HydrophobicContact CG-CD1 3.87Å; L967-I971 HydrophobicContact CG-CG1 4.45Å; L967-I971 VanDerWaalsContact O-CB 3.24Å; L967-I971 WeakPolarHBondContact O-CB 3.34Å; L967-I971 WeakPolarHBondContact O-CG1 3.5Å; L967-I971 PolarHBondContact O-N 2.74Å; I971-I973 PolarHBondContact O-N 2.97Å; I971-I974 PolarHBondContact O-N 3.35Å; I971-T975 HydrophobicContact CG2-CG2 4.11Å; I971-T975 WeakPolarHBondContact O-CB 3.49Å; I971-T975 WeakPolarHBondContact O-CG2 3.38Å; I971-T975 PolarHBondContact O-N 3.43Å; I971-T975 PolarHBondContact O-OG1 3.07Å
972	A	84.4	Confident	76.9	Confident	56 Å²	56	83.9 Å²	83.9	46%	0.463	47%	0.472	S	S	.	.	H	α-helix	trans	-66.4	-36.1	176.7	0	0	0	0	0	112.6	Y968 I969 T975 G976	Y968-A972 WeakPolarHBondContact O-CB 3.41Å; Y968-A972 PolarHBondContact O-N 3.21Å; I969-A972 CarbonylContact O-C 3.35Å; I969-A972 PolarHBondContact O-N 3.25Å; A972-T975 PolarHBondContact O-OG1 2.53Å; A972-G976 VanDerWaalsContact O-CA 3.3Å; A972-G976 WeakPolarHBondContact O-CA 3.35Å; A972-G976 PolarHBondContact O-N 3.2Å
973	I	85.5	Confident	79.4	Confident	110 Å²	110	86.9 Å²	86.9	56%	0.564	48%	0.48	S	S	*	.	H	α-helix	trans	-70	-43.9	174.1	-70.3	168.3	0	0	0	110.1	I969 I970 I971 G976 A977	I969-I973 HydrophobicContact CG2-CD1 3.73Å; I969-I973 HydrophobicContact CG2-CG1 4.39Å; I969-I973 WeakPolarHBondContact O-CB 3.41Å; I969-I973 WeakPolarHBondContact O-CG1 3.29Å; I969-I973 PolarHBondContact O-N 3.49Å; I970-I973 PolarHBondContact O-N 3.06Å; I971-I973 PolarHBondContact O-N 2.97Å; I973-G976 PolarHBondContact O-N 3.4Å; I973-A977 WeakPolarHBondContact O-CB 3.41Å; I973-A977 PolarHBondContact O-N 3.26Å
974	I	86.3	Confident	81.6	Confident	96 Å²	96	86.3 Å²	86.3	49%	0.492	48%	0.476	S	S	.	.	H	α-helix	trans	-66.9	-49.9	177	-70.4	168.7	0	0	0	110.4	I970 I971 G976 A977 C978	I970-I974 HydrophobicContact CG2-CD1 3.64Å; I970-I974 HydrophobicContact CG2-CG1 4.38Å; I970-I974 VanDerWaalsContact O-CB 3.31Å; I970-I974 WeakPolarHBondContact O-CB 3.24Å; I970-I974 WeakPolarHBondContact O-CG1 3.41Å; I970-I974 PolarHBondContact O-N 3.19Å; I971-I974 PolarHBondContact O-N 3.35Å; I974-G976 VanDerWaalsContact C-N 3.3Å; I974-G976 PolarHBondContact O-N 3.44Å; I974-A977 PolarHBondContact O-N 3.06Å; I974-C978 WeakPolarHBondContact O-CB 3.49Å; I974-C978 PolarHBondContact O-N 3.47Å; I974-C978 PolarHBondContact O-SG 3.46Å
975	T	90.9	Very high	83.6	Confident	68 Å²	68	88.2 Å²	88.2	42%	0.417	48%	0.483	S	S	.	.	H	α-helix	trans	-65.5	-35.5	176.2	59.4	0	0	0	0	111.5	I971 A972 C978 I979	I971-T975 HydrophobicContact CG2-CG2 4.11Å; I971-T975 WeakPolarHBondContact O-CB 3.49Å; I971-T975 WeakPolarHBondContact O-CG2 3.38Å; I971-T975 PolarHBondContact O-N 3.43Å; I971-T975 PolarHBondContact O-OG1 3.07Å; A972-T975 PolarHBondContact O-OG1 2.53Å; T975-C978 PolarHBondContact O-N 2.83Å; T975-I979 VanDerWaalsContact O-CB 3.24Å; T975-I979 WeakPolarHBondContact O-CB 3.2Å; T975-I979 WeakPolarHBondContact O-CD1 3.46Å; T975-I979 WeakPolarHBondContact O-CG1 3.15Å; T975-I979 PolarHBondContact O-N 2.69Å
976	G	91.3	Very high	85.2	Confident	25 Å²	25	88.8 Å²	88.8	26%	0.258	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-47.9	173.9	0	0	0	0	0	111.6	A972 I973 I974 I979 I980	A972-G976 VanDerWaalsContact O-CA 3.3Å; A972-G976 WeakPolarHBondContact O-CA 3.35Å; A972-G976 PolarHBondContact O-N 3.2Å; I973-G976 PolarHBondContact O-N 3.4Å; I974-G976 VanDerWaalsContact C-N 3.3Å; I974-G976 PolarHBondContact O-N 3.44Å; G976-I979 PolarHBondContact O-N 3.16Å; G976-I980 WeakPolarHBondContact O-CB 3.25Å; G976-I980 WeakPolarHBondContact O-CD1 3.37Å; G976-I980 WeakPolarHBondContact O-CG1 3.17Å; G976-I980 PolarHBondContact O-N 2.8Å
977	A	88.2	Confident	86.6	Confident	58 Å²	58	89.4 Å²	89.4	48%	0.479	48%	0.484	S	S	.	.	H	α-helix	trans	-64.8	-40.5	175.4	0	0	0	0	0	112.2	I973 I974 I980 S981	I973-A977 WeakPolarHBondContact O-CB 3.41Å; I973-A977 PolarHBondContact O-N 3.26Å; I974-A977 PolarHBondContact O-N 3.06Å; A977-I980 PolarHBondContact O-N 2.69Å; A977-S981 WeakPolarHBondContact O-CB 3.17Å; A977-S981 PolarHBondContact O-N 2.9Å
978	C	91.8	Very high	87.5	Confident	66 Å²	66	88.5 Å²	88.5	45%	0.446	48%	0.482	S	S	.	.	H	α-helix	trans	-64.6	-42.2	173.1	-71.4	0	0	0	0	111.7	I974 T975 S981 I982	I974-C978 WeakPolarHBondContact O-CB 3.49Å; I974-C978 PolarHBondContact O-N 3.47Å; I974-C978 PolarHBondContact O-SG 3.46Å; T975-C978 PolarHBondContact O-N 2.83Å; C978-S981 PolarHBondContact O-N 2.83Å; C978-I982 VanDerWaalsContact O-CB 3.3Å; C978-I982 WeakPolarHBondContact O-CB 3.47Å; C978-I982 WeakPolarHBondContact O-CD1 3.4Å; C978-I982 WeakPolarHBondContact O-CG1 3.45Å; C978-I982 PolarHBondContact O-N 3.27Å
979	I	94	Very high	87.9	Confident	96 Å²	96	86 Å²	86	49%	0.492	48%	0.475	S	S	.	.	H	α-helix	trans	-66	-43.9	176	-73.1	164.4	0	0	0	110.4	T975 G976 I982 I983	T975-I979 VanDerWaalsContact O-CB 3.24Å; T975-I979 WeakPolarHBondContact O-CB 3.2Å; T975-I979 WeakPolarHBondContact O-CD1 3.46Å; T975-I979 WeakPolarHBondContact O-CG1 3.15Å; T975-I979 PolarHBondContact O-N 2.69Å; G976-I979 PolarHBondContact O-N 3.16Å; I979-I982 PolarHBondContact O-N 2.77Å; I979-I983 HydrophobicContact CG2-CD1 3.68Å; I979-I983 HydrophobicContact CG2-CG1 4.42Å; I979-I983 VanDerWaalsContact O-CB 3.32Å; I979-I983 WeakPolarHBondContact O-CB 3.48Å; I979-I983 WeakPolarHBondContact O-CG1 3.44Å; I979-I983 PolarHBondContact O-N 3.37Å
980	I	91.8	Very high	88.2	Confident	105 Å²	105	85.3 Å²	85.3	54%	0.538	47%	0.472	S	S	.	.	H	α-helix	trans	-62.8	-43	175	-71.2	164.6	0	0	0	110.6	G976 A977 I983 L984	G976-I980 WeakPolarHBondContact O-CB 3.25Å; G976-I980 WeakPolarHBondContact O-CD1 3.37Å; G976-I980 WeakPolarHBondContact O-CG1 3.17Å; G976-I980 PolarHBondContact O-N 2.8Å; A977-I980 PolarHBondContact O-N 2.69Å; I980-I983 PolarHBondContact O-N 3.21Å; I980-L984 HydrophobicContact CG2-CD1 3.91Å; I980-L984 HydrophobicContact CG2-CG 4.42Å; I980-L984 WeakPolarHBondContact O-CB 3.46Å; I980-L984 VanDerWaalsContact O-CG 3.3Å; I980-L984 WeakPolarHBondContact O-CG 3.38Å; I980-L984 PolarHBondContact O-N 2.72Å
981	S	88.9	Confident	88.3	Confident	60 Å²	60	88.1 Å²	88.1	42%	0.42	48%	0.481	S	S	.	.	H	α-helix	trans	-65.3	-42.7	176.9	-174.2	0	0	0	0	111.9	A977 C978 L984 L985	A977-S981 WeakPolarHBondContact O-CB 3.17Å; A977-S981 PolarHBondContact O-N 2.9Å; C978-S981 PolarHBondContact O-N 2.83Å; S981-L984 PolarHBondContact O-N 3.14Å; S981-L985 VanDerWaalsContact O-CB 3.31Å; S981-L985 WeakPolarHBondContact O-CB 3.41Å; S981-L985 VanDerWaalsContact O-CG 3.27Å; S981-L985 WeakPolarHBondContact O-CG 3.38Å; S981-L985 PolarHBondContact O-N 2.81Å
982	I	92.2	Very high	87.9	Confident	111 Å²	111	89.2 Å²	89.2	57%	0.569	49%	0.487	S	S	*	.	H	α-helix	trans	-65.1	-39.9	173.9	-71.2	164.3	0	0	0	110.9	C978 I979 F986	C978-I982 VanDerWaalsContact O-CB 3.3Å; C978-I982 WeakPolarHBondContact O-CB 3.47Å; C978-I982 WeakPolarHBondContact O-CD1 3.4Å; C978-I982 WeakPolarHBondContact O-CG1 3.45Å; C978-I982 PolarHBondContact O-N 3.27Å; I979-I982 PolarHBondContact O-N 2.77Å; I982-F986 WeakPolarHBondContact O-CB 3.41Å; I982-F986 PolarHBondContact O-N 3Å
983	I	92.2	Very high	87.1	Confident	90 Å²	90	90.3 Å²	90.3	46%	0.462	48%	0.483	S	S	.	.	H	α-helix	trans	-66.2	-42.1	175	-73	168	0	0	0	110.6	I979 I980 F986 L987	I979-I983 HydrophobicContact CG2-CD1 3.68Å; I979-I983 HydrophobicContact CG2-CG1 4.42Å; I979-I983 VanDerWaalsContact O-CB 3.32Å; I979-I983 WeakPolarHBondContact O-CB 3.48Å; I979-I983 WeakPolarHBondContact O-CG1 3.44Å; I979-I983 PolarHBondContact O-N 3.37Å; I980-I983 PolarHBondContact O-N 3.21Å; I983-F986 PolarHBondContact O-N 3.02Å; I983-L987 HydrophobicContact CG2-CD1 3.81Å; I983-L987 HydrophobicContact CG2-CG 4.27Å; I983-L987 VanDerWaalsContact O-CB 3.26Å; I983-L987 WeakPolarHBondContact O-CB 3.28Å; I983-L987 WeakPolarHBondContact O-CG 3.35Å; I983-L987 PolarHBondContact O-N 2.89Å
984	L	91.1	Very high	86	Confident	100 Å²	100	93.6 Å²	93.6	52%	0.524	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-44.7	175.7	-75.5	170.2	0	0	0	111.5	I980 S981 F986 L987 V988	I980-L984 HydrophobicContact CG2-CD1 3.91Å; I980-L984 HydrophobicContact CG2-CG 4.42Å; I980-L984 WeakPolarHBondContact O-CB 3.46Å; I980-L984 VanDerWaalsContact O-CG 3.3Å; I980-L984 WeakPolarHBondContact O-CG 3.38Å; I980-L984 PolarHBondContact O-N 2.72Å; S981-L984 PolarHBondContact O-N 3.14Å; L984-F986 VanDerWaalsContact C-N 3.33Å; L984-F986 PolarHBondContact O-N 2.94Å; L984-L987 PolarHBondContact O-N 3.13Å; L984-V988 WeakPolarHBondContact O-CB 3.33Å; L984-V988 VanDerWaalsContact O-CG2 3.28Å; L984-V988 WeakPolarHBondContact O-CG2 3.44Å; L984-V988 PolarHBondContact O-N 3.43Å
985	L	89.8	Confident	84.6	Confident	114 Å²	114	91.9 Å²	91.9	60%	0.597	48%	0.482	S	S	*	.	H	α-helix	trans	-63.5	-37.8	174.4	-73.9	169.5	0	0	0	111.8	S981 F989	S981-L985 VanDerWaalsContact O-CB 3.31Å; S981-L985 WeakPolarHBondContact O-CB 3.41Å; S981-L985 VanDerWaalsContact O-CG 3.27Å; S981-L985 WeakPolarHBondContact O-CG 3.38Å; S981-L985 PolarHBondContact O-N 2.81Å; L985-F989 WeakPolarHBondContact O-CB 3.49Å; L985-F989 PolarHBondContact O-N 3.33Å
986	F	90.3	Very high	82.8	Confident	119 Å²	119	97.3 Å²	97.3	52%	0.522	50%	0.5	S	S	.	.	H	α-helix	trans	-73.4	-33.8	175.4	-173.8	-111.1	0	0	0	112.4	I982 I983 L984 F989 L990	I982-F986 WeakPolarHBondContact O-CB 3.41Å; I982-F986 PolarHBondContact O-N 3Å; I983-F986 PolarHBondContact O-N 3.02Å; L984-F986 VanDerWaalsContact C-N 3.33Å; L984-F986 PolarHBondContact O-N 2.94Å; F986-F989 PolarHBondContact O-N 2.93Å; F986-L990 HydrophobicContact CD1-CD1 3.86Å; F986-L990 HydrophobicContact CD1-CG 4.23Å; F986-L990 HydrophobicContact CE1-CD1 3.43Å; F986-L990 VanDerWaalsContact CE1-CD1 3.43Å; F986-L990 HydrophobicContact CE1-CD2 4.49Å; F986-L990 HydrophobicContact CE1-CG 3.91Å; F986-L990 HydrophobicContact CE2-CG 4.36Å; F986-L990 HydrophobicContact CZ-CD1 3.93Å; F986-L990 HydrophobicContact CZ-CD2 4.14Å; F986-L990 HydrophobicContact CZ-CG 3.97Å; F986-L990 VanDerWaalsContact O-CB 3.29Å; F986-L990 WeakPolarHBondContact O-CB 3.42Å; F986-L990 VanDerWaalsContact O-CG 3.3Å; F986-L990 WeakPolarHBondContact O-CG 3.41Å; F986-L990 PolarHBondContact O-N 2.91Å
987	L	89.4	Confident	80.9	Confident	97 Å²	97	105.5 Å²	105.5	51%	0.508	52%	0.523	S	S	.	.	H	α-helix	trans	-69.2	-41.9	172	-77.1	171.3	0	0	0	111.2	I983 L984 L990 F991	I983-L987 HydrophobicContact CG2-CD1 3.81Å; I983-L987 HydrophobicContact CG2-CG 4.27Å; I983-L987 VanDerWaalsContact O-CB 3.26Å; I983-L987 WeakPolarHBondContact O-CB 3.28Å; I983-L987 WeakPolarHBondContact O-CG 3.35Å; I983-L987 PolarHBondContact O-N 2.89Å; L984-L987 PolarHBondContact O-N 3.13Å; L987-L990 PolarHBondContact O-N 2.84Å; L987-F991 VanDerWaalsContact O-CB 3.27Å; L987-F991 WeakPolarHBondContact O-CB 3.39Å; L987-F991 PolarHBondContact O-N 3.07Å
988	V	86.7	Confident	79	Confident	81 Å²	81	108.3 Å²	108.3	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-62.4	-43.4	170.8	168.1	0	0	0	0	110.1	L984 F991 L992	L984-V988 WeakPolarHBondContact O-CB 3.33Å; L984-V988 VanDerWaalsContact O-CG2 3.28Å; L984-V988 WeakPolarHBondContact O-CG2 3.44Å; L984-V988 PolarHBondContact O-N 3.43Å; V988-F991 PolarHBondContact O-N 2.86Å; V988-L992 HydrophobicContact CG1-CD1 3.82Å; V988-L992 HydrophobicContact CG1-CG 4.33Å; V988-L992 WeakPolarHBondContact O-CB 3.3Å; V988-L992 VanDerWaalsContact O-CG 3.24Å; V988-L992 WeakPolarHBondContact O-CG 3.49Å; V988-L992 PolarHBondContact O-N 2.82Å
989	F	85.2	Confident	76.6	Confident	108 Å²	108	112.9 Å²	112.9	47%	0.474	54%	0.544	S	S	.	.	H	α-helix	trans	-66.1	-37.7	175.7	-174.2	-105.2	0	0	0	112.6	L985 F986 Q993	L985-F989 WeakPolarHBondContact O-CB 3.49Å; L985-F989 PolarHBondContact O-N 3.33Å; F986-F989 PolarHBondContact O-N 2.93Å; F989-Q993 HydrophobicContact CD1-CG 4.27Å; F989-Q993 HydrophobicContact CE1-CG 4Å; F989-Q993 HydrophobicContact CZ-CG 4.16Å; F989-Q993 VanDerWaalsContact O-CB 3.27Å; F989-Q993 WeakPolarHBondContact O-CB 3.31Å; F989-Q993 WeakPolarHBondContact O-CG 3.45Å; F989-Q993 PolarHBondContact O-N 3.13Å
990	L	82.6	Confident	74	Confident	67 Å²	67	114.3 Å²	114.3	35%	0.351	55%	0.553	S	S	.	*	H	α-helix	trans	-69.9	-32	171.9	-79.1	-178.9	0	0	0	112.3	F986 L987 R994	F986-L990 HydrophobicContact CD1-CD1 3.86Å; F986-L990 HydrophobicContact CD1-CG 4.23Å; F986-L990 HydrophobicContact CE1-CD1 3.43Å; F986-L990 VanDerWaalsContact CE1-CD1 3.43Å; F986-L990 HydrophobicContact CE1-CD2 4.49Å; F986-L990 HydrophobicContact CE1-CG 3.91Å; F986-L990 HydrophobicContact CE2-CG 4.36Å; F986-L990 HydrophobicContact CZ-CD1 3.93Å; F986-L990 HydrophobicContact CZ-CD2 4.14Å; F986-L990 HydrophobicContact CZ-CG 3.97Å; F986-L990 VanDerWaalsContact O-CB 3.29Å; F986-L990 WeakPolarHBondContact O-CB 3.42Å; F986-L990 VanDerWaalsContact O-CG 3.3Å; F986-L990 WeakPolarHBondContact O-CG 3.41Å; F986-L990 PolarHBondContact O-N 2.91Å; L987-L990 PolarHBondContact O-N 2.84Å; L990-R994 VanDerWaalsContact O-CB 3.24Å; L990-R994 WeakPolarHBondContact O-CB 3.43Å; L990-R994 WeakPolarHBondContact O-CG 3.19Å; L990-R994 PolarHBondContact O-N 3.18Å
991	F	78.4	Confident	71.5	Confident	148 Å²	148	117 Å²	117	65%	0.649	57%	0.569	S	S	*	*	H	α-helix	trans	-69.8	-46	173.8	-161	-89.8	0	0	0	110.1	L987 V988 R994 T995	L987-F991 VanDerWaalsContact O-CB 3.27Å; L987-F991 WeakPolarHBondContact O-CB 3.39Å; L987-F991 PolarHBondContact O-N 3.07Å; V988-F991 PolarHBondContact O-N 2.86Å; F991-R994 CarbonylContact O-C 3.5Å; F991-R994 PolarHBondContact O-N 2.83Å; F991-T995 HydrophobicContact CD1-CG2 4.23Å; F991-T995 HydrophobicContact CE1-CG2 4.12Å; F991-T995 WeakPolarHBondContact O-CG2 3.22Å; F991-T995 PolarHBondContact O-N 2.9Å; F991-T995 PolarHBondContact O-OG1 2.9Å
992	L	74.5	Confident	68.7	Low	99 Å²	99	125 Å²	125	52%	0.518	59%	0.589	S	S	.	*	H	α-helix	trans	-65.5	-34.9	173.7	-69.2	171.9	0	0	0	112.8	V988 T995 K996	V988-L992 HydrophobicContact CG1-CD1 3.82Å; V988-L992 HydrophobicContact CG1-CG 4.33Å; V988-L992 WeakPolarHBondContact O-CB 3.3Å; V988-L992 VanDerWaalsContact O-CG 3.24Å; V988-L992 WeakPolarHBondContact O-CG 3.49Å; V988-L992 PolarHBondContact O-N 2.82Å; L992-T995 WeakPolarHBondContact CA-OG1 3.33Å; L992-T995 PolarHBondContact O-OG1 2.86Å; L992-T995 VanDerWaalsContact O-OG1 3.13Å; L992-K996 WeakPolarHBondContact O-CB 3.32Å; L992-K996 PolarHBondContact O-N 2.67Å
993	Q	67.6	Low	66	Low	78 Å²	78	124.3 Å²	124.3	36%	0.364	59%	0.594	S	S	.	*	H	α-helix	trans	-72.8	-33.5	170.9	-79.6	-154.5	-2.9	0	0	112.1	F989 K996 R997	F989-Q993 HydrophobicContact CD1-CG 4.27Å; F989-Q993 HydrophobicContact CE1-CG 4Å; F989-Q993 HydrophobicContact CZ-CG 4.16Å; F989-Q993 VanDerWaalsContact O-CB 3.27Å; F989-Q993 WeakPolarHBondContact O-CB 3.31Å; F989-Q993 WeakPolarHBondContact O-CG 3.45Å; F989-Q993 PolarHBondContact O-N 3.13Å; Q993-K996 CarbonylContact O-C 3.57Å; Q993-K996 PolarHBondContact O-N 2.81Å; Q993-R997 VanDerWaalsContact O-CB 3.28Å; Q993-R997 WeakPolarHBondContact O-CB 3.35Å; Q993-R997 PolarHBondContact O-N 3.48Å
994	R	62.4	Low	63.4	Low	179 Å²	179	127.7 Å²	127.7	68%	0.675	61%	0.613	S	S	*	*	H	α-helix	trans	-69.1	-41.5	172.1	-85.8	-180	161.9	173.5	-4.3	111.5	L990 F991 K996 R997 N998	L990-R994 VanDerWaalsContact O-CB 3.24Å; L990-R994 WeakPolarHBondContact O-CB 3.43Å; L990-R994 WeakPolarHBondContact O-CG 3.19Å; L990-R994 PolarHBondContact O-N 3.18Å; F991-R994 CarbonylContact O-C 3.5Å; F991-R994 PolarHBondContact O-N 2.83Å; R994-K996 VanDerWaalsContact C-N 3.31Å; R994-K996 PolarHBondContact O-N 2.81Å; R994-R997 PolarHBondContact O-N 2.55Å; R994-N998 VanDerWaalsContact O-CB 3.26Å; R994-N998 WeakPolarHBondContact O-CB 3.36Å; R994-N998 PolarHBondContact O-N 2.84Å
995	T	58.5	Low	60.8	Low	60 Å²	60	128.3 Å²	128.3	37%	0.368	62%	0.621	S	S	.	*	H	α-helix	trans	-67.4	-31.3	172.8	57.1	0	0	0	0	111.8	F991 L992 H999	F991-T995 HydrophobicContact CD1-CG2 4.23Å; F991-T995 HydrophobicContact CE1-CG2 4.12Å; F991-T995 WeakPolarHBondContact O-CG2 3.22Å; F991-T995 PolarHBondContact O-N 2.9Å; F991-T995 PolarHBondContact O-OG1 2.9Å; L992-T995 WeakPolarHBondContact CA-OG1 3.33Å; L992-T995 PolarHBondContact O-OG1 2.86Å; L992-T995 VanDerWaalsContact O-OG1 3.13Å; T995-H999 WeakPolarHBondContact O-CB 3.4Å; T995-H999 PolarHBondContact O-CD2 3.07Å
996	K	52.3	Low	57.9	Low	182 Å²	182	130.7 Å²	130.7	79%	0.791	63%	0.633	S	S	*	*	H	α-helix	trans	-78.5	-16.2	169.4	-90.5	-172.3	170.7	179.9	0	116.4	L992 Q993 R994	L992-K996 WeakPolarHBondContact O-CB 3.32Å; L992-K996 PolarHBondContact O-N 2.67Å; Q993-K996 CarbonylContact O-C 3.57Å; Q993-K996 PolarHBondContact O-N 2.81Å; R994-K996 VanDerWaalsContact C-N 3.31Å; R994-K996 PolarHBondContact O-N 2.81Å
997	R	52.3	Low	55.4	Low	198 Å²	198	132.9 Å²	132.9	75%	0.747	65%	0.645	S	S	*	*	H	α-helix	trans	-105.6	-18.2	177.4	-81.1	-178.9	127.2	154.5	-4.1	114.9	Q993 R994	Q993-R997 VanDerWaalsContact O-CB 3.28Å; Q993-R997 WeakPolarHBondContact O-CB 3.35Å; Q993-R997 PolarHBondContact O-N 3.48Å; R994-R997 PolarHBondContact O-N 2.55Å
998	N	47.8	Very low	52.7	Low	117 Å²	117	134.8 Å²	134.8	63%	0.626	66%	0.656	S	S	*	*	S	Bend	trans	-104.1	0.8	178.2	-67.1	6.9	0	0	0	113.7	R994	R994-N998 VanDerWaalsContact O-CB 3.26Å; R994-N998 WeakPolarHBondContact O-CB 3.36Å; R994-N998 PolarHBondContact O-N 2.84Å
999	H	41.3	Very low	50.3	Low	161 Å²	161	136.6 Å²	136.6	75%	0.745	67%	0.667	S	S	*	*	S	Bend	trans	-92.5	-6.1	173	-101.4	-68.5	0	0	0	114.8	T995	T995-H999 WeakPolarHBondContact O-CB 3.4Å; T995-H999 PolarHBondContact O-CD2 3.07Å
1000	N	39.1	Very low	47.7	Very low	126 Å²	126	139.4 Å²	139.4	67%	0.674	69%	0.686	S	S	*	*	S	Bend	trans	-91	144.2	157.1	-69.7	-0.3	0	0	0	108.1
1001	D	38.4	Very low	45.3	Very low	162 Å²	162	147.1 Å²	147.1	87%	0.866	71%	0.71	S	S	*	*	S	Bend	trans	60.2	47.3	172.9	-56.6	-27.3	0	0	0	117.5
1002	R	30	Very low	43.2	Very low	227 Å²	227	148.7 Å²	148.7	86%	0.857	72%	0.717	S	S	*	*			trans	-151.7	119.2	149.2	-120.9	171.1	-171.1	-162	-0.4	115.4
1003	C	37.1	Very low	41.1	Very low	97 Å²	97	154.5 Å²	154.5	66%	0.655	73%	0.733	S	S	*	*			trans	41.3	114.6	157.8	-56.8	0	0	0	0	117.8	T1005	C1003-T1005 VanDerWaalsContact C-N 3.35Å
1004	N	37.8	Very low	39.5	Very low	162 Å²	162	157 Å²	157	87%	0.866	75%	0.749	S	S	*	*			cis	48.9	44.7	19.7	-80.4	3.5	0	0	0	113.9
1005	T	35.9	Very low	38.1	Very low	113 Å²	113	154.3 Å²	154.3	69%	0.693	75%	0.752	S	S	*	*			trans	178.7	64.3	148.4	47.7	0	0	0	0	111.3	C1003	C1003-T1005 VanDerWaalsContact C-N 3.35Å
1006	L	29.3	Very low	37	Very low	163 Å²	163	158.3 Å²	158.3	85%	0.853	77%	0.77	S	S	*	*			trans	-144	28.3	146.1	-154.5	64.6	0	0	0	112.3
1007	E	36.7	Very low	36.1	Very low	166 Å²	166	156 Å²	156	78%	0.776	77%	0.766	S	S	*	*	S	Bend	trans	-80.3	145.6	143	-73.9	-171.5	104	0	0	108.4
1008	N	33.2	Very low	35.1	Very low	136 Å²	136	154.5 Å²	154.5	73%	0.727	77%	0.77	S	S	*	*	S	Bend	trans	74.6	129.7	-179.2	-51	-67.3	0	0	0	115.9
1009	T	36.1	Very low	34.3	Very low	120 Å²	120	157 Å²	157	74%	0.736	78%	0.775	S	S	*	*	S	Bend	trans	62.8	99	-172.3	-3.8	0	0	0	0	112.4
1010	I	30.8	Very low	33.8	Very low	167 Å²	167	156.4 Å²	156.4	86%	0.856	77%	0.772	S	S	*	*	S	Bend	cis	-111.6	97.1	30.5	-56.4	174.2	0	0	0	112.2
1011	R	32.5	Very low	33.5	Very low	229 Å²	229	158.1 Å²	158.1	86%	0.864	78%	0.78	S	S	*	*			trans	-113	109.1	143.7	-71.9	-171.2	-173.8	-165.5	4.7	106.6
1012	K	33.9	Very low	33	Very low	181 Å²	181	159 Å²	159	79%	0.787	78%	0.779	S	S	*	*			trans	-174.8	83.2	164.4	-113.6	178.6	-179.8	-175.9	0	110.7
1013	Y	30.6	Very low	32.9	Very low	221 Å²	221	153 Å²	153	87%	0.867	77%	0.771	S	S	*	*	S	Bend	trans	162.1	101.4	164.5	-86.9	-60.2	0	0	0	104.5
1014	D	34.3	Very low	32.5	Very low	130 Å²	130	154.6 Å²	154.6	70%	0.695	77%	0.774	S	S	*	*			cis	-140.9	132.4	-14.1	-79.8	-53.1	0	0	0	106.1
1015	V	33	Very low	32.2	Very low	122 Å²	122	156.1 Å²	156.1	74%	0.739	77%	0.773	S	S	*	*				54.9	102.3	85.9	-177.2	0	0	0	0	109.8
1016	I	35.7	Very low	31.8	Very low	145 Å²	145	156.4 Å²	156.4	74%	0.744	78%	0.775	S	S	*	*				-153.5	148	62.8	-71.5	-177.8	0	0	0	113.6
1017	N	32.7	Very low	31.8	Very low	134 Å²	134	154.1 Å²	154.1	72%	0.717	77%	0.767	S	S	*	*			trans	2.7	153.8	149.3	-56.9	-14.8	0	0	0	121.8
1018	M	31.8	Very low	31.5	Very low	166 Å²	166	151.7 Å²	151.7	82%	0.818	76%	0.764	S	S	*	*			cis	-160.3	-177.1	-4.7	-118.6	-168.3	-57.2	0	0	112.7
1019	K	30.6	Very low	31.2	Very low	168 Å²	168	151.6 Å²	151.6	73%	0.73	76%	0.762	S	S	*	*			trans	-63.4	-179.6	171.9	-49.8	-179.8	178.2	176.4	0	113.2
1020	E	31.3	Very low	30.8	Very low	149 Å²	149	154.1 Å²	154.1	70%	0.696	77%	0.766	S	S	*	*			cis	-165.8	-173.5	29.7	-153.8	148.7	-126.1	0	0	113.3
1021	I	31.8	Very low	30.7	Very low	162 Å²	162	150.9 Å²	150.9	83%	0.831	76%	0.758	S	S	*	*			trans	88.8	138.6	168.7	-57.1	170.3	0	0	0	116.7
1022	Q	28	Very low	30.7	Very low	182 Å²	182	146.6 Å²	146.6	85%	0.85	75%	0.747	S	S	*	*			trans	-106.1	178.3	177.6	-61.3	174.9	-85.3	0	0	111.6
1023	S	28.6	Very low	30.5	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	73%	0.734	S	S	*	*			trans	87.2	138.1	163.7	80.3	0	0	0	0	117.3
1024	N	28.9	Very low	30.6	Very low	132 Å²	132	140.6 Å²	140.6	71%	0.706	72%	0.724	S	S	*	*			trans	57.7	130.6	162.9	-45.2	-21.1	0	0	0	115.6
1025	F	31.1	Very low	30.4	Very low	193 Å²	193	141.7 Å²	141.7	85%	0.846	73%	0.73	S	S	*	*			cis	-155.3	154.2	43.4	-99	-89.7	0	0	0	111.8
1026	T	27.9	Very low	30.3	Very low	120 Å²	120	139.3 Å²	139.3	74%	0.736	73%	0.73	S	S	*	*			trans	-74.1	150.6	150.2	46.8	0	0	0	0	110.2
1027	T	29.5	Very low	30	Very low	114 Å²	114	140.7 Å²	140.7	70%	0.699	74%	0.739	S	S	*	*				142.4	130.9	124.3	-42.7	0	0	0	0	112.4
1028	T	29.4	Very low	29.8	Very low	115 Å²	115	143.7 Å²	143.7	71%	0.706	75%	0.746	S	S	*	*			trans	63.7	131.6	154.6	41.2	0	0	0	0	124.1
1029	I	27.6	Very low	29.6	Very low	134 Å²	134	145.5 Å²	145.5	69%	0.687	75%	0.75	S	S	*	*			trans	88.3	103.3	131.4	-69.9	166.6	0	0	0	120.7
1030	Q	27.5	Very low	29.4	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	75%	0.748	S	S	*	*				55.3	119.4	129.6	-58.2	-178.4	-28.3	0	0	122.7
1031	S	28.9	Very low	29.3	Very low	99 Å²	99	144.4 Å²	144.4	69%	0.692	76%	0.756	S	S	*	*				131.5	144.3	105.2	67.2	0	0	0	0	117.7
1032	Q	30.8	Very low	29.1	Very low	139 Å²	139	146.7 Å²	146.7	65%	0.65	76%	0.756	S	S	*	*			trans	66.5	147.4	157.7	-71	174.9	14	0	0	117.5	Y1128	Q1032-Y1128 PolarHBondContact NE2-OH 2.69Å
1033	H	31.4	Very low	29.2	Very low	111 Å²	111	147.2 Å²	147.2	51%	0.514	76%	0.758	S	S	.	*			cis	-161.3	159.4	10.9	-130.4	-60	0	0	0	112.2
1034	Y	31.6	Very low	29.2	Very low	166 Å²	166	148.8 Å²	148.8	65%	0.651	76%	0.763	S	S	*	*			trans	79.2	126.7	150.9	-86.3	-67.8	0	0	0	125.6
1035	N	30.1	Very low	29.2	Very low	152 Å²	152	151 Å²	151	81%	0.813	77%	0.769	S	S	*	*			trans	61.4	132	146.4	-76.4	-9.2	0	0	0	123.2
1036	G	30.6	Very low	29.4	Very low	73 Å²	73	147.4 Å²	147.4	75%	0.753	77%	0.765	S	S	*	*			trans	158.1	61.8	152.4	0	0	0	0	0	120.9
1037	N	30.7	Very low	29.4	Very low	174 Å²	174	151.7 Å²	151.7	93%	0.93	77%	0.774	S	S	*	*			trans	61.2	152.2	160.4	-70.3	-15.6	0	0	0	121.3
1038	K	26.8	Very low	29.7	Very low	197 Å²	197	151.9 Å²	151.9	86%	0.857	78%	0.777	S	S	*	*			trans	-70.7	146	168.2	-57.6	171.7	175.6	-179	0	111.1
1039	F	29.1	Very low	29.8	Very low	204 Å²	204	154.1 Å²	154.1	90%	0.895	78%	0.784	S	S	*	*				-157.3	167.2	112.2	-114.4	-79.5	0	0	0	109.7
1040	L	26.2	Very low	29.7	Very low	131 Å²	131	153.8 Å²	153.8	69%	0.686	79%	0.793	S	S	*	*			trans	-81.3	140.4	178.1	-75.7	70.4	0	0	0	110.3	Y1042	L1040-Y1042 HydrophobicContact CD2-CE2 4.42Å
1041	D	28.8	Very low	29.8	Very low	163 Å²	163	150.8 Å²	150.8	87%	0.872	79%	0.791	S	S	*	*			trans	-135.7	139.4	153.1	-94.7	-49.2	0	0	0	109.6
1042	Y	27.2	Very low	29.8	Very low	210 Å²	210	154.6 Å²	154.6	82%	0.824	80%	0.798	S	S	*	*			trans	-97.6	104.1	179	-88.9	-106.5	0	0	0	109.5	L1040 V1044	L1040-Y1042 HydrophobicContact CD2-CE2 4.42Å; Y1042-V1044 PolarHBondContact O-N 3.25Å
1043	E	29.8	Very low	29.7	Very low	192 Å²	192	157.2 Å²	157.2	90%	0.897	81%	0.81	S	S	*	*			trans	-88.9	98.4	172.6	-73.2	-152.2	124.8	0	0	112.7
1044	V	29.9	Very low	29.6	Very low	132 Å²	132	159 Å²	159	80%	0.8	82%	0.822	S	S	*	*			trans	-32	125.1	167.7	178.6	0	0	0	0	114.9	Y1042 P1046	Y1042-V1044 PolarHBondContact O-N 3.25Å; V1044-P1046 WeakPolarHBondContact O-CD 3.06Å
1045	H	29.3	Very low	29.4	Very low	179 Å²	179	157.5 Å²	157.5	83%	0.829	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-66.8	128.9	164.6	-80	-79.5	0	0	0	112
1046	P	34.4	Very low	29.4	Very low	118 Å²	118	156 Å²	156	77%	0.766	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-85.3	132.6	169.7	32.4	-32.1	0	0	0	112.3	V1044	V1044-P1046 WeakPolarHBondContact O-CD 3.06Å
1047	F	27.9	Very low	29.4	Very low	209 Å²	209	162.4 Å²	162.4	92%	0.917	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-64.3	157.4	170.4	-77.2	-97.1	0	0	0	112.8
1048	P	36.2	Very low	29.3	Very low	118 Å²	118	161.3 Å²	161.3	77%	0.766	83%	0.827	S	S	*	*			trans	-130.1	118.3	136.2	34.3	-23.3	0	0	0	114.3
1049	N	31.3	Very low	29.5	Very low	162 Å²	162	159.8 Å²	159.8	87%	0.866	83%	0.828	S	S	*	*			trans	36.3	131.2	146.9	-67.6	-20.1	0	0	0	122.9
1050	C	26.1	Very low	29.6	Very low	128 Å²	128	153.9 Å²	153.9	87%	0.865	83%	0.825	S	S	*	*			trans	-62.4	149.7	164.2	-41	0	0	0	0	113.5
1051	S	29	Very low	29.7	Very low	109 Å²	109	155.2 Å²	155.2	76%	0.762	83%	0.832	S	S	*	*				-160.1	115.1	122.5	52.9	0	0	0	0	113.2
1052	Q	28.7	Very low	29.9	Very low	180 Å²	180	154.3 Å²	154.3	84%	0.841	83%	0.833	S	S	*	*			trans	43.9	124	145.9	-59.2	177.7	-9.9	0	0	121
1053	Q	29.2	Very low	29.9	Very low	194 Å²	194	151.5 Å²	151.5	91%	0.907	83%	0.832	S	S	*	*				-154	139.8	110.6	-110.1	169.7	6.7	0	0	111.2
1054	L	28.1	Very low	29.9	Very low	148 Å²	148	150.4 Å²	150.4	78%	0.775	83%	0.832	S	S	*	*			trans	-88.7	154.5	169.4	-83	78.7	0	0	0	109.4	S1056	L1054-S1056 PolarHBondContact O-N 3.12Å
1055	P	28.9	Very low	29.7	Very low	135 Å²	135	152.3 Å²	152.3	88%	0.877	83%	0.832	S	S	*	*			trans	-64.8	124.2	166.9	28.6	-33.5	0	0	0	109.8
1056	S	29.3	Very low	29.7	Very low	121 Å²	121	151.6 Å²	151.6	85%	0.846	83%	0.833	S	S	*	*			trans	-104.8	140.7	173.9	49.5	0	0	0	0	110.3	L1054	L1054-S1056 PolarHBondContact O-N 3.12Å
1057	Y	30.9	Very low	29.6	Very low	206 Å²	206	153 Å²	153	81%	0.808	83%	0.833	S	S	*	*			trans	-107	131.3	-173.7	-152	-103.2	0	0	0	109.7
1058	E	28.8	Very low	29.6	Very low	152 Å²	152	149.3 Å²	149.3	71%	0.71	82%	0.823	S	S	*	*	S	Bend	trans	63	147.1	161.9	-70.3	176.5	155.8	0	0	122
1059	D	31.3	Very low	29.3	Very low	164 Å²	164	151.7 Å²	151.7	88%	0.877	82%	0.823	S	S	*	*			trans	57.5	123.9	156.5	-71.5	1.2	0	0	0	123.5
1060	G	29.8	Very low	29.6	Very low	80 Å²	80	148.6 Å²	148.6	83%	0.825	81%	0.813	S	S	*	*			trans	162.3	78.7	162.2	0	0	0	0	0	116.6
1061	N	29.4	Very low	29.7	Very low	159 Å²	159	150.3 Å²	150.3	85%	0.85	81%	0.813	S	S	*	*			trans	-61.7	137.1	171.9	-78.2	-55.1	0	0	0	112.8
1062	T	32.4	Very low	29.7	Very low	144 Å²	144	149 Å²	149	88%	0.883	82%	0.817	S	S	*	*				-172.1	149.6	120.8	16.1	0	0	0	0	112.9
1063	N	27.7	Very low	29.5	Very low	152 Å²	152	146.2 Å²	146.2	81%	0.813	82%	0.817	S	S	*	*			trans	-87.2	151.2	-178	-54	-39.3	0	0	0	112.3
1064	L	28.8	Very low	29.5	Very low	169 Å²	169	145.2 Å²	145.2	89%	0.885	82%	0.817	S	S	*	*			trans	-156.1	102	150.9	-116	161.4	0	0	0	110.8
1065	E	26.2	Very low	29.3	Very low	172 Å²	172	146.5 Å²	146.5	80%	0.804	82%	0.816	S	S	*	*			trans	-76.9	148.2	170.5	-60.6	173.6	102.2	0	0	110.8
1066	L	29.8	Very low	29.2	Very low	163 Å²	163	148.2 Å²	148.2	85%	0.853	82%	0.818	S	S	*	*			trans	-148.4	70.6	161.2	-111.9	174	0	0	0	113.3
1067	I	31.5	Very low	29	Very low	147 Å²	147	149.4 Å²	149.4	75%	0.754	81%	0.814	S	S	*	*			trans	29.6	96.8	138	-49.7	177.9	0	0	0	117.9
1068	N	29.3	Very low	29.1	Very low	133 Å²	133	145 Å²	145	71%	0.711	81%	0.81	S	S	*	*				54.7	136.7	112.2	-126.3	0.6	0	0	0	123.2
1069	Q	29.9	Very low	29.2	Very low	167 Å²	167	142.9 Å²	142.9	78%	0.78	81%	0.808	S	S	*	*			trans	87	157.5	142.2	-87.8	-169.4	14.4	0	0	121.8
1070	P	36	Very low	29.2	Very low	98 Å²	98	143.4 Å²	143.4	64%	0.636	80%	0.804	S	S	*	*				-138.3	-158	-125.6	45	-24.4	0	0	0	115.6
1071	N	29.3	Very low	29.2	Very low	164 Å²	164	145.6 Å²	145.6	88%	0.877	80%	0.802	S	S	*	*			trans	76.5	129.5	173	-60.6	-17.6	0	0	0	116.8
1072	G	28.5	Very low	29.1	Very low	81 Å²	81	144 Å²	144	84%	0.835	79%	0.794	S	S	*	*			trans	156.2	99	171.3	0	0	0	0	0	113.4
1073	S	25.2	Very low	28.9	Very low	122 Å²	122	148.4 Å²	148.4	85%	0.853	80%	0.796	S	S	*	*			trans	-88.9	144.9	166.7	49.9	0	0	0	0	110.5
1074	L	28.2	Very low	28.8	Very low	172 Å²	172	147.3 Å²	147.3	90%	0.901	79%	0.79	S	S	*	*			trans	-152.6	130.1	176.2	-124.3	152.5	0	0	0	112.1
1075	F	23.7	Very low	28.9	Very low	175 Å²	175	150.3 Å²	150.3	77%	0.768	79%	0.791	S	S	*	*			trans	-89.1	156.3	179.3	-93.3	-106.2	0	0	0	112.1
1076	L	28.1	Very low	29	Very low	172 Å²	172	145.2 Å²	145.2	90%	0.901	79%	0.785	S	S	*	*			trans	-134.9	129.2	149.4	-78.6	176.5	0	0	0	111.4
1077	L	24.8	Very low	28.9	Very low	146 Å²	146	145.9 Å²	145.9	76%	0.764	78%	0.784	S	S	*	*			trans	-113.9	-171.5	169.2	-84.1	166.7	0	0	0	107
1078	P	32.3	Very low	28.7	Very low	112 Å²	112	144.7 Å²	144.7	73%	0.727	78%	0.779	S	S	*	*			cis	-123.5	-164.5	2.4	30	-4.5	0	0	0	112.4
1079	V	31	Very low	28.6	Very low	109 Å²	109	142.8 Å²	142.8	66%	0.661	78%	0.776	S	S	*	*				-167.3	136	61.6	164.3	0	0	0	0	111.3
1080	E	30.5	Very low	28.5	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.813	78%	0.776	S	S	*	*			trans	26	155.3	141.2	-47.1	172.2	166.1	0	0	121.6
1081	T	31.7	Very low	28.1	Very low	126 Å²	126	144.2 Å²	144.2	77%	0.773	78%	0.776	S	S	*	*			cis	-143.6	165.3	23.5	54.6	0	0	0	0	114.1
1082	D	25.4	Very low	28.2	Very low	126 Å²	126	144.5 Å²	144.5	67%	0.674	77%	0.769	S	S	*	*			trans	-66.3	169.3	178.2	-48.1	-103.1	0	0	0	117
1083	Y	30.2	Very low	28.2	Very low	236 Å²	236	147.8 Å²	147.8	93%	0.925	77%	0.766	S	S	*	*				-163.4	161	104.9	-114.1	-82.7	0	0	0	113.5
1084	N	24.9	Very low	28.6	Very low	130 Å²	130	147.9 Å²	147.9	70%	0.695	76%	0.764	S	S	*	*			trans	-111.1	180	-163	-102.1	-66.3	0	0	0	115.3
1085	Y	30.2	Very low	28.8	Very low	231 Å²	231	143.1 Å²	143.1	91%	0.906	76%	0.757	S	S	*	*			trans	81.5	144.8	172	-65.7	-96.2	0	0	0	118
1086	G	29	Very low	29.1	Very low	66 Å²	66	141.2 Å²	141.2	68%	0.68	75%	0.754	S	S	*	*			cis	166.8	130.7	-10.7	0	0	0	0	0	116.3
1087	Q	26.9	Very low	29.3	Very low	177 Å²	177	144.3 Å²	144.3	83%	0.827	76%	0.756	S	S	*	*			trans	52.5	134.9	149.7	-83.7	-170.7	-0.2	0	0	124
1088	N	28.1	Very low	29.4	Very low	122 Å²	122	148.1 Å²	148.1	65%	0.652	76%	0.76	S	S	*	*			trans	77.6	96.5	133.7	-63.4	-8.9	0	0	0	123.1
1089	S	25.7	Very low	29.5	Very low	93 Å²	93	148 Å²	148	65%	0.65	76%	0.761	S	S	*	*				85.4	155.9	109	76.4	0	0	0	0	123.1
1090	F	28.1	Very low	29.4	Very low	175 Å²	175	148.3 Å²	148.3	77%	0.768	76%	0.764	S	S	*	*			trans	79.3	118	159.8	-70.9	-62.6	0	0	0	122.6
1091	N	29.2	Very low	29.4	Very low	120 Å²	120	146.6 Å²	146.6	64%	0.642	76%	0.76	S	S	*	*			trans	80.3	112.2	130.3	-73	-32.7	0	0	0	122.8
1092	K	29.5	Very low	29.4	Very low	169 Å²	169	146.2 Å²	146.2	74%	0.735	76%	0.758	S	S	*	*				88.5	116.3	119.1	-74.4	-179	176.8	-178.3	0	122.2
1093	I	29.4	Very low	29.7	Very low	151 Å²	151	146.5 Å²	146.5	77%	0.774	76%	0.76	S	S	*	*			trans	88.4	130.5	131.5	-64.9	168.1	0	0	0	117.7
1094	P	34.7	Very low	29.8	Very low	123 Å²	123	141.8 Å²	141.8	80%	0.799	75%	0.749	S	S	*	*			trans	-107.2	-175.9	-175.2	43	-37.4	0	0	0	114.5
1095	G	31.5	Very low	30.2	Very low	73 Å²	73	142.6 Å²	142.6	75%	0.753	75%	0.751	S	S	*	*			trans	-156.2	143.8	168.2	0	0	0	0	0	113.4
1096	N	30.5	Very low	30.4	Very low	135 Å²	135	137.3 Å²	137.3	72%	0.722	74%	0.738	S	S	*	*			trans	-103.1	158.3	-175.4	-62.3	-22.4	0	0	0	112.7
1097	Y	30.7	Very low	30.7	Very low	237 Å²	237	139.6 Å²	139.6	93%	0.929	74%	0.735	S	S	*	*			trans	-140.5	168.5	154.4	-90.8	-75.4	0	0	0	111.6
1098	W	27.6	Very low	31.1	Very low	226 Å²	226	136.9 Å²	136.9	86%	0.856	73%	0.726	S	S	*	*			trans	-131.5	-178.6	-152.5	-92.9	38.4	0	0	0	114.3
1099	S	33.5	Very low	31.4	Very low	108 Å²	108	137 Å²	137	76%	0.755	73%	0.726	S	S	*	*			trans	99.5	151	155.3	79.2	0	0	0	0	118.8
1100	T	29	Very low	31.8	Very low	116 Å²	116	138.3 Å²	138.3	71%	0.712	73%	0.726	S	S	*	*				-172.2	169.7	-54.6	22.6	0	0	0	0	111.2
1101	N	31.7	Very low	32	Very low	138 Å²	138	137 Å²	137	74%	0.738	73%	0.726	S	S	*	*			trans	84.5	126.6	170.3	-56.4	-22.5	0	0	0	115.7
1102	T	31.3	Very low	32.1	Very low	119 Å²	119	136.7 Å²	136.7	73%	0.73	73%	0.727	S	S	*	*			cis	78.5	146.4	48	71.7	0	0	0	0	113.4
1103	N	31.8	Very low	32.1	Very low	132 Å²	132	135.4 Å²	135.4	71%	0.706	73%	0.729	S	S	*	*			cis	-166.2	176.9	21.5	-145.2	0.8	0	0	0	113.1
1104	I	33.1	Very low	32.2	Very low	136 Å²	136	135 Å²	135	70%	0.697	73%	0.726	S	S	*	*			trans	73.5	144.2	152.2	-68.5	161.2	0	0	0	118.7
1105	M	32.5	Very low	32.1	Very low	148 Å²	148	136.3 Å²	136.3	73%	0.729	72%	0.721	S	S	*	*			cis	-173.5	153.1	-21.2	-105.2	175.9	161.3	0	0	110.6
1106	N	34	Very low	32.2	Very low	120 Å²	120	138.7 Å²	138.7	64%	0.642	72%	0.721	S	S	*	*			trans	53.4	159.1	138.5	-68.6	43.7	0	0	0	122.3
1107	D	36.3	Very low	32.4	Very low	114 Å²	114	138.1 Å²	138.1	61%	0.61	72%	0.718	S	S	*	*			cis	-159.5	144.9	1.8	-115.5	-17.2	0	0	0	114.1
1108	N	35	Very low	32.6	Very low	120 Å²	120	133.9 Å²	133.9	64%	0.642	71%	0.706	S	S	*	*			trans	61	130.8	131.1	-64	-15.7	0	0	0	127.1
1109	N	35.2	Very low	32.8	Very low	125 Å²	125	129 Å²	129	67%	0.668	70%	0.697	S	S	*	*				75.8	152.1	127	-65.8	33.6	0	0	0	120.5
1110	D	33	Very low	32.7	Very low	120 Å²	120	135.4 Å²	135.4	64%	0.642	71%	0.705	S	S	*	*			cis	-166.7	170.1	-8.2	-121.9	-32.3	0	0	0	113.1
1111	I	32.5	Very low	32.8	Very low	148 Å²	148	137.9 Å²	137.9	76%	0.759	71%	0.712	S	S	*	*			trans	66.4	153.2	147.7	-72.7	161.5	0	0	0	119.7
1112	V	31.6	Very low	32.6	Very low	112 Å²	112	138.9 Å²	138.9	68%	0.679	72%	0.717	S	S	*	*				-176.6	135.6	-52.8	135.2	0	0	0	0	109.6
1113	N	29.4	Very low	32.3	Very low	142 Å²	142	140.8 Å²	140.8	76%	0.759	72%	0.722	S	S	*	*			trans	63	161.2	168.3	-66.2	-11.9	0	0	0	117.8
1114	M	31	Very low	32.1	Very low	144 Å²	144	140.1 Å²	140.1	71%	0.709	72%	0.723	S	S	*	*			cis	-153.6	141.1	9.6	-148	149.8	166.7	0	0	114.3
1115	Q	33.9	Very low	31.8	Very low	150 Å²	150	139.7 Å²	139.7	70%	0.701	73%	0.726	S	S	*	*			trans	54.5	125.6	148.7	-77.3	177.9	-39.6	0	0	124.8
1116	T	32.9	Very low	31.6	Very low	123 Å²	123	137.3 Å²	137.3	76%	0.755	73%	0.725	S	S	*	*			trans	67.2	144.5	143.1	59.2	0	0	0	0	119.9
1117	N	34.8	Very low	31.4	Very low	123 Å²	123	135.3 Å²	135.3	66%	0.658	72%	0.72	S	S	*	*			cis	-147.8	155.4	1.4	-137.1	28.1	0	0	0	113.5
1118	E	35.2	Very low	31.2	Very low	147 Å²	147	137.6 Å²	137.6	69%	0.687	72%	0.721	S	S	*	*			trans	66.8	126.7	150.1	-81.1	179.5	-119.9	0	0	124.8
1119	N	31.8	Very low	30.9	Very low	125 Å²	125	138.1 Å²	138.1	67%	0.668	72%	0.724	S	S	*	*			trans	72.6	85.8	131.7	-72.9	-38.4	0	0	0	122.1
1120	R	30.6	Very low	30.7	Very low	241 Å²	241	136.9 Å²	136.9	91%	0.909	72%	0.721	S	S	*	*				172.6	160.5	86.5	-97.7	178.3	170	176.8	-4.2	111.8
1121	I	31.4	Very low	30.5	Very low	168 Å²	168	138.2 Å²	138.2	86%	0.862	73%	0.728	S	S	*	*			trans	-99.8	142.9	-162.4	-67.3	170.2	0	0	0	112.6
1122	N	27.4	Very low	30.4	Very low	160 Å²	160	136.5 Å²	136.5	86%	0.856	73%	0.729	S	S	*	*			trans	-104.9	166.9	174.7	-98.1	-25.6	0	0	0	112.7
1123	L	24.4	Very low	30.3	Very low	158 Å²	158	139.1 Å²	139.1	83%	0.827	74%	0.739	S	S	*	*			trans	-82.6	177.2	178.1	-75.3	155.6	0	0	0	114
1124	T	28.1	Very low	30.3	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	74%	0.741	S	S	*	*			trans	80.8	104.6	144.2	37.5	0	0	0	0	122.9
1125	V	27.8	Very low	30.3	Very low	126 Å²	126	140.4 Å²	140.4	76%	0.764	73%	0.734	S	S	*	*				75.3	138.5	108.7	167	0	0	0	0	122.2
1126	S	28.2	Very low	30.1	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	74%	0.739	S	S	*	*			trans	75.6	155.5	155.1	69.5	0	0	0	0	120.3
1127	S	30	Very low	30.1	Very low	77 Å²	77	145 Å²	145	54%	0.538	74%	0.74	S	S	.	*			cis	-176.8	152.7	-29.9	56.7	0	0	0	0	112
1128	Y	30.5	Very low	30.2	Very low	162 Å²	162	144 Å²	144	64%	0.635	74%	0.739	S	S	*	*			trans	63.9	166.3	163.7	-59	-66	0	0	0	118.8	Q1032	Q1032-Y1128 PolarHBondContact NE2-OH 2.69Å
1129	N	30.2	Very low	30.1	Very low	132 Å²	132	143.1 Å²	143.1	71%	0.706	74%	0.739	S	S	*	*			cis	-167.2	164.9	-47.3	-160.8	5.8	0	0	0	111.8
1130	T	29.6	Very low	30.1	Very low	98 Å²	98	146.3 Å²	146.3	60%	0.601	74%	0.743	S	S	*	*			trans	78.2	134.2	155.6	64.2	0	0	0	0	123.8
1131	N	30	Very low	30.4	Very low	148 Å²	148	141.6 Å²	141.6	79%	0.791	73%	0.731	S	S	*	*			trans	72.8	147.2	144	-63.5	-9.6	0	0	0	121.6
1132	S	30.6	Very low	30.5	Very low	113 Å²	113	140.9 Å²	140.9	79%	0.79	73%	0.729	S	S	*	*			cis	-167	167.6	-20.7	51.7	0	0	0	0	111.9
1133	L	28.2	Very low	30.7	Very low	167 Å²	167	136.9 Å²	136.9	87%	0.874	73%	0.725	S	S	*	*			trans	-92.9	168.3	-168.3	-89.5	159.4	0	0	0	117.5
1134	Y	28.9	Very low	31.2	Very low	206 Å²	206	137.4 Å²	137.4	81%	0.808	73%	0.728	S	S	*	*			trans	-161.5	157.9	164.7	-126.6	-140.4	0	0	0	107.3
1135	N	32.1	Very low	31.2	Very low	106 Å²	106	140.8 Å²	140.8	57%	0.567	73%	0.733	S	S	*	*			cis	-155.2	176.7	-0.3	-166.2	21.9	0	0	0	110.4
1136	E	30.2	Very low	31.5	Very low	169 Å²	169	142.8 Å²	142.8	79%	0.79	74%	0.738	S	S	*	*			trans	-101.5	177.7	-177.5	-51.2	177.3	107	0	0	115
1137	Y	33.1	Very low	31.5	Very low	202 Å²	202	144.8 Å²	144.8	79%	0.792	74%	0.741	S	S	*	*			trans	179	106.5	132.6	-104.3	-72.8	0	0	0	115.5
1138	T	35.6	Very low	31.7	Very low	102 Å²	102	148.6 Å²	148.6	63%	0.626	75%	0.753	S	S	*	*			trans	54.2	157.7	135	60.8	0	0	0	0	123.9
1139	N	33.5	Very low	31.7	Very low	128 Å²	128	147.4 Å²	147.4	68%	0.684	76%	0.763	S	S	*	*			cis	-172.6	147.6	-8.6	-103.1	-12.4	0	0	0	114.1
1140	Y	31.7	Very low	31.8	Very low	191 Å²	191	144.6 Å²	144.6	75%	0.749	77%	0.765	S	S	*	*			trans	57.4	155.1	146.7	-77.3	-108.1	0	0	0	121.6
1141	H	36.2	Very low	31.6	Very low	143 Å²	143	145.8 Å²	145.8	66%	0.662	78%	0.776	S	S	*	*			cis	-166.4	148.1	32.1	-123.8	-58.2	0	0	0	114
1142	N	35.4	Very low	31.7	Very low	153 Å²	153	146.6 Å²	146.6	82%	0.818	78%	0.775	S	S	*	*			trans	52.6	158.6	154.2	-56.4	-6.3	0	0	0	120.9
1143	G	30.6	Very low	31.8	Very low	75 Å²	75	147.2 Å²	147.2	77%	0.773	77%	0.77	S	S	*	*			cis	175.1	147.6	-4	0	0	0	0	0	107.3
1144	D	35.1	Very low	32	Very low	169 Å²	169	147.2 Å²	147.2	90%	0.904	77%	0.769	S	S	*	*				-175.7	-173	68.2	-133	-36.1	0	0	0	112.6
1145	K	28.8	Very low	31.9	Very low	190 Å²	190	143 Å²	143	83%	0.826	77%	0.768	S	S	*	*			trans	-111	151.4	-170.2	-46.3	165.1	-173.5	166.6	0	116.5
1146	I	33.2	Very low	31.9	Very low	169 Å²	169	146.8 Å²	146.8	87%	0.867	78%	0.782	S	S	*	*			trans	-140.4	151.4	142.9	-64.3	-171.2	0	0	0	109.8
1147	N	27.3	Very low	31.9	Very low	141 Å²	141	144.5 Å²	144.5	75%	0.754	78%	0.78	S	S	*	*			trans	-149.5	143.7	-177	-173.8	32.6	0	0	0	110
1148	I	34.9	Very low	32	Very low	157 Å²	157	142.3 Å²	142.3	81%	0.805	78%	0.781	S	S	*	*			trans	-161.3	155.4	172.1	-104.8	147.9	0	0	0	111.6
1149	T	29.9	Very low	31.9	Very low	136 Å²	136	143.7 Å²	143.7	83%	0.834	78%	0.783	S	S	*	*			trans	-145.9	164.6	-171	46.3	0	0	0	0	112.3
1150	G	32.6	Very low	32	Very low	73 Å²	73	145 Å²	145	75%	0.753	79%	0.791	S	S	*	*			trans	115	126.2	178.5	0	0	0	0	0	112.3
1151	C	26.4	Very low	32	Very low	124 Å²	124	139.3 Å²	139.3	84%	0.838	79%	0.79	S	S	*	*			cis	83.1	102.5	17.9	-152.1	0	0	0	0	115.7
1152	Q	32.6	Very low	32	Very low	165 Å²	165	141.6 Å²	141.6	77%	0.771	80%	0.801	S	S	*	*				172.3	136.1	122.1	-91.5	-167.1	-93.8	0	0	114.2
1153	D	31.1	Very low	31.9	Very low	126 Å²	126	140 Å²	140	67%	0.674	80%	0.8	S	S	*	*			trans	31	137.2	139.3	-43	-38.1	0	0	0	123.6
1154	I	32.6	Very low	32.1	Very low	166 Å²	166	141.3 Å²	141.3	85%	0.851	80%	0.798	S	S	*	*				-170.5	140.8	116.1	-96	155.2	0	0	0	110.8
1155	C	27	Very low	32.1	Very low	117 Å²	117	141 Å²	141	79%	0.791	79%	0.794	S	S	*	*			trans	-132.8	143.8	167.9	-59	0	0	0	0	110.3
1156	Q	32	Very low	32.5	Very low	186 Å²	186	136.4 Å²	136.4	87%	0.869	78%	0.784	S	S	*	*			trans	179.7	117.3	143.7	-99.8	162.2	20.2	0	0	109.2
1157	T	30.5	Very low	32.7	Very low	121 Å²	121	137.1 Å²	137.1	74%	0.742	78%	0.781	S	S	*	*				96.1	158.8	72.2	-55.3	0	0	0	0	112.4
1158	I	34.7	Very low	33.2	Very low	156 Å²	156	134.8 Å²	134.8	80%	0.8	78%	0.776	S	S	*	*			trans	88.9	133.7	173.9	-51.7	171.2	0	0	0	114.7
1159	L	33.4	Very low	33.1	Very low	131 Å²	131	135.2 Å²	135.2	69%	0.686	78%	0.776	S	S	*	*			cis	-173.9	158.9	-37.7	-115.8	161.8	0	0	0	109.9
1160	N	36.4	Very low	33.6	Very low	157 Å²	157	132.7 Å²	132.7	84%	0.84	76%	0.763	S	S	*	*			trans	72.3	134.6	172.8	-42.7	-42.4	0	0	0	116.7
1161	G	32.4	Very low	33.7	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	77%	0.766	S	S	*	*			cis	168.6	168.1	-11.5	0	0	0	0	0	115
1162	Q	36.2	Very low	34.1	Very low	191 Å²	191	136 Å²	136	89%	0.893	76%	0.762	S	S	*	*			trans	89.7	129.6	168.2	-56.1	-171.5	-22.4	0	0	120.7
1163	C	31.7	Very low	33.7	Very low	119 Å²	119	134.5 Å²	134.5	80%	0.804	77%	0.768	S	S	*	*			trans	65.6	142.4	162.7	-57.5	0	0	0	0	120.7
1164	S	36.3	Very low	33.8	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	77%	0.773	S	S	*	*			cis	-171.5	108.4	-23.9	47.2	0	0	0	0	113.9
1165	I	35	Very low	33.8	Very low	162 Å²	162	134.6 Å²	134.6	83%	0.831	77%	0.773	S	S	*	*			trans	33.8	145.4	131.5	-53.1	170.5	0	0	0	120.4
1166	P	37.5	Very low	33.8	Very low	94 Å²	94	137.2 Å²	137.2	61%	0.61	78%	0.778	S	S	*	*			cis	-113.9	-156.7	-10.7	21.7	3.8	0	0	0	110.7
1167	F	36.9	Very low	33.7	Very low	183 Å²	183	134.1 Å²	134.1	80%	0.803	77%	0.772	S	S	*	*			cis	-139.6	166.4	2.5	-71.6	-86.5	0	0	0	106.9
1168	S	36.9	Very low	33.8	Very low	92 Å²	92	135.9 Å²	135.9	64%	0.643	78%	0.777	S	S	*	*			cis	81.5	132.9	16.1	76.8	0	0	0	0	117.3
1169	M	34.1	Very low	33.5	Very low	166 Å²	166	136 Å²	136	82%	0.818	78%	0.777	S	S	*	*			cis	-178.7	-175.1	0.1	-117.7	-174.9	139.7	0	0	109.3
1170	P	39.5	Very low	33.5	Very low	84 Å²	84	135.4 Å²	135.4	55%	0.545	78%	0.779	S	S	.	*			cis	-137.8	-177.6	-32	40.4	-22.7	0	0	0	115.4
1171	E	35.7	Very low	33.3	Very low	175 Å²	175	136.8 Å²	136.8	82%	0.818	78%	0.778	S	S	*	*			trans	65.6	152.1	145.3	-78.2	145.8	-135.2	0	0	121.5
1172	A	33.8	Very low	33.3	Very low	91 Å²	91	141.9 Å²	141.9	75%	0.752	78%	0.783	S	S	*	*			cis	-139.2	163.3	9.2	0	0	0	0	0	113.6
1173	C	25.2	Very low	33.4	Very low	133 Å²	133	137.7 Å²	137.7	90%	0.899	77%	0.772	S	S	*	*			trans	-127.4	115.9	177.6	-68.1	0	0	0	0	113
1174	S	31.7	Very low	33.5	Very low	112 Å²	112	140.4 Å²	140.4	78%	0.783	77%	0.772	S	S	*	*			trans	-175.7	138.6	169.1	54.7	0	0	0	0	108.4
1175	E	32.2	Very low	33.4	Very low	183 Å²	183	142.4 Å²	142.4	86%	0.855	77%	0.773	S	S	*	*			cis	-138.8	157.3	8.1	-61.9	-177.6	120.9	0	0	111.8
1176	L	27.4	Very low	33.1	Very low	172 Å²	172	142.4 Å²	142.4	90%	0.901	77%	0.774	S	S	*	*			trans	-111.2	97.4	169	-109.7	169	0	0	0	109.2
1177	T	31.2	Very low	32.8	Very low	120 Å²	120	146 Å²	146	74%	0.736	79%	0.785	S	S	*	*			trans	-175	107.5	153.6	21.9	0	0	0	0	113.1
1178	N	31	Very low	32.5	Very low	159 Å²	159	141.3 Å²	141.3	85%	0.85	78%	0.775	S	S	*	*				-176	122.9	117.3	-103.6	-54.3	0	0	0	112.2
1179	I	30	Very low	32.2	Very low	157 Å²	157	141.8 Å²	141.8	81%	0.805	78%	0.778	S	S	*	*			trans	-115.3	132.7	169.9	-66.1	168.5	0	0	0	107.1
1180	T	31.8	Very low	31.9	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	78%	0.78	S	S	*	*			trans	179.8	151.6	141.8	21.2	0	0	0	0	112.7
1181	K	31.9	Very low	31.5	Very low	186 Å²	186	145.4 Å²	145.4	81%	0.809	79%	0.793	S	S	*	*			trans	70.8	96.6	172.1	-58.7	163.9	-171.1	173.8	0	113.8
1182	H	34.3	Very low	31.2	Very low	179 Å²	179	144.1 Å²	144.1	83%	0.829	79%	0.791	S	S	*	*			cis	61.5	148.9	41.9	-67.8	-47.5	0	0	0	115.5
1183	P	37.2	Very low	30.9	Very low	103 Å²	103	151.6 Å²	151.6	67%	0.669	80%	0.8	S	S	*	*			cis	-141.8	164.1	-28.3	36.6	-20.4	0	0	0	115
1184	H	34.4	Very low	31.2	Very low	176 Å²	176	150.6 Å²	150.6	82%	0.815	79%	0.792	S	S	*	*			trans	-160.4	111.3	142.3	-98.9	-69.5	0	0	0	113
1185	I	33.3	Very low	31.1	Very low	144 Å²	144	155.5 Å²	155.5	74%	0.738	80%	0.799	S	S	*	*			trans	29.7	108.1	137	-52.6	171.8	0	0	0	117.8
1186	L	29.3	Very low	30.9	Very low	162 Å²	162	154.1 Å²	154.1	85%	0.848	80%	0.797	S	S	*	*				67.1	104	73.5	-107.7	170.5	0	0	0	117.3
1187	M	31	Very low	30.9	Very low	171 Å²	171	151.3 Å²	151.3	84%	0.842	79%	0.792	S	S	*	*			trans	-172.1	164.4	132	-108.6	175.3	69.6	0	0	114.4
1188	S	31.1	Very low	30.8	Very low	83 Å²	83	151.1 Å²	151.1	58%	0.58	79%	0.791	S	S	*	*			trans	-34.4	141.3	168.6	44.4	0	0	0	0	116
1189	S	29.6	Very low	30.8	Very low	102 Å²	102	149.6 Å²	149.6	71%	0.713	79%	0.787	S	S	*	*			cis	73.5	129.7	47.9	82.9	0	0	0	0	114.9
1190	M	28.5	Very low	30.9	Very low	175 Å²	175	149.6 Å²	149.6	86%	0.862	79%	0.789	S	S	*	*			trans	68	136.5	-172.8	-66.5	162.4	165.6	0	0	112.7
1191	D	30.3	Very low	30.8	Very low	152 Å²	152	153.5 Å²	153.5	81%	0.813	80%	0.796	S	S	*	*			cis	-139.2	161	21.5	-93	-49.8	0	0	0	114.9
1192	N	29.8	Very low	31	Very low	148 Å²	148	151.3 Å²	151.3	79%	0.791	80%	0.798	S	S	*	*			trans	-72.7	153.1	157.8	-79	-41.3	0	0	0	110.3
1193	W	27.3	Very low	30.9	Very low	247 Å²	247	147 Å²	147	94%	0.936	79%	0.788	S	S	*	*			trans	-173.3	128.8	135.3	-103.5	23.9	0	0	0	111.5
1194	P	32.1	Very low	30.7	Very low	113 Å²	113	148.6 Å²	148.6	73%	0.734	79%	0.792	S	S	*	*			trans	-76.3	134	168.3	31.6	-32.2	0	0	0	110.5
1195	K	29.6	Very low	30.6	Very low	214 Å²	214	146.6 Å²	146.6	93%	0.93	79%	0.785	S	S	*	*			trans	-83.3	113.7	170.6	-75.4	-175.1	176.6	179.5	0	110.2
1196	L	26.8	Very low	30.7	Very low	155 Å²	155	146.8 Å²	146.8	81%	0.812	79%	0.786	S	S	*	*			trans	-149.6	146.8	173.6	-118.3	163.5	0	0	0	110.1
1197	S	28.1	Very low	31	Very low	112 Å²	112	146 Å²	146	78%	0.783	78%	0.782	S	S	*	*			trans	64.9	153.3	-162.5	82.6	0	0	0	0	112.9
1198	T	28.4	Very low	31.2	Very low	117 Å²	117	142.7 Å²	142.7	72%	0.718	77%	0.773	S	S	*	*			cis	-130.7	-176.4	32	53.7	0	0	0	0	114.5
1199	T	32.8	Very low	31.4	Very low	127 Å²	127	144.5 Å²	144.5	78%	0.779	78%	0.78	S	S	*	*			trans	80.2	132.1	-168.4	66.3	0	0	0	0	112.7
1200	D	32.3	Very low	31.6	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	78%	0.781	S	S	*	*			cis	-118.2	168.3	13.4	-89.3	-45.9	0	0	0	116.2
1201	F	28.6	Very low	31.8	Very low	201 Å²	201	142.2 Å²	142.2	88%	0.882	77%	0.77	S	S	*	*			trans	-103.3	131.2	175.4	-99.8	-100.5	0	0	0	112.1
1202	T	35.6	Very low	32.2	Very low	139 Å²	139	142.1 Å²	142.1	85%	0.853	77%	0.769	S	S	*	*			trans	173.4	151.8	152.6	25.1	0	0	0	0	108.8
1203	S	33.2	Very low	32.6	Very low	88 Å²	88	140.5 Å²	140.5	62%	0.615	77%	0.769	S	S	*	*			cis	-168.1	143.3	-25.1	52.5	0	0	0	0	111.9
1204	N	33.2	Very low	33.1	Very low	138 Å²	138	132.2 Å²	132.2	74%	0.738	76%	0.761	S	S	*	*			trans	74.2	120.1	145.8	-65.3	-15.4	0	0	0	124.1
1205	I	31.4	Very low	33.6	Very low	134 Å²	134	134.8 Å²	134.8	69%	0.687	77%	0.768	S	S	*	*				51.7	123.3	129.1	-33.1	163.4	0	0	0	118.2	I1207	I1205-I1207 HydrophobicContact CG2-CD1 4.27Å
1206	I	35.3	Very low	33.9	Very low	147 Å²	147	127.8 Å²	127.8	75%	0.754	76%	0.757	S	S	*	*				-179.1	111.8	91	-82.1	172.1	0	0	0	106.1
1207	I	35.2	Very low	34.6	Very low	147 Å²	147	128.4 Å²	128.4	75%	0.754	76%	0.761	S	S	*	*				92.8	145.1	83.4	-81.1	167.6	0	0	0	113.9	I1205	I1205-I1207 HydrophobicContact CG2-CD1 4.27Å
1208	P	36.2	Very low	34.8	Very low	100 Å²	100	128 Å²	128	65%	0.649	76%	0.758	S	S	*	*			trans	-130.1	-152.4	-143.2	42.9	-25.4	0	0	0	116.5
1209	T	35.2	Very low	35	Very low	121 Å²	121	129.6 Å²	129.6	74%	0.742	77%	0.768	S	S	*	*			trans	75.8	150.6	169.3	49.4	0	0	0	0	117.7
1210	D	33.9	Very low	34.9	Very low	138 Å²	138	129.8 Å²	129.8	74%	0.738	76%	0.76	S	S	*	*			cis	-157	174.6	5.8	-135	-22.5	0	0	0	116.5
1211	C	32.9	Very low	34.9	Very low	91 Å²	91	130.3 Å²	130.3	62%	0.615	76%	0.761	S	S	*	*			trans	62.4	128.1	148	-71	0	0	0	0	125.6
1212	D	38.8	Very low	35.2	Very low	151 Å²	151	127.3 Å²	127.3	81%	0.807	75%	0.75	S	S	*	*			trans	61.2	152.8	131.1	-76.7	-34.9	0	0	0	123.1
1213	S	37.7	Very low	35.2	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	75%	0.745	S	S	*	*			cis	-166.2	167.7	-9.2	48.9	0	0	0	0	110.3
1214	G	37.9	Very low	35.3	Very low	73 Å²	73	129.2 Å²	129.2	75%	0.753	75%	0.754	S	S	*	*			trans	156.4	116	162.3	0	0	0	0	0	118.7
1215	N	42.2	Very low	35.4	Very low	167 Å²	167	129.5 Å²	129.5	89%	0.893	76%	0.755	S	S	*	*			trans	-50.1	168	173.1	-45.6	-21.6	0	0	0	115.2
1216	G	36.2	Very low	35.4	Very low	68 Å²	68	128 Å²	128	70%	0.701	76%	0.756	S	S	*	*			cis	-176	-173	8.3	0	0	0	0	0	109.1
1217	D	41	Very low	35.2	Very low	167 Å²	167	128 Å²	128	89%	0.893	76%	0.763	S	S	*	*			cis	-140.4	170.3	5	-80.4	-35.3	0	0	0	110.7
1218	S	33.4	Very low	35	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	77%	0.766	S	S	*	*			trans	-121	158.4	-172.8	58.5	0	0	0	0	114.4
1219	V	32.7	Very low	34.5	Very low	151 Å²	151	130.9 Å²	130.9	92%	0.915	77%	0.77	S	S	*	*			trans	-136.1	130.3	143.7	-178.4	0	0	0	0	107.9
1220	E	29.9	Very low	34.4	Very low	131 Å²	131	135.2 Å²	135.2	61%	0.612	77%	0.774	S	S	*	*			trans	-125.4	141	-172.2	180	-173.4	-178.5	0	0	109.9	Q1222	E1220-Q1222 HydrophobicContact CG-CG 4.02Å; E1220-Q1222 WeakPolarHBondContact OE1-CG 3.48Å; E1220-Q1222 PolarHBondContact OE1-NE2 2.67Å
1221	I	33	Very low	34.3	Very low	168 Å²	168	138 Å²	138	86%	0.862	78%	0.78	S	S	*	*			trans	-132.3	123.5	158.7	-61.3	-176.5	0	0	0	107.5
1222	Q	33.8	Very low	34.2	Very low	139 Å²	139	142.1 Å²	142.1	65%	0.65	80%	0.795	S	S	*	*			trans	-84.1	145.7	-164.3	-74.3	-179.1	-15.7	0	0	114.8	E1220	E1220-Q1222 HydrophobicContact CG-CG 4.02Å; E1220-Q1222 WeakPolarHBondContact OE1-CG 3.48Å; E1220-Q1222 PolarHBondContact OE1-NE2 2.67Å
1223	P	35.5	Very low	33.7	Very low	117 Å²	117	138.4 Å²	138.4	76%	0.76	79%	0.792	S	S	*	*			trans	-84	170	160.6	37.7	-34.8	0	0	0	111
1224	N	35.7	Very low	33.3	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	80%	0.796	S	S	*	*			trans	-154.3	161	160.2	-137.5	-36	0	0	0	114.2
1225	L	34.8	Very low	33	Very low	145 Å²	145	151 Å²	151	76%	0.759	82%	0.824	S	S	*	*			trans	69.8	61.5	165	-66.4	161.2	0	0	0	119
1226	S	31.6	Very low	32.5	Very low	103 Å²	103	150.2 Å²	150.2	72%	0.72	82%	0.82	S	S	*	*				24.2	128.7	123.7	63.5	0	0	0	0	121
1227	T	30.9	Very low	32.3	Very low	145 Å²	145	154.5 Å²	154.5	89%	0.89	83%	0.827	S	S	*	*			trans	-145.9	149	140.6	-63	0	0	0	0	109.1
1228	K	30.9	Very low	31.8	Very low	188 Å²	188	153.8 Å²	153.8	82%	0.817	82%	0.823	S	S	*	*			trans	-76.5	144.9	-174.2	-71.5	-176	176.9	-178.8	0	113.2
1229	V	26.5	Very low	31.7	Very low	120 Å²	120	156.8 Å²	156.8	73%	0.727	83%	0.829	S	S	*	*			trans	-76.2	140.9	169.3	176.7	0	0	0	0	110.7	F1231	V1229-F1231 HydrophobicContact CG1-CD2 3.89Å
1230	Y	32.7	Very low	31.7	Very low	212 Å²	212	157.2 Å²	157.2	83%	0.831	82%	0.824	S	S	*	*			trans	-122.8	117.4	155.3	-77.5	-86.9	0	0	0	108.7
1231	F	32.1	Very low	31.8	Very low	198 Å²	198	158.9 Å²	158.9	87%	0.868	84%	0.838	S	S	*	*			trans	-128.4	112.4	158.8	-94.1	-80.6	0	0	0	108.5	V1229 G1233	V1229-F1231 HydrophobicContact CG1-CD2 3.89Å; F1231-G1233 PolarHBondContact O-N 2.98Å
1232	L	31.8	Very low	31.7	Very low	177 Å²	177	158.3 Å²	158.3	93%	0.927	84%	0.836	S	S	*	*			trans	-79.3	93.9	169.4	-97.4	156.5	0	0	0	108.1
1233	G	28.3	Very low	31.5	Very low	72 Å²	72	159.8 Å²	159.8	74%	0.742	85%	0.85	S	S	*	*			trans	-70.6	137.7	161.6	0	0	0	0	0	109.9	F1231	F1231-G1233 PolarHBondContact O-N 2.98Å
1234	R	28.1	Very low	31.2	Very low	234 Å²	234	163.3 Å²	163.3	88%	0.883	86%	0.858	S	S	*	*			trans	-145.3	116.2	162.3	-159.5	178.7	-163	-160.8	2.5	108
1235	T	30.8	Very low	30.8	Very low	217 Å²	217	164.6 Å²	164.6	100%	1.331	86%	0.863	S	S	*	*			trans	51.4	0	-169.1	60.7	0	0	0	0	113.1

Retrieved 1,235 of 1,235 residues in 1641.1 ms (Link to these results)

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