A0A077YYE6_TRITR Loading...

Deleted in malignant brain tumors 1 protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A077YYE6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 2,970 aa.

						>A0A077YYE6_TRITR|A0A077YYE6
MALRRVPDQSFRFIRTLQQLRIRSIVLLLVLSYFHCSLLTNGAAFIDTLQEAGGTYTLNHTLYQQDGPYKVTRPIFVQAGANLTIEQGVKLYFASGVGITVQGVLNAIGNKYVQIEMLPWLTPPDNLHAQNYSSIRLVDGPSTRQGRLQVLFKGKWRAVCTMMTNWTSVDYRVACRTMGFDDGGFWKWFRRNNDTMPFVMPKPGCNYTHGDLHQCTNWTTEKIMLAENLCQGEDDLGLVCWGPPTFPGWEFHWKGLEFQDAPWHYVPLSGVSIKKESKSRLEHVNIWYAGYDRERANATAALLIHGVAPFMNYIDVKYSAQDGVRITSADGPVEITNSTISYNRGHGVVVENTTDGRLFINETRIEFNFGDGIQFRPLLGLSYRPVVDEAFGRDSIIYYEPEIPEIDICTAHVLNPARKSFPRIVSAQLTNTSGLTTAGDQWPCYLVTIDDSLYLYVCEYKRLNDLCKFPRYKIPVRNGLLLPSINARNLGGNLWIGLKYEDLNTTVRRESRVVMKIHSSIDNFVFYGLNVSNSRVCNNGGSGIYLQDVRDRTALNNVTISGNQHTAGVHIFGGVGDLWINNSFIMDNWGDGVNVSHCGGSLVVNGTQISRNRMRGFAFHHREMKQFLPLKFEVVFKGRPALNNDYTATYVNENSWGGILIGNFCTTADKRYVVRDPRVVVAYVEFVGNRYHPAFEYHSCQSDRQPITRVEVSGSVFRLSTGICFRIQPAVNIKLDINDCRFVENHRPVLLIRNRDHPQLANLPATVSITRNHMKYNVGPFIVSIGLNEPSFVQNMHFHVQNEVKENRVVNPYPLLNGRTLPHAAVIITSSNVIIRRNCFYNIHAEFEIATDLNEHALVIDARENNYGSSVPSTFMYKIFDQFKRYSLAKINVDPYAAVCNSQNPKITDLRNFYRRFRQAERPNIIGGTVYENTDLPRGDYLVVDDLHVSPGSILTLQPGTVLRFQNSIGMLVQGELVRTDYSRSPEPILFTLAQREKQQPHNIRIISDDDNKNSSDALSGRLEVLVNGQWGTICNRSWTVNLAAASCHQLGMILDPEFLENWRVYPSPGSLPVVMDNIRCEELEYDITQCRHDGVDQAIHLSCKPAEVVGVRCVQPMWAGVRYSLLASPASVTGQTTIKHLIIEKAGLLDFRLPEFAAAFTVDWNYHLFEHLTVQDNFWTGVDIIYTDPIKKPKLLHCQLVRNRRHGLRLRSVGLTLENVTLAGNENAGIRYNPQITQKMQRDVSSWLRRDDAVFHDGSLLIMPHGTEIVLTTSLYESRKYLIASSSSCGLNSVDDCIYTLTVRSTAISPGVEGRVGVQIINRPSQEGDENLYIFDEAAGGMEVNMRGNLIEFPWVSSGDTIRVRYKRTYGLAEVAVLLFHISDFEYLDDFVHVRSSAIRQNQYGLSGVHYSSFFRNDGSVLLRRRRSKLWFQKTYFTGNRQAVIWVNGPLMEVEMDSPLAEVAYLIDNCSVSFNNGSVIETHRDLQSSANSFWWKIWQSNFFSNYESGLSISLPDPQNVLLNLSHRFELRESNFQDNVDFQFLLSGYYAWLNISSNNFTMNRARHDIGLMKLAGMEKELVMERNRWRYNQGKWVLSFDIKSNALVNYPVPCRVHRNYFFDNYFLTPEDNYVDNWPRSFALGLFGVQNVEVHFNNFRNTLLDFEVVAGLRTTMFLSKANISHNYFGQDTEVGVLQRIFDFDDWNIFCLANVNPYFVTEERSINWEWRPEDAQLGMVAYEEPSVYDLHGRLYKSLTLKRQREKWTVFPYYFKPDKPYYIRKDLTIMPGAKLTIEKGVEIHIYPNVRILVLGSLEAQGTFWEPIRLKPVNLTDIAHFDVGKKIFASHGGDSSFRRKEKRDAVYEMFPLLHRQYSFYQKFETFLVDGPDARTGFLEIYNATTGERVPICDRQFTKRNAEVVCREHGFQSKNVYVRIGPRWNNDPKLHLVKSYSEPRQCFGNEKRLADCDLRLSNDANLWKCVDAEHFVFLHCGRAEAVNPEYVGHWGGLFFAADSVETARNMQSSLRHVEIVGAGLSHNDSSAAITVVYRSVIFDHVNVTNSSMHAIEIVAPHAEIVLNKMNITDNLGVGLRLLGLNMHSSTTVEDEPLLHATFPYYLYGLIEMCSVDKVIEVEKRVLVYYKYDSYPVDCYKTFLSLNSAKKLEFKLLLANIYNSSDQAIRKDRIAFFNGRQMSSAAFIDSFGHETSRHGLSQPVRSSGNALTVHLRANAADGAYGLIAEIVTVPAPPDPAPLKNIFIHEGRFERNDRGAVRYDCTGDVNAVVDIDLCSFNYNGYQLWENFTTSSGAVRLSMYNTQSFKLQNSMFFRNAGGLSIFAASTTPSARMVGLIRNCAFGNNVIWETLKLVGRNYQKVYAVNNYFGRNWSPYKDVVFVDHMLVNFTRNTFYNNTGTHIVHLGGYRDVSTEFQLFRSNVLYDNIATGHGYHFIPQYGYFGKQEGLPIVPSLHSRKRRRLAVQTSEKVAKVQPPEATGTSFEWWANVGFEAERYHSTVFAASGQVKIENNFFSNPDNNFELTTAVVNLSDAYSGPVDARQNYWGQISTPAVASGKIRDGNDHDYLLKVNFLPVLESNTSLLDGSCPPGWFEAGYEEWKSYRSCFLFVPGAVAYRVAEEFCKEQGGYLPFFRDQDKRLAPLAKKVDMLNRQFSIASELVPTYMKTYETRFWISSVTVPPEKCGYLSSKTASIGVYNCDDVLPFVCEKGPKPYEEPIYLQPAVIATIVVSTLLIFIIGLLTFMWWLKSKQRAKQFFERKSSLRASIRSLKNGSAAVDSEETSEAKQWKYRPSSPDLIEAAHRNLVFGSKSIESLTRTARSSSAGKIPSPSLAKFPTEPGYDSLDSSTVYQNESLRSGRKVKCDVSPSSSYCESAYRSDFSPSSERSSLAGTPSLPSFQAVSRRWSPWSINTKLTGQTAAMSGVTYAGKNKVTEHKVQAVRAVQLRELNKATISRRRVIQRH
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 9 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	30.6	Very low	250 Å²	250	167.5 Å²	167.5	100%	1.232	86%	0.855	S	S	*	*				0	117.4	0	-78.2	175.6	-172.6	0	0	108.2
2	A	27.9	Very low	29.9	Very low	102 Å²	102	173 Å²	173	84%	0.843	86%	0.857	S	S	*	*			trans	-98.7	119.6	174.3	0	0	0	0	0	108.3
3	L	35.2	Very low	29.9	Very low	179 Å²	179	174.1 Å²	174.1	94%	0.937	86%	0.855	S	S	*	*			trans	-138.8	127.4	159	-99.7	161.7	0	0	0	109
4	R	30.4	Very low	29.9	Very low	224 Å²	224	171.1 Å²	171.1	85%	0.845	84%	0.842	S	S	*	*			trans	-73.4	147	-170.1	-77.9	164.8	164.5	178.5	-3.8	113
5	R	27.2	Very low	29.6	Very low	224 Å²	224	175.5 Å²	175.5	85%	0.845	85%	0.846	S	S	*	*			trans	51.2	115.8	131.9	-67.3	-179.3	171.9	178.9	-3.6	121.1
6	V	30.1	Very low	29.8	Very low	131 Å²	131	172.8 Å²	172.8	79%	0.794	84%	0.843	S	S	*	*				52.5	139.9	113.8	-179.4	0	0	0	0	116.6
7	P	39.6	Very low	29.9	Very low	107 Å²	107	171.5 Å²	171.5	70%	0.695	84%	0.84	S	S	*	*			cis	-147	172.2	39.2	19	9.7	0	0	0	119.5
8	D	25.9	Very low	29.8	Very low	149 Å²	149	172.7 Å²	172.7	80%	0.797	84%	0.844	S	S	*	*			trans	28.6	126.2	140.5	-62.6	-32.9	0	0	0	121
9	Q	30.3	Very low	29.9	Very low	180 Å²	180	172.6 Å²	172.6	84%	0.841	84%	0.841	S	S	*	*				-167.5	124.5	117	-103.9	174.4	24.3	0	0	112.2
10	S	23.9	Very low	30.1	Very low	107 Å²	107	172.8 Å²	172.8	75%	0.748	85%	0.845	S	S	*	*			trans	-69.1	131.5	165.3	50.6	0	0	0	0	111.6
11	F	30.6	Very low	30.2	Very low	189 Å²	189	175.3 Å²	175.3	83%	0.829	85%	0.845	S	S	*	*			trans	-147.5	122.7	152.1	-106.4	-80.7	0	0	0	112.1
12	R	22.2	Very low	30.6	Very low	234 Å²	234	170.4 Å²	170.4	88%	0.883	82%	0.823	S	S	*	*			trans	-74.9	135	168	-71.5	173.1	169.4	175.9	-3.2	109.2
13	F	30.2	Very low	31.1	Very low	187 Å²	187	176.8 Å²	176.8	82%	0.82	83%	0.825	S	S	*	*			trans	-136.5	98.9	157.2	-114.1	-88.5	0	0	0	111
14	I	29.6	Very low	31.7	Very low	133 Å²	133	172.5 Å²	172.5	68%	0.682	81%	0.81	S	S	*	*			trans	31	114.1	131.8	-60	173.5	0	0	0	119
15	R	25.4	Very low	32.6	Very low	237 Å²	237	166.7 Å²	166.7	89%	0.894	80%	0.795	S	S	*	*			trans	41.9	111.3	131.4	-59.3	177.8	171.2	175.1	-3.8	119
16	T	32.5	Very low	33.6	Very low	131 Å²	131	160.6 Å²	160.6	80%	0.804	78%	0.782	S	S	*	*			trans	-124.6	112.9	142.6	36.8	0	0	0	0	110.5
17	L	31.4	Very low	34.5	Very low	152 Å²	152	160.1 Å²	160.1	80%	0.796	78%	0.775	S	S	*	*			trans	50.3	92	147.9	-70.3	117.7	0	0	0	119.9	Q19	L17-Q19 PolarHBondContact O-N 3.12Å
18	Q	28.3	Very low	34.9	Very low	193 Å²	193	160.9 Å²	160.9	90%	0.902	77%	0.772	S	S	*	*			trans	-57.5	112.5	134.4	-72.7	172.7	-44.2	0	0	109.5
19	Q	31.9	Very low	36	Very low	171 Å²	171	158.6 Å²	158.6	80%	0.799	76%	0.76	S	S	*	*			trans	176.9	90.2	145.4	-103.1	176.7	5.2	0	0	108.9	L17	L17-Q19 PolarHBondContact O-N 3.12Å
20	L	33.9	Very low	36.8	Very low	175 Å²	175	154 Å²	154	92%	0.916	74%	0.743	S	S	*	*			trans	174.9	54.3	151.9	-94.1	146.8	0	0	0	108.3
21	R	32.3	Very low	37.7	Very low	226 Å²	226	153.4 Å²	153.4	85%	0.853	73%	0.731	S	S	*	*			trans	-124.7	46.7	179.3	-97.7	-160.1	-178.2	-174.4	1.3	111.8
22	I	44.5	Very low	38.2	Very low	148 Å²	148	147.1 Å²	147.1	76%	0.759	71%	0.711	S	S	*	*	S	Bend	trans	-136.7	-11.4	169.6	-60	-175.9	0	0	0	114.9
23	R	38.8	Very low	38.9	Very low	235 Å²	235	145 Å²	145	89%	0.887	70%	0.704	S	S	*	*	S	Bend	trans	-98.2	-13.7	179	-75.4	-170.4	175.6	-175.7	-0.6	117.2
24	S	45.9	Very low	39.1	Very low	89 Å²	89	143.4 Å²	143.4	62%	0.622	70%	0.697	S	S	*	*	H	α-helix	trans	-94.8	-15.7	-178.1	-48.6	0	0	0	0	114.9	L28	S24-L28 PolarHBondContact O-N 3.4Å
25	I	49.3	Very low	39.3	Very low	103 Å²	103	143.7 Å²	143.7	53%	0.528	70%	0.695	S	S	.	*	H	α-helix	trans	-80.1	-32.6	-178.2	-61.8	174.4	0	0	0	111.4	L27 L28 L29	I25-L27 VanDerWaalsContact C-N 3.34Å; I25-L28 PolarHBondContact O-N 3.43Å; I25-L29 HydrophobicContact CG2-CD1 4.19Å; I25-L29 PolarHBondContact O-N 3.11Å; I25-L29 VanDerWaalsContact O-N 3.12Å
26	V	49.8	Very low	39.6	Very low	95 Å²	95	137.8 Å²	137.8	58%	0.576	69%	0.689	S	S	*	*	H	α-helix	trans	-70.6	-33.1	176.6	-177.3	0	0	0	0	111.2	L29 V30	V26-L29 PolarHBondContact O-N 3.47Å; V26-V30 HydrophobicContact CG1-CG2 4.49Å; V26-V30 WeakPolarHBondContact O-CG2 3.36Å; V26-V30 PolarHBondContact O-N 2.72Å; V26-V30 VanDerWaalsContact O-N 3.12Å
27	L	47.7	Very low	39.6	Very low	121 Å²	121	135.8 Å²	135.8	63%	0.634	68%	0.681	S	S	*	*	H	α-helix	trans	-68.6	-36.9	175.9	-146.7	84.3	0	0	0	111.9	I25 L31	I25-L27 VanDerWaalsContact C-N 3.34Å; L27-L31 HydrophobicContact CG-CD1 4.42Å; L27-L31 WeakPolarHBondContact O-CB 3.49Å; L27-L31 WeakPolarHBondContact O-CD1 3.47Å; L27-L31 VanDerWaalsContact O-CG 3.28Å; L27-L31 WeakPolarHBondContact O-CG 3.47Å; L27-L31 PolarHBondContact O-N 3.43Å
28	L	48.8	Very low	39.8	Very low	124 Å²	124	133.8 Å²	133.8	65%	0.649	67%	0.67	S	S	*	*	H	α-helix	trans	-70.6	-34.7	176.6	-87.8	154.6	0	0	0	113	S24 I25 S32	S24-L28 PolarHBondContact O-N 3.4Å; I25-L28 PolarHBondContact O-N 3.43Å; L28-S32 WeakPolarHBondContact O-CB 3.28Å; L28-S32 PolarHBondContact O-N 3.21Å
29	L	48.3	Very low	40.3	Very low	101 Å²	101	132.3 Å²	132.3	53%	0.529	67%	0.667	S	S	.	*	H	α-helix	trans	-73.2	-37.9	176.5	-84.5	160.3	0	0	0	112.7	I25 V26 S32 Y33	I25-L29 HydrophobicContact CG2-CD1 4.19Å; I25-L29 PolarHBondContact O-N 3.11Å; I25-L29 VanDerWaalsContact O-N 3.12Å; V26-L29 PolarHBondContact O-N 3.47Å; L29-S32 WeakPolarHBondContact CA-OG 3.36Å; L29-S32 PolarHBondContact O-N 3.39Å; L29-S32 PolarHBondContact O-OG 3.13Å; L29-Y33 PolarHBondContact O-N 3.27Å; L29-Y33 VanDerWaalsContact O-N 3.13Å
30	V	47.7	Very low	40.7	Very low	83 Å²	83	129.7 Å²	129.7	50%	0.503	66%	0.663	S	S	.	*	H	α-helix	trans	-71.2	-34.6	175.7	178.1	0	0	0	0	111.3	V26 S32 Y33 F34	V26-V30 HydrophobicContact CG1-CG2 4.49Å; V26-V30 WeakPolarHBondContact O-CG2 3.36Å; V26-V30 PolarHBondContact O-N 2.72Å; V26-V30 VanDerWaalsContact O-N 3.12Å; V30-S32 VanDerWaalsContact C-N 3.33Å; V30-Y33 PolarHBondContact O-N 3.01Å; V30-F34 HydrophobicContact CG1-CD2 4.38Å; V30-F34 PolarHBondContact O-N 3.06Å
31	L	42.3	Very low	40.9	Very low	94 Å²	94	125 Å²	125	49%	0.492	64%	0.639	S	S	.	*	H	α-helix	trans	-67.5	-31.8	171.2	-75.8	163.5	0	0	0	112.4	L27 F34 H35	L27-L31 HydrophobicContact CG-CD1 4.42Å; L27-L31 WeakPolarHBondContact O-CB 3.49Å; L27-L31 WeakPolarHBondContact O-CD1 3.47Å; L27-L31 VanDerWaalsContact O-CG 3.28Å; L27-L31 WeakPolarHBondContact O-CG 3.47Å; L27-L31 PolarHBondContact O-N 3.43Å; L31-F34 PolarHBondContact O-N 3.12Å; L31-H35 WeakPolarHBondContact O-CB 3.36Å; L31-H35 PolarHBondContact O-N 3.41Å; L31-H35 VanDerWaalsContact O-N 3.11Å
32	S	41.2	Very low	41.5	Very low	57 Å²	57	116.7 Å²	116.7	40%	0.399	62%	0.624	S	S	.	*	H	α-helix	trans	-71.1	-31.6	174.7	74.4	0	0	0	0	113.6	L28 L29 V30 C36	L28-S32 WeakPolarHBondContact O-CB 3.28Å; L28-S32 PolarHBondContact O-N 3.21Å; L29-S32 WeakPolarHBondContact CA-OG 3.36Å; L29-S32 PolarHBondContact O-N 3.39Å; L29-S32 PolarHBondContact O-OG 3.13Å; V30-S32 VanDerWaalsContact C-N 3.33Å; S32-C36 PolarHBondContact O-N 3.43Å
33	Y	37.3	Very low	41.7	Very low	190 Å²	190	111.8 Å²	111.8	75%	0.745	61%	0.605	S	S	*	*	H	α-helix	trans	-76.3	-23.5	174.4	-98.4	-86.9	0	0	0	113.3	L29 V30	L29-Y33 PolarHBondContact O-N 3.27Å; L29-Y33 VanDerWaalsContact O-N 3.13Å; V30-Y33 PolarHBondContact O-N 3.01Å
34	F	35.1	Very low	42.5	Very low	154 Å²	154	102.8 Å²	102.8	68%	0.675	58%	0.581	S	S	*	*	H	α-helix	trans	-91.4	-6.1	173	-90.5	-83.1	0	0	0	114.6	V30 L31	V30-F34 HydrophobicContact CG1-CD2 4.38Å; V30-F34 PolarHBondContact O-N 3.06Å; L31-F34 PolarHBondContact O-N 3.12Å
35	H	33.3	Very low	43.3	Very low	139 Å²	139	104.4 Å²	104.4	64%	0.644	58%	0.577	S	S	*	*	H	α-helix	trans	-104.9	-4.2	174	-86.8	-4.3	0	0	0	114.9	L31	L31-H35 WeakPolarHBondContact O-CB 3.36Å; L31-H35 PolarHBondContact O-N 3.41Å; L31-H35 VanDerWaalsContact O-N 3.11Å
36	C	32.1	Very low	43.9	Very low	112 Å²	112	100.2 Å²	100.2	76%	0.757	56%	0.556	S	S	*	*	S	Bend	trans	-95.4	10.4	-178.2	-135.9	0	0	0	0	115.4	S32	S32-C36 PolarHBondContact O-N 3.43Å
37	S	33	Very low	44.6	Very low	90 Å²	90	100.2 Å²	100.2	63%	0.629	55%	0.553	S	S	*	*	S	Bend	trans	-130.2	14.5	178.9	40.6	0	0	0	0	115.1
38	L	34	Very low	45.8	Very low	109 Å²	109	99.7 Å²	99.7	57%	0.571	55%	0.554	S	S	*	*	S	Bend	trans	-120.3	-0.2	175.5	-86.9	156.7	0	0	0	115.2	T40 N41	L38-T40 VanDerWaalsContact C-N 3.26Å; L38-T40 PolarHBondContact O-N 3.35Å; L38-N41 HydrophobicContact CD2-CB 4.39Å; L38-N41 WeakPolarHBondContact CD2-ND2 3.43Å; L38-N41 PolarHBondContact O-N 3.25Å
39	L	39.1	Very low	47.3	Very low	162 Å²	162	94.6 Å²	94.6	85%	0.848	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	7.8	-178	-83.9	162	0	0	0	115.5
40	T	40.1	Very low	49.1	Very low	117 Å²	117	94.4 Å²	94.4	72%	0.718	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	3.8	169	53.1	0	0	0	0	113.6	L38	L38-T40 VanDerWaalsContact C-N 3.26Å; L38-T40 PolarHBondContact O-N 3.35Å
41	N	38.2	Very low	51	Low	77 Å²	77	93.8 Å²	93.8	41%	0.412	52%	0.516	S	S	.	.	H	α-helix	trans	-93.1	2.7	-173.4	-76.4	0.6	0	0	0	115.4	L38 A44 F45	L38-N41 HydrophobicContact CD2-CB 4.39Å; L38-N41 WeakPolarHBondContact CD2-ND2 3.43Å; L38-N41 PolarHBondContact O-N 3.25Å; N41-A44 HydrophobicContact CB-CB 4.33Å; N41-A44 PolarHBondContact O-N 2.92Å; N41-F45 PolarHBondContact O-N 3.28Å
42	G	45.4	Very low	53.2	Low	51 Å²	51	89.4 Å²	89.4	53%	0.526	49%	0.493	S	S	.	.	H	α-helix	trans	-62.7	-44.9	172	0	0	0	0	0	112.3	A44 F45 I46	G42-A44 VanDerWaalsContact C-N 3.33Å; G42-A44 PolarHBondContact O-N 3.49Å; G42-F45 PolarHBondContact O-N 3.01Å; G42-I46 WeakPolarHBondContact O-CG1 3.38Å; G42-I46 PolarHBondContact O-N 3.18Å
43	A	49	Very low	55.4	Low	44 Å²	44	88 Å²	88	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-65	-37.9	173.1	0	0	0	0	0	111.8	F45 I46 D47	A43-F45 PolarHBondContact O-N 3.36Å; A43-I46 PolarHBondContact O-N 3.48Å; A43-D47 PolarHBondContact O-N 3.44Å
44	A	54.7	Low	58	Low	47 Å²	47	80.1 Å²	80.1	39%	0.388	46%	0.464	S	S	.	.	H	α-helix	trans	-66.7	-35.6	179	0	0	0	0	0	113.1	N41 G42	N41-A44 HydrophobicContact CB-CB 4.33Å; N41-A44 PolarHBondContact O-N 2.92Å; G42-A44 VanDerWaalsContact C-N 3.33Å; G42-A44 PolarHBondContact O-N 3.49Å
45	F	63.1	Low	60.7	Low	122 Å²	122	76.9 Å²	76.9	54%	0.535	46%	0.457	S	S	.	.	H	α-helix	trans	-66.8	-45.9	174.4	177.4	-102.9	0	0	0	111.4	N41 G42 A43 D47 T48 L49	N41-F45 PolarHBondContact O-N 3.28Å; G42-F45 PolarHBondContact O-N 3.01Å; A43-F45 PolarHBondContact O-N 3.36Å; F45-D47 VanDerWaalsContact C-N 3.26Å; F45-D47 PolarHBondContact O-N 3.1Å; F45-T48 PolarHBondContact O-N 3.43Å; F45-T48 VanDerWaalsContact O-N 3.07Å; F45-T48 PolarHBondContact O-OG1 2.75Å; F45-L49 HydrophobicContact CE1-CD2 4Å; F45-L49 HydrophobicContact CZ-CD2 4.13Å
46	I	61.1	Low	63.5	Low	15 Å²	15	71.6 Å²	71.6	8%	0.077	43%	0.432	C	S	.	.	H	α-helix	trans	-63.2	-36.7	-179.8	-60.5	172.4	0	0	0	110.4	G42 A43 T48 L49 K70 W120	G42-I46 WeakPolarHBondContact O-CG1 3.38Å; G42-I46 PolarHBondContact O-N 3.18Å; A43-I46 PolarHBondContact O-N 3.48Å; I46-T48 PolarHBondContact O-N 3.03Å; I46-T48 VanDerWaalsContact O-N 3.12Å; I46-L49 HydrophobicContact CB-CD1 4.28Å; I46-L49 HydrophobicContact CG1-CD1 4.39Å; I46-L49 HydrophobicContact CG2-CD1 3.97Å; I46-L49 VanDerWaalsContact O-CB 3.27Å; I46-L49 WeakPolarHBondContact O-CB 3.41Å; I46-L49 WeakPolarHBondContact O-CG 3.5Å; I46-L49 PolarHBondContact O-N 3.39Å; I46-K70 HydrophobicContact CG2-CB 4.11Å; I46-K70 WeakPolarHBondContact O-CD 3.48Å; I46-W120 HydrophobicContact CB-CH2 4.26Å; I46-W120 HydrophobicContact CB-CZ2 3.99Å; I46-W120 WeakPolarHBondContact CD1-O 3.47Å; I46-W120 HydrophobicContact CG2-CD2 3.82Å; I46-W120 HydrophobicContact CG2-CE3 3.66Å; I46-W120 HydrophobicContact CG2-CH2 3.3Å; I46-W120 HydrophobicContact CG2-CZ2 3.42Å; I46-W120 VanDerWaalsContact CG2-CZ2 3.42Å; I46-W120 HydrophobicContact CG2-CZ3 3.44Å; I46-W120 VanDerWaalsContact CG2-CZ3 3.44Å
47	D	64.6	Low	66.2	Low	96 Å²	96	69.7 Å²	69.7	51%	0.513	42%	0.416	S	S	.	.	H	α-helix	trans	-60.6	-22.8	176.6	-78.8	-25.3	0	0	0	113.9	A43 F45 K70	A43-D47 PolarHBondContact O-N 3.44Å; F45-D47 VanDerWaalsContact C-N 3.26Å; F45-D47 PolarHBondContact O-N 3.1Å; D47-K70 PolarHBondContact O-NZ 3.1Å
48	T	73.9	Confident	69	Low	109 Å²	109	71.8 Å²	71.8	67%	0.669	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-8.9	174.8	65.3	0	0	0	0	114.7	F45 I46	F45-T48 PolarHBondContact O-N 3.43Å; F45-T48 VanDerWaalsContact O-N 3.07Å; F45-T48 PolarHBondContact O-OG1 2.75Å; I46-T48 PolarHBondContact O-N 3.03Å; I46-T48 VanDerWaalsContact O-N 3.12Å
49	L	80.8	Confident	71.8	Confident	17 Å²	17	72 Å²	72	9%	0.089	42%	0.421	C	S	.	.	S	Bend	trans	-71.2	156.7	-177.8	-61.5	179.8	0	0	0	112.5	F45 I46 E51 P68 K70 Y92	F45-L49 HydrophobicContact CE1-CD2 4Å; F45-L49 HydrophobicContact CZ-CD2 4.13Å; I46-L49 HydrophobicContact CB-CD1 4.28Å; I46-L49 HydrophobicContact CG1-CD1 4.39Å; I46-L49 HydrophobicContact CG2-CD1 3.97Å; I46-L49 VanDerWaalsContact O-CB 3.27Å; I46-L49 WeakPolarHBondContact O-CB 3.41Å; I46-L49 WeakPolarHBondContact O-CG 3.5Å; I46-L49 PolarHBondContact O-N 3.39Å; L49-E51 PolarHBondContact O-N 2.97Å; L49-P68 HydrophobicContact CD1-CB 4.26Å; L49-P68 HydrophobicContact CD1-CG 4.43Å; L49-P68 HydrophobicContact CD2-CB 4.19Å; L49-P68 HydrophobicContact CD2-CG 3.64Å; L49-K70 HydrophobicContact CB-CB 3.98Å; L49-K70 HydrophobicContact CB-CD 4.38Å; L49-K70 HydrophobicContact CB-CG 4.01Å; L49-K70 HydrophobicContact CD1-CB 4.42Å; L49-K70 WeakPolarHBondContact O-CE 3.26Å; L49-Y92 HydrophobicContact CD1-CD2 3.86Å; L49-Y92 HydrophobicContact CD1-CE2 4.33Å
50	Q	85.1	Confident	74.3	Confident	97 Å²	97	67.9 Å²	67.9	45%	0.453	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	129.5	173.9	-174.5	165.1	-20.5	0	0	110.4	D66 Y69 K70	Q50-D66 PolarHBondContact OE1-O 3.43Å; Q50-D66 VanDerWaalsContact OE1-O 3.05Å; Q50-Y69 HydrophobicContact CB-CD1 4Å; Q50-Y69 HydrophobicContact CB-CE1 4.29Å; Q50-Y69 HydrophobicContact CG-CD1 3.97Å; Q50-Y69 HydrophobicContact CG-CE1 3.98Å; Q50-Y69 CarbonylContact O-C 3.6Å; Q50-Y69 VanDerWaalsContact O-CA 3.26Å; Q50-Y69 WeakPolarHBondContact O-CA 3.35Å; Q50-K70 PolarHBondContact O-N 3.03Å
51	E	88.6	Confident	76.9	Confident	71 Å²	71	64.2 Å²	64.2	33%	0.332	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124.2	178	-174	74.5	-154.7	0	0	110.3	L49 K70 T72 R73	L49-E51 PolarHBondContact O-N 2.97Å; E51-K70 CarbonylContact C-O 3.58Å; E51-K70 WeakPolarHBondContact CA-O 3.05Å; E51-K70 HydrophobicContact CB-CG 4.41Å; E51-K70 WeakPolarHBondContact OE2-CD 3.09Å; E51-K70 WeakPolarHBondContact OE2-CE 3.34Å; E51-K70 WeakPolarHBondContact OE2-CG 3.5Å; E51-T72 WeakPolarHBondContact OE1-CA 3.27Å; E51-T72 WeakPolarHBondContact OE1-CB 3.25Å; E51-T72 PolarHBondContact OE1-N 3.45Å; E51-T72 PolarHBondContact OE1-OG1 3.48Å; E51-T72 WeakPolarHBondContact OE2-CG2 3.43Å; E51-T72 PolarHBondContact OE2-OG1 2.98Å; E51-R73 PolarHBondContact OE1-N 3.34Å
52	A	87.3	Confident	79.5	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.008	36%	0.357	C	S	.	.			trans	-111	108.9	165.3	0	0	0	0	0	107.9	L62 Y69 K70 V71 I75 L91	A52-L62 HydrophobicContact CB-CD1 4.13Å; A52-L62 HydrophobicContact CB-CD2 4.07Å; A52-Y69 HydrophobicContact CB-CD1 3.91Å; A52-Y69 HydrophobicContact CB-CG 4.15Å; A52-K70 PolarHBondContact N-O 3.02Å; A52-V71 HydrophobicContact CB-CG2 4.32Å; A52-V71 WeakPolarHBondContact O-CA 3.23Å; A52-V71 WeakPolarHBondContact O-CG1 3.18Å; A52-V71 WeakPolarHBondContact O-CG2 3.1Å; A52-I75 HydrophobicContact CB-CD1 4.4Å; A52-L91 HydrophobicContact CB-CD2 4.38Å
53	G	88.1	Confident	81.8	Confident	27 Å²	27	63.3 Å²	63.3	28%	0.278	35%	0.351	S	S	.	.			trans	-174.7	160.5	-175.4	0	0	0	0	0	112.9
54	G	91	Very high	83.7	Confident	25 Å²	25	65.3 Å²	65.3	26%	0.258	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	98.2	-167.2	-177.6	0	0	0	0	0	113.5	P74 I75 F76	G54-P74 WeakPolarHBondContact CA-O 3.31Å; G54-P74 PolarHBondContact N-O 2.03Å; G54-I75 WeakPolarHBondContact O-CA 3.42Å; G54-F76 PolarHBondContact O-N 2.98Å
55	T	92.3	Very high	85.2	Confident	86 Å²	86	70.5 Å²	70.5	53%	0.528	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	117.1	-174.3	-59.2	0	0	0	0	111.1	T57 F76 Q78	T55-T57 HydrophobicContact CG2-CG2 3.88Å; T55-F76 CarbonylContact C-O 3.6Å; T55-F76 WeakPolarHBondContact CA-O 3.5Å; T55-F76 HydrophobicContact CG2-CD1 3.74Å; T55-F76 HydrophobicContact CG2-CE1 4.47Å; T55-Q78 HydrophobicContact CG2-CB 4.48Å
56	Y	91.1	Very high	86.4	Confident	29 Å²	29	67.8 Å²	67.8	11%	0.114	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	107.1	173.2	-64.3	-80.6	0	0	0	109.7	H60 I75 F76 Q78 A81 L83	Y56-H60 HydrophobicContact CD1-CB 3.57Å; Y56-H60 AromaticContact CD1-CD2 3.83Å; Y56-H60 AromaticContact CD1-CG 3.67Å; Y56-H60 HydrophobicContact CE1-CB 3.92Å; Y56-H60 AromaticContact CE1-CD2 3.19Å; Y56-H60 WeakPolarHBondContact CE1-CD2 3.27Å; Y56-H60 AromaticContact CE1-CG 3.49Å; Y56-H60 VanDerWaalsContact CE1-CG 3.49Å; Y56-H60 AromaticContact CE1-NE2 3.73Å; Y56-H60 HydrophobicContact CG-CB 4.45Å; Y56-H60 AromaticContact CZ-CD2 3.9Å; Y56-I75 HydrophobicContact CD2-CG2 3.75Å; Y56-I75 HydrophobicContact CE2-CB 4.41Å; Y56-I75 HydrophobicContact CE2-CG1 4.21Å; Y56-I75 HydrophobicContact CE2-CG2 3.6Å; Y56-F76 PolarHBondContact N-O 3.11Å; Y56-Q78 PolarHBondContact O-N 3.12Å; Y56-Q78 VanDerWaalsContact O-N 3.1Å; Y56-A81 VanDerWaalsContact O-CB 3.25Å; Y56-A81 WeakPolarHBondContact O-CB 3.41Å; Y56-L83 HydrophobicContact CE2-CD1 4.49Å; Y56-L83 HydrophobicContact CE2-CD2 4.49Å
57	T	89.8	Confident	87.3	Confident	71 Å²	71	68.1 Å²	68.1	44%	0.436	37%	0.368	S	S	.	.			trans	-97.3	-13.5	176.4	63.8	0	0	0	0	113.6	T55	T55-T57 HydrophobicContact CG2-CG2 3.88Å
58	L	91.2	Very high	88.6	Confident	134 Å²	134	65.6 Å²	65.6	70%	0.702	36%	0.357	S	S	*	.	S	Bend	trans	-124.6	164.4	178.3	-66.9	173.8	0	0	0	109.2	H60	L58-H60 PolarHBondContact O-N 3.35Å
59	N	92.5	Very high	89.5	Confident	113 Å²	113	60.6 Å²	60.6	60%	0.604	33%	0.326	S	S	*	.			trans	-58.6	128.8	175.5	-65.4	-14.9	0	0	0	110.4	N82	N59-N82 CarbonylContact C-O 3.58Å; N59-N82 VanDerWaalsContact CA-O 3.3Å; N59-N82 WeakPolarHBondContact CA-O 3.24Å; N59-N82 WeakPolarHBondContact OD1-CB 3.4Å; N59-N82 PolarHBondContact OD1-N 3.26Å
60	H	93.2	Very high	90	Very high	76 Å²	76	61.4 Å²	61.4	35%	0.352	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144.7	-178.5	-166.4	72.2	0	0	0	110.1	Y56 L58 N82 L83 T84	Y56-H60 HydrophobicContact CD1-CB 3.57Å; Y56-H60 AromaticContact CD1-CD2 3.83Å; Y56-H60 AromaticContact CD1-CG 3.67Å; Y56-H60 HydrophobicContact CE1-CB 3.92Å; Y56-H60 AromaticContact CE1-CD2 3.19Å; Y56-H60 WeakPolarHBondContact CE1-CD2 3.27Å; Y56-H60 AromaticContact CE1-CG 3.49Å; Y56-H60 VanDerWaalsContact CE1-CG 3.49Å; Y56-H60 AromaticContact CE1-NE2 3.73Å; Y56-H60 HydrophobicContact CG-CB 4.45Å; Y56-H60 AromaticContact CZ-CD2 3.9Å; L58-H60 PolarHBondContact O-N 3.35Å; H60-N82 PolarHBondContact N-O 2.96Å; H60-L83 HydrophobicContact CB-CD1 4.27Å; H60-L83 WeakPolarHBondContact O-CA 3.38Å; H60-T84 PolarHBondContact O-N 2.94Å
61	T	94.3	Very high	90.4	Very high	41 Å²	41	56.8 Å²	56.8	25%	0.252	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.5	178.4	-57.6	0	0	0	0	108.8	Y63 T84	T61-Y63 HydrophobicContact CG2-CD1 3.92Å; T61-Y63 HydrophobicContact CG2-CD2 4.38Å; T61-Y63 HydrophobicContact CG2-CE1 3.68Å; T61-Y63 HydrophobicContact CG2-CE2 4.15Å; T61-Y63 HydrophobicContact CG2-CG 4.26Å; T61-Y63 WeakPolarHBondContact O-CD2 3.36Å; T61-T84 CarbonylContact C-O 3.56Å; T61-T84 VanDerWaalsContact CA-O 3.26Å; T61-T84 WeakPolarHBondContact CA-O 3.11Å; T61-T84 HydrophobicContact CG2-CG2 4.38Å
62	L	93.4	Very high	90.5	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	106.9	166.8	-59.6	-177.4	0	0	0	107.5	A52 Y69 L83 T84 I85 E86 V89 L91	A52-L62 HydrophobicContact CB-CD1 4.13Å; A52-L62 HydrophobicContact CB-CD2 4.07Å; L62-Y69 HydrophobicContact CB-CE2 3.91Å; L62-Y69 HydrophobicContact CD2-CD1 4.24Å; L62-Y69 HydrophobicContact CD2-CE1 3.87Å; L62-L83 HydrophobicContact CG-CD1 4.2Å; L62-T84 PolarHBondContact N-O 3.32Å; L62-I85 HydrophobicContact CD1-CG1 4.31Å; L62-E86 WeakPolarHBondContact O-CB 3.37Å; L62-E86 PolarHBondContact O-N 3.26Å; L62-V89 WeakPolarHBondContact O-CG2 3.48Å; L62-L91 HydrophobicContact CD1-CD2 3.88Å
63	Y	92.9	Very high	90.7	Very high	106 Å²	106	64 Å²	64	42%	0.416	34%	0.336	S	S	.	.			trans	-81.5	145.9	180	-62.2	-80.9	0	0	0	111.4	T61 Q65 D66 G67 Y69 E86	T61-Y63 HydrophobicContact CG2-CD1 3.92Å; T61-Y63 HydrophobicContact CG2-CD2 4.38Å; T61-Y63 HydrophobicContact CG2-CE1 3.68Å; T61-Y63 HydrophobicContact CG2-CE2 4.15Å; T61-Y63 HydrophobicContact CG2-CG 4.26Å; T61-Y63 WeakPolarHBondContact O-CD2 3.36Å; Y63-Q65 VanDerWaalsContact C-N 3.29Å; Y63-Q65 PolarHBondContact O-N 3.45Å; Y63-D66 PolarHBondContact O-N 3.07Å; Y63-G67 PolarHBondContact O-N 2.68Å; Y63-Y69 PolarHBondContact N-OH 3.4Å; Y63-Y69 WeakPolarHBondContact O-CE2 3.48Å; Y63-Y69 PolarHBondContact O-OH 3.44Å; Y63-E86 WeakPolarHBondContact CA-OE2 3.17Å
64	Q	88.7	Confident	90.9	Very high	87 Å²	87	65.9 Å²	65.9	41%	0.407	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-61.2	-38.7	177.3	-173	-176.8	12.5	0	0	111.8	D66 G67 E86 Q87 V89	Q64-D66 VanDerWaalsContact C-N 3.28Å; Q64-D66 PolarHBondContact O-N 2.82Å; Q64-G67 PolarHBondContact O-N 2.99Å; Q64-E86 HydrophobicContact CB-CG 4.44Å; Q64-E86 PolarHBondContact N-OE2 2.81Å; Q64-Q87 PolarHBondContact OE1-O 2.96Å; Q64-V89 HydrophobicContact CB-CG2 4.31Å
65	Q	87	Confident	91.1	Very high	155 Å²	155	64.7 Å²	64.7	72%	0.724	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.4	-30	-178.1	69.7	-172.1	-2.1	0	0	113.9	Y63	Y63-Q65 VanDerWaalsContact C-N 3.29Å; Y63-Q65 PolarHBondContact O-N 3.45Å
66	D	86.9	Confident	91.3	Very high	66 Å²	66	63.3 Å²	63.3	35%	0.353	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-92.1	-11.3	-177.6	-64	-31.9	0	0	0	110.8	Q50 Y63 Q64 Y69	Q50-D66 PolarHBondContact OE1-O 3.43Å; Q50-D66 VanDerWaalsContact OE1-O 3.05Å; Y63-D66 PolarHBondContact O-N 3.07Å; Q64-D66 VanDerWaalsContact C-N 3.28Å; Q64-D66 PolarHBondContact O-N 2.82Å; D66-Y69 HydrophobicContact CB-CE1 4.47Å; D66-Y69 VanDerWaalsContact CB-OH 3.27Å; D66-Y69 WeakPolarHBondContact CB-OH 3.34Å
67	G	81.5	Confident	91.4	Very high	22 Å²	22	62 Å²	62	23%	0.227	31%	0.313	C	S	.	.			trans	-82	171.1	174.4	0	0	0	0	0	113.3	Y63 Q64 Y69	Y63-G67 PolarHBondContact O-N 2.68Å; Q64-G67 PolarHBondContact O-N 2.99Å; G67-Y69 VanDerWaalsContact CA-CE2 3.46Å
68	P	90.6	Very high	91.5	Very high	43 Å²	43	60.8 Å²	60.8	28%	0.279	30%	0.303	S	S	.	.			cis	-74.4	155	6.2	12.8	-5	0	0	0	113.2	L49 K90 Y92	L49-P68 HydrophobicContact CD1-CB 4.26Å; L49-P68 HydrophobicContact CD1-CG 4.43Å; L49-P68 HydrophobicContact CD2-CB 4.19Å; L49-P68 HydrophobicContact CD2-CG 3.64Å; P68-K90 HydrophobicContact CB-CB 4.24Å; P68-Y92 HydrophobicContact CB-CD2 4.29Å; P68-Y92 HydrophobicContact CB-CE2 3.85Å
69	Y	93.3	Very high	91.3	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.8	-178.2	-61.1	-93.2	0	0	0	111.4	Q50 A52 L62 Y63 D66 G67 V89 K90 L91 Y92	Q50-Y69 HydrophobicContact CB-CD1 4Å; Q50-Y69 HydrophobicContact CB-CE1 4.29Å; Q50-Y69 HydrophobicContact CG-CD1 3.97Å; Q50-Y69 HydrophobicContact CG-CE1 3.98Å; Q50-Y69 CarbonylContact O-C 3.6Å; Q50-Y69 VanDerWaalsContact O-CA 3.26Å; Q50-Y69 WeakPolarHBondContact O-CA 3.35Å; A52-Y69 HydrophobicContact CB-CD1 3.91Å; A52-Y69 HydrophobicContact CB-CG 4.15Å; L62-Y69 HydrophobicContact CB-CE2 3.91Å; L62-Y69 HydrophobicContact CD2-CD1 4.24Å; L62-Y69 HydrophobicContact CD2-CE1 3.87Å; Y63-Y69 PolarHBondContact N-OH 3.4Å; Y63-Y69 WeakPolarHBondContact O-CE2 3.48Å; Y63-Y69 PolarHBondContact O-OH 3.44Å; D66-Y69 HydrophobicContact CB-CE1 4.47Å; D66-Y69 VanDerWaalsContact CB-OH 3.27Å; D66-Y69 WeakPolarHBondContact CB-OH 3.34Å; G67-Y69 VanDerWaalsContact CA-CE2 3.46Å; Y69-V89 HydrophobicContact CD2-CG1 3.7Å; Y69-V89 HydrophobicContact CE2-CG1 3.87Å; Y69-V89 HydrophobicContact CE2-CG2 4.32Å; Y69-K90 PolarHBondContact N-O 3.02Å; Y69-L91 HydrophobicContact CD2-CD2 4.42Å; Y69-L91 HydrophobicContact CG-CD2 4.32Å; Y69-Y92 PolarHBondContact O-N 3.3Å
70	K	92	Very high	91	Very high	33 Å²	33	54.9 Å²	54.9	14%	0.143	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	140.2	168.2	66.9	168.8	179.1	-167.5	0	110.5	I46 D47 L49 Q50 E51 A52 T72 W120	I46-K70 HydrophobicContact CG2-CB 4.11Å; I46-K70 WeakPolarHBondContact O-CD 3.48Å; D47-K70 PolarHBondContact O-NZ 3.1Å; L49-K70 HydrophobicContact CB-CB 3.98Å; L49-K70 HydrophobicContact CB-CD 4.38Å; L49-K70 HydrophobicContact CB-CG 4.01Å; L49-K70 HydrophobicContact CD1-CB 4.42Å; L49-K70 WeakPolarHBondContact O-CE 3.26Å; Q50-K70 PolarHBondContact O-N 3.03Å; E51-K70 CarbonylContact C-O 3.58Å; E51-K70 WeakPolarHBondContact CA-O 3.05Å; E51-K70 HydrophobicContact CB-CG 4.41Å; E51-K70 WeakPolarHBondContact OE2-CD 3.09Å; E51-K70 WeakPolarHBondContact OE2-CE 3.34Å; E51-K70 WeakPolarHBondContact OE2-CG 3.5Å; A52-K70 PolarHBondContact N-O 3.02Å; K70-T72 HydrophobicContact CD-CG2 4.44Å; K70-W120 HydrophobicContact CB-CH2 4.27Å; K70-W120 HydrophobicContact CB-CZ3 3.72Å; K70-W120 HydrophobicContact CD-CH2 3.99Å; K70-W120 HydrophobicContact CD-CZ3 4.19Å; K70-W120 HydrophobicContact CG-CZ3 4.49Å
71	V	93.2	Very high	90.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	89.5	-178.7	-174.2	0	0	0	0	108.6	A52 R73 I75 L91 Y92 F93 A94 V97	A52-V71 HydrophobicContact CB-CG2 4.32Å; A52-V71 WeakPolarHBondContact O-CA 3.23Å; A52-V71 WeakPolarHBondContact O-CG1 3.18Å; A52-V71 WeakPolarHBondContact O-CG2 3.1Å; V71-R73 VanDerWaalsContact CG1-O 3.31Å; V71-R73 WeakPolarHBondContact CG1-O 3.34Å; V71-I75 HydrophobicContact CG1-CD1 3.91Å; V71-I75 HydrophobicContact CG1-CG1 3.97Å; V71-I75 HydrophobicContact CG2-CD1 4.06Å; V71-L91 HydrophobicContact CG2-CB 4.48Å; V71-L91 HydrophobicContact CG2-CD2 3.82Å; V71-Y92 PolarHBondContact N-O 3.14Å; V71-F93 HydrophobicContact CB-CD1 3.64Å; V71-F93 HydrophobicContact CB-CE1 3.91Å; V71-F93 HydrophobicContact CB-CG 4.21Å; V71-F93 HydrophobicContact CG1-CD1 3.58Å; V71-F93 HydrophobicContact CG1-CE1 3.68Å; V71-F93 HydrophobicContact CG2-CD1 4.05Å; V71-F93 HydrophobicContact CG2-CE1 3.88Å; V71-F93 HydrophobicContact CG2-CZ 4.21Å; V71-A94 PolarHBondContact O-N 3.18Å; V71-V97 HydrophobicContact CG1-CG1 3.99Å
72	T	90.9	Very high	90.9	Very high	52 Å²	52	51.9 Å²	51.9	32%	0.319	28%	0.281	S	S	.	.			trans	-94.2	-24.5	177.8	69.3	0	0	0	0	112.6	E51 K70 W120	E51-T72 WeakPolarHBondContact OE1-CA 3.27Å; E51-T72 WeakPolarHBondContact OE1-CB 3.25Å; E51-T72 PolarHBondContact OE1-N 3.45Å; E51-T72 PolarHBondContact OE1-OG1 3.48Å; E51-T72 WeakPolarHBondContact OE2-CG2 3.43Å; E51-T72 PolarHBondContact OE2-OG1 2.98Å; K70-T72 HydrophobicContact CD-CG2 4.44Å; T72-W120 HydrophobicContact CG2-CE3 4.48Å; T72-W120 HydrophobicContact CG2-CH2 3.86Å; T72-W120 HydrophobicContact CG2-CZ3 3.53Å
73	R	91.7	Very high	91.1	Very high	172 Å²	172	51.8 Å²	51.8	65%	0.649	28%	0.28	S	S	*	.	S	Bend	trans	-109.1	144.9	175.3	-61.6	-178.2	-176.6	177.6	1	110.1	E51 V71 I75 V97	E51-R73 PolarHBondContact OE1-N 3.34Å; V71-R73 VanDerWaalsContact CG1-O 3.31Å; V71-R73 WeakPolarHBondContact CG1-O 3.34Å; R73-I75 PolarHBondContact O-N 3.42Å; R73-V97 VanDerWaalsContact C-CG1 3.42Å; R73-V97 WeakPolarHBondContact O-CG1 3.18Å
74	P	92.4	Very high	91.2	Very high	66 Å²	66	49.1 Å²	49.1	43%	0.429	28%	0.275	S	S	.	.			trans	-58.2	138.7	178.7	25	-33.5	0	0	0	110.4	G54 V97	G54-P74 WeakPolarHBondContact CA-O 3.31Å; G54-P74 PolarHBondContact N-O 2.03Å; P74-V97 HydrophobicContact CB-CG1 4.37Å
75	I	95.1	Very high	91.6	Very high	1 Å²	1	45 Å²	45	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117.9	172.1	-68.7	173.1	0	0	0	107	A52 G54 Y56 V71 R73 V77 L83 G98 I99 T100	A52-I75 HydrophobicContact CB-CD1 4.4Å; G54-I75 WeakPolarHBondContact O-CA 3.42Å; Y56-I75 HydrophobicContact CD2-CG2 3.75Å; Y56-I75 HydrophobicContact CE2-CB 4.41Å; Y56-I75 HydrophobicContact CE2-CG1 4.21Å; Y56-I75 HydrophobicContact CE2-CG2 3.6Å; V71-I75 HydrophobicContact CG1-CD1 3.91Å; V71-I75 HydrophobicContact CG1-CG1 3.97Å; V71-I75 HydrophobicContact CG2-CD1 4.06Å; R73-I75 PolarHBondContact O-N 3.42Å; I75-V77 HydrophobicContact CG2-CG2 4.14Å; I75-L83 HydrophobicContact CG2-CD2 3.86Å; I75-G98 PolarHBondContact N-O 3.38Å; I75-I99 HydrophobicContact CB-CB 4.44Å; I75-I99 HydrophobicContact CB-CG1 4.15Å; I75-I99 HydrophobicContact CB-CG2 4.26Å; I75-I99 HydrophobicContact CD1-CD1 4.3Å; I75-I99 HydrophobicContact CD1-CG1 4.26Å; I75-I99 HydrophobicContact CG2-CG2 3.91Å; I75-I99 WeakPolarHBondContact O-CA 3.5Å; I75-T100 PolarHBondContact O-N 3.04Å
76	F	95	Very high	91.9	Very high	57 Å²	57	41.1 Å²	41.1	25%	0.25	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.9	173.6	-178.1	-107.6	0	0	0	109.4	G54 T55 Y56 Q78 T100 Q102	G54-F76 PolarHBondContact O-N 2.98Å; T55-F76 CarbonylContact C-O 3.6Å; T55-F76 WeakPolarHBondContact CA-O 3.5Å; T55-F76 HydrophobicContact CG2-CD1 3.74Å; T55-F76 HydrophobicContact CG2-CE1 4.47Å; Y56-F76 PolarHBondContact N-O 3.11Å; F76-Q78 HydrophobicContact CD1-CB 4.26Å; F76-Q78 HydrophobicContact CE1-CB 3.87Å; F76-Q78 HydrophobicContact CE1-CG 4.1Å; F76-Q78 PolarHBondContact O-N 2.78Å; F76-T100 WeakPolarHBondContact CA-O 3.47Å; F76-T100 HydrophobicContact CD2-CG2 3.97Å; F76-T100 HydrophobicContact CE2-CG2 4.12Å; F76-Q102 HydrophobicContact CE2-CG 4.09Å; F76-Q102 HydrophobicContact CZ-CG 4.21Å; F76-Q102 VanDerWaalsContact CZ-OE1 3.29Å
77	V	94.3	Very high	92.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	101.9	174.3	-172.4	0	0	0	0	107.4	I75 A81 L83 T100 V101 Q102 G103	I75-V77 HydrophobicContact CG2-CG2 4.14Å; V77-A81 HydrophobicContact CG1-CB 4.27Å; V77-A81 WeakPolarHBondContact CG1-O 3.37Å; V77-L83 HydrophobicContact CG1-CB 4.24Å; V77-L83 HydrophobicContact CG2-CB 3.74Å; V77-L83 HydrophobicContact CG2-CD2 3.75Å; V77-L83 HydrophobicContact CG2-CG 4.41Å; V77-T100 PolarHBondContact N-O 2.96Å; V77-V101 HydrophobicContact CB-CG1 4.34Å; V77-V101 HydrophobicContact CG2-CG2 4.38Å; V77-Q102 PolarHBondContact O-N 3.17Å; V77-G103 PolarHBondContact O-N 3.42Å
78	Q	92	Very high	92.7	Very high	47 Å²	47	41.1 Å²	41.1	22%	0.22	23%	0.234	C	C	.	.			trans	-68.5	153.8	-177.9	-170.8	170	0.9	0	0	110.7	T55 Y56 F76 G80 A81 G103 R393	T55-Q78 HydrophobicContact CG2-CB 4.48Å; Y56-Q78 PolarHBondContact O-N 3.12Å; Y56-Q78 VanDerWaalsContact O-N 3.1Å; F76-Q78 HydrophobicContact CD1-CB 4.26Å; F76-Q78 HydrophobicContact CE1-CB 3.87Å; F76-Q78 HydrophobicContact CE1-CG 4.1Å; F76-Q78 PolarHBondContact O-N 2.78Å; Q78-G80 PolarHBondContact O-N 2.83Å; Q78-A81 WeakPolarHBondContact O-CB 3.3Å; Q78-A81 PolarHBondContact O-N 3.05Å; Q78-A81 VanDerWaalsContact O-N 3.09Å; Q78-G103 WeakPolarHBondContact O-CA 3.2Å; Q78-G103 PolarHBondContact O-N 3.07Å; Q78-R393 PolarHBondContact NE2-O 3.49Å
79	A	86.9	Confident	93	Very high	49 Å²	49	39.1 Å²	39.1	41%	0.405	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	133.6	172.8	0	0	0	0	0	111.5
80	G	85.3	Confident	93	Very high	73 Å²	73	42.5 Å²	42.5	75%	0.753	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.3	-14	-177.2	0	0	0	0	0	115.8	Q78	Q78-G80 PolarHBondContact O-N 2.83Å
81	A	91.5	Very high	93.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.229	C	C	.	.			trans	-93.6	145.5	175.6	0	0	0	0	0	112.2	Y56 V77 Q78 G103 V104	Y56-A81 VanDerWaalsContact O-CB 3.25Å; Y56-A81 WeakPolarHBondContact O-CB 3.41Å; V77-A81 HydrophobicContact CG1-CB 4.27Å; V77-A81 WeakPolarHBondContact CG1-O 3.37Å; Q78-A81 WeakPolarHBondContact O-CB 3.3Å; Q78-A81 PolarHBondContact O-N 3.05Å; Q78-A81 VanDerWaalsContact O-N 3.09Å; A81-G103 WeakPolarHBondContact O-CA 3.47Å; A81-V104 PolarHBondContact O-N 2.9Å
82	N	94.8	Very high	93.2	Very high	54 Å²	54	43.3 Å²	43.3	29%	0.289	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.5	172.4	-61.7	-6.9	0	0	0	110.5	N59 H60 V104	N59-N82 CarbonylContact C-O 3.58Å; N59-N82 VanDerWaalsContact CA-O 3.3Å; N59-N82 WeakPolarHBondContact CA-O 3.24Å; N59-N82 WeakPolarHBondContact OD1-CB 3.4Å; N59-N82 PolarHBondContact OD1-N 3.26Å; H60-N82 PolarHBondContact N-O 2.96Å; N82-V104 WeakPolarHBondContact CA-O 3.1Å; N82-V104 HydrophobicContact CB-CB 4.36Å; N82-V104 WeakPolarHBondContact OD1-CB 3.49Å; N82-V104 WeakPolarHBondContact OD1-CG2 3.4Å
83	L	96.7	Very high	93.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	116.8	167.4	-179	60.9	0	0	0	109.1	Y56 H60 L62 I75 V77 V104 L105 N106	Y56-L83 HydrophobicContact CE2-CD1 4.49Å; Y56-L83 HydrophobicContact CE2-CD2 4.49Å; H60-L83 HydrophobicContact CB-CD1 4.27Å; H60-L83 WeakPolarHBondContact O-CA 3.38Å; L62-L83 HydrophobicContact CG-CD1 4.2Å; I75-L83 HydrophobicContact CG2-CD2 3.86Å; V77-L83 HydrophobicContact CG1-CB 4.24Å; V77-L83 HydrophobicContact CG2-CB 3.74Å; V77-L83 HydrophobicContact CG2-CD2 3.75Å; V77-L83 HydrophobicContact CG2-CG 4.41Å; L83-V104 PolarHBondContact N-O 2.66Å; L83-L105 HydrophobicContact CB-CD1 4.15Å; L83-L105 HydrophobicContact CD2-CD1 3.96Å; L83-L105 HydrophobicContact CG-CD1 4.03Å; L83-N106 PolarHBondContact O-N 3.2Å
84	T	96.3	Very high	93.4	Very high	50 Å²	50	33.2 Å²	33.2	31%	0.307	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.3	175.4	-53.7	0	0	0	0	109.2	H60 T61 L62 N106	H60-T84 PolarHBondContact O-N 2.94Å; T61-T84 CarbonylContact C-O 3.56Å; T61-T84 VanDerWaalsContact CA-O 3.26Å; T61-T84 WeakPolarHBondContact CA-O 3.11Å; T61-T84 HydrophobicContact CG2-CG2 4.38Å; L62-T84 PolarHBondContact N-O 3.32Å; T84-N106 WeakPolarHBondContact CA-O 3.26Å; T84-N106 HydrophobicContact CG2-CB 4.37Å
85	I	95.5	Very high	93.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116	174.6	-56.6	174.5	0	0	0	106.9	L62 V89 L91 L105 N106 A107 I115 M117	L62-I85 HydrophobicContact CD1-CG1 4.31Å; I85-V89 HydrophobicContact CG2-CB 3.7Å; I85-V89 HydrophobicContact CG2-CG1 3.77Å; I85-V89 HydrophobicContact CG2-CG2 4.18Å; I85-L91 HydrophobicContact CD1-CD1 3.82Å; I85-L105 HydrophobicContact CD1-CD1 3.85Å; I85-L105 HydrophobicContact CG1-CD1 4.22Å; I85-N106 PolarHBondContact N-O 2.84Å; I85-A107 HydrophobicContact CB-CB 4.33Å; I85-A107 HydrophobicContact CD1-CB 4.33Å; I85-I115 HydrophobicContact CB-CD1 4.16Å; I85-I115 HydrophobicContact CG2-CD1 3.9Å; I85-I115 HydrophobicContact CG2-CG1 4.25Å; I85-I115 HydrophobicContact CG2-CG2 3.81Å; I85-I115 WeakPolarHBondContact O-CD1 3.4Å; I85-M117 HydrophobicContact CD1-CE 3.88Å
86	E	94.3	Very high	93.3	Very high	73 Å²	73	32 Å²	32	34%	0.341	19%	0.19	S	C	.	.			trans	-68.2	151	178.5	-168.1	174.4	-157.5	0	0	111.2	L62 Y63 Q64 G88 V89	L62-E86 WeakPolarHBondContact O-CB 3.37Å; L62-E86 PolarHBondContact O-N 3.26Å; Y63-E86 WeakPolarHBondContact CA-OE2 3.17Å; Q64-E86 HydrophobicContact CB-CG 4.44Å; Q64-E86 PolarHBondContact N-OE2 2.81Å; E86-G88 PolarHBondContact O-N 3.31Å; E86-V89 HydrophobicContact CB-CG2 4.13Å; E86-V89 WeakPolarHBondContact O-CB 3.19Å; E86-V89 WeakPolarHBondContact O-CG2 3.37Å; E86-V89 PolarHBondContact O-N 3.3Å
87	Q	93.6	Very high	93.3	Very high	72 Å²	72	29.5 Å²	29.5	34%	0.336	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	139.6	172.9	63.9	-178.4	29.7	0	0	111.8	Q64 V89 N110 V113	Q64-Q87 PolarHBondContact OE1-O 2.96Å; Q87-V89 PolarHBondContact O-N 3.36Å; Q87-N110 PolarHBondContact NE2-ND2 3.46Å; Q87-N110 PolarHBondContact OE1-ND2 2.79Å; Q87-V113 HydrophobicContact CB-CG1 4.44Å; Q87-V113 HydrophobicContact CG-CG1 4.49Å
88	G	92.4	Very high	93.3	Very high	16 Å²	16	29.6 Å²	29.6	17%	0.165	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-3.8	176.2	0	0	0	0	0	115	E86 Q114	E86-G88 PolarHBondContact O-N 3.31Å; G88-Q114 VanDerWaalsContact CA-O 3.27Å; G88-Q114 WeakPolarHBondContact CA-O 3.15Å; G88-Q114 PolarHBondContact N-O 2.6Å
89	V	95.4	Very high	93.5	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	17%	0.17	C	C	.	.			trans	-63.6	134.3	169.3	171.2	0	0	0	0	109.8	L62 Q64 Y69 I85 E86 Q87 L91 E116	L62-V89 WeakPolarHBondContact O-CG2 3.48Å; Q64-V89 HydrophobicContact CB-CG2 4.31Å; Y69-V89 HydrophobicContact CD2-CG1 3.7Å; Y69-V89 HydrophobicContact CE2-CG1 3.87Å; Y69-V89 HydrophobicContact CE2-CG2 4.32Å; I85-V89 HydrophobicContact CG2-CB 3.7Å; I85-V89 HydrophobicContact CG2-CG1 3.77Å; I85-V89 HydrophobicContact CG2-CG2 4.18Å; E86-V89 HydrophobicContact CB-CG2 4.13Å; E86-V89 WeakPolarHBondContact O-CB 3.19Å; E86-V89 WeakPolarHBondContact O-CG2 3.37Å; E86-V89 PolarHBondContact O-N 3.3Å; Q87-V89 PolarHBondContact O-N 3.36Å; V89-L91 HydrophobicContact CG1-CG 4.13Å; V89-E116 PolarHBondContact O-N 2.83Å; V89-E116 VanDerWaalsContact O-N 3.09Å
90	K	94.1	Very high	93.9	Very high	74 Å²	74	25.8 Å²	25.8	32%	0.322	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.7	170.5	-50.9	-168.4	178.4	-142	0	109.8	P68 Y69 Y92 E116	P68-K90 HydrophobicContact CB-CB 4.24Å; Y69-K90 PolarHBondContact N-O 3.02Å; K90-Y92 HydrophobicContact CB-CE2 4.12Å; K90-E116 WeakPolarHBondContact CA-O 3.49Å; K90-E116 HydrophobicContact CB-CB 4.5Å; K90-E116 WeakPolarHBondContact CD-OE2 3.31Å; K90-E116 VanDerWaalsContact CE-OE2 3.22Å; K90-E116 WeakPolarHBondContact CE-OE2 3.21Å; K90-E116 HydrophobicContact CG-CB 4.19Å; K90-E116 VanDerWaalsContact NZ-CD 3.28Å; K90-E116 IonicContact NZ-OE1 3.78Å; K90-E116 PolarHBondContact NZ-OE1 3.13Å; K90-E116 IonicContact NZ-OE2 3.7Å; K90-E116 PolarHBondContact NZ-OE2 2.85Å
91	L	94.9	Very high	94.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.6	179.3	-70.9	161.8	0	0	0	109.4	A52 L62 Y69 V71 I85 V89 F93 E116 M117 L118	A52-L91 HydrophobicContact CB-CD2 4.38Å; L62-L91 HydrophobicContact CD1-CD2 3.88Å; Y69-L91 HydrophobicContact CD2-CD2 4.42Å; Y69-L91 HydrophobicContact CG-CD2 4.32Å; V71-L91 HydrophobicContact CG2-CB 4.48Å; V71-L91 HydrophobicContact CG2-CD2 3.82Å; I85-L91 HydrophobicContact CD1-CD1 3.82Å; V89-L91 HydrophobicContact CG1-CG 4.13Å; L91-F93 HydrophobicContact CB-CD2 4.22Å; L91-F93 HydrophobicContact CB-CE2 3.48Å; L91-F93 VanDerWaalsContact CB-CE2 3.48Å; L91-F93 HydrophobicContact CB-CZ 3.98Å; L91-F93 HydrophobicContact CD1-CE2 4.4Å; L91-F93 HydrophobicContact CD1-CZ 4.24Å; L91-E116 PolarHBondContact N-O 2.72Å; L91-M117 HydrophobicContact CD1-CE 4.41Å; L91-M117 HydrophobicContact CD1-CG 4.34Å; L91-L118 PolarHBondContact O-N 2.93Å
92	Y	94.3	Very high	94.5	Very high	50 Å²	50	24.3 Å²	24.3	20%	0.196	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110.6	176.8	-66.1	-81.8	0	0	0	110.4	L49 P68 Y69 V71 K90 L118	L49-Y92 HydrophobicContact CD1-CD2 3.86Å; L49-Y92 HydrophobicContact CD1-CE2 4.33Å; P68-Y92 HydrophobicContact CB-CD2 4.29Å; P68-Y92 HydrophobicContact CB-CE2 3.85Å; Y69-Y92 PolarHBondContact O-N 3.3Å; V71-Y92 PolarHBondContact N-O 3.14Å; K90-Y92 HydrophobicContact CB-CE2 4.12Å; Y92-L118 WeakPolarHBondContact CA-O 3.34Å; Y92-L118 HydrophobicContact CD1-CB 4.1Å; Y92-L118 HydrophobicContact CE1-CB 4.15Å; Y92-L118 HydrophobicContact CE1-CD1 3.88Å
93	F	94.9	Very high	94.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	129.1	-174.1	-68.4	-93.4	0	0	0	112.8	V71 L91 I99 M117 L118 W120 W253	V71-F93 HydrophobicContact CB-CD1 3.64Å; V71-F93 HydrophobicContact CB-CE1 3.91Å; V71-F93 HydrophobicContact CB-CG 4.21Å; V71-F93 HydrophobicContact CG1-CD1 3.58Å; V71-F93 HydrophobicContact CG1-CE1 3.68Å; V71-F93 HydrophobicContact CG2-CD1 4.05Å; V71-F93 HydrophobicContact CG2-CE1 3.88Å; V71-F93 HydrophobicContact CG2-CZ 4.21Å; L91-F93 HydrophobicContact CB-CD2 4.22Å; L91-F93 HydrophobicContact CB-CE2 3.48Å; L91-F93 VanDerWaalsContact CB-CE2 3.48Å; L91-F93 HydrophobicContact CB-CZ 3.98Å; L91-F93 HydrophobicContact CD1-CE2 4.4Å; L91-F93 HydrophobicContact CD1-CZ 4.24Å; F93-I99 HydrophobicContact CE1-CD1 4.25Å; F93-I99 HydrophobicContact CE1-CG1 3.72Å; F93-I99 HydrophobicContact CZ-CD1 3.88Å; F93-I99 HydrophobicContact CZ-CG1 3.84Å; F93-M117 HydrophobicContact CE2-CB 3.95Å; F93-M117 HydrophobicContact CE2-CG 4.23Å; F93-L118 PolarHBondContact N-O 2.98Å; F93-W120 WeakPolarHBondContact O-CA 3.46Å; F93-W120 WeakPolarHBondContact O-CB 3.45Å; F93-W120 PolarHBondContact O-N 3.05Å; F93-W253 HydrophobicContact CB-CB 3.43Å; F93-W253 VanDerWaalsContact CB-CB 3.43Å; F93-W253 HydrophobicContact CB-CD2 3.91Å; F93-W253 HydrophobicContact CB-CE3 4.11Å; F93-W253 HydrophobicContact CB-CG 3.63Å; F93-W253 HydrophobicContact CD1-CD2 4.41Å; F93-W253 AromaticContact CD1-CE3 3.77Å; F93-W253 HydrophobicContact CD1-CE3 3.77Å; F93-W253 HydrophobicContact CD1-CZ3 4.22Å; F93-W253 AromaticContact CD2-CD2 3.85Å; F93-W253 HydrophobicContact CD2-CD2 3.85Å; F93-W253 AromaticContact CD2-CE3 3.83Å; F93-W253 HydrophobicContact CD2-CE3 3.83Å; F93-W253 HydrophobicContact CD2-CG 4.34Å; F93-W253 HydrophobicContact CD2-CH2 4.43Å; F93-W253 HydrophobicContact CD2-CZ2 4.41Å; F93-W253 HydrophobicContact CD2-CZ3 4.12Å; F93-W253 HydrophobicContact CE1-CE3 4.1Å; F93-W253 HydrophobicContact CE1-CZ3 4.07Å; F93-W253 HydrophobicContact CE2-CD2 4.48Å; F93-W253 HydrophobicContact CE2-CE3 4.15Å; F93-W253 HydrophobicContact CE2-CH2 4.14Å; F93-W253 HydrophobicContact CE2-CZ2 4.42Å; F93-W253 AromaticContact CE2-CZ3 3.97Å; F93-W253 HydrophobicContact CE2-CZ3 3.97Å; F93-W253 HydrophobicContact CG-CB 4.26Å; F93-W253 AromaticContact CG-CD2 3.81Å; F93-W253 HydrophobicContact CG-CD2 3.81Å; F93-W253 AromaticContact CG-CE3 3.63Å; F93-W253 HydrophobicContact CG-CE3 3.63Å; F93-W253 HydrophobicContact CG-CG 4.09Å; F93-W253 HydrophobicContact CG-CZ3 4.25Å; F93-W253 HydrophobicContact CZ-CE3 4.28Å; F93-W253 HydrophobicContact CZ-CH2 4.41Å; F93-W253 AromaticContact CZ-CZ3 3.94Å; F93-W253 HydrophobicContact CZ-CZ3 3.94Å
94	A	92.6	Very high	94.3	Very high	13 Å²	13	22.1 Å²	22.1	11%	0.107	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-62.3	153	169.1	0	0	0	0	0	111.6	V71 G96 V97 W120	V71-A94 PolarHBondContact O-N 3.18Å; A94-G96 PolarHBondContact O-N 3.45Å; A94-V97 HydrophobicContact CB-CB 4.39Å; A94-V97 HydrophobicContact CB-CG2 3.9Å; A94-V97 WeakPolarHBondContact O-CB 3.45Å; A94-V97 PolarHBondContact O-N 3.23Å; A94-W120 HydrophobicContact CB-CE3 4.44Å
95	S	92.2	Very high	94.3	Very high	36 Å²	36	19.8 Å²	19.8	25%	0.252	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	120.8	-176.5	-175	0	0	0	0	112.5	V97 E250 R293	S95-V97 VanDerWaalsContact C-N 3.27Å; S95-V97 PolarHBondContact O-N 3.18Å; S95-E250 WeakPolarHBondContact CB-O 3.36Å; S95-E250 PolarHBondContact OG-O 2.99Å; S95-R293 PolarHBondContact O-NE 2.91Å; S95-R293 PolarHBondContact O-NH2 2.83Å
96	G	92.3	Very high	94.4	Very high	4 Å²	4	21.4 Å²	21.4	4%	0.041	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	19	-176.4	0	0	0	0	0	118.6	A94 H252 Y291 R293	A94-G96 PolarHBondContact O-N 3.45Å; G96-H252 PolarHBondContact N-O 3.28Å; G96-Y291 WeakPolarHBondContact CA-O 3.41Å; G96-R293 VanDerWaalsContact O-CB 3.3Å; G96-R293 WeakPolarHBondContact O-CB 3.45Å; G96-R293 PolarHBondContact O-N 2.89Å
97	V	94.7	Very high	94.5	Very high	6 Å²	6	18 Å²	18	4%	0.036	10%	0.096	C	C	.	.			trans	-94.8	146.4	166.5	-176.3	0	0	0	0	108.9	V71 R73 P74 A94 S95 W253 K254	V71-V97 HydrophobicContact CG1-CG1 3.99Å; R73-V97 VanDerWaalsContact C-CG1 3.42Å; R73-V97 WeakPolarHBondContact O-CG1 3.18Å; P74-V97 HydrophobicContact CB-CG1 4.37Å; A94-V97 HydrophobicContact CB-CB 4.39Å; A94-V97 HydrophobicContact CB-CG2 3.9Å; A94-V97 WeakPolarHBondContact O-CB 3.45Å; A94-V97 PolarHBondContact O-N 3.23Å; S95-V97 VanDerWaalsContact C-N 3.27Å; S95-V97 PolarHBondContact O-N 3.18Å; V97-W253 WeakPolarHBondContact O-CB 2.99Å; V97-K254 PolarHBondContact O-N 2.91Å
98	G	94.3	Very high	94.6	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	-163.4	177.4	0	0	0	0	0	113	I75	I75-G98 PolarHBondContact N-O 3.38Å
99	I	96.4	Very high	94.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	122.8	-178.5	-50.9	-169.8	0	0	0	108.6	I75 F93 V101 G255 L256 E257	I75-I99 HydrophobicContact CB-CB 4.44Å; I75-I99 HydrophobicContact CB-CG1 4.15Å; I75-I99 HydrophobicContact CB-CG2 4.26Å; I75-I99 HydrophobicContact CD1-CD1 4.3Å; I75-I99 HydrophobicContact CD1-CG1 4.26Å; I75-I99 HydrophobicContact CG2-CG2 3.91Å; I75-I99 WeakPolarHBondContact O-CA 3.5Å; F93-I99 HydrophobicContact CE1-CD1 4.25Å; F93-I99 HydrophobicContact CE1-CG1 3.72Å; F93-I99 HydrophobicContact CZ-CD1 3.88Å; F93-I99 HydrophobicContact CZ-CG1 3.84Å; I99-V101 HydrophobicContact CG2-CG2 3.64Å; I99-G255 PolarHBondContact N-O 2.85Å; I99-G255 VanDerWaalsContact N-O 3.16Å; I99-L256 HydrophobicContact CB-CD2 3.66Å; I99-L256 HydrophobicContact CD1-CD2 3.74Å; I99-L256 HydrophobicContact CG1-CD2 3.77Å; I99-E257 PolarHBondContact O-N 3.14Å
100	T	95.6	Very high	94.6	Very high	16 Å²	16	19.6 Å²	19.6	10%	0.098	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.7	169.8	-61	0	0	0	0	109	I75 F76 V77 E257 Q259	I75-T100 PolarHBondContact O-N 3.04Å; F76-T100 WeakPolarHBondContact CA-O 3.47Å; F76-T100 HydrophobicContact CD2-CG2 3.97Å; F76-T100 HydrophobicContact CE2-CG2 4.12Å; V77-T100 PolarHBondContact N-O 2.96Å; T100-E257 CarbonylContact C-O 3.55Å; T100-E257 WeakPolarHBondContact CA-O 3.34Å; T100-E257 PolarHBondContact OG1-OE2 3.44Å; T100-Q259 HydrophobicContact CG2-CG 4.13Å
101	V	95.8	Very high	94.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	109.9	-169.7	-174.9	0	0	0	0	110.4	V77 I99 G103 L105 E257 F258 Q259	V77-V101 HydrophobicContact CB-CG1 4.34Å; V77-V101 HydrophobicContact CG2-CG2 4.38Å; I99-V101 HydrophobicContact CG2-CG2 3.64Å; V101-G103 VanDerWaalsContact CG1-O 3.23Å; V101-G103 WeakPolarHBondContact CG1-O 3.35Å; V101-L105 HydrophobicContact CG1-CB 4.04Å; V101-L105 HydrophobicContact CG2-CB 3.99Å; V101-L105 HydrophobicContact CG2-CD2 4.07Å; V101-E257 PolarHBondContact N-O 2.82Å; V101-F258 HydrophobicContact CB-CD1 3.81Å; V101-F258 HydrophobicContact CB-CE1 4.07Å; V101-F258 HydrophobicContact CB-CG 4.43Å; V101-F258 HydrophobicContact CG1-CD1 3.91Å; V101-F258 HydrophobicContact CG1-CE1 3.99Å; V101-F258 HydrophobicContact CG2-CD1 4.32Å; V101-F258 HydrophobicContact CG2-CE1 4.15Å; V101-Q259 PolarHBondContact O-N 3.31Å
102	Q	93.1	Very high	94.3	Very high	43 Å²	43	32.9 Å²	32.9	20%	0.201	16%	0.158	C	C	.	.	S	Bend	trans	-106.1	-19.7	164.3	-68.1	-177.6	-7.4	0	0	111.9	F76 V77 Q259 P262	F76-Q102 HydrophobicContact CE2-CG 4.09Å; F76-Q102 HydrophobicContact CZ-CG 4.21Å; F76-Q102 VanDerWaalsContact CZ-OE1 3.29Å; V77-Q102 PolarHBondContact O-N 3.17Å; Q102-Q259 HydrophobicContact CG-CB 3.99Å; Q102-P262 WeakPolarHBondContact O-CD 3.24Å
103	G	92.1	Very high	94.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	-89.8	-143.8	168.3	0	0	0	0	0	112.4	V77 Q78 A81 V101 P262	V77-G103 PolarHBondContact O-N 3.42Å; Q78-G103 WeakPolarHBondContact O-CA 3.2Å; Q78-G103 PolarHBondContact O-N 3.07Å; A81-G103 WeakPolarHBondContact O-CA 3.47Å; V101-G103 VanDerWaalsContact CG1-O 3.23Å; V101-G103 WeakPolarHBondContact CG1-O 3.35Å; G103-P262 WeakPolarHBondContact O-CD 3.39Å
104	V	95.3	Very high	94.1	Very high	8 Å²	8	36 Å²	36	5%	0.048	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	132	180	-178	0	0	0	0	110.8	A81 N82 L83 P262 K278	A81-V104 PolarHBondContact O-N 2.9Å; N82-V104 WeakPolarHBondContact CA-O 3.1Å; N82-V104 HydrophobicContact CB-CB 4.36Å; N82-V104 WeakPolarHBondContact OD1-CB 3.49Å; N82-V104 WeakPolarHBondContact OD1-CG2 3.4Å; L83-V104 PolarHBondContact N-O 2.66Å; V104-P262 HydrophobicContact CG2-CG 3.6Å; V104-K278 HydrophobicContact CG1-CB 4.12Å; V104-K278 VanDerWaalsContact CG1-O 3.31Å; V104-K278 WeakPolarHBondContact CG1-O 3.39Å; V104-K278 HydrophobicContact CG2-CB 3.75Å; V104-K278 HydrophobicContact CG2-CD 4.24Å
105	L	97	Very high	94.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.4	168.6	-179.8	62.9	0	0	0	110.1	L83 I85 V101 L256 F258 S279 R280 L281	L83-L105 HydrophobicContact CB-CD1 4.15Å; L83-L105 HydrophobicContact CD2-CD1 3.96Å; L83-L105 HydrophobicContact CG-CD1 4.03Å; I85-L105 HydrophobicContact CD1-CD1 3.85Å; I85-L105 HydrophobicContact CG1-CD1 4.22Å; V101-L105 HydrophobicContact CG1-CB 4.04Å; V101-L105 HydrophobicContact CG2-CB 3.99Å; V101-L105 HydrophobicContact CG2-CD2 4.07Å; L105-L256 HydrophobicContact CD2-CD1 4.37Å; L105-F258 HydrophobicContact CB-CE1 4.06Å; L105-F258 HydrophobicContact CB-CZ 4.34Å; L105-F258 HydrophobicContact CD2-CE1 4.45Å; L105-F258 HydrophobicContact CD2-CZ 3.97Å; L105-S279 PolarHBondContact N-OG 3.02Å; L105-S279 CarbonylContact O-C 3.56Å; L105-S279 VanDerWaalsContact O-CA 3.24Å; L105-S279 WeakPolarHBondContact O-CA 3.46Å; L105-S279 VanDerWaalsContact O-CB 3.31Å; L105-S279 WeakPolarHBondContact O-CB 3.4Å; L105-R280 PolarHBondContact O-N 3.28Å; L105-L281 HydrophobicContact CD2-CD2 4.23Å
106	N	96.8	Very high	94.5	Very high	37 Å²	37	35.9 Å²	35.9	20%	0.198	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	95.9	173.9	-72.5	-29.1	0	0	0	109.4	L83 T84 I85 K278	L83-N106 PolarHBondContact O-N 3.2Å; T84-N106 WeakPolarHBondContact CA-O 3.26Å; T84-N106 HydrophobicContact CG2-CB 4.37Å; I85-N106 PolarHBondContact N-O 2.84Å; N106-K278 PolarHBondContact OD1-O 3.33Å
107	A	96.5	Very high	94.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	92.3	173.3	0	0	0	0	0	108.5	I85 I115 M117 R280 L281 E282 V284	I85-A107 HydrophobicContact CB-CB 4.33Å; I85-A107 HydrophobicContact CD1-CB 4.33Å; A107-I115 HydrophobicContact CB-CD1 3.82Å; A107-M117 HydrophobicContact CB-CE 4.43Å; A107-R280 PolarHBondContact N-O 2.85Å; A107-L281 HydrophobicContact CB-CD2 3.97Å; A107-E282 PolarHBondContact O-N 2.76Å; A107-V284 HydrophobicContact CB-CG2 3.95Å
108	I	95.7	Very high	94.7	Very high	77 Å²	77	36.3 Å²	36.3	40%	0.395	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	97.5	-174.7	-54.4	175.5	0	0	0	108.3	R280 E282	I108-R280 HydrophobicContact CD1-CB 4.3Å; I108-R280 HydrophobicContact CG1-CB 4.21Å; I108-E282 HydrophobicContact CG2-CB 4.33Å
109	G	94.2	Very high	94.6	Very high	7 Å²	7	36.7 Å²	36.7	7%	0.072	17%	0.174	C	C	.	.			trans	-85.1	-169.6	169.2	0	0	0	0	0	112.2	E282	G109-E282 PolarHBondContact N-O 2.94Å
110	N	93.5	Very high	94	Very high	40 Å²	40	38.7 Å²	38.7	21%	0.214	18%	0.182	C	C	.	.			trans	-133.9	171.8	167.9	73.8	55.6	0	0	0	111.1	Q87 Y112 V113 Q114	Q87-N110 PolarHBondContact NE2-ND2 3.46Å; Q87-N110 PolarHBondContact OE1-ND2 2.79Å; N110-Y112 PolarHBondContact O-N 3.17Å; N110-Y112 VanDerWaalsContact O-N 3.12Å; N110-Y112 WeakPolarHBondContact OD1-CA 3.47Å; N110-Y112 WeakPolarHBondContact OD1-CB 3.4Å; N110-Y112 PolarHBondContact OD1-N 2.97Å; N110-V113 PolarHBondContact N-O 3.19Å; N110-V113 CarbonylContact O-C 3.56Å; N110-V113 VanDerWaalsContact O-C 3.32Å; N110-V113 PolarHBondContact O-N 3.5Å; N110-V113 PolarHBondContact OD1-N 2.83Å; N110-Q114 WeakPolarHBondContact O-CG 3.38Å
111	K	90	Very high	93.3	Very high	150 Å²	150	41.8 Å²	41.8	65%	0.652	20%	0.197	S	C	*	.	S	Bend	trans	-55.1	-32.2	-177.3	-175.7	178.2	178.1	-178.7	0	114.3
112	Y	92.3	Very high	92.4	Very high	203 Å²	203	47.9 Å²	47.9	80%	0.796	24%	0.235	S	C	*	.	S	Bend	trans	-94.5	-29.8	-176.8	-54.1	-70	0	0	0	112.7	N110	N110-Y112 PolarHBondContact O-N 3.17Å; N110-Y112 VanDerWaalsContact O-N 3.12Å; N110-Y112 WeakPolarHBondContact OD1-CA 3.47Å; N110-Y112 WeakPolarHBondContact OD1-CB 3.4Å; N110-Y112 PolarHBondContact OD1-N 2.97Å
113	V	92.6	Very high	91.5	Very high	49 Å²	49	46.3 Å²	46.3	30%	0.297	23%	0.228	S	C	.	.	S	Bend	trans	-133.8	91.1	-172.6	-174.4	0	0	0	0	107.5	Q87 N110	Q87-V113 HydrophobicContact CB-CG1 4.44Å; Q87-V113 HydrophobicContact CG-CG1 4.49Å; N110-V113 PolarHBondContact N-O 3.19Å; N110-V113 CarbonylContact O-C 3.56Å; N110-V113 VanDerWaalsContact O-C 3.32Å; N110-V113 PolarHBondContact O-N 3.5Å; N110-V113 PolarHBondContact OD1-N 2.83Å
114	Q	94	Very high	90.6	Very high	65 Å²	65	49.6 Å²	49.6	30%	0.304	25%	0.25	S	C	.	.			trans	-88.8	160.1	-176.2	-62.6	-178.5	-14	0	0	110.8	G88 N110 H283 N285	G88-Q114 VanDerWaalsContact CA-O 3.27Å; G88-Q114 WeakPolarHBondContact CA-O 3.15Å; G88-Q114 PolarHBondContact N-O 2.6Å; N110-Q114 WeakPolarHBondContact O-CG 3.38Å; Q114-H283 WeakPolarHBondContact CA-O 3.11Å; Q114-H283 WeakPolarHBondContact CB-O 3.1Å; Q114-H283 HydrophobicContact CG-CB 4.28Å; Q114-N285 PolarHBondContact OE1-ND2 2.65Å; Q114-N285 PolarHBondContact OE1-OD1 3.37Å; Q114-N285 VanDerWaalsContact OE1-OD1 3.14Å
115	I	96.9	Very high	89.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	129.9	168.9	-63.1	168.5	0	0	0	107.6	I85 A107 M117 H283 V284 N285	I85-I115 HydrophobicContact CB-CD1 4.16Å; I85-I115 HydrophobicContact CG2-CD1 3.9Å; I85-I115 HydrophobicContact CG2-CG1 4.25Å; I85-I115 HydrophobicContact CG2-CG2 3.81Å; I85-I115 WeakPolarHBondContact O-CD1 3.4Å; A107-I115 HydrophobicContact CB-CD1 3.82Å; I115-M117 HydrophobicContact CG2-CE 4.31Å; I115-H283 PolarHBondContact N-O 3.18Å; I115-V284 HydrophobicContact CB-CG1 4.39Å; I115-V284 HydrophobicContact CB-CG2 4.34Å; I115-V284 HydrophobicContact CG2-CG1 4.34Å; I115-V284 WeakPolarHBondContact O-CA 3.46Å; I115-N285 PolarHBondContact O-N 2.82Å
116	E	95.7	Very high	87.3	Confident	47 Å²	47	62.7 Å²	62.7	22%	0.22	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.3	-178.3	-64.7	176	-164.8	0	0	110.5	V89 K90 L91 L118	V89-E116 PolarHBondContact O-N 2.83Å; V89-E116 VanDerWaalsContact O-N 3.09Å; K90-E116 WeakPolarHBondContact CA-O 3.49Å; K90-E116 HydrophobicContact CB-CB 4.5Å; K90-E116 WeakPolarHBondContact CD-OE2 3.31Å; K90-E116 VanDerWaalsContact CE-OE2 3.22Å; K90-E116 WeakPolarHBondContact CE-OE2 3.21Å; K90-E116 HydrophobicContact CG-CB 4.19Å; K90-E116 VanDerWaalsContact NZ-CD 3.28Å; K90-E116 IonicContact NZ-OE1 3.78Å; K90-E116 PolarHBondContact NZ-OE1 3.13Å; K90-E116 IonicContact NZ-OE2 3.7Å; K90-E116 PolarHBondContact NZ-OE2 2.85Å; L91-E116 PolarHBondContact N-O 2.72Å; E116-L118 HydrophobicContact CB-CD1 4.07Å; E116-L118 HydrophobicContact CB-CD2 4.42Å; E116-L118 HydrophobicContact CB-CG 4.02Å
117	M	96.1	Very high	85.8	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	107.3	173.3	-61.1	-177.7	-178.1	0	0	108.7	I85 L91 F93 A107 I115 W253 L256 V284 N285 I286 W287	I85-M117 HydrophobicContact CD1-CE 3.88Å; L91-M117 HydrophobicContact CD1-CE 4.41Å; L91-M117 HydrophobicContact CD1-CG 4.34Å; F93-M117 HydrophobicContact CE2-CB 3.95Å; F93-M117 HydrophobicContact CE2-CG 4.23Å; A107-M117 HydrophobicContact CB-CE 4.43Å; I115-M117 HydrophobicContact CG2-CE 4.31Å; M117-W253 HydrophobicContact CB-CH2 3.99Å; M117-W253 HydrophobicContact CB-CZ2 3.73Å; M117-W253 HydrophobicContact SD-CH2 4.12Å; M117-L256 HydrophobicContact CE-CD1 4.26Å; M117-L256 HydrophobicContact CE-CD2 4.36Å; M117-L256 HydrophobicContact SD-CD1 3.95Å; M117-L256 HydrophobicContact SD-CD2 3.8Å; M117-L256 HydrophobicContact SD-CG 4.23Å; M117-V284 HydrophobicContact CE-CG1 3.96Å; M117-V284 HydrophobicContact CG-CG1 4.35Å; M117-V284 HydrophobicContact SD-CG1 4.13Å; M117-N285 PolarHBondContact N-O 3Å; M117-I286 HydrophobicContact SD-CG1 4.3Å; M117-W287 PolarHBondContact O-N 3.25Å
118	L	94.4	Very high	83.9	Confident	20 Å²	20	66 Å²	66	11%	0.105	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	154.6	-163.7	-61.3	177.4	0	0	0	111.7	L91 Y92 F93 E116 W287	L91-L118 PolarHBondContact O-N 2.93Å; Y92-L118 WeakPolarHBondContact CA-O 3.34Å; Y92-L118 HydrophobicContact CD1-CB 4.1Å; Y92-L118 HydrophobicContact CE1-CB 4.15Å; Y92-L118 HydrophobicContact CE1-CD1 3.88Å; F93-L118 PolarHBondContact N-O 2.98Å; E116-L118 HydrophobicContact CB-CD1 4.07Å; E116-L118 HydrophobicContact CB-CD2 4.42Å; E116-L118 HydrophobicContact CB-CG 4.02Å; L118-W287 HydrophobicContact CD2-CB 4.42Å; L118-W287 HydrophobicContact CD2-CD2 4.19Å; L118-W287 HydrophobicContact CD2-CE3 3.62Å; L118-W287 HydrophobicContact CD2-CZ3 4.24Å
119	P	91.9	Very high	81.7	Confident	9 Å²	9	66.5 Å²	66.5	6%	0.058	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	152.7	172.3	32.1	-37.6	0	0	0	111.7	P123 F251 Y288	P119-P123 HydrophobicContact CG-CG 4.08Å; P119-F251 WeakPolarHBondContact CB-O 3.47Å; P119-Y288 HydrophobicContact CG-CD2 3.79Å; P119-Y288 HydrophobicContact CG-CG 3.99Å
120	W	84.6	Confident	79.4	Confident	41 Å²	41	73.2 Å²	73.2	16%	0.155	38%	0.38	C	S	.	.	S	Bend	trans	-58.7	-46.8	177.7	-179.4	-85.9	0	0	0	113.3	I46 K70 T72 F93 A94	I46-W120 HydrophobicContact CB-CH2 4.26Å; I46-W120 HydrophobicContact CB-CZ2 3.99Å; I46-W120 WeakPolarHBondContact CD1-O 3.47Å; I46-W120 HydrophobicContact CG2-CD2 3.82Å; I46-W120 HydrophobicContact CG2-CE3 3.66Å; I46-W120 HydrophobicContact CG2-CH2 3.3Å; I46-W120 HydrophobicContact CG2-CZ2 3.42Å; I46-W120 VanDerWaalsContact CG2-CZ2 3.42Å; I46-W120 HydrophobicContact CG2-CZ3 3.44Å; I46-W120 VanDerWaalsContact CG2-CZ3 3.44Å; K70-W120 HydrophobicContact CB-CH2 4.27Å; K70-W120 HydrophobicContact CB-CZ3 3.72Å; K70-W120 HydrophobicContact CD-CH2 3.99Å; K70-W120 HydrophobicContact CD-CZ3 4.19Å; K70-W120 HydrophobicContact CG-CZ3 4.49Å; T72-W120 HydrophobicContact CG2-CE3 4.48Å; T72-W120 HydrophobicContact CG2-CH2 3.86Å; T72-W120 HydrophobicContact CG2-CZ3 3.53Å; F93-W120 WeakPolarHBondContact O-CA 3.46Å; F93-W120 WeakPolarHBondContact O-CB 3.45Å; F93-W120 PolarHBondContact O-N 3.05Å; A94-W120 HydrophobicContact CB-CE3 4.44Å
121	L	81.2	Confident	77.5	Confident	81 Å²	81	77.5 Å²	77.5	42%	0.424	40%	0.403	S	S	.	.	S	Bend	trans	-98.3	134.9	176.1	-59.2	171.7	0	0	0	108.4	P123 F251	L121-P123 WeakPolarHBondContact O-CD 3.14Å; L121-F251 HydrophobicContact CB-CD1 3.62Å; L121-F251 HydrophobicContact CB-CE1 3.65Å; L121-F251 HydrophobicContact CD1-CD1 4.06Å; L121-F251 HydrophobicContact CD1-CE1 3.76Å; L121-F251 HydrophobicContact CG-CD1 4.41Å; L121-F251 HydrophobicContact CG-CE1 4.34Å
122	T	75.8	Confident	76.2	Confident	128 Å²	128	77.1 Å²	77.1	79%	0.785	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-66.6	117.9	171.8	-44.7	0	0	0	0	109
123	P	74.5	Confident	75.3	Confident	10 Å²	10	68.2 Å²	68.2	7%	0.065	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-65.4	143.5	177	-22.6	38.4	0	0	0	109.4	P119 L121 D125 L127 F251 Y288	P119-P123 HydrophobicContact CG-CG 4.08Å; L121-P123 WeakPolarHBondContact O-CD 3.14Å; P123-D125 PolarHBondContact O-N 2.65Å; P123-L127 HydrophobicContact CB-CD2 4.33Å; P123-F251 HydrophobicContact CB-CD2 4.01Å; P123-F251 HydrophobicContact CB-CE2 4.41Å; P123-F251 HydrophobicContact CB-CG 4.37Å; P123-F251 HydrophobicContact CG-CB 4.11Å; P123-F251 HydrophobicContact CG-CD2 4.23Å; P123-F251 HydrophobicContact CG-CG 4.12Å; P123-Y288 HydrophobicContact CB-CD1 4.46Å; P123-Y288 HydrophobicContact CB-CE1 3.74Å; P123-Y288 HydrophobicContact CG-CD1 3.79Å; P123-Y288 HydrophobicContact CG-CD2 4.13Å; P123-Y288 HydrophobicContact CG-CE1 3.46Å; P123-Y288 VanDerWaalsContact CG-CE1 3.46Å; P123-Y288 HydrophobicContact CG-CE2 3.85Å; P123-Y288 HydrophobicContact CG-CG 4.1Å; P123-Y288 VanDerWaalsContact CG-CZ 3.48Å
124	P	72.8	Confident	74.9	Confident	70 Å²	70	67.4 Å²	67.4	46%	0.455	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-63.2	138.1	177.8	23.1	-29.8	0	0	0	110.6	N126 L127	P124-N126 PolarHBondContact O-N 2.83Å; P124-L127 HydrophobicContact CG-CB 4.32Å; P124-L127 HydrophobicContact CG-CD1 4.16Å; P124-L127 WeakPolarHBondContact O-CB 3.05Å; P124-L127 PolarHBondContact O-N 3.48Å
125	D	64.3	Low	74.8	Confident	158 Å²	158	64.3 Å²	64.3	85%	0.845	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-26	-174.8	-70.6	-31.9	0	0	0	114.1	P123	P123-D125 PolarHBondContact O-N 2.65Å
126	N	58.9	Low	74.6	Confident	124 Å²	124	64.4 Å²	64.4	66%	0.663	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	0.7	-177.6	-71.6	-25.8	0	0	0	115.3	P124 H128 A129	P124-N126 PolarHBondContact O-N 2.83Å; N126-H128 PolarHBondContact O-N 3.28Å; N126-H128 VanDerWaalsContact O-N 3.17Å; N126-A129 PolarHBondContact O-N 3.5Å
127	L	65.4	Low	74.5	Confident	38 Å²	38	62.5 Å²	62.5	20%	0.199	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-31.3	-175.9	-161.9	79.3	0	0	0	112.6	P123 P124 P247 F251	P123-L127 HydrophobicContact CB-CD2 4.33Å; P124-L127 HydrophobicContact CG-CB 4.32Å; P124-L127 HydrophobicContact CG-CD1 4.16Å; P124-L127 WeakPolarHBondContact O-CB 3.05Å; P124-L127 PolarHBondContact O-N 3.48Å; L127-P247 HydrophobicContact CD1-CB 4.41Å; L127-F251 HydrophobicContact CD2-CD2 4.18Å; L127-F251 HydrophobicContact CD2-CE2 4.44Å
128	H	57.3	Low	74.3	Confident	68 Å²	68	63.2 Å²	63.2	32%	0.315	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-19.9	-172.5	-57.7	-65.2	0	0	0	114.9	N126 Q130 Y288 Y318	N126-H128 PolarHBondContact O-N 3.28Å; N126-H128 VanDerWaalsContact O-N 3.17Å; H128-Q130 PolarHBondContact O-N 2.95Å; H128-Y288 AromaticContact CE1-CE1 3.51Å; H128-Y288 AromaticContact CE1-CZ 3.99Å; H128-Y288 AromaticContact NE2-CE1 3.32Å; H128-Y288 VanDerWaalsContact NE2-CE1 3.32Å; H128-Y288 WeakPolarHBondContact NE2-CE1 3.41Å; H128-Y288 AromaticContact NE2-CZ 3.37Å; H128-Y288 PolarHBondContact NE2-OH 3.44Å; H128-Y318 HydrophobicContact CB-CE1 4.37Å; H128-Y318 AromaticContact CD2-CE1 3.85Å; H128-Y318 AromaticContact CE1-CD1 3.22Å; H128-Y318 WeakPolarHBondContact CE1-CD1 3.45Å; H128-Y318 AromaticContact CE1-CE1 3.72Å; H128-Y318 AromaticContact CE1-CG 3.56Å; H128-Y318 AromaticContact CG-CD1 3.93Å; H128-Y318 AromaticContact CG-CE1 3.67Å; H128-Y318 AromaticContact ND1-CD1 3.37Å; H128-Y318 WeakPolarHBondContact ND1-CD1 3.41Å; H128-Y318 AromaticContact ND1-CE1 3.61Å; H128-Y318 AromaticContact NE2-CD1 3.72Å; H128-Y318 AromaticContact NE2-CE1 3.86Å; H128-Y318 AromaticContact NE2-CG 3.89Å
129	A	49.8	Very low	74.1	Confident	89 Å²	89	64.6 Å²	64.6	74%	0.736	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-14.1	175.7	0	0	0	0	0	111.9	N126	N126-A129 PolarHBondContact O-N 3.5Å
130	Q	45.9	Very low	74	Confident	147 Å²	147	64.6 Å²	64.6	69%	0.687	35%	0.353	S	S	*	.	S	Bend	trans	-111.1	120	-177.6	-68.1	-174.6	-12.8	0	0	111.8	H128	H128-Q130 PolarHBondContact O-N 2.95Å
131	N	52.2	Low	74.1	Confident	131 Å²	131	64.9 Å²	64.9	70%	0.701	36%	0.36	S	S	*	.			trans	77.5	72.6	161.3	-64.1	-11.1	0	0	0	119	S133	N131-S133 PolarHBondContact O-N 3.05Å
132	Y	62.6	Low	74.6	Confident	141 Å²	141	62 Å²	62	55%	0.553	35%	0.346	S	S	*	.			trans	-64.1	116.3	135.8	-72.5	-82.6	0	0	0	107.7	S134 Y342 F369	Y132-S134 PolarHBondContact O-N 2.95Å; Y132-Y342 WeakPolarHBondContact OH-CD1 3.37Å; Y132-F369 HydrophobicContact CD1-CD2 4.35Å
133	S	74.3	Confident	75.3	Confident	16 Å²	16	56.3 Å²	56.3	11%	0.112	31%	0.311	C	S	.	.			trans	-56	135.2	177.5	170.9	0	0	0	0	110.2	N131 I135	N131-S133 PolarHBondContact O-N 3.05Å; S133-I135 WeakPolarHBondContact CB-O 3.46Å; S133-I135 PolarHBondContact O-N 3.49Å; S133-I135 PolarHBondContact OG-N 3.11Å; S133-I135 PolarHBondContact OG-O 3.18Å
134	S	85.1	Confident	76.1	Confident	32 Å²	32	57 Å²	57	22%	0.224	31%	0.313	C	S	.	.	S	Bend	trans	-67.9	3.9	169.1	52.8	0	0	0	0	113	Y132 V150 L151 H213	Y132-S134 PolarHBondContact O-N 2.95Å; S134-V150 CarbonylContact O-C 3.44Å; S134-V150 WeakPolarHBondContact O-CA 3.37Å; S134-L151 PolarHBondContact O-N 3.26Å; S134-H213 PolarHBondContact OG-NE2 3.16Å; S134-H213 VanDerWaalsContact OG-NE2 3.13Å
135	I	91.1	Very high	77.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.1	-172.3	-51.4	-173.1	0	0	0	109.3	S133 L148 Q149 V150 T177 M178 L212 W218	S133-I135 WeakPolarHBondContact CB-O 3.46Å; S133-I135 PolarHBondContact O-N 3.49Å; S133-I135 PolarHBondContact OG-N 3.11Å; S133-I135 PolarHBondContact OG-O 3.18Å; I135-L148 HydrophobicContact CG2-CD1 3.38Å; I135-L148 HydrophobicContact CG2-CG 4.48Å; I135-Q149 WeakPolarHBondContact CA-O 3.22Å; I135-V150 HydrophobicContact CG1-CG1 4.44Å; I135-V150 HydrophobicContact CG1-CG2 4.26Å; I135-T177 HydrophobicContact CD1-CG2 3.84Å; I135-T177 HydrophobicContact CG1-CG2 4.33Å; I135-M178 HydrophobicContact CB-CG 4.38Å; I135-M178 HydrophobicContact CG2-CG 4.31Å; I135-M178 HydrophobicContact CG2-SD 4.13Å; I135-L212 HydrophobicContact CD1-CB 3.98Å; I135-L212 HydrophobicContact CD1-CD1 3.26Å; I135-L212 HydrophobicContact CD1-CG 4.19Å; I135-W218 HydrophobicContact CD1-CZ2 4.14Å
136	R	92.3	Very high	78.6	Confident	3 Å²	3	48.4 Å²	48.4	1%	0.011	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	164.5	-179.6	69.7	-178.2	-173.7	-172.3	9.4	112.5	V138 Q149 W156 F369 G540 Q564	R136-V138 HydrophobicContact CG-CG1 4.03Å; R136-Q149 HydrophobicContact CG-CB 4Å; R136-Q149 VanDerWaalsContact CZ-OE1 3.25Å; R136-Q149 PolarHBondContact N-O 3.06Å; R136-Q149 PolarHBondContact O-N 3.35Å; R136-W156 HydrophobicContact CB-CH2 4.35Å; R136-W156 HydrophobicContact CB-CZ3 4.22Å; R136-W156 HydrophobicContact CG-CE3 3.97Å; R136-W156 HydrophobicContact CG-CH2 4.02Å; R136-W156 HydrophobicContact CG-CZ3 3.59Å; R136-W156 VanDerWaalsContact CZ-CD2 3.49Å; R136-W156 VanDerWaalsContact NH1-CE2 3.29Å; R136-F369 HydrophobicContact CB-CE1 3.98Å; R136-F369 HydrophobicContact CB-CE2 4.44Å; R136-F369 HydrophobicContact CB-CZ 3.6Å; R136-G540 PolarHBondContact NH1-O 3.47Å; R136-Q564 PolarHBondContact NH1-O 2.98Å; R136-Q564 PolarHBondContact NH2-O 3.05Å
137	L	93.7	Very high	80.2	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.1	169.1	-58.3	178.3	0	0	0	110	R144 R147 L148 M178 L238	L137-R144 VanDerWaalsContact CD1-O 3.24Å; L137-R144 WeakPolarHBondContact CD1-O 3.42Å; L137-R147 WeakPolarHBondContact CA-O 3.32Å; L137-L148 HydrophobicContact CD2-CB 4.25Å; L137-L148 HydrophobicContact CD2-CD1 3.9Å; L137-M178 HydrophobicContact CD1-CE 3.9Å; L137-M178 HydrophobicContact CD1-SD 4.43Å; L137-M178 HydrophobicContact CD2-CE 4.05Å; L137-M178 HydrophobicContact CD2-SD 4.39Å; L137-M178 HydrophobicContact CG-CE 3.77Å; L137-M178 HydrophobicContact CG-SD 3.83Å; L137-L238 HydrophobicContact CD1-CB 4.32Å; L137-L238 HydrophobicContact CD2-CB 3.88Å; L137-L238 HydrophobicContact CD2-CD1 4.45Å; L137-L238 HydrophobicContact CD2-CG 4.39Å
138	V	92.5	Very high	81.6	Confident	15 Å²	15	41.3 Å²	41.3	9%	0.091	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	172.1	-179.1	-63.9	0	0	0	0	111.5	R136 G140 G146 R147 Q149 H565	R136-V138 HydrophobicContact CG-CG1 4.03Å; V138-G140 PolarHBondContact O-N 3.18Å; V138-G146 CarbonylContact O-C 3.5Å; V138-G146 VanDerWaalsContact O-C 3.32Å; V138-G146 WeakPolarHBondContact O-CA 3Å; V138-R147 HydrophobicContact CG2-CB 4.17Å; V138-R147 PolarHBondContact N-O 3.13Å; V138-R147 PolarHBondContact O-N 3.35Å; V138-Q149 VanDerWaalsContact CG2-CD 3.47Å; V138-Q149 HydrophobicContact CG2-CG 3.89Å; V138-H565 VanDerWaalsContact CG2-CE1 3.45Å; V138-H565 WeakPolarHBondContact CG2-CE1 3.48Å
139	D	89.9	Confident	83.3	Confident	50 Å²	50	38.7 Å²	38.7	27%	0.267	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	61.5	6.1	179	-54.1	-27.1	0	0	0	116.4	R147 F189 H565	D139-R147 IonicContact OD2-CZ 3.28Å; D139-R147 IonicContact OD2-NE 3.12Å; D139-R147 PolarHBondContact OD2-NE 3.13Å; D139-R147 IonicContact OD2-NH2 3.79Å; D139-R147 PolarHBondContact OD2-NH2 3.31Å; D139-F189 HydrophobicContact CB-CD1 4.48Å; D139-F189 HydrophobicContact CB-CE1 3.94Å; D139-H565 IonicContact OD1-CE1 2.71Å; D139-H565 PolarHBondContact OD1-CE1 3.24Å; D139-H565 IonicContact OD1-NE2 3.77Å; D139-H565 PolarHBondContact OD1-NE2 3.18Å
140	G	89.4	Confident	85.3	Confident	9 Å²	9	34.6 Å²	34.6	9%	0.093	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-171	172	0	0	0	0	0	113	V138 S142 Q145	V138-G140 PolarHBondContact O-N 3.18Å; G140-S142 VanDerWaalsContact C-N 3.28Å; G140-S142 PolarHBondContact O-N 3.05Å; G140-Q145 WeakPolarHBondContact CA-O 3Å
141	P	87.2	Confident	87.3	Confident	46 Å²	46	31 Å²	31	30%	0.299	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-14.5	-174.2	30.5	-35.3	0	0	0	114	Q145	P141-Q145 HydrophobicContact CG-CB 4.2Å; P141-Q145 HydrophobicContact CG-CG 4.12Å
142	S	90.8	Very high	89	Confident	20 Å²	20	26.2 Å²	26.2	14%	0.14	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	172.7	179	67.3	0	0	0	0	110.6	G140 R144 Q145	G140-S142 VanDerWaalsContact C-N 3.28Å; G140-S142 PolarHBondContact O-N 3.05Å; S142-R144 PolarHBondContact O-N 2.93Å; S142-R144 PolarHBondContact OG-N 3.41Å; S142-Q145 PolarHBondContact O-N 2.98Å; S142-Q145 VanDerWaalsContact O-N 3.17Å
143	T	91.2	Very high	90	Very high	9 Å²	9	26.1 Å²	26.1	6%	0.055	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-2.2	171.9	58.7	0	0	0	0	114.6	F369	T143-F369 HydrophobicContact CG2-CD1 4.38Å
144	R	92	Very high	90.3	Very high	26 Å²	26	27.9 Å²	27.9	10%	0.098	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-8.2	174.4	-59.3	-162.7	-178.6	146	15.2	114.3	L137 S142 F180 V239 C240 N297 A298 Q321	L137-R144 VanDerWaalsContact CD1-O 3.24Å; L137-R144 WeakPolarHBondContact CD1-O 3.42Å; S142-R144 PolarHBondContact O-N 2.93Å; S142-R144 PolarHBondContact OG-N 3.41Å; R144-F180 HydrophobicContact CB-CZ 4.47Å; R144-F180 HydrophobicContact CG-CD1 4.49Å; R144-F180 HydrophobicContact CG-CE1 3.68Å; R144-F180 HydrophobicContact CG-CE2 4.35Å; R144-F180 HydrophobicContact CG-CZ 3.6Å; R144-F180 VanDerWaalsContact NE-CE1 3.3Å; R144-V239 CarbonylContact O-C 3.59Å; R144-V239 WeakPolarHBondContact O-CA 3.36Å; R144-C240 PolarHBondContact O-N 2.91Å; R144-N297 PolarHBondContact NH1-OD1 3.33Å; R144-A298 PolarHBondContact NH1-O 2.79Å; R144-A298 PolarHBondContact NH2-O 3.03Å; R144-Q321 VanDerWaalsContact NH2-OE1 3.15Å
145	Q	94.3	Very high	90.2	Very high	46 Å²	46	30.8 Å²	30.8	22%	0.215	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	123.5	-170.3	-178.8	177.5	5.9	0	0	109	G140 P141 S142 W186 L238 V239	G140-Q145 WeakPolarHBondContact CA-O 3Å; P141-Q145 HydrophobicContact CG-CB 4.2Å; P141-Q145 HydrophobicContact CG-CG 4.12Å; S142-Q145 PolarHBondContact O-N 2.98Å; S142-Q145 VanDerWaalsContact O-N 3.17Å; Q145-W186 HydrophobicContact CG-CD2 3.75Å; Q145-W186 HydrophobicContact CG-CE3 3.52Å; Q145-W186 HydrophobicContact CG-CG 4.34Å; Q145-W186 HydrophobicContact CG-CH2 4.12Å; Q145-W186 HydrophobicContact CG-CZ2 4.35Å; Q145-W186 HydrophobicContact CG-CZ3 3.67Å; Q145-W186 VanDerWaalsContact NE2-NE1 3.15Å; Q145-L238 WeakPolarHBondContact CA-O 3.25Å; Q145-V239 HydrophobicContact CB-CB 4.41Å; Q145-V239 HydrophobicContact CB-CG2 4.13Å; Q145-V239 HydrophobicContact CG-CB 4.06Å; Q145-V239 HydrophobicContact CG-CG2 4.04Å
146	G	94.5	Very high	90.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-177.7	-174.5	0	0	0	0	0	114.8	V138 G237 L238	V138-G146 CarbonylContact O-C 3.5Å; V138-G146 VanDerWaalsContact O-C 3.32Å; V138-G146 WeakPolarHBondContact O-CA 3Å; G146-G237 CarbonylContact O-C 3.45Å; G146-G237 VanDerWaalsContact O-CA 3.26Å; G146-G237 WeakPolarHBondContact O-CA 3.4Å; G146-L238 PolarHBondContact N-O 2.04Å; G146-L238 PolarHBondContact O-N 2.93Å
147	R	93.6	Very high	89.9	Confident	13 Å²	13	31.7 Å²	31.7	5%	0.049	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	129.1	168.2	-168.7	-164.8	-48.5	-131.9	1.8	109.4	L137 V138 D139 Q149 A158 F189 R190 N192 D235	L137-R147 WeakPolarHBondContact CA-O 3.32Å; V138-R147 HydrophobicContact CG2-CB 4.17Å; V138-R147 PolarHBondContact N-O 3.13Å; V138-R147 PolarHBondContact O-N 3.35Å; D139-R147 IonicContact OD2-CZ 3.28Å; D139-R147 IonicContact OD2-NE 3.12Å; D139-R147 PolarHBondContact OD2-NE 3.13Å; D139-R147 IonicContact OD2-NH2 3.79Å; D139-R147 PolarHBondContact OD2-NH2 3.31Å; R147-Q149 PolarHBondContact O-N 3.43Å; R147-A158 HydrophobicContact CG-CB 4.49Å; R147-F189 HydrophobicContact CB-CD1 4.42Å; R147-F189 HydrophobicContact CB-CD2 3.98Å; R147-F189 HydrophobicContact CB-CE2 4.17Å; R147-F189 HydrophobicContact CB-CG 4.09Å; R147-F189 HydrophobicContact CB-CZ 4.43Å; R147-F189 HydrophobicContact CG-CB 4.27Å; R147-F189 HydrophobicContact CG-CD2 4.38Å; R147-F189 HydrophobicContact CG-CG 4.32Å; R147-R190 PolarHBondContact NH1-O 2.94Å; R147-N192 PolarHBondContact NH1-OD1 2.9Å; R147-N192 PolarHBondContact NH2-ND2 3.35Å; R147-N192 PolarHBondContact NH2-OD1 2.76Å; R147-N192 VanDerWaalsContact NH2-OD1 3.16Å; R147-D235 HydrophobicContact CG-CB 3.91Å; R147-D235 IonicContact CZ-OD2 3.37Å; R147-D235 IonicContact NE-OD2 3.34Å; R147-D235 IonicContact NH1-OD2 2.68Å; R147-D235 PolarHBondContact NH1-OD2 2.75Å
148	L	94.1	Very high	89.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	123.9	176.9	-176.2	64	0	0	0	110.6	I135 L137 V159 W166 L236 L238	I135-L148 HydrophobicContact CG2-CD1 3.38Å; I135-L148 HydrophobicContact CG2-CG 4.48Å; L137-L148 HydrophobicContact CD2-CB 4.25Å; L137-L148 HydrophobicContact CD2-CD1 3.9Å; L148-V159 HydrophobicContact CB-CB 4.45Å; L148-V159 HydrophobicContact CB-CG2 4.37Å; L148-V159 HydrophobicContact CD2-CB 4.06Å; L148-V159 HydrophobicContact CD2-CG1 4.36Å; L148-V159 HydrophobicContact CD2-CG2 3.77Å; L148-V159 HydrophobicContact CG-CB 4.31Å; L148-V159 HydrophobicContact CG-CG2 3.8Å; L148-V159 PolarHBondContact O-N 3.35Å; L148-V159 VanDerWaalsContact O-N 3.14Å; L148-W166 HydrophobicContact CD2-CH2 3.83Å; L148-W166 HydrophobicContact CD2-CZ3 3.96Å; L148-L236 WeakPolarHBondContact CB-O 3.05Å; L148-L236 HydrophobicContact CD2-CD2 4.05Å; L148-L236 PolarHBondContact N-O 3.09Å; L148-L238 HydrophobicContact CB-CG 4.5Å; L148-L238 HydrophobicContact CD1-CD1 4.09Å; L148-L238 HydrophobicContact CD2-CD1 4.01Å; L148-L238 HydrophobicContact CG-CD1 4.45Å
149	Q	92.3	Very high	89.8	Confident	13 Å²	13	31.2 Å²	31.2	6%	0.061	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.2	172.7	-71.1	-173.7	-25.4	0	0	111.8	I135 R136 V138 R147 W156 R157	I135-Q149 WeakPolarHBondContact CA-O 3.22Å; R136-Q149 HydrophobicContact CG-CB 4Å; R136-Q149 VanDerWaalsContact CZ-OE1 3.25Å; R136-Q149 PolarHBondContact N-O 3.06Å; R136-Q149 PolarHBondContact O-N 3.35Å; V138-Q149 VanDerWaalsContact CG2-CD 3.47Å; V138-Q149 HydrophobicContact CG2-CG 3.89Å; R147-Q149 PolarHBondContact O-N 3.43Å; Q149-W156 HydrophobicContact CB-CE3 4.06Å; Q149-R157 CarbonylContact C-O 3.4Å; Q149-R157 VanDerWaalsContact CA-O 3.23Å; Q149-R157 WeakPolarHBondContact CA-O 3.35Å
150	V	92	Very high	89.8	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.024	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.2	177.4	-177.3	0	0	0	0	109.6	S134 I135 F152 R157 V159 F198 W218	S134-V150 CarbonylContact O-C 3.44Å; S134-V150 WeakPolarHBondContact O-CA 3.37Å; I135-V150 HydrophobicContact CG1-CG1 4.44Å; I135-V150 HydrophobicContact CG1-CG2 4.26Å; V150-F152 HydrophobicContact CG1-CB 4.47Å; V150-F152 PolarHBondContact O-N 3.08Å; V150-R157 PolarHBondContact N-O 2.91Å; V150-R157 PolarHBondContact O-N 2.96Å; V150-V159 HydrophobicContact CG2-CG2 3.68Å; V150-F198 HydrophobicContact CB-CD2 4.25Å; V150-F198 HydrophobicContact CB-CE2 4.48Å; V150-F198 HydrophobicContact CB-CG 4.39Å; V150-F198 HydrophobicContact CG1-CD2 4.28Å; V150-F198 HydrophobicContact CG1-CE2 4.07Å; V150-F198 HydrophobicContact CG1-CZ 4.44Å; V150-W218 HydrophobicContact CG1-CZ2 4.17Å; V150-W218 HydrophobicContact CG2-CH2 4.02Å; V150-W218 HydrophobicContact CG2-CZ2 3.98Å
151	L	88.8	Confident	89.8	Confident	71 Å²	71	28.5 Å²	28.5	37%	0.372	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	100.2	171.5	-176.8	62.7	0	0	0	108.8	S134 W156	S134-L151 PolarHBondContact O-N 3.26Å; L151-W156 HydrophobicContact CB-CD2 3.97Å; L151-W156 HydrophobicContact CB-CE3 3.77Å; L151-W156 HydrophobicContact CB-CH2 3.75Å; L151-W156 HydrophobicContact CB-CZ2 3.94Å; L151-W156 HydrophobicContact CB-CZ3 3.66Å; L151-W156 HydrophobicContact CD1-CD2 4.09Å; L151-W156 HydrophobicContact CD1-CG 4.23Å; L151-W156 HydrophobicContact CD1-CZ2 4.46Å; L151-W156 HydrophobicContact CD2-CZ2 4.16Å; L151-W156 HydrophobicContact CG-CZ2 4.41Å
152	F	87.6	Confident	89.7	Confident	31 Å²	31	29.7 Å²	29.7	14%	0.136	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.5	-177.8	-169.9	-106.1	0	0	0	111.4	V150 G154 K155 R157 F198 T220 I223 L225	V150-F152 HydrophobicContact CG1-CB 4.47Å; V150-F152 PolarHBondContact O-N 3.08Å; F152-G154 VanDerWaalsContact C-N 3.3Å; F152-G154 PolarHBondContact O-N 3.19Å; F152-K155 PolarHBondContact N-O 3.46Å; F152-K155 PolarHBondContact O-N 3.48Å; F152-R157 PolarHBondContact O-NE 3.33Å; F152-F198 HydrophobicContact CB-CD2 4Å; F152-F198 HydrophobicContact CB-CE2 4.06Å; F152-F198 HydrophobicContact CD1-CD2 4.45Å; F152-F198 HydrophobicContact CD1-CE2 4.39Å; F152-F198 HydrophobicContact CD2-CE2 4.01Å; F152-F198 HydrophobicContact CG-CD2 4.16Å; F152-F198 AromaticContact CG-CE2 3.91Å; F152-F198 HydrophobicContact CG-CE2 3.91Å; F152-T220 HydrophobicContact CE2-CG2 4.02Å; F152-T220 HydrophobicContact CZ-CG2 4.05Å; F152-I223 HydrophobicContact CD1-CG2 4.41Å; F152-I223 HydrophobicContact CD2-CD1 4.42Å; F152-I223 HydrophobicContact CE1-CG2 4.05Å; F152-I223 HydrophobicContact CE2-CD1 3.77Å; F152-I223 HydrophobicContact CZ-CB 4.41Å; F152-I223 HydrophobicContact CZ-CD1 3.93Å; F152-I223 HydrophobicContact CZ-CG2 4.31Å; F152-L225 HydrophobicContact CD1-CD1 3.92Å; F152-L225 HydrophobicContact CD1-CD2 4.08Å; F152-L225 HydrophobicContact CD1-CG 4.48Å; F152-L225 HydrophobicContact CE1-CD1 3.76Å; F152-L225 HydrophobicContact CE1-CD2 4.36Å; F152-L225 HydrophobicContact CE1-CG 4.34Å
153	K	82.8	Confident	89.3	Confident	139 Å²	139	36.2 Å²	36.2	60%	0.604	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	46	-173.1	-62.8	-173.5	177.7	-172.6	0	112.9	K155 L225 D1097	K153-K155 VanDerWaalsContact C-N 3.32Å; K153-K155 PolarHBondContact O-N 3.38Å; K153-L225 HydrophobicContact CD-CD1 4.35Å; K153-D1097 PolarHBondContact NZ-O 3.34Å
154	G	80.8	Confident	88.9	Confident	53 Å²	53	38.5 Å²	38.5	55%	0.546	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	12.5	175.8	0	0	0	0	0	116.1	F152	F152-G154 VanDerWaalsContact C-N 3.3Å; F152-G154 PolarHBondContact O-N 3.19Å
155	K	83.8	Confident	88.4	Confident	92 Å²	92	43.2 Å²	43.2	40%	0.4	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.5	175.2	-66.3	-172.8	179.8	-176.4	0	110.9	F152 K153 R157 W589	F152-K155 PolarHBondContact N-O 3.46Å; F152-K155 PolarHBondContact O-N 3.48Å; K153-K155 VanDerWaalsContact C-N 3.32Å; K153-K155 PolarHBondContact O-N 3.38Å; K155-R157 HydrophobicContact CB-CG 4.5Å; K155-W589 HydrophobicContact CB-CZ2 4.33Å
156	W	88.4	Confident	88.4	Confident	11 Å²	11	41.5 Å²	41.5	4%	0.042	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	134	165.5	-70.3	107.9	0	0	0	109.2	R136 Q149 L151 W589	R136-W156 HydrophobicContact CB-CH2 4.35Å; R136-W156 HydrophobicContact CB-CZ3 4.22Å; R136-W156 HydrophobicContact CG-CE3 3.97Å; R136-W156 HydrophobicContact CG-CH2 4.02Å; R136-W156 HydrophobicContact CG-CZ3 3.59Å; R136-W156 VanDerWaalsContact CZ-CD2 3.49Å; R136-W156 VanDerWaalsContact NH1-CE2 3.29Å; Q149-W156 HydrophobicContact CB-CE3 4.06Å; L151-W156 HydrophobicContact CB-CD2 3.97Å; L151-W156 HydrophobicContact CB-CE3 3.77Å; L151-W156 HydrophobicContact CB-CH2 3.75Å; L151-W156 HydrophobicContact CB-CZ2 3.94Å; L151-W156 HydrophobicContact CB-CZ3 3.66Å; L151-W156 HydrophobicContact CD1-CD2 4.09Å; L151-W156 HydrophobicContact CD1-CG 4.23Å; L151-W156 HydrophobicContact CD1-CZ2 4.46Å; L151-W156 HydrophobicContact CD2-CZ2 4.16Å; L151-W156 HydrophobicContact CG-CZ2 4.41Å; W156-W589 HydrophobicContact CB-CH2 4.11Å; W156-W589 HydrophobicContact CB-CZ2 3.98Å; W156-W589 WeakPolarHBondContact O-CH2 3.44Å; W156-W589 WeakPolarHBondContact O-CZ2 3.4Å
157	R	89	Confident	88.3	Confident	12 Å²	12	44.5 Å²	44.5	5%	0.045	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	131.4	-175.7	-63	174.2	-174.7	-91.1	3.2	109.3	Q149 V150 F152 K155 M196 F198	Q149-R157 CarbonylContact C-O 3.4Å; Q149-R157 VanDerWaalsContact CA-O 3.23Å; Q149-R157 WeakPolarHBondContact CA-O 3.35Å; V150-R157 PolarHBondContact N-O 2.91Å; V150-R157 PolarHBondContact O-N 2.96Å; F152-R157 PolarHBondContact O-NE 3.33Å; K155-R157 HydrophobicContact CB-CG 4.5Å; R157-M196 PolarHBondContact NH1-O 3.18Å; R157-M196 VanDerWaalsContact NH1-O 3.13Å; R157-F198 HydrophobicContact CB-CB 3.84Å
158	A	91	Very high	88.3	Confident	10 Å²	10	47.8 Å²	47.8	8%	0.083	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	143.4	172.5	0	0	0	0	0	110.4	R147 F198 D235	R147-A158 HydrophobicContact CG-CB 4.49Å; A158-F198 PolarHBondContact O-N 3.18Å; A158-D235 HydrophobicContact CB-CB 4.06Å; A158-D235 VanDerWaalsContact CB-CG 3.43Å; A158-D235 VanDerWaalsContact CB-OD2 3.3Å; A158-D235 WeakPolarHBondContact CB-OD2 3.05Å
159	V	92	Very high	88.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	122.9	-178.6	179.4	0	0	0	0	110.4	L148 V150 W166 F198 M200 L236	L148-V159 HydrophobicContact CB-CB 4.45Å; L148-V159 HydrophobicContact CB-CG2 4.37Å; L148-V159 HydrophobicContact CD2-CB 4.06Å; L148-V159 HydrophobicContact CD2-CG1 4.36Å; L148-V159 HydrophobicContact CD2-CG2 3.77Å; L148-V159 HydrophobicContact CG-CB 4.31Å; L148-V159 HydrophobicContact CG-CG2 3.8Å; L148-V159 PolarHBondContact O-N 3.35Å; L148-V159 VanDerWaalsContact O-N 3.14Å; V150-V159 HydrophobicContact CG2-CG2 3.68Å; V159-W166 HydrophobicContact CG1-CH2 4.09Å; V159-W166 HydrophobicContact CG1-CZ2 3.61Å; V159-F198 WeakPolarHBondContact CA-O 3.15Å; V159-F198 HydrophobicContact CG2-CB 4.35Å; V159-F198 HydrophobicContact CG2-CD1 4.13Å; V159-M200 HydrophobicContact CG1-CB 4.42Å; V159-L236 PolarHBondContact O-N 3.12Å
160	C	89.9	Confident	88.4	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	142.8	169.9	172.7	0	0	0	0	110.4	M162 P197 F198 V199 M200 C230 E233	C160-M162 PolarHBondContact SG-N 3.49Å; C160-M162 VanDerWaalsContact SG-N 3.35Å; C160-P197 HydrophobicContact CB-CB 4.11Å; C160-F198 PolarHBondContact N-O 2.93Å; C160-V199 WeakPolarHBondContact O-CA 3.27Å; C160-M200 PolarHBondContact O-N 2.04Å; C160-C230 HydrophobicContact CB-CB 3.78Å; C160-C230 WeakPolarHBondContact CB-SG 3.47Å; C160-C230 WeakPolarHBondContact SG-CB 3.33Å; C160-C230 CovalentContact SG-SG 2.01Å; C160-C230 PolarHBondContact SG-SG 2.85Å; C160-E233 PolarHBondContact SG-OE2 2.71Å
161	T	89.1	Confident	88.5	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.012	27%	0.265	C	S	.	.			trans	-105.4	3.7	-177.1	72	0	0	0	0	115.1	M163 T164 W166 W188 P201 L236	T161-M163 PolarHBondContact O-N 2.84Å; T161-T164 WeakPolarHBondContact CB-O 3.46Å; T161-T164 WeakPolarHBondContact O-CB 3.15Å; T161-T164 PolarHBondContact O-N 3.29Å; T161-T164 VanDerWaalsContact O-N 3.09Å; T161-T164 PolarHBondContact O-OG1 3.17Å; T161-T164 PolarHBondContact OG1-O 3.47Å; T161-W166 HydrophobicContact CG2-CG 4.4Å; T161-W188 HydrophobicContact CG2-CH2 4.13Å; T161-W188 HydrophobicContact CG2-CZ3 4.3Å; T161-P201 WeakPolarHBondContact O-CA 3.38Å; T161-L236 HydrophobicContact CG2-CB 4.4Å; T161-L236 HydrophobicContact CG2-CD2 4.29Å
162	M	85.6	Confident	88.7	Confident	71 Å²	71	48.7 Å²	48.7	35%	0.35	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	50.5	-175.5	-84.2	-177.4	129	0	0	112.4	C160 T164 V199 P201 M224 L229 E233	C160-M162 PolarHBondContact SG-N 3.49Å; C160-M162 VanDerWaalsContact SG-N 3.35Å; M162-T164 PolarHBondContact O-N 2.95Å; M162-V199 HydrophobicContact CG-CG1 3.66Å; M162-V199 HydrophobicContact SD-CG1 3.76Å; M162-P201 HydrophobicContact CB-CG 4.12Å; M162-P201 HydrophobicContact SD-CG 4.22Å; M162-M224 HydrophobicContact SD-CE 3.78Å; M162-L229 HydrophobicContact CE-CD2 3.92Å; M162-E233 WeakPolarHBondContact CA-OE2 3.17Å; M162-E233 PolarHBondContact N-OE2 2.87Å
163	M	82.6	Confident	89	Confident	158 Å²	158	47.2 Å²	47.2	78%	0.778	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	17.2	-177.2	-57.3	-70.4	-84.4	0	0	115	T161 E233	T161-M163 PolarHBondContact O-N 2.84Å; M163-E233 HydrophobicContact CG-CG 4.11Å; M163-E233 PolarHBondContact N-OE2 2.82Å; M163-E233 HydrophobicContact SD-CG 4Å
164	T	83.2	Confident	89.5	Confident	56 Å²	56	40.6 Å²	40.6	34%	0.344	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-101.5	140.1	174.3	65.8	0	0	0	0	111.3	T161 M162 P201	T161-T164 WeakPolarHBondContact CB-O 3.46Å; T161-T164 WeakPolarHBondContact O-CB 3.15Å; T161-T164 PolarHBondContact O-N 3.29Å; T161-T164 VanDerWaalsContact O-N 3.09Å; T161-T164 PolarHBondContact O-OG1 3.17Å; T161-T164 PolarHBondContact OG1-O 3.47Å; M162-T164 PolarHBondContact O-N 2.95Å; T164-P201 HydrophobicContact CG2-CB 4.28Å; T164-P201 VanDerWaalsContact OG1-C 3.26Å; T164-P201 WeakPolarHBondContact OG1-CA 3.49Å; T164-P201 WeakPolarHBondContact OG1-CB 3.31Å; T164-P201 PolarHBondContact OG1-O 3.25Å
165	N	82.1	Confident	90.1	Very high	126 Å²	126	38.1 Å²	38.1	67%	0.674	20%	0.199	S	C	*	.	P	Polyproline II helix	trans	-85.1	126.9	177.1	-72.9	-22	0	0	0	110
166	W	92.9	Very high	90.5	Very high	9 Å²	9	37 Å²	37	3%	0.034	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-64.4	149.3	164.7	-78.1	26.1	0	0	0	109.9	L148 V159 T161 D170 Y171 A174 M200 P201 P203 W218 L236	L148-W166 HydrophobicContact CD2-CH2 3.83Å; L148-W166 HydrophobicContact CD2-CZ3 3.96Å; V159-W166 HydrophobicContact CG1-CH2 4.09Å; V159-W166 HydrophobicContact CG1-CZ2 3.61Å; T161-W166 HydrophobicContact CG2-CG 4.4Å; W166-D170 HydrophobicContact CB-CB 4.1Å; W166-D170 HydrophobicContact CD2-CB 4.21Å; W166-D170 HydrophobicContact CE3-CB 3.81Å; W166-D170 HydrophobicContact CG-CB 4.37Å; W166-Y171 HydrophobicContact CB-CD1 4.06Å; W166-Y171 HydrophobicContact CB-CE1 3.36Å; W166-Y171 HydrophobicContact CB-CE2 4.38Å; W166-Y171 HydrophobicContact CD2-CE1 4.4Å; W166-Y171 HydrophobicContact CE3-CD1 4.07Å; W166-Y171 HydrophobicContact CE3-CE1 4.17Å; W166-Y171 HydrophobicContact CG-CE1 4.16Å; W166-Y171 WeakPolarHBondContact O-CE2 3.47Å; W166-Y171 PolarHBondContact O-OH 2.88Å; W166-A174 HydrophobicContact CZ3-CB 4.44Å; W166-M200 HydrophobicContact CZ2-CB 4.12Å; W166-M200 HydrophobicContact CZ2-CG 3.89Å; W166-M200 PolarHBondContact NE1-O 2.96Å; W166-P201 VanDerWaalsContact CD1-O 3.3Å; W166-P201 PolarHBondContact NE1-O 2.99Å; W166-P203 HydrophobicContact CD2-CG 3.72Å; W166-P203 VanDerWaalsContact CE2-CG 3.41Å; W166-P203 HydrophobicContact CE3-CG 3.99Å; W166-P203 HydrophobicContact CG-CG 4.38Å; W166-P203 HydrophobicContact CH2-CG 3.75Å; W166-P203 HydrophobicContact CZ2-CG 3.44Å; W166-P203 VanDerWaalsContact CZ2-CG 3.44Å; W166-P203 HydrophobicContact CZ3-CG 4Å; W166-W218 HydrophobicContact CH2-CH2 4.32Å; W166-W218 AromaticContact CH2-CZ3 3.9Å; W166-W218 HydrophobicContact CH2-CZ3 3.9Å; W166-W218 HydrophobicContact CZ2-CZ3 4.27Å; W166-L236 HydrophobicContact CD2-CD2 3.72Å; W166-L236 HydrophobicContact CE3-CD2 3.73Å; W166-L236 HydrophobicContact CG-CD2 4.26Å; W166-L236 HydrophobicContact CH2-CD2 4.26Å; W166-L236 HydrophobicContact CZ2-CD2 4.25Å; W166-L236 HydrophobicContact CZ3-CD2 4.02Å
167	T	92.7	Very high	90.6	Very high	63 Å²	63	37.6 Å²	37.6	39%	0.387	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-79.7	162.3	177.5	68.2	0	0	0	0	110.8	V169 D170 Y171	T167-V169 PolarHBondContact O-N 2.9Å; T167-V169 PolarHBondContact OG1-N 3.45Å; T167-D170 WeakPolarHBondContact CB-OD2 3.34Å; T167-D170 PolarHBondContact N-OD2 3.44Å; T167-D170 WeakPolarHBondContact O-CB 3.38Å; T167-D170 PolarHBondContact O-N 3.36Å; T167-D170 PolarHBondContact OG1-N 3.16Å; T167-D170 PolarHBondContact OG1-OD2 3.05Å; T167-Y171 VanDerWaalsContact O-CD2 3.31Å; T167-Y171 WeakPolarHBondContact O-CD2 3.5Å; T167-Y171 PolarHBondContact O-N 2.92Å
168	S	92.9	Very high	90.7	Very high	82 Å²	82	37.3 Å²	37.3	57%	0.573	20%	0.196	S	C	*	.	H	α-helix	trans	-57	-29.7	172.7	58.6	0	0	0	0	112.9	R172	S168-R172 PolarHBondContact O-N 2.79Å; S168-R172 VanDerWaalsContact O-N 3.11Å
169	V	94.4	Very high	90.6	Very high	14 Å²	14	37.1 Å²	37.1	9%	0.085	20%	0.195	C	C	.	.	H	α-helix	trans	-68.6	-42.1	175.7	-173.2	0	0	0	0	111	T167 Y171 R172 V173 C205 Y207	T167-V169 PolarHBondContact O-N 2.9Å; T167-V169 PolarHBondContact OG1-N 3.45Å; V169-Y171 VanDerWaalsContact C-N 3.34Å; V169-Y171 PolarHBondContact O-N 3.35Å; V169-R172 PolarHBondContact O-N 2.87Å; V169-V173 HydrophobicContact CG1-CG2 4.41Å; V169-V173 WeakPolarHBondContact O-CG2 3.43Å; V169-V173 PolarHBondContact O-N 3.01Å; V169-C205 HydrophobicContact CG1-CB 4.31Å; V169-Y207 HydrophobicContact CG1-CD1 4.45Å; V169-Y207 HydrophobicContact CG1-CG 4.4Å; V169-Y207 HydrophobicContact CG2-CD1 4.22Å; V169-Y207 HydrophobicContact CG2-CD2 4.17Å; V169-Y207 HydrophobicContact CG2-CE1 3.68Å; V169-Y207 HydrophobicContact CG2-CE2 3.6Å; V169-Y207 HydrophobicContact CG2-CG 4.45Å
170	D	94.6	Very high	90.5	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-41.9	178.4	-57	-53.5	0	0	0	110.8	W166 T167 V173 A174 P203 G204 C205	W166-D170 HydrophobicContact CB-CB 4.1Å; W166-D170 HydrophobicContact CD2-CB 4.21Å; W166-D170 HydrophobicContact CE3-CB 3.81Å; W166-D170 HydrophobicContact CG-CB 4.37Å; T167-D170 WeakPolarHBondContact CB-OD2 3.34Å; T167-D170 PolarHBondContact N-OD2 3.44Å; T167-D170 WeakPolarHBondContact O-CB 3.38Å; T167-D170 PolarHBondContact O-N 3.36Å; T167-D170 PolarHBondContact OG1-N 3.16Å; T167-D170 PolarHBondContact OG1-OD2 3.05Å; D170-V173 PolarHBondContact O-N 2.81Å; D170-A174 WeakPolarHBondContact O-CB 3.22Å; D170-A174 PolarHBondContact O-N 2.97Å; D170-P203 HydrophobicContact CB-CG 4.25Å; D170-G204 PolarHBondContact OD1-N 3.04Å; D170-C205 VanDerWaalsContact OD1-CB 3.26Å; D170-C205 WeakPolarHBondContact OD1-CB 3.45Å; D170-C205 PolarHBondContact OD1-N 2.83Å; D170-C205 PolarHBondContact OD1-SG 3.08Å; D170-C205 VanDerWaalsContact OD1-SG 3.38Å
171	Y	94.4	Very high	90.5	Very high	22 Å²	22	41.1 Å²	41.1	9%	0.086	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-44.8	175.7	-57.6	-44.1	0	0	0	112.6	W166 T167 V169 A174 C175 F185 L236 L238	W166-Y171 HydrophobicContact CB-CD1 4.06Å; W166-Y171 HydrophobicContact CB-CE1 3.36Å; W166-Y171 HydrophobicContact CB-CE2 4.38Å; W166-Y171 HydrophobicContact CD2-CE1 4.4Å; W166-Y171 HydrophobicContact CE3-CD1 4.07Å; W166-Y171 HydrophobicContact CE3-CE1 4.17Å; W166-Y171 HydrophobicContact CG-CE1 4.16Å; W166-Y171 WeakPolarHBondContact O-CE2 3.47Å; W166-Y171 PolarHBondContact O-OH 2.88Å; T167-Y171 VanDerWaalsContact O-CD2 3.31Å; T167-Y171 WeakPolarHBondContact O-CD2 3.5Å; T167-Y171 PolarHBondContact O-N 2.92Å; V169-Y171 VanDerWaalsContact C-N 3.34Å; V169-Y171 PolarHBondContact O-N 3.35Å; Y171-A174 WeakPolarHBondContact O-CB 3.32Å; Y171-A174 PolarHBondContact O-N 2.87Å; Y171-C175 PolarHBondContact O-N 3.23Å; Y171-F185 HydrophobicContact CD2-CB 4.35Å; Y171-F185 HydrophobicContact CE1-CB 4.41Å; Y171-F185 HydrophobicContact CE2-CB 3.83Å; Y171-L236 HydrophobicContact CE1-CD1 3.94Å; Y171-L236 HydrophobicContact CE1-CD2 4.1Å; Y171-L238 HydrophobicContact CD1-CD2 3.33Å; Y171-L238 HydrophobicContact CE1-CD2 3.74Å; Y171-L238 HydrophobicContact CG-CD2 4.14Å
172	R	93.8	Very high	90.7	Very high	69 Å²	69	42.4 Å²	42.4	26%	0.26	22%	0.222	S	C	.	.	H	α-helix	trans	-58.3	-50	175.9	174.1	178.8	-69	-172.8	-5.5	111.7	S168 V169 A174 C175 R176 D182	S168-R172 PolarHBondContact O-N 2.79Å; S168-R172 VanDerWaalsContact O-N 3.11Å; V169-R172 PolarHBondContact O-N 2.87Å; R172-A174 VanDerWaalsContact C-N 3.29Å; R172-A174 PolarHBondContact O-N 2.71Å; R172-C175 PolarHBondContact O-N 3.38Å; R172-R176 WeakPolarHBondContact O-CG 3.27Å; R172-R176 PolarHBondContact O-N 3.17Å; R172-D182 WeakPolarHBondContact CB-OD1 3.37Å; R172-D182 VanDerWaalsContact CG-OD1 3.27Å; R172-D182 WeakPolarHBondContact CG-OD1 3.14Å; R172-D182 IonicContact CZ-OD1 3.66Å; R172-D182 IonicContact CZ-OD2 3.48Å; R172-D182 IonicContact NE-OD1 2.83Å; R172-D182 PolarHBondContact NE-OD1 2.75Å; R172-D182 IonicContact NE-OD2 3.42Å; R172-D182 PolarHBondContact NE-OD2 2.95Å; R172-D182 IonicContact NH2-OD1 3.63Å; R172-D182 IonicContact NH2-OD2 2.78Å; R172-D182 PolarHBondContact NH2-OD2 3.4Å
173	V	93.9	Very high	91.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65	-35.7	-178.7	175.4	0	0	0	0	111.1	V169 D170 R176 T177 C205 H209 L212	V169-V173 HydrophobicContact CG1-CG2 4.41Å; V169-V173 WeakPolarHBondContact O-CG2 3.43Å; V169-V173 PolarHBondContact O-N 3.01Å; D170-V173 PolarHBondContact O-N 2.81Å; V173-R176 PolarHBondContact O-N 3.34Å; V173-T177 PolarHBondContact O-N 3.37Å; V173-T177 PolarHBondContact O-OG1 3.09Å; V173-C205 HydrophobicContact CB-CB 4.18Å; V173-C205 HydrophobicContact CG1-CB 4.46Å; V173-C205 HydrophobicContact CG2-CB 3.99Å; V173-H209 HydrophobicContact CG1-CB 4.23Å; V173-H209 HydrophobicContact CG2-CB 4.22Å; V173-L212 HydrophobicContact CG1-CD2 4.4Å; V173-L212 HydrophobicContact CG1-CG 4.32Å
174	A	93.6	Very high	91.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-45.7	172.2	0	0	0	0	0	112.3	W166 D170 Y171 R172 T177 M178 L212 L238	W166-A174 HydrophobicContact CZ3-CB 4.44Å; D170-A174 WeakPolarHBondContact O-CB 3.22Å; D170-A174 PolarHBondContact O-N 2.97Å; Y171-A174 WeakPolarHBondContact O-CB 3.32Å; Y171-A174 PolarHBondContact O-N 2.87Å; R172-A174 VanDerWaalsContact C-N 3.29Å; R172-A174 PolarHBondContact O-N 2.71Å; A174-T177 WeakPolarHBondContact O-CB 3.33Å; A174-T177 PolarHBondContact O-N 2.7Å; A174-M178 WeakPolarHBondContact O-CE 3.33Å; A174-M178 PolarHBondContact O-N 3.44Å; A174-L212 HydrophobicContact CB-CD1 3.66Å; A174-L212 HydrophobicContact CB-CG 4.26Å; A174-L238 HydrophobicContact CB-CD1 3.84Å
175	C	93.3	Very high	92.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-37.2	176.6	-74.5	0	0	0	0	113.1	Y171 R172 T177 M178 G179 F180 C240	Y171-C175 PolarHBondContact O-N 3.23Å; R172-C175 PolarHBondContact O-N 3.38Å; C175-T177 VanDerWaalsContact C-N 3.34Å; C175-T177 PolarHBondContact O-N 3.11Å; C175-M178 PolarHBondContact O-N 3.02Å; C175-M178 VanDerWaalsContact O-N 3.08Å; C175-G179 PolarHBondContact O-N 2.87Å; C175-F180 CarbonylContact C-O 3.55Å; C175-F180 HydrophobicContact CB-CB 4.28Å; C175-F180 PolarHBondContact O-N 2.62Å; C175-C240 VanDerWaalsContact CA-SG 3.55Å; C175-C240 HydrophobicContact CB-CB 3.7Å; C175-C240 WeakPolarHBondContact CB-SG 3.22Å; C175-C240 VanDerWaalsContact SG-CA 3.52Å; C175-C240 WeakPolarHBondContact SG-CB 3.07Å; C175-C240 CovalentContact SG-SG 2.04Å; C175-C240 PolarHBondContact SG-SG 2.88Å
176	R	91.5	Very high	92.8	Very high	69 Å²	69	31.4 Å²	31.4	26%	0.26	16%	0.16	S	C	.	.	H	α-helix	trans	-61.7	-39	173.1	-74	178.4	173.2	-169.4	-10.2	113.5	R172 V173 M178 G179 F180 D181 Y207 G210	R172-R176 WeakPolarHBondContact O-CG 3.27Å; R172-R176 PolarHBondContact O-N 3.17Å; V173-R176 PolarHBondContact O-N 3.34Å; R176-M178 PolarHBondContact O-N 2.98Å; R176-G179 PolarHBondContact O-N 2.85Å; R176-F180 WeakPolarHBondContact CA-O 3.42Å; R176-F180 VanDerWaalsContact CG-O 3.31Å; R176-F180 WeakPolarHBondContact CG-O 3.49Å; R176-F180 PolarHBondContact N-O 3.08Å; R176-D181 WeakPolarHBondContact CG-O 3.45Å; R176-D181 PolarHBondContact NE-O 2.86Å; R176-D181 IonicContact NH2-OD1 3.33Å; R176-Y207 PolarHBondContact NH1-O 2.99Å; R176-G210 CarbonylContact C-O 3.58Å; R176-G210 WeakPolarHBondContact CB-O 3.02Å
177	T	90.7	Very high	92.8	Very high	24 Å²	24	35 Å²	35	15%	0.147	18%	0.176	C	C	.	.	H	α-helix	trans	-58	-31.8	174.1	-50.3	0	0	0	0	111.8	I135 V173 A174 C175 D211 L212	I135-T177 HydrophobicContact CD1-CG2 3.84Å; I135-T177 HydrophobicContact CG1-CG2 4.33Å; V173-T177 PolarHBondContact O-N 3.37Å; V173-T177 PolarHBondContact O-OG1 3.09Å; A174-T177 WeakPolarHBondContact O-CB 3.33Å; A174-T177 PolarHBondContact O-N 2.7Å; C175-T177 VanDerWaalsContact C-N 3.34Å; C175-T177 PolarHBondContact O-N 3.11Å; T177-D211 VanDerWaalsContact CG2-OD1 3.25Å; T177-D211 WeakPolarHBondContact CG2-OD1 3.23Å; T177-D211 WeakPolarHBondContact OG1-CA 2.97Å; T177-L212 PolarHBondContact OG1-N 2.98Å
178	M	90.2	Very high	92.8	Very high	6 Å²	6	36.3 Å²	36.3	3%	0.03	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.7	178.2	-64.7	-177.6	-73.7	0	0	113.9	I135 L137 A174 C175 R176 F180 C240 R344	I135-M178 HydrophobicContact CB-CG 4.38Å; I135-M178 HydrophobicContact CG2-CG 4.31Å; I135-M178 HydrophobicContact CG2-SD 4.13Å; L137-M178 HydrophobicContact CD1-CE 3.9Å; L137-M178 HydrophobicContact CD1-SD 4.43Å; L137-M178 HydrophobicContact CD2-CE 4.05Å; L137-M178 HydrophobicContact CD2-SD 4.39Å; L137-M178 HydrophobicContact CG-CE 3.77Å; L137-M178 HydrophobicContact CG-SD 3.83Å; A174-M178 WeakPolarHBondContact O-CE 3.33Å; A174-M178 PolarHBondContact O-N 3.44Å; C175-M178 PolarHBondContact O-N 3.02Å; C175-M178 VanDerWaalsContact O-N 3.08Å; R176-M178 PolarHBondContact O-N 2.98Å; M178-F180 HydrophobicContact CB-CD2 3.89Å; M178-F180 HydrophobicContact CB-CE2 3.86Å; M178-C240 VanDerWaalsContact CE-SG 3.58Å; M178-R344 PolarHBondContact O-NH2 2.77Å
179	G	88.6	Confident	92.6	Very high	5 Å²	5	33.3 Å²	33.3	5%	0.052	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	25.2	178.6	0	0	0	0	0	115.3	C175 R176 T245	C175-G179 PolarHBondContact O-N 2.87Å; R176-G179 PolarHBondContact O-N 2.85Å; G179-T245 WeakPolarHBondContact CA-OG1 3.38Å; G179-T245 PolarHBondContact O-N 3.01Å; G179-T245 PolarHBondContact O-OG1 3.23Å
180	F	90.1	Very high	92.2	Very high	25 Å²	25	42.8 Å²	42.8	11%	0.11	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	148.8	172.6	-53.7	-67.9	0	0	0	110.7	R144 C175 R176 M178 C240 T245	R144-F180 HydrophobicContact CB-CZ 4.47Å; R144-F180 HydrophobicContact CG-CD1 4.49Å; R144-F180 HydrophobicContact CG-CE1 3.68Å; R144-F180 HydrophobicContact CG-CE2 4.35Å; R144-F180 HydrophobicContact CG-CZ 3.6Å; R144-F180 VanDerWaalsContact NE-CE1 3.3Å; C175-F180 CarbonylContact C-O 3.55Å; C175-F180 HydrophobicContact CB-CB 4.28Å; C175-F180 PolarHBondContact O-N 2.62Å; R176-F180 WeakPolarHBondContact CA-O 3.42Å; R176-F180 VanDerWaalsContact CG-O 3.31Å; R176-F180 WeakPolarHBondContact CG-O 3.49Å; R176-F180 PolarHBondContact N-O 3.08Å; M178-F180 HydrophobicContact CB-CD2 3.89Å; M178-F180 HydrophobicContact CB-CE2 3.86Å; F180-C240 HydrophobicContact CB-CB 3.8Å; F180-C240 HydrophobicContact CD2-CB 3.45Å; F180-C240 VanDerWaalsContact CD2-CB 3.45Å; F180-C240 HydrophobicContact CE2-CB 4.19Å; F180-C240 HydrophobicContact CG-CB 3.64Å; F180-T245 PolarHBondContact N-OG1 3.27Å; F180-T245 PolarHBondContact O-OG1 3.33Å
181	D	90.4	Very high	91.3	Very high	60 Å²	60	44.8 Å²	44.8	32%	0.321	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	-43.9	-178.5	179.6	46.8	0	0	0	113.5	R176 P243 T245	R176-D181 WeakPolarHBondContact CG-O 3.45Å; R176-D181 PolarHBondContact NE-O 2.86Å; R176-D181 IonicContact NH2-OD1 3.33Å; D181-P243 HydrophobicContact CB-CG 4.1Å; D181-P243 PolarHBondContact N-O 3.44Å; D181-T245 HydrophobicContact CB-CG2 3.9Å
182	D	92.6	Very high	90	Very high	29 Å²	29	47 Å²	47	16%	0.155	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	171.2	-176.2	-150.2	-2.3	0	0	0	112.7	R172 C240 W241	R172-D182 WeakPolarHBondContact CB-OD1 3.37Å; R172-D182 VanDerWaalsContact CG-OD1 3.27Å; R172-D182 WeakPolarHBondContact CG-OD1 3.14Å; R172-D182 IonicContact CZ-OD1 3.66Å; R172-D182 IonicContact CZ-OD2 3.48Å; R172-D182 IonicContact NE-OD1 2.83Å; R172-D182 PolarHBondContact NE-OD1 2.75Å; R172-D182 IonicContact NE-OD2 3.42Å; R172-D182 PolarHBondContact NE-OD2 2.95Å; R172-D182 IonicContact NH2-OD1 3.63Å; R172-D182 IonicContact NH2-OD2 2.78Å; R172-D182 PolarHBondContact NH2-OD2 3.4Å; D182-C240 WeakPolarHBondContact O-CA 3.23Å; D182-W241 PolarHBondContact N-O 2.93Å; D182-W241 VanDerWaalsContact N-O 3.13Å; D182-W241 PolarHBondContact O-N 2.85Å
183	G	93.7	Very high	88.2	Confident	6 Å²	6	51.6 Å²	51.6	6%	0.062	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.2	-177.8	173.5	0	0	0	0	0	114.3	V239	G183-V239 CarbonylContact C-O 3.58Å; G183-V239 WeakPolarHBondContact CA-O 3.36Å
184	G	95.1	Very high	86.1	Confident	12 Å²	12	54.5 Å²	54.5	12%	0.124	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	175.2	-173.5	0	0	0	0	0	113.8	L238 V239 W241	G184-L238 WeakPolarHBondContact O-CA 3.08Å; G184-V239 PolarHBondContact N-O 3.32Å; G184-V239 PolarHBondContact O-N 3.33Å; G184-W241 VanDerWaalsContact N-CZ3 3.34Å
185	F	95.1	Very high	84.5	Confident	81 Å²	81	56.7 Å²	56.7	36%	0.355	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	137.4	170.6	174.5	-101.4	0	0	0	110.7	Y171 W188 L236	Y171-F185 HydrophobicContact CD2-CB 4.35Å; Y171-F185 HydrophobicContact CE1-CB 4.41Å; Y171-F185 HydrophobicContact CE2-CB 3.83Å; F185-W188 AromaticContact CE2-CD2 3.88Å; F185-W188 HydrophobicContact CE2-CD2 3.88Å; F185-W188 AromaticContact CE2-CE2 3.7Å; F185-W188 HydrophobicContact CE2-CE3 4.43Å; F185-W188 HydrophobicContact CE2-CG 4.18Å; F185-W188 HydrophobicContact CE2-CZ2 4.09Å; F185-W188 AromaticContact CE2-NE1 3.88Å; F185-W188 AromaticContact CZ-CD1 3.65Å; F185-W188 HydrophobicContact CZ-CD2 4.14Å; F185-W188 AromaticContact CZ-CE2 3.89Å; F185-W188 AromaticContact CZ-CG 3.99Å; F185-W188 HydrophobicContact CZ-CG 3.99Å; F185-W188 AromaticContact CZ-NE1 3.56Å; F185-L236 HydrophobicContact CD2-CD1 3.75Å; F185-L236 HydrophobicContact CE2-CD1 4.09Å
186	W	94.1	Very high	83.7	Confident	80 Å²	80	57.4 Å²	57.4	30%	0.303	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-62.8	173.5	177.8	36.5	0	0	0	112.1	Q145 F189 G237 V239	Q145-W186 HydrophobicContact CG-CD2 3.75Å; Q145-W186 HydrophobicContact CG-CE3 3.52Å; Q145-W186 HydrophobicContact CG-CG 4.34Å; Q145-W186 HydrophobicContact CG-CH2 4.12Å; Q145-W186 HydrophobicContact CG-CZ2 4.35Å; Q145-W186 HydrophobicContact CG-CZ3 3.67Å; Q145-W186 VanDerWaalsContact NE2-NE1 3.15Å; W186-F189 AromaticContact CE3-CE2 3.87Å; W186-F189 HydrophobicContact CE3-CE2 3.87Å; W186-F189 AromaticContact CE3-CZ 3.88Å; W186-F189 HydrophobicContact CE3-CZ 3.88Å; W186-F189 HydrophobicContact CH2-CZ 4.26Å; W186-F189 AromaticContact CZ3-CE2 3.95Å; W186-F189 HydrophobicContact CZ3-CE2 3.95Å; W186-F189 AromaticContact CZ3-CZ 3.45Å; W186-F189 HydrophobicContact CZ3-CZ 3.45Å; W186-F189 VanDerWaalsContact CZ3-CZ 3.45Å; W186-G237 PolarHBondContact N-O 3.06Å; W186-V239 HydrophobicContact CB-CB 4.15Å; W186-V239 HydrophobicContact CB-CG1 4.06Å
187	K	93.6	Very high	83.4	Confident	84 Å²	84	54.1 Å²	54.1	37%	0.365	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	163.8	-179.9	67.6	-180	-176.7	-179.7	0	110.9	F189 G237	K187-F189 HydrophobicContact CD-CE2 4.42Å; K187-F189 HydrophobicContact CD-CZ 4.43Å; K187-F189 VanDerWaalsContact CE-CE1 3.46Å; K187-F189 HydrophobicContact CG-CD2 4.15Å; K187-F189 HydrophobicContact CG-CE2 3.85Å; K187-F189 HydrophobicContact CG-CZ 4.33Å; K187-G237 WeakPolarHBondContact O-CA 3.34Å; K187-G237 PolarHBondContact O-N 2.7Å
188	W	92.1	Very high	83.3	Confident	92 Å²	92	53 Å²	53	35%	0.348	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	137	166.2	-64.6	114.5	0	0	0	110.3	T161 F185 D234 L236	T161-W188 HydrophobicContact CG2-CH2 4.13Å; T161-W188 HydrophobicContact CG2-CZ3 4.3Å; F185-W188 AromaticContact CE2-CD2 3.88Å; F185-W188 HydrophobicContact CE2-CD2 3.88Å; F185-W188 AromaticContact CE2-CE2 3.7Å; F185-W188 HydrophobicContact CE2-CE3 4.43Å; F185-W188 HydrophobicContact CE2-CG 4.18Å; F185-W188 HydrophobicContact CE2-CZ2 4.09Å; F185-W188 AromaticContact CE2-NE1 3.88Å; F185-W188 AromaticContact CZ-CD1 3.65Å; F185-W188 HydrophobicContact CZ-CD2 4.14Å; F185-W188 AromaticContact CZ-CE2 3.89Å; F185-W188 AromaticContact CZ-CG 3.99Å; F185-W188 HydrophobicContact CZ-CG 3.99Å; F185-W188 AromaticContact CZ-NE1 3.56Å; W188-D234 HydrophobicContact CB-CB 3.73Å; W188-D234 HydrophobicContact CE3-CB 4.44Å; W188-D234 HydrophobicContact CG-CB 4.45Å; W188-L236 HydrophobicContact CH2-CD1 4.12Å; W188-L236 HydrophobicContact CZ3-CB 4.09Å; W188-L236 HydrophobicContact CZ3-CD1 4Å
189	F	88.8	Confident	83.3	Confident	18 Å²	18	52.7 Å²	52.7	8%	0.079	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.2	177.2	-82	-92.8	0	0	0	110	D139 R147 W186 K187 R191 D234 D235	D139-F189 HydrophobicContact CB-CD1 4.48Å; D139-F189 HydrophobicContact CB-CE1 3.94Å; R147-F189 HydrophobicContact CB-CD1 4.42Å; R147-F189 HydrophobicContact CB-CD2 3.98Å; R147-F189 HydrophobicContact CB-CE2 4.17Å; R147-F189 HydrophobicContact CB-CG 4.09Å; R147-F189 HydrophobicContact CB-CZ 4.43Å; R147-F189 HydrophobicContact CG-CB 4.27Å; R147-F189 HydrophobicContact CG-CD2 4.38Å; R147-F189 HydrophobicContact CG-CG 4.32Å; W186-F189 AromaticContact CE3-CE2 3.87Å; W186-F189 HydrophobicContact CE3-CE2 3.87Å; W186-F189 AromaticContact CE3-CZ 3.88Å; W186-F189 HydrophobicContact CE3-CZ 3.88Å; W186-F189 HydrophobicContact CH2-CZ 4.26Å; W186-F189 AromaticContact CZ3-CE2 3.95Å; W186-F189 HydrophobicContact CZ3-CE2 3.95Å; W186-F189 AromaticContact CZ3-CZ 3.45Å; W186-F189 HydrophobicContact CZ3-CZ 3.45Å; W186-F189 VanDerWaalsContact CZ3-CZ 3.45Å; K187-F189 HydrophobicContact CD-CE2 4.42Å; K187-F189 HydrophobicContact CD-CZ 4.43Å; K187-F189 VanDerWaalsContact CE-CE1 3.46Å; K187-F189 HydrophobicContact CG-CD2 4.15Å; K187-F189 HydrophobicContact CG-CE2 3.85Å; K187-F189 HydrophobicContact CG-CZ 4.33Å; F189-R191 PolarHBondContact O-N 2.89Å; F189-R191 VanDerWaalsContact O-N 3.1Å; F189-D234 CarbonylContact O-C 3.51Å; F189-D234 WeakPolarHBondContact O-CA 3.28Å; F189-D234 VanDerWaalsContact O-CB 3.24Å; F189-D234 WeakPolarHBondContact O-CB 3.45Å; F189-D235 HydrophobicContact CB-CB 4.27Å; F189-D235 PolarHBondContact N-O 3.14Å; F189-D235 PolarHBondContact O-N 3.29Å
190	R	85.5	Confident	83.4	Confident	214 Å²	214	52.7 Å²	52.7	81%	0.808	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-53.5	126.1	172.1	-167	175.9	-175.5	174	1.8	109.7	R147 N192 D234	R147-R190 PolarHBondContact NH1-O 2.94Å; R190-N192 PolarHBondContact O-N 2.9Å; R190-D234 WeakPolarHBondContact CA-OD1 3.44Å
191	R	77	Confident	83.3	Confident	45 Å²	45	53.1 Å²	53.1	17%	0.17	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-59.9	132.9	179.9	-175.7	166.8	167.9	-172.5	-7.3	110.4	F189 E227 L229 C230 E233	F189-R191 PolarHBondContact O-N 2.89Å; F189-R191 VanDerWaalsContact O-N 3.1Å; R191-E227 PolarHBondContact NH2-O 3.49Å; R191-L229 PolarHBondContact NH1-O 3.25Å; R191-C230 PolarHBondContact NH1-O 3.11Å; R191-E233 WeakPolarHBondContact CB-O 3.4Å
192	N	66.2	Low	83.3	Confident	69 Å²	69	56.8 Å²	56.8	37%	0.369	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-80.3	136.3	170	-70.6	-0.6	0	0	0	107.3	R147 R190 D194	R147-N192 PolarHBondContact NH1-OD1 2.9Å; R147-N192 PolarHBondContact NH2-ND2 3.35Å; R147-N192 PolarHBondContact NH2-OD1 2.76Å; R147-N192 VanDerWaalsContact NH2-OD1 3.16Å; R190-N192 PolarHBondContact O-N 2.9Å; N192-D194 PolarHBondContact O-N 3.3Å
193	N	57	Low	83.3	Confident	164 Å²	164	55.4 Å²	55.4	88%	0.877	26%	0.257	S	S	*	.	S	Bend	trans	-61.6	-5.5	179.1	-86.4	-3.9	0	0	0	113.8
194	D	48.7	Very low	83.2	Confident	61 Å²	61	55.9 Å²	55.9	33%	0.326	26%	0.262	S	S	.	.	S	Bend	trans	-104.7	122	-172	-60.7	-43.3	0	0	0	110.9	N192 M614	N192-D194 PolarHBondContact O-N 3.3Å; D194-M614 HydrophobicContact CB-CE 3.47Å; D194-M614 VanDerWaalsContact CB-CE 3.47Å; D194-M614 HydrophobicContact CB-SD 4.06Å; D194-M614 WeakPolarHBondContact OD1-CE 3.45Å; D194-M614 VanDerWaalsContact OD2-CE 3.3Å; D194-M614 WeakPolarHBondContact OD2-CE 3.3Å
195	T	61.2	Low	83.2	Confident	46 Å²	46	56.3 Å²	56.3	28%	0.282	26%	0.262	S	S	.	.	S	Bend	trans	79	109.8	173.6	73.1	0	0	0	0	116.2	W589	T195-W589 HydrophobicContact CG2-CH2 3.7Å; T195-W589 HydrophobicContact CG2-CZ2 4.07Å; T195-W589 HydrophobicContact CG2-CZ3 4.45Å
196	M	76.3	Confident	83.1	Confident	15 Å²	15	56.2 Å²	56.2	7%	0.074	27%	0.266	C	S	.	.			trans	-15	117.2	158.5	-65	174.9	85.5	0	0	115	R157 L225 E227 Q1098	R157-M196 PolarHBondContact NH1-O 3.18Å; R157-M196 VanDerWaalsContact NH1-O 3.13Å; M196-L225 HydrophobicContact CE-CB 3.81Å; M196-L225 WeakPolarHBondContact CE-O 3.48Å; M196-E227 HydrophobicContact CB-CG 4.2Å; M196-E227 HydrophobicContact CG-CG 3.31Å; M196-Q1098 HydrophobicContact CE-CB 3.97Å; M196-Q1098 HydrophobicContact CE-CG 3.28Å; M196-Q1098 HydrophobicContact SD-CG 4.27Å
197	P	84.6	Confident	82.8	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.006	28%	0.277	C	S	.	.			trans	-70.9	155.8	-175.1	31	-33.5	0	0	0	111	C160 V199 A226	C160-P197 HydrophobicContact CB-CB 4.11Å; P197-V199 HydrophobicContact CB-CG2 4.26Å; P197-V199 HydrophobicContact CG-CG2 3.78Å; P197-V199 PolarHBondContact O-N 2.83Å; P197-A226 WeakPolarHBondContact CD-O 3.32Å
198	F	89.5	Confident	82.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	96.6	163.2	-172.8	-85.6	0	0	0	107.1	V150 F152 R157 A158 V159 C160 M200 W218 I223	V150-F198 HydrophobicContact CB-CD2 4.25Å; V150-F198 HydrophobicContact CB-CE2 4.48Å; V150-F198 HydrophobicContact CB-CG 4.39Å; V150-F198 HydrophobicContact CG1-CD2 4.28Å; V150-F198 HydrophobicContact CG1-CE2 4.07Å; V150-F198 HydrophobicContact CG1-CZ 4.44Å; F152-F198 HydrophobicContact CB-CD2 4Å; F152-F198 HydrophobicContact CB-CE2 4.06Å; F152-F198 HydrophobicContact CD1-CD2 4.45Å; F152-F198 HydrophobicContact CD1-CE2 4.39Å; F152-F198 HydrophobicContact CD2-CE2 4.01Å; F152-F198 HydrophobicContact CG-CD2 4.16Å; F152-F198 AromaticContact CG-CE2 3.91Å; F152-F198 HydrophobicContact CG-CE2 3.91Å; R157-F198 HydrophobicContact CB-CB 3.84Å; A158-F198 PolarHBondContact O-N 3.18Å; V159-F198 WeakPolarHBondContact CA-O 3.15Å; V159-F198 HydrophobicContact CG2-CB 4.35Å; V159-F198 HydrophobicContact CG2-CD1 4.13Å; C160-F198 PolarHBondContact N-O 2.93Å; F198-M200 HydrophobicContact CD1-CB 3.86Å; F198-M200 HydrophobicContact CE1-CB 3.71Å; F198-M200 HydrophobicContact CE1-CE 3.71Å; F198-M200 HydrophobicContact CE1-CG 4.26Å; F198-M200 HydrophobicContact CZ-CE 4.01Å; F198-M200 PolarHBondContact O-N 2.72Å; F198-W218 HydrophobicContact CD1-CH2 4.42Å; F198-W218 HydrophobicContact CE1-CE3 4.44Å; F198-W218 AromaticContact CE1-CH2 3.55Å; F198-W218 HydrophobicContact CE1-CH2 3.55Å; F198-W218 AromaticContact CE1-CZ2 3.82Å; F198-W218 HydrophobicContact CE1-CZ2 3.82Å; F198-W218 AromaticContact CE1-CZ3 3.9Å; F198-W218 HydrophobicContact CE1-CZ3 3.9Å; F198-W218 HydrophobicContact CZ-CD2 4.5Å; F198-W218 AromaticContact CZ-CE2 3.99Å; F198-W218 AromaticContact CZ-CH2 3.97Å; F198-W218 HydrophobicContact CZ-CH2 3.97Å; F198-W218 AromaticContact CZ-CZ2 3.71Å; F198-W218 HydrophobicContact CZ-CZ2 3.71Å; F198-W218 HydrophobicContact CZ-CZ3 4.46Å; F198-I223 HydrophobicContact CD2-CG2 3.73Å; F198-I223 HydrophobicContact CE1-CG1 4.38Å; F198-I223 HydrophobicContact CE1-CG2 4.43Å; F198-I223 HydrophobicContact CE2-CB 4.39Å; F198-I223 HydrophobicContact CE2-CD1 3.68Å; F198-I223 HydrophobicContact CE2-CG1 4.02Å; F198-I223 HydrophobicContact CE2-CG2 3.48Å; F198-I223 VanDerWaalsContact CE2-CG2 3.48Å; F198-I223 HydrophobicContact CG-CG2 4.33Å; F198-I223 HydrophobicContact CZ-CB 4.44Å; F198-I223 HydrophobicContact CZ-CD1 3.49Å; F198-I223 VanDerWaalsContact CZ-CD1 3.49Å; F198-I223 HydrophobicContact CZ-CG1 3.67Å; F198-I223 HydrophobicContact CZ-CG2 3.86Å
199	V	88.9	Confident	82.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	110.5	-176.4	-172.9	0	0	0	0	108.9	C160 M162 P197 P201 M224 L229	C160-V199 WeakPolarHBondContact O-CA 3.27Å; M162-V199 HydrophobicContact CG-CG1 3.66Å; M162-V199 HydrophobicContact SD-CG1 3.76Å; P197-V199 HydrophobicContact CB-CG2 4.26Å; P197-V199 HydrophobicContact CG-CG2 3.78Å; P197-V199 PolarHBondContact O-N 2.83Å; V199-P201 HydrophobicContact CG1-CG 4.49Å; V199-M224 HydrophobicContact CB-CB 4.16Å; V199-M224 HydrophobicContact CB-CE 4.48Å; V199-M224 HydrophobicContact CG1-CE 3.87Å; V199-M224 PolarHBondContact N-O 3.36Å; V199-L229 HydrophobicContact CG2-CB 3.89Å; V199-L229 HydrophobicContact CG2-CD1 4.23Å
200	M	91	Very high	82.4	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.02	30%	0.299	C	S	.	.			trans	-136.5	90.8	180	-176.9	60.3	62.7	0	0	109.7	V159 C160 W166 F198 P203 W218 I223	V159-M200 HydrophobicContact CG1-CB 4.42Å; C160-M200 PolarHBondContact O-N 2.04Å; W166-M200 HydrophobicContact CZ2-CB 4.12Å; W166-M200 HydrophobicContact CZ2-CG 3.89Å; W166-M200 PolarHBondContact NE1-O 2.96Å; F198-M200 HydrophobicContact CD1-CB 3.86Å; F198-M200 HydrophobicContact CE1-CB 3.71Å; F198-M200 HydrophobicContact CE1-CE 3.71Å; F198-M200 HydrophobicContact CE1-CG 4.26Å; F198-M200 HydrophobicContact CZ-CE 4.01Å; F198-M200 PolarHBondContact O-N 2.72Å; M200-P203 HydrophobicContact CG-CG 3.88Å; M200-W218 HydrophobicContact CB-CZ3 4.5Å; M200-W218 HydrophobicContact CE-CD2 4.34Å; M200-W218 HydrophobicContact CE-CE3 3.89Å; M200-W218 HydrophobicContact CE-CZ3 4.33Å; M200-W218 HydrophobicContact CG-CE3 4.02Å; M200-W218 HydrophobicContact CG-CZ3 3.79Å; M200-W218 HydrophobicContact SD-CE3 4.24Å; M200-I223 HydrophobicContact CE-CD1 4.35Å; M200-I223 HydrophobicContact CE-CG1 3.52Å
201	P	89	Confident	82.5	Confident	35 Å²	35	50.9 Å²	50.9	23%	0.227	27%	0.274	C	S	.	.	S	Bend	trans	-66.2	-48.6	-179.3	-20.2	32.5	0	0	0	112.3	T161 M162 T164 W166 V199 M224	T161-P201 WeakPolarHBondContact O-CA 3.38Å; M162-P201 HydrophobicContact CB-CG 4.12Å; M162-P201 HydrophobicContact SD-CG 4.22Å; T164-P201 HydrophobicContact CG2-CB 4.28Å; T164-P201 VanDerWaalsContact OG1-C 3.26Å; T164-P201 WeakPolarHBondContact OG1-CA 3.49Å; T164-P201 WeakPolarHBondContact OG1-CB 3.31Å; T164-P201 PolarHBondContact OG1-O 3.25Å; W166-P201 VanDerWaalsContact CD1-O 3.3Å; W166-P201 PolarHBondContact NE1-O 2.99Å; V199-P201 HydrophobicContact CG1-CG 4.49Å; P201-M224 HydrophobicContact CG-CE 4.48Å
202	K	90.3	Very high	83.1	Confident	136 Å²	136	48.8 Å²	48.8	59%	0.591	27%	0.266	S	S	*	.			trans	-138.6	102.3	-177	-173.8	177.3	-178	177.9	0	111.5	G204 N217	K202-G204 VanDerWaalsContact C-N 3.32Å; K202-G204 PolarHBondContact O-N 3.42Å; K202-N217 WeakPolarHBondContact O-CB 3.46Å; K202-N217 PolarHBondContact O-ND2 3.48Å
203	P	92	Very high	84.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.271	C	S	.	.			trans	-61.3	-38.1	175.3	-23.8	34	0	0	0	113.3	W166 D170 M200 L212 C215 T216 N217 W218	W166-P203 HydrophobicContact CD2-CG 3.72Å; W166-P203 VanDerWaalsContact CE2-CG 3.41Å; W166-P203 HydrophobicContact CE3-CG 3.99Å; W166-P203 HydrophobicContact CG-CG 4.38Å; W166-P203 HydrophobicContact CH2-CG 3.75Å; W166-P203 HydrophobicContact CZ2-CG 3.44Å; W166-P203 VanDerWaalsContact CZ2-CG 3.44Å; W166-P203 HydrophobicContact CZ3-CG 4Å; D170-P203 HydrophobicContact CB-CG 4.25Å; M200-P203 HydrophobicContact CG-CG 3.88Å; P203-L212 HydrophobicContact CB-CD2 4.37Å; P203-C215 HydrophobicContact CB-CB 4.3Å; P203-C215 WeakPolarHBondContact O-CB 3.34Å; P203-T216 PolarHBondContact O-N 2.88Å; P203-N217 WeakPolarHBondContact O-CB 3.44Å; P203-N217 PolarHBondContact O-N 2.87Å; P203-W218 HydrophobicContact CB-CE3 4.18Å; P203-W218 HydrophobicContact CB-CZ3 4.49Å; P203-W218 HydrophobicContact CG-CE3 4.5Å; P203-W218 HydrophobicContact CG-CZ3 4.36Å
204	G	92.2	Very high	85.7	Confident	17 Å²	17	47.5 Å²	47.5	18%	0.175	25%	0.252	C	S	.	.			trans	71.4	50	178.5	0	0	0	0	0	112.2	D170 K202 T216	D170-G204 PolarHBondContact OD1-N 3.04Å; K202-G204 VanDerWaalsContact C-N 3.32Å; K202-G204 PolarHBondContact O-N 3.42Å; G204-T216 PolarHBondContact O-N 3.21Å; G204-T216 PolarHBondContact O-OG1 2.82Å
205	C	94.6	Very high	87.8	Confident	20 Å²	20	44.9 Å²	44.9	14%	0.135	24%	0.238	C	C	.	.			trans	-82	161	179.7	-59.5	0	0	0	0	113.3	V169 D170 V173 C215	V169-C205 HydrophobicContact CG1-CB 4.31Å; D170-C205 VanDerWaalsContact OD1-CB 3.26Å; D170-C205 WeakPolarHBondContact OD1-CB 3.45Å; D170-C205 PolarHBondContact OD1-N 2.83Å; D170-C205 PolarHBondContact OD1-SG 3.08Å; D170-C205 VanDerWaalsContact OD1-SG 3.38Å; V173-C205 HydrophobicContact CB-CB 4.18Å; V173-C205 HydrophobicContact CG1-CB 4.46Å; V173-C205 HydrophobicContact CG2-CB 3.99Å; C205-C215 WeakPolarHBondContact CA-SG 3.3Å; C205-C215 HydrophobicContact CB-CB 4.06Å; C205-C215 WeakPolarHBondContact CB-SG 3.27Å; C205-C215 WeakPolarHBondContact SG-CB 3.27Å; C205-C215 CovalentContact SG-SG 2.03Å; C205-C215 PolarHBondContact SG-SG 2.85Å
206	N	93.6	Very high	89.3	Confident	80 Å²	80	47.1 Å²	47.1	43%	0.428	25%	0.252	S	S	.	.			trans	-123.4	156.2	176.5	-169.4	0.8	0	0	0	109.7	T208 H209	N206-T208 PolarHBondContact O-N 3.18Å; N206-H209 VanDerWaalsContact CB-CE1 3.5Å; N206-H209 WeakPolarHBondContact CB-CE1 3.36Å; N206-H209 PolarHBondContact N-ND1 2.76Å; N206-H209 VanDerWaalsContact N-ND1 3.1Å; N206-H209 WeakPolarHBondContact O-CB 3.31Å; N206-H209 PolarHBondContact O-N 3.48Å
207	Y	88	Confident	89.9	Confident	135 Å²	135	48.6 Å²	48.6	53%	0.529	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.6	-179.8	-72.6	-79.1	0	0	0	114.4	V169 R176 H209	V169-Y207 HydrophobicContact CG1-CD1 4.45Å; V169-Y207 HydrophobicContact CG1-CG 4.4Å; V169-Y207 HydrophobicContact CG2-CD1 4.22Å; V169-Y207 HydrophobicContact CG2-CD2 4.17Å; V169-Y207 HydrophobicContact CG2-CE1 3.68Å; V169-Y207 HydrophobicContact CG2-CE2 3.6Å; V169-Y207 HydrophobicContact CG2-CG 4.45Å; R176-Y207 PolarHBondContact NH1-O 2.99Å; Y207-H209 VanDerWaalsContact C-N 3.32Å
208	T	89.1	Confident	90	Very high	111 Å²	111	49.4 Å²	49.4	68%	0.681	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-12	177.9	55	0	0	0	0	113.3	N206	N206-T208 PolarHBondContact O-N 3.18Å
209	H	90.9	Very high	89.9	Confident	38 Å²	38	52.3 Å²	52.3	18%	0.176	28%	0.282	C	S	.	.			trans	-78.7	135.4	-177.8	-60.9	154.8	0	0	0	111.1	V173 N206 Y207 Q214	V173-H209 HydrophobicContact CG1-CB 4.23Å; V173-H209 HydrophobicContact CG2-CB 4.22Å; N206-H209 VanDerWaalsContact CB-CE1 3.5Å; N206-H209 WeakPolarHBondContact CB-CE1 3.36Å; N206-H209 PolarHBondContact N-ND1 2.76Å; N206-H209 VanDerWaalsContact N-ND1 3.1Å; N206-H209 WeakPolarHBondContact O-CB 3.31Å; N206-H209 PolarHBondContact O-N 3.48Å; Y207-H209 VanDerWaalsContact C-N 3.32Å; H209-Q214 VanDerWaalsContact CA-OE1 3.23Å; H209-Q214 HydrophobicContact CB-CB 4.1Å; H209-Q214 PolarHBondContact CE1-O 2.98Å
210	G	84.7	Confident	89.5	Confident	39 Å²	39	57.2 Å²	57.2	40%	0.402	31%	0.311	S	S	.	.	S	Bend	trans	-96.8	-18	175.3	0	0	0	0	0	113.4	R176	R176-G210 CarbonylContact C-O 3.58Å; R176-G210 WeakPolarHBondContact CB-O 3.02Å
211	D	87.5	Confident	89	Confident	53 Å²	53	64.3 Å²	64.3	28%	0.283	35%	0.345	S	S	.	.	S	Bend	trans	-138.7	142.3	-173.4	-169.1	-19.6	0	0	0	110.4	T177 H213 Q214	T177-D211 VanDerWaalsContact CG2-OD1 3.25Å; T177-D211 WeakPolarHBondContact CG2-OD1 3.23Å; T177-D211 WeakPolarHBondContact OG1-CA 2.97Å; D211-H213 PolarHBondContact O-N 3.46Å; D211-H213 IonicContact OD1-CD2 3.88Å; D211-H213 PolarHBondContact OD1-CD2 2.75Å; D211-H213 IonicContact OD1-CG 2.79Å; D211-H213 PolarHBondContact OD1-N 2.76Å; D211-H213 IonicContact OD2-CD2 3.2Å; D211-H213 PolarHBondContact OD2-CD2 3.36Å; D211-Q214 HydrophobicContact CB-CG 4.42Å; D211-Q214 WeakPolarHBondContact O-CB 3.35Å; D211-Q214 PolarHBondContact O-N 3.07Å
212	L	89.4	Confident	88.7	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-57.1	-30	173	-85.8	170.1	0	0	0	112.7	I135 V173 A174 T177 P203 Q214 C215 W218	I135-L212 HydrophobicContact CD1-CB 3.98Å; I135-L212 HydrophobicContact CD1-CD1 3.26Å; I135-L212 HydrophobicContact CD1-CG 4.19Å; V173-L212 HydrophobicContact CG1-CD2 4.4Å; V173-L212 HydrophobicContact CG1-CG 4.32Å; A174-L212 HydrophobicContact CB-CD1 3.66Å; A174-L212 HydrophobicContact CB-CG 4.26Å; T177-L212 PolarHBondContact OG1-N 2.98Å; P203-L212 HydrophobicContact CB-CD2 4.37Å; L212-Q214 PolarHBondContact O-N 3.3Å; L212-Q214 VanDerWaalsContact O-N 3.11Å; L212-C215 WeakPolarHBondContact O-CB 3.1Å; L212-C215 PolarHBondContact O-N 2.97Å; L212-C215 PolarHBondContact O-SG 3.22Å; L212-C215 VanDerWaalsContact O-SG 3.42Å; L212-W218 HydrophobicContact CB-CD2 4.2Å; L212-W218 HydrophobicContact CB-CE3 4.45Å; L212-W218 HydrophobicContact CB-CZ2 4.3Å; L212-W218 HydrophobicContact CD1-CH2 3.92Å; L212-W218 HydrophobicContact CD1-CZ2 4.25Å; L212-W218 HydrophobicContact CD1-CZ3 4.24Å; L212-W218 HydrophobicContact CD2-CE3 4.13Å; L212-W218 HydrophobicContact CD2-CZ3 4.02Å; L212-W218 VanDerWaalsContact O-CB 3.23Å; L212-W218 WeakPolarHBondContact O-CB 3.11Å; L212-W218 VanDerWaalsContact O-CG 3.3Å
213	H	88	Confident	88.5	Confident	103 Å²	103	61.4 Å²	61.4	48%	0.477	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-62.8	-15.3	175.6	-66.1	-67.4	0	0	0	113.8	S134 D211 W218	S134-H213 PolarHBondContact OG-NE2 3.16Å; S134-H213 VanDerWaalsContact OG-NE2 3.13Å; D211-H213 PolarHBondContact O-N 3.46Å; D211-H213 IonicContact OD1-CD2 3.88Å; D211-H213 PolarHBondContact OD1-CD2 2.75Å; D211-H213 IonicContact OD1-CG 2.79Å; D211-H213 PolarHBondContact OD1-N 2.76Å; D211-H213 IonicContact OD2-CD2 3.2Å; D211-H213 PolarHBondContact OD2-CD2 3.36Å; H213-W218 AromaticContact CE1-NE1 3.84Å; H213-W218 AromaticContact ND1-CD1 3.58Å; H213-W218 AromaticContact ND1-NE1 3.6Å
214	Q	91	Very high	88.1	Confident	104 Å²	104	63 Å²	63	49%	0.486	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-87.9	-8.5	175.1	-60.6	176.3	-22.2	0	0	112.9	H209 D211 L212	H209-Q214 VanDerWaalsContact CA-OE1 3.23Å; H209-Q214 HydrophobicContact CB-CB 4.1Å; H209-Q214 PolarHBondContact CE1-O 2.98Å; D211-Q214 HydrophobicContact CB-CG 4.42Å; D211-Q214 WeakPolarHBondContact O-CB 3.35Å; D211-Q214 PolarHBondContact O-N 3.07Å; L212-Q214 PolarHBondContact O-N 3.3Å; L212-Q214 VanDerWaalsContact O-N 3.11Å
215	C	93.1	Very high	87.6	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.034	33%	0.329	C	S	.	.	S	Bend	trans	-75.9	142.2	-177.6	-53.9	0	0	0	0	111.6	P203 C205 L212 N217 W218	P203-C215 HydrophobicContact CB-CB 4.3Å; P203-C215 WeakPolarHBondContact O-CB 3.34Å; C205-C215 WeakPolarHBondContact CA-SG 3.3Å; C205-C215 HydrophobicContact CB-CB 4.06Å; C205-C215 WeakPolarHBondContact CB-SG 3.27Å; C205-C215 WeakPolarHBondContact SG-CB 3.27Å; C205-C215 CovalentContact SG-SG 2.03Å; C205-C215 PolarHBondContact SG-SG 2.85Å; L212-C215 WeakPolarHBondContact O-CB 3.1Å; L212-C215 PolarHBondContact O-N 2.97Å; L212-C215 PolarHBondContact O-SG 3.22Å; L212-C215 VanDerWaalsContact O-SG 3.42Å; C215-N217 VanDerWaalsContact C-N 3.25Å; C215-N217 PolarHBondContact O-N 3Å; C215-N217 VanDerWaalsContact O-N 3.1Å; C215-W218 HydrophobicContact CB-CB 4.27Å; C215-W218 PolarHBondContact O-N 3.09Å
216	T	91.4	Very high	86.8	Confident	94 Å²	94	61.6 Å²	61.6	58%	0.577	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.5	-167	52.2	0	0	0	0	115.5	P203 G204 K222	P203-T216 PolarHBondContact O-N 2.88Å; G204-T216 PolarHBondContact O-N 3.21Å; G204-T216 PolarHBondContact O-OG1 2.82Å; T216-K222 PolarHBondContact O-NZ 3.26Å
217	N	88.5	Confident	86	Confident	46 Å²	46	58.5 Å²	58.5	25%	0.246	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	2	179.6	-68.2	-29.9	0	0	0	113.6	K202 P203 C215 T219 K222	K202-N217 WeakPolarHBondContact O-CB 3.46Å; K202-N217 PolarHBondContact O-ND2 3.48Å; P203-N217 WeakPolarHBondContact O-CB 3.44Å; P203-N217 PolarHBondContact O-N 2.87Å; C215-N217 VanDerWaalsContact C-N 3.25Å; C215-N217 PolarHBondContact O-N 3Å; C215-N217 VanDerWaalsContact O-N 3.1Å; N217-T219 PolarHBondContact O-N 2.83Å; N217-K222 HydrophobicContact CB-CD 4.17Å; N217-K222 PolarHBondContact OD1-NZ 3.1Å
218	W	88.2	Confident	85.3	Confident	17 Å²	17	53 Å²	53	6%	0.064	29%	0.286	C	S	.	.			trans	-82.6	48.5	-179.6	-155.1	-89.4	0	0	0	112.3	I135 V150 W166 F198 M200 P203 L212 H213 C215	I135-W218 HydrophobicContact CD1-CZ2 4.14Å; V150-W218 HydrophobicContact CG1-CZ2 4.17Å; V150-W218 HydrophobicContact CG2-CH2 4.02Å; V150-W218 HydrophobicContact CG2-CZ2 3.98Å; W166-W218 HydrophobicContact CH2-CH2 4.32Å; W166-W218 AromaticContact CH2-CZ3 3.9Å; W166-W218 HydrophobicContact CH2-CZ3 3.9Å; W166-W218 HydrophobicContact CZ2-CZ3 4.27Å; F198-W218 HydrophobicContact CD1-CH2 4.42Å; F198-W218 HydrophobicContact CE1-CE3 4.44Å; F198-W218 AromaticContact CE1-CH2 3.55Å; F198-W218 HydrophobicContact CE1-CH2 3.55Å; F198-W218 AromaticContact CE1-CZ2 3.82Å; F198-W218 HydrophobicContact CE1-CZ2 3.82Å; F198-W218 AromaticContact CE1-CZ3 3.9Å; F198-W218 HydrophobicContact CE1-CZ3 3.9Å; F198-W218 HydrophobicContact CZ-CD2 4.5Å; F198-W218 AromaticContact CZ-CE2 3.99Å; F198-W218 AromaticContact CZ-CH2 3.97Å; F198-W218 HydrophobicContact CZ-CH2 3.97Å; F198-W218 AromaticContact CZ-CZ2 3.71Å; F198-W218 HydrophobicContact CZ-CZ2 3.71Å; F198-W218 HydrophobicContact CZ-CZ3 4.46Å; M200-W218 HydrophobicContact CB-CZ3 4.5Å; M200-W218 HydrophobicContact CE-CD2 4.34Å; M200-W218 HydrophobicContact CE-CE3 3.89Å; M200-W218 HydrophobicContact CE-CZ3 4.33Å; M200-W218 HydrophobicContact CG-CE3 4.02Å; M200-W218 HydrophobicContact CG-CZ3 3.79Å; M200-W218 HydrophobicContact SD-CE3 4.24Å; P203-W218 HydrophobicContact CB-CE3 4.18Å; P203-W218 HydrophobicContact CB-CZ3 4.49Å; P203-W218 HydrophobicContact CG-CE3 4.5Å; P203-W218 HydrophobicContact CG-CZ3 4.36Å; L212-W218 HydrophobicContact CB-CD2 4.2Å; L212-W218 HydrophobicContact CB-CE3 4.45Å; L212-W218 HydrophobicContact CB-CZ2 4.3Å; L212-W218 HydrophobicContact CD1-CH2 3.92Å; L212-W218 HydrophobicContact CD1-CZ2 4.25Å; L212-W218 HydrophobicContact CD1-CZ3 4.24Å; L212-W218 HydrophobicContact CD2-CE3 4.13Å; L212-W218 HydrophobicContact CD2-CZ3 4.02Å; L212-W218 VanDerWaalsContact O-CB 3.23Å; L212-W218 WeakPolarHBondContact O-CB 3.11Å; L212-W218 VanDerWaalsContact O-CG 3.3Å; H213-W218 AromaticContact CE1-NE1 3.84Å; H213-W218 AromaticContact ND1-CD1 3.58Å; H213-W218 AromaticContact ND1-NE1 3.6Å; C215-W218 HydrophobicContact CB-CB 4.27Å; C215-W218 PolarHBondContact O-N 3.09Å
219	T	86.4	Confident	84.7	Confident	62 Å²	62	48.2 Å²	48.2	38%	0.38	26%	0.257	S	S	.	.	S	Bend	trans	-109.6	144.6	180	55.3	0	0	0	0	110.6	N217 E221 K222 I223	N217-T219 PolarHBondContact O-N 2.83Å; T219-E221 PolarHBondContact O-N 2.89Å; T219-K222 PolarHBondContact O-N 2.77Å; T219-K222 WeakPolarHBondContact OG1-CD 3.39Å; T219-K222 WeakPolarHBondContact OG1-CG 3.25Å; T219-I223 WeakPolarHBondContact O-CG1 3.42Å; T219-I223 PolarHBondContact O-N 3.07Å
220	T	81.1	Confident	84.3	Confident	102 Å²	102	46.7 Å²	46.7	63%	0.626	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-33.1	-179.9	43	0	0	0	0	114.1	F152 K222	F152-T220 HydrophobicContact CE2-CG2 4.02Å; F152-T220 HydrophobicContact CZ-CG2 4.05Å; T220-K222 VanDerWaalsContact C-N 3.33Å; T220-K222 PolarHBondContact O-N 3.31Å
221	E	80.2	Confident	83.8	Confident	154 Å²	154	51.2 Å²	51.2	72%	0.72	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-13	-179.6	-62.4	178.4	178.4	0	0	114.6	T219 L1102	T219-E221 PolarHBondContact O-N 2.89Å; E221-L1102 WeakPolarHBondContact O-CD1 3.37Å; E221-L1102 WeakPolarHBondContact O-CD2 3.48Å
222	K	83	Confident	83.3	Confident	105 Å²	105	52.8 Å²	52.8	46%	0.457	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-8.6	-179.7	-69.4	-179.8	179.6	173.7	0	113.1	T216 N217 T219 T220 M224	T216-K222 PolarHBondContact O-NZ 3.26Å; N217-K222 HydrophobicContact CB-CD 4.17Å; N217-K222 PolarHBondContact OD1-NZ 3.1Å; T219-K222 PolarHBondContact O-N 2.77Å; T219-K222 WeakPolarHBondContact OG1-CD 3.39Å; T219-K222 WeakPolarHBondContact OG1-CG 3.25Å; T220-K222 VanDerWaalsContact C-N 3.33Å; T220-K222 PolarHBondContact O-N 3.31Å; K222-M224 PolarHBondContact O-N 3.31Å
223	I	84.8	Confident	83.1	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.026	30%	0.298	C	S	.	.			trans	-86.6	109.2	-177.8	-64.8	159.3	0	0	0	108.5	F152 F198 M200 T219 L225	F152-I223 HydrophobicContact CD1-CG2 4.41Å; F152-I223 HydrophobicContact CD2-CD1 4.42Å; F152-I223 HydrophobicContact CE1-CG2 4.05Å; F152-I223 HydrophobicContact CE2-CD1 3.77Å; F152-I223 HydrophobicContact CZ-CB 4.41Å; F152-I223 HydrophobicContact CZ-CD1 3.93Å; F152-I223 HydrophobicContact CZ-CG2 4.31Å; F198-I223 HydrophobicContact CD2-CG2 3.73Å; F198-I223 HydrophobicContact CE1-CG1 4.38Å; F198-I223 HydrophobicContact CE1-CG2 4.43Å; F198-I223 HydrophobicContact CE2-CB 4.39Å; F198-I223 HydrophobicContact CE2-CD1 3.68Å; F198-I223 HydrophobicContact CE2-CG1 4.02Å; F198-I223 HydrophobicContact CE2-CG2 3.48Å; F198-I223 VanDerWaalsContact CE2-CG2 3.48Å; F198-I223 HydrophobicContact CG-CG2 4.33Å; F198-I223 HydrophobicContact CZ-CB 4.44Å; F198-I223 HydrophobicContact CZ-CD1 3.49Å; F198-I223 VanDerWaalsContact CZ-CD1 3.49Å; F198-I223 HydrophobicContact CZ-CG1 3.67Å; F198-I223 HydrophobicContact CZ-CG2 3.86Å; M200-I223 HydrophobicContact CE-CD1 4.35Å; M200-I223 HydrophobicContact CE-CG1 3.52Å; T219-I223 WeakPolarHBondContact O-CG1 3.42Å; T219-I223 PolarHBondContact O-N 3.07Å; I223-L225 HydrophobicContact CG2-CD2 4.02Å; I223-L225 HydrophobicContact CG2-CG 4.4Å
224	M	83.7	Confident	83.1	Confident	32 Å²	32	53 Å²	53	16%	0.158	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-81.9	138.2	175.6	-61.3	174.2	-79.7	0	0	110.5	M162 V199 P201 K222 L229 L1102	M162-M224 HydrophobicContact SD-CE 3.78Å; V199-M224 HydrophobicContact CB-CB 4.16Å; V199-M224 HydrophobicContact CB-CE 4.48Å; V199-M224 HydrophobicContact CG1-CE 3.87Å; V199-M224 PolarHBondContact N-O 3.36Å; P201-M224 HydrophobicContact CG-CE 4.48Å; K222-M224 PolarHBondContact O-N 3.31Å; M224-L229 HydrophobicContact CB-CD1 3.62Å; M224-L229 HydrophobicContact CG-CD1 4.47Å; M224-L229 HydrophobicContact SD-CD1 4.27Å; M224-L1102 HydrophobicContact CG-CB 4.02Å; M224-L1102 HydrophobicContact CG-CD1 4.38Å
225	L	82.7	Confident	83.1	Confident	6 Å²	6	48.1 Å²	48.1	3%	0.031	27%	0.271	C	S	.	.			trans	-130.6	89.3	179.3	-60.7	179.1	0	0	0	109.1	F152 K153 M196 I223 Q1098	F152-L225 HydrophobicContact CD1-CD1 3.92Å; F152-L225 HydrophobicContact CD1-CD2 4.08Å; F152-L225 HydrophobicContact CD1-CG 4.48Å; F152-L225 HydrophobicContact CE1-CD1 3.76Å; F152-L225 HydrophobicContact CE1-CD2 4.36Å; F152-L225 HydrophobicContact CE1-CG 4.34Å; K153-L225 HydrophobicContact CD-CD1 4.35Å; M196-L225 HydrophobicContact CE-CB 3.81Å; M196-L225 WeakPolarHBondContact CE-O 3.48Å; I223-L225 HydrophobicContact CG2-CD2 4.02Å; I223-L225 HydrophobicContact CG2-CG 4.4Å; L225-Q1098 WeakPolarHBondContact O-CB 3.19Å; L225-Q1098 VanDerWaalsContact O-O 3.08Å
226	A	77.9	Confident	83.1	Confident	2 Å²	2	47.9 Å²	47.9	2%	0.017	27%	0.269	C	S	.	.			trans	-145	144.8	170	0	0	0	0	0	110.3	P197 N228 L229	P197-A226 WeakPolarHBondContact CD-O 3.32Å; A226-N228 VanDerWaalsContact C-N 3.3Å; A226-N228 WeakPolarHBondContact CB-OD1 3.49Å; A226-N228 PolarHBondContact O-N 3.47Å; A226-L229 HydrophobicContact CB-CD1 3.74Å; A226-L229 HydrophobicContact CB-CG 3.86Å; A226-L229 PolarHBondContact O-N 2.99Å
227	E	76.2	Confident	83.3	Confident	15 Å²	15	43.4 Å²	43.4	7%	0.07	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-29.7	-172.8	-57.9	-169.9	150.3	0	0	112.9	R191 M196 R1080 R1092 D1094	R191-E227 PolarHBondContact NH2-O 3.49Å; M196-E227 HydrophobicContact CB-CG 4.2Å; M196-E227 HydrophobicContact CG-CG 3.31Å; E227-R1080 IonicContact OE2-CZ 4Å; E227-R1080 IonicContact OE2-NH1 3.02Å; E227-R1080 PolarHBondContact OE2-NH1 3.05Å; E227-R1080 IonicContact OE2-NH2 2.7Å; E227-R1092 IonicContact OE1-CZ 2.75Å; E227-R1092 VanDerWaalsContact OE1-CZ 3.26Å; E227-R1092 IonicContact OE1-NH1 3.75Å; E227-R1092 IonicContact OE1-NH2 2.66Å; E227-R1092 PolarHBondContact OE1-NH2 2.82Å; E227-R1092 IonicContact OE2-CZ 3.42Å; E227-R1092 IonicContact OE2-NH1 3.42Å; E227-R1092 IonicContact OE2-NH2 3.56Å; E227-D1094 PolarHBondContact N-OD2 2.9Å
228	N	74.2	Confident	83.6	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.102	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-17.3	177.9	62.8	-8.1	0	0	0	113.5	A226 Q231	A226-N228 VanDerWaalsContact C-N 3.3Å; A226-N228 WeakPolarHBondContact CB-OD1 3.49Å; A226-N228 PolarHBondContact O-N 3.47Å; N228-Q231 WeakPolarHBondContact O-CG 3.27Å; N228-Q231 PolarHBondContact O-N 3.12Å
229	L	77	Confident	84	Confident	12 Å²	12	42.1 Å²	42.1	6%	0.063	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	138.4	171.7	-64.3	172.2	0	0	0	108.6	M162 R191 V199 M224 A226 Q231	M162-L229 HydrophobicContact CE-CD2 3.92Å; R191-L229 PolarHBondContact NH1-O 3.25Å; V199-L229 HydrophobicContact CG2-CB 3.89Å; V199-L229 HydrophobicContact CG2-CD1 4.23Å; M224-L229 HydrophobicContact CB-CD1 3.62Å; M224-L229 HydrophobicContact CG-CD1 4.47Å; M224-L229 HydrophobicContact SD-CD1 4.27Å; A226-L229 HydrophobicContact CB-CD1 3.74Å; A226-L229 HydrophobicContact CB-CG 3.86Å; A226-L229 PolarHBondContact O-N 2.99Å; L229-Q231 VanDerWaalsContact C-N 3.34Å; L229-Q231 PolarHBondContact O-N 2.93Å
230	C	80.7	Confident	84.4	Confident	6 Å²	6	39.4 Å²	39.4	4%	0.041	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	29	-175.7	-55.9	0	0	0	0	115.3	C160 R191 G232 E233	C160-C230 HydrophobicContact CB-CB 3.78Å; C160-C230 WeakPolarHBondContact CB-SG 3.47Å; C160-C230 WeakPolarHBondContact SG-CB 3.33Å; C160-C230 CovalentContact SG-SG 2.01Å; C160-C230 PolarHBondContact SG-SG 2.85Å; R191-C230 PolarHBondContact NH1-O 3.11Å; C230-G232 PolarHBondContact O-N 2.7Å; C230-E233 HydrophobicContact CB-CB 4.03Å; C230-E233 HydrophobicContact CB-CG 4.27Å; C230-E233 PolarHBondContact O-N 2.92Å; C230-E233 VanDerWaalsContact O-N 3.11Å
231	Q	75.7	Confident	84.9	Confident	133 Å²	133	40.3 Å²	40.3	62%	0.621	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	124.6	173.7	-87.2	178.9	-5.5	0	0	110.8	N228 L229 E233	N228-Q231 WeakPolarHBondContact O-CG 3.27Å; N228-Q231 PolarHBondContact O-N 3.12Å; L229-Q231 VanDerWaalsContact C-N 3.34Å; L229-Q231 PolarHBondContact O-N 2.93Å; Q231-E233 VanDerWaalsContact C-N 3.27Å; Q231-E233 PolarHBondContact O-N 3.33Å
232	G	77.3	Confident	85.2	Confident	87 Å²	87	34 Å²	34	90%	0.897	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	81	1.2	-176.8	0	0	0	0	0	114.8	C230	C230-G232 PolarHBondContact O-N 2.7Å
233	E	84.5	Confident	85.4	Confident	37 Å²	37	31.4 Å²	31.4	17%	0.173	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-94.4	156.1	172.5	-56.8	-177.7	-153.9	0	0	111.5	C160 M162 M163 R191 C230 Q231	C160-E233 PolarHBondContact SG-OE2 2.71Å; M162-E233 WeakPolarHBondContact CA-OE2 3.17Å; M162-E233 PolarHBondContact N-OE2 2.87Å; M163-E233 HydrophobicContact CG-CG 4.11Å; M163-E233 PolarHBondContact N-OE2 2.82Å; M163-E233 HydrophobicContact SD-CG 4Å; R191-E233 WeakPolarHBondContact CB-O 3.4Å; C230-E233 HydrophobicContact CB-CB 4.03Å; C230-E233 HydrophobicContact CB-CG 4.27Å; C230-E233 PolarHBondContact O-N 2.92Å; C230-E233 VanDerWaalsContact O-N 3.11Å; Q231-E233 VanDerWaalsContact C-N 3.27Å; Q231-E233 PolarHBondContact O-N 3.33Å
234	D	88.5	Confident	85.5	Confident	69 Å²	69	31.5 Å²	31.5	37%	0.369	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-95.2	153.6	179.1	-74.9	-16.2	0	0	0	112	W188 F189 R190	W188-D234 HydrophobicContact CB-CB 3.73Å; W188-D234 HydrophobicContact CE3-CB 4.44Å; W188-D234 HydrophobicContact CG-CB 4.45Å; F189-D234 CarbonylContact O-C 3.51Å; F189-D234 WeakPolarHBondContact O-CA 3.28Å; F189-D234 VanDerWaalsContact O-CB 3.24Å; F189-D234 WeakPolarHBondContact O-CB 3.45Å; R190-D234 WeakPolarHBondContact CA-OD1 3.44Å
235	D	90.5	Very high	85.8	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	148.5	177.7	-61.2	-34.7	0	0	0	111.6	R147 A158 F189	R147-D235 HydrophobicContact CG-CB 3.91Å; R147-D235 IonicContact CZ-OD2 3.37Å; R147-D235 IonicContact NE-OD2 3.34Å; R147-D235 IonicContact NH1-OD2 2.68Å; R147-D235 PolarHBondContact NH1-OD2 2.75Å; A158-D235 HydrophobicContact CB-CB 4.06Å; A158-D235 VanDerWaalsContact CB-CG 3.43Å; A158-D235 VanDerWaalsContact CB-OD2 3.3Å; A158-D235 WeakPolarHBondContact CB-OD2 3.05Å; F189-D235 HydrophobicContact CB-CB 4.27Å; F189-D235 PolarHBondContact N-O 3.14Å; F189-D235 PolarHBondContact O-N 3.29Å
236	L	92.7	Very high	85.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.4	-179	179.1	61.9	0	0	0	112.4	L148 V159 T161 W166 Y171 F185 W188 L238	L148-L236 WeakPolarHBondContact CB-O 3.05Å; L148-L236 HydrophobicContact CD2-CD2 4.05Å; L148-L236 PolarHBondContact N-O 3.09Å; V159-L236 PolarHBondContact O-N 3.12Å; T161-L236 HydrophobicContact CG2-CB 4.4Å; T161-L236 HydrophobicContact CG2-CD2 4.29Å; W166-L236 HydrophobicContact CD2-CD2 3.72Å; W166-L236 HydrophobicContact CE3-CD2 3.73Å; W166-L236 HydrophobicContact CG-CD2 4.26Å; W166-L236 HydrophobicContact CH2-CD2 4.26Å; W166-L236 HydrophobicContact CZ2-CD2 4.25Å; W166-L236 HydrophobicContact CZ3-CD2 4.02Å; Y171-L236 HydrophobicContact CE1-CD1 3.94Å; Y171-L236 HydrophobicContact CE1-CD2 4.1Å; F185-L236 HydrophobicContact CD2-CD1 3.75Å; F185-L236 HydrophobicContact CE2-CD1 4.09Å; W188-L236 HydrophobicContact CH2-CD1 4.12Å; W188-L236 HydrophobicContact CZ3-CB 4.09Å; W188-L236 HydrophobicContact CZ3-CD1 4Å; L236-L238 HydrophobicContact CD1-CD2 4.17Å; L236-L238 HydrophobicContact CD2-CD2 4.22Å; L236-L238 HydrophobicContact CG-CD2 4.07Å
237	G	94.7	Very high	86.2	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.1	172.1	0	0	0	0	0	113.5	G146 W186 K187	G146-G237 CarbonylContact O-C 3.45Å; G146-G237 VanDerWaalsContact O-CA 3.26Å; G146-G237 WeakPolarHBondContact O-CA 3.4Å; W186-G237 PolarHBondContact N-O 3.06Å; K187-G237 WeakPolarHBondContact O-CA 3.34Å; K187-G237 PolarHBondContact O-N 2.7Å
238	L	96	Very high	86.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	161.1	-178.5	-55.6	-176.2	0	0	0	112.5	L137 Q145 G146 L148 Y171 A174 G184 L236	L137-L238 HydrophobicContact CD1-CB 4.32Å; L137-L238 HydrophobicContact CD2-CB 3.88Å; L137-L238 HydrophobicContact CD2-CD1 4.45Å; L137-L238 HydrophobicContact CD2-CG 4.39Å; Q145-L238 WeakPolarHBondContact CA-O 3.25Å; G146-L238 PolarHBondContact N-O 2.04Å; G146-L238 PolarHBondContact O-N 2.93Å; L148-L238 HydrophobicContact CB-CG 4.5Å; L148-L238 HydrophobicContact CD1-CD1 4.09Å; L148-L238 HydrophobicContact CD2-CD1 4.01Å; L148-L238 HydrophobicContact CG-CD1 4.45Å; Y171-L238 HydrophobicContact CD1-CD2 3.33Å; Y171-L238 HydrophobicContact CE1-CD2 3.74Å; Y171-L238 HydrophobicContact CG-CD2 4.14Å; A174-L238 HydrophobicContact CB-CD1 3.84Å; G184-L238 WeakPolarHBondContact O-CA 3.08Å; L236-L238 HydrophobicContact CD1-CD2 4.17Å; L236-L238 HydrophobicContact CD2-CD2 4.22Å; L236-L238 HydrophobicContact CG-CD2 4.07Å
239	V	96	Very high	87.1	Confident	35 Å²	35	40.4 Å²	40.4	21%	0.212	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	129.8	166.6	57.4	0	0	0	0	109.3	R144 Q145 G183 G184 W186 W241	R144-V239 CarbonylContact O-C 3.59Å; R144-V239 WeakPolarHBondContact O-CA 3.36Å; Q145-V239 HydrophobicContact CB-CB 4.41Å; Q145-V239 HydrophobicContact CB-CG2 4.13Å; Q145-V239 HydrophobicContact CG-CB 4.06Å; Q145-V239 HydrophobicContact CG-CG2 4.04Å; G183-V239 CarbonylContact C-O 3.58Å; G183-V239 WeakPolarHBondContact CA-O 3.36Å; G184-V239 PolarHBondContact N-O 3.32Å; G184-V239 PolarHBondContact O-N 3.33Å; W186-V239 HydrophobicContact CB-CB 4.15Å; W186-V239 HydrophobicContact CB-CG1 4.06Å; V239-W241 HydrophobicContact CG1-CE3 4.19Å; V239-W241 HydrophobicContact CG1-CZ3 3.7Å; V239-W241 HydrophobicContact CG2-CE3 4.38Å; V239-W241 VanDerWaalsContact O-CZ3 3.23Å; V239-W241 WeakPolarHBondContact O-CZ3 3.08Å
240	C	94.3	Very high	87.5	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.034	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	143.7	-178.6	-55.1	0	0	0	0	111.1	R144 C175 M178 F180 D182	R144-C240 PolarHBondContact O-N 2.91Å; C175-C240 VanDerWaalsContact CA-SG 3.55Å; C175-C240 HydrophobicContact CB-CB 3.7Å; C175-C240 WeakPolarHBondContact CB-SG 3.22Å; C175-C240 VanDerWaalsContact SG-CA 3.52Å; C175-C240 WeakPolarHBondContact SG-CB 3.07Å; C175-C240 CovalentContact SG-SG 2.04Å; C175-C240 PolarHBondContact SG-SG 2.88Å; M178-C240 VanDerWaalsContact CE-SG 3.58Å; F180-C240 HydrophobicContact CB-CB 3.8Å; F180-C240 HydrophobicContact CD2-CB 3.45Å; F180-C240 VanDerWaalsContact CD2-CB 3.45Å; F180-C240 HydrophobicContact CE2-CB 4.19Å; F180-C240 HydrophobicContact CG-CB 3.64Å; D182-C240 WeakPolarHBondContact O-CA 3.23Å
241	W	91.7	Very high	87.9	Confident	122 Å²	122	44.5 Å²	44.5	46%	0.462	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	-179.5	-178.3	62.2	80.6	0	0	0	111.7	D182 G184 V239	D182-W241 PolarHBondContact N-O 2.93Å; D182-W241 VanDerWaalsContact N-O 3.13Å; D182-W241 PolarHBondContact O-N 2.85Å; G184-W241 VanDerWaalsContact N-CZ3 3.34Å; V239-W241 HydrophobicContact CG1-CE3 4.19Å; V239-W241 HydrophobicContact CG1-CZ3 3.7Å; V239-W241 HydrophobicContact CG2-CE3 4.38Å; V239-W241 VanDerWaalsContact O-CZ3 3.23Å; V239-W241 WeakPolarHBondContact O-CZ3 3.08Å
242	G	88	Confident	88.7	Confident	21 Å²	21	38.6 Å²	38.6	22%	0.216	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92	177.7	-177.6	0	0	0	0	0	113.1
243	P	85.8	Confident	89.5	Confident	51 Å²	51	34.4 Å²	34.4	33%	0.331	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	154	-179.8	26.8	-34.6	0	0	0	111.3	D181 A296	D181-P243 HydrophobicContact CB-CG 4.1Å; D181-P243 PolarHBondContact N-O 3.44Å; P243-A296 WeakPolarHBondContact CA-O 3.02Å
244	P	88.6	Confident	90	Very high	6 Å²	6	33.6 Å²	33.6	4%	0.039	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	139.4	175.4	28.4	-34.4	0	0	0	110.9	F246 W249 Y291	P244-F246 HydrophobicContact CB-CD1 3.79Å; P244-F246 HydrophobicContact CB-CE1 3.38Å; P244-F246 HydrophobicContact CB-CZ 4.2Å; P244-F246 HydrophobicContact CG-CE1 4.5Å; P244-W249 HydrophobicContact CB-CB 3.83Å; P244-W249 HydrophobicContact CB-CG 4.23Å; P244-W249 HydrophobicContact CG-CB 3.94Å; P244-W249 HydrophobicContact CG-CD2 3.99Å; P244-W249 HydrophobicContact CG-CE3 3.73Å; P244-W249 HydrophobicContact CG-CG 4.11Å; P244-Y291 HydrophobicContact CG-CD2 3.76Å; P244-Y291 HydrophobicContact CG-CE2 3.95Å
245	T	88.5	Confident	90.4	Very high	59 Å²	59	30.3 Å²	30.3	36%	0.362	16%	0.16	S	C	.	.			trans	-121.4	2	179.6	56.5	0	0	0	0	113.1	G179 F180 D181	G179-T245 WeakPolarHBondContact CA-OG1 3.38Å; G179-T245 PolarHBondContact O-N 3.01Å; G179-T245 PolarHBondContact O-OG1 3.23Å; F180-T245 PolarHBondContact N-OG1 3.27Å; F180-T245 PolarHBondContact O-OG1 3.33Å; D181-T245 HydrophobicContact CB-CG2 3.9Å
246	F	86.2	Confident	90.7	Very high	15 Å²	15	30.2 Å²	30.2	7%	0.066	16%	0.159	C	C	.	.	S	Bend	trans	-71.2	146.8	179.8	61.5	-95.5	0	0	0	111.8	P244 G248 W249 H252 A320	P244-F246 HydrophobicContact CB-CD1 3.79Å; P244-F246 HydrophobicContact CB-CE1 3.38Å; P244-F246 HydrophobicContact CB-CZ 4.2Å; P244-F246 HydrophobicContact CG-CE1 4.5Å; F246-G248 PolarHBondContact O-N 3.35Å; F246-W249 HydrophobicContact CD1-CB 4.25Å; F246-W249 HydrophobicContact CD2-CB 3.94Å; F246-W249 HydrophobicContact CE1-CB 3.94Å; F246-W249 VanDerWaalsContact CE2-CA 3.42Å; F246-W249 HydrophobicContact CE2-CB 3.59Å; F246-W249 HydrophobicContact CG-CB 4.24Å; F246-W249 HydrophobicContact CZ-CB 3.58Å; F246-W249 WeakPolarHBondContact O-CB 3.47Å; F246-W249 PolarHBondContact O-N 3Å; F246-W249 VanDerWaalsContact O-N 3.13Å; F246-H252 AromaticContact CE2-CE1 3.59Å; F246-A320 HydrophobicContact CE1-CB 4.17Å; F246-A320 HydrophobicContact CZ-CB 3.66Å
247	P	83.3	Confident	90.9	Very high	101 Å²	101	31 Å²	31	66%	0.656	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	129.1	-178.8	-26	34.4	0	0	0	113.2	L127	L127-P247 HydrophobicContact CD1-CB 4.41Å
248	G	83.5	Confident	91	Very high	4 Å²	4	31 Å²	31	4%	0.041	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	12.9	179.6	0	0	0	0	0	115.3	F246 E250 F251 H252	F246-G248 PolarHBondContact O-N 3.35Å; G248-E250 VanDerWaalsContact C-OE2 3.22Å; G248-E250 WeakPolarHBondContact CA-OE2 3.37Å; G248-E250 PolarHBondContact N-OE2 2.01Å; G248-E250 PolarHBondContact O-N 3.01Å; G248-F251 VanDerWaalsContact CA-CD2 3.49Å; G248-F251 WeakPolarHBondContact O-CB 3.32Å; G248-F251 VanDerWaalsContact O-CD2 3.24Å; G248-F251 WeakPolarHBondContact O-CD2 3.38Å; G248-F251 PolarHBondContact O-N 3.42Å; G248-H252 PolarHBondContact O-CE1 3.03Å; G248-H252 VanDerWaalsContact O-CE1 3.28Å; G248-H252 PolarHBondContact O-ND1 3.49Å
249	W	86.2	Confident	90.8	Very high	82 Å²	82	33.7 Å²	33.7	31%	0.311	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-55.5	-32.5	172.4	71.8	-92.5	0	0	0	112.2	P244 F246 F251 H252 Y291	P244-W249 HydrophobicContact CB-CB 3.83Å; P244-W249 HydrophobicContact CB-CG 4.23Å; P244-W249 HydrophobicContact CG-CB 3.94Å; P244-W249 HydrophobicContact CG-CD2 3.99Å; P244-W249 HydrophobicContact CG-CE3 3.73Å; P244-W249 HydrophobicContact CG-CG 4.11Å; F246-W249 HydrophobicContact CD1-CB 4.25Å; F246-W249 HydrophobicContact CD2-CB 3.94Å; F246-W249 HydrophobicContact CE1-CB 3.94Å; F246-W249 VanDerWaalsContact CE2-CA 3.42Å; F246-W249 HydrophobicContact CE2-CB 3.59Å; F246-W249 HydrophobicContact CG-CB 4.24Å; F246-W249 HydrophobicContact CZ-CB 3.58Å; F246-W249 WeakPolarHBondContact O-CB 3.47Å; F246-W249 PolarHBondContact O-N 3Å; F246-W249 VanDerWaalsContact O-N 3.13Å; W249-F251 PolarHBondContact O-N 2.99Å; W249-F251 VanDerWaalsContact O-N 3.14Å; W249-H252 WeakPolarHBondContact O-CB 3.05Å; W249-H252 PolarHBondContact O-N 3.44Å; W249-H252 PolarHBondContact O-ND1 2.94Å; W249-Y291 HydrophobicContact CE3-CE1 4.41Å; W249-Y291 HydrophobicContact CE3-CE2 4.44Å; W249-Y291 AromaticContact CZ3-CE1 3.9Å; W249-Y291 HydrophobicContact CZ3-CE1 3.9Å; W249-Y291 HydrophobicContact CZ3-CE2 4.23Å; W249-Y291 AromaticContact CZ3-CZ 3.75Å
250	E	85.3	Confident	90.4	Very high	79 Å²	79	33.7 Å²	33.7	37%	0.369	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-61.6	-22.4	-179.3	66.3	-83.5	-166.3	0	0	113.3	S95 G248 H252	S95-E250 WeakPolarHBondContact CB-O 3.36Å; S95-E250 PolarHBondContact OG-O 2.99Å; G248-E250 VanDerWaalsContact C-OE2 3.22Å; G248-E250 WeakPolarHBondContact CA-OE2 3.37Å; G248-E250 PolarHBondContact N-OE2 2.01Å; G248-E250 PolarHBondContact O-N 3.01Å; E250-H252 VanDerWaalsContact C-N 3.25Å; E250-H252 PolarHBondContact O-N 3.35Å
251	F	88.4	Confident	90.1	Very high	26 Å²	26	33.5 Å²	33.5	11%	0.114	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-75.9	-14.7	176.4	-56.3	-51.9	0	0	0	113.2	P119 L121 P123 L127 G248 W249	P119-F251 WeakPolarHBondContact CB-O 3.47Å; L121-F251 HydrophobicContact CB-CD1 3.62Å; L121-F251 HydrophobicContact CB-CE1 3.65Å; L121-F251 HydrophobicContact CD1-CD1 4.06Å; L121-F251 HydrophobicContact CD1-CE1 3.76Å; L121-F251 HydrophobicContact CG-CD1 4.41Å; L121-F251 HydrophobicContact CG-CE1 4.34Å; P123-F251 HydrophobicContact CB-CD2 4.01Å; P123-F251 HydrophobicContact CB-CE2 4.41Å; P123-F251 HydrophobicContact CB-CG 4.37Å; P123-F251 HydrophobicContact CG-CB 4.11Å; P123-F251 HydrophobicContact CG-CD2 4.23Å; P123-F251 HydrophobicContact CG-CG 4.12Å; L127-F251 HydrophobicContact CD2-CD2 4.18Å; L127-F251 HydrophobicContact CD2-CE2 4.44Å; G248-F251 VanDerWaalsContact CA-CD2 3.49Å; G248-F251 WeakPolarHBondContact O-CB 3.32Å; G248-F251 VanDerWaalsContact O-CD2 3.24Å; G248-F251 WeakPolarHBondContact O-CD2 3.38Å; G248-F251 PolarHBondContact O-N 3.42Å; W249-F251 PolarHBondContact O-N 2.99Å; W249-F251 VanDerWaalsContact O-N 3.14Å
252	H	92.1	Very high	90.1	Very high	8 Å²	8	29.5 Å²	29.5	4%	0.037	16%	0.163	C	C	.	.			trans	-80.1	131.5	-169.7	-64.3	67.5	0	0	0	111.4	G96 F246 G248 W249 E250 Y288 Y318 A320	G96-H252 PolarHBondContact N-O 3.28Å; F246-H252 AromaticContact CE2-CE1 3.59Å; G248-H252 PolarHBondContact O-CE1 3.03Å; G248-H252 VanDerWaalsContact O-CE1 3.28Å; G248-H252 PolarHBondContact O-ND1 3.49Å; W249-H252 WeakPolarHBondContact O-CB 3.05Å; W249-H252 PolarHBondContact O-N 3.44Å; W249-H252 PolarHBondContact O-ND1 2.94Å; E250-H252 VanDerWaalsContact C-N 3.25Å; E250-H252 PolarHBondContact O-N 3.35Å; H252-Y288 CarbonylContact C-O 3.47Å; H252-Y288 WeakPolarHBondContact CA-O 3.37Å; H252-Y318 PolarHBondContact CD2-O 3.08Å; H252-Y318 PolarHBondContact NE2-O 2.87Å; H252-Y318 VanDerWaalsContact NE2-O 3.16Å; H252-A320 HydrophobicContact CB-CB 4.41Å
253	W	95.3	Very high	90.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-96.1	170.2	172.7	65.7	-82.8	0	0	0	110.4	F93 V97 M117 G255 L256 I286 W287 Y288 A289 G290 Y291	F93-W253 HydrophobicContact CB-CB 3.43Å; F93-W253 VanDerWaalsContact CB-CB 3.43Å; F93-W253 HydrophobicContact CB-CD2 3.91Å; F93-W253 HydrophobicContact CB-CE3 4.11Å; F93-W253 HydrophobicContact CB-CG 3.63Å; F93-W253 HydrophobicContact CD1-CD2 4.41Å; F93-W253 AromaticContact CD1-CE3 3.77Å; F93-W253 HydrophobicContact CD1-CE3 3.77Å; F93-W253 HydrophobicContact CD1-CZ3 4.22Å; F93-W253 AromaticContact CD2-CD2 3.85Å; F93-W253 HydrophobicContact CD2-CD2 3.85Å; F93-W253 AromaticContact CD2-CE3 3.83Å; F93-W253 HydrophobicContact CD2-CE3 3.83Å; F93-W253 HydrophobicContact CD2-CG 4.34Å; F93-W253 HydrophobicContact CD2-CH2 4.43Å; F93-W253 HydrophobicContact CD2-CZ2 4.41Å; F93-W253 HydrophobicContact CD2-CZ3 4.12Å; F93-W253 HydrophobicContact CE1-CE3 4.1Å; F93-W253 HydrophobicContact CE1-CZ3 4.07Å; F93-W253 HydrophobicContact CE2-CD2 4.48Å; F93-W253 HydrophobicContact CE2-CE3 4.15Å; F93-W253 HydrophobicContact CE2-CH2 4.14Å; F93-W253 HydrophobicContact CE2-CZ2 4.42Å; F93-W253 AromaticContact CE2-CZ3 3.97Å; F93-W253 HydrophobicContact CE2-CZ3 3.97Å; F93-W253 HydrophobicContact CG-CB 4.26Å; F93-W253 AromaticContact CG-CD2 3.81Å; F93-W253 HydrophobicContact CG-CD2 3.81Å; F93-W253 AromaticContact CG-CE3 3.63Å; F93-W253 HydrophobicContact CG-CE3 3.63Å; F93-W253 HydrophobicContact CG-CG 4.09Å; F93-W253 HydrophobicContact CG-CZ3 4.25Å; F93-W253 HydrophobicContact CZ-CE3 4.28Å; F93-W253 HydrophobicContact CZ-CH2 4.41Å; F93-W253 AromaticContact CZ-CZ3 3.94Å; F93-W253 HydrophobicContact CZ-CZ3 3.94Å; V97-W253 WeakPolarHBondContact O-CB 2.99Å; M117-W253 HydrophobicContact CB-CH2 3.99Å; M117-W253 HydrophobicContact CB-CZ2 3.73Å; M117-W253 HydrophobicContact SD-CH2 4.12Å; W253-G255 VanDerWaalsContact C-N 3.34Å; W253-G255 VanDerWaalsContact CZ3-O 3.3Å; W253-G255 WeakPolarHBondContact CZ3-O 3.39Å; W253-G255 PolarHBondContact O-N 3.22Å; W253-L256 HydrophobicContact CH2-CD2 4.05Å; W253-L256 HydrophobicContact CH2-CG 4.33Å; W253-L256 HydrophobicContact CZ3-CD2 4.13Å; W253-I286 HydrophobicContact CH2-CG2 4.16Å; W253-I286 HydrophobicContact CZ2-CG2 3.76Å; W253-W287 PolarHBondContact NE1-O 2.95Å; W253-Y288 PolarHBondContact N-O 3.44Å; W253-A289 HydrophobicContact CD2-CB 4.17Å; W253-A289 HydrophobicContact CH2-CB 4.4Å; W253-A289 HydrophobicContact CZ2-CB 3.8Å; W253-A289 CarbonylContact O-C 3.51Å; W253-A289 VanDerWaalsContact O-C 3.3Å; W253-A289 WeakPolarHBondContact O-CA 3.46Å; W253-G290 PolarHBondContact O-N 3.22Å; W253-Y291 CarbonylContact C-O 3.55Å; W253-Y291 PolarHBondContact O-N 3.26Å
254	K	95.2	Very high	90.4	Very high	19 Å²	19	33 Å²	33	8%	0.083	17%	0.166	C	C	.	.			trans	-66.5	-32.5	-170.2	178.2	-179.7	174.8	-178.4	0	114	V97 E257 Y291 D292 T299	V97-K254 PolarHBondContact O-N 2.91Å; K254-E257 WeakPolarHBondContact CE-OE2 3.36Å; K254-E257 IonicContact NZ-OE2 3.43Å; K254-E257 PolarHBondContact NZ-OE2 3.01Å; K254-Y291 WeakPolarHBondContact CA-O 3.25Å; K254-Y291 WeakPolarHBondContact CB-O 3.46Å; K254-Y291 PolarHBondContact N-O 2.87Å; K254-D292 HydrophobicContact CD-CB 4.34Å; K254-D292 VanDerWaalsContact CE-OD2 3.27Å; K254-D292 WeakPolarHBondContact CE-OD2 3.49Å; K254-D292 HydrophobicContact CG-CB 4.15Å; K254-D292 IonicContact NZ-OD2 2.68Å; K254-T299 HydrophobicContact CG-CG2 4.41Å; K254-T299 VanDerWaalsContact O-CG2 3.31Å; K254-T299 WeakPolarHBondContact O-CG2 3.43Å
255	G	96.2	Very high	90.3	Very high	1 Å²	1	38 Å²	38	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.9	-167.7	-170.6	0	0	0	0	0	112.3	I99 W253 A301	I99-G255 PolarHBondContact N-O 2.85Å; I99-G255 VanDerWaalsContact N-O 3.16Å; W253-G255 VanDerWaalsContact C-N 3.34Å; W253-G255 VanDerWaalsContact CZ3-O 3.3Å; W253-G255 WeakPolarHBondContact CZ3-O 3.39Å; W253-G255 PolarHBondContact O-N 3.22Å; G255-A301 CarbonylContact C-O 3.58Å; G255-A301 VanDerWaalsContact CA-O 3.27Å; G255-A301 WeakPolarHBondContact CA-O 3.26Å
256	L	97.5	Very high	90.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.5	175.5	-48.7	-179.3	0	0	0	109.5	I99 L105 M117 W253 F258 L281 I286 A301 L302 L303	I99-L256 HydrophobicContact CB-CD2 3.66Å; I99-L256 HydrophobicContact CD1-CD2 3.74Å; I99-L256 HydrophobicContact CG1-CD2 3.77Å; L105-L256 HydrophobicContact CD2-CD1 4.37Å; M117-L256 HydrophobicContact CE-CD1 4.26Å; M117-L256 HydrophobicContact CE-CD2 4.36Å; M117-L256 HydrophobicContact SD-CD1 3.95Å; M117-L256 HydrophobicContact SD-CD2 3.8Å; M117-L256 HydrophobicContact SD-CG 4.23Å; W253-L256 HydrophobicContact CH2-CD2 4.05Å; W253-L256 HydrophobicContact CH2-CG 4.33Å; W253-L256 HydrophobicContact CZ3-CD2 4.13Å; L256-F258 HydrophobicContact CB-CE2 4Å; L256-F258 HydrophobicContact CD1-CE2 4.48Å; L256-L281 HydrophobicContact CD1-CD1 4.06Å; L256-L281 HydrophobicContact CD1-CD2 4.04Å; L256-I286 HydrophobicContact CD1-CD1 3.84Å; L256-I286 HydrophobicContact CG-CD1 4.46Å; L256-A301 PolarHBondContact N-O 2.97Å; L256-L302 HydrophobicContact CB-CD2 3.7Å; L256-L302 HydrophobicContact CD1-CD2 3.71Å; L256-L302 HydrophobicContact CG-CD2 3.93Å; L256-L303 PolarHBondContact O-N 3.39Å
257	E	96.8	Very high	90.1	Very high	15 Å²	15	40.8 Å²	40.8	7%	0.07	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	112	177.4	-171.9	-178.4	-179.6	0	0	109.7	I99 T100 V101 K254 Q259 L303	I99-E257 PolarHBondContact O-N 3.14Å; T100-E257 CarbonylContact C-O 3.55Å; T100-E257 WeakPolarHBondContact CA-O 3.34Å; T100-E257 PolarHBondContact OG1-OE2 3.44Å; V101-E257 PolarHBondContact N-O 2.82Å; K254-E257 WeakPolarHBondContact CE-OE2 3.36Å; K254-E257 IonicContact NZ-OE2 3.43Å; K254-E257 PolarHBondContact NZ-OE2 3.01Å; E257-Q259 VanDerWaalsContact CD-NE2 3.35Å; E257-Q259 HydrophobicContact CG-CG 4.06Å; E257-Q259 PolarHBondContact OE1-NE2 2.95Å; E257-L303 CarbonylContact C-O 3.53Å; E257-L303 VanDerWaalsContact CA-O 3.25Å; E257-L303 WeakPolarHBondContact CA-O 3.23Å; E257-L303 HydrophobicContact CG-CB 4.48Å; E257-L303 HydrophobicContact CG-CD2 4.2Å; E257-L303 HydrophobicContact CG-CG 4.44Å
258	F	96	Very high	89.7	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.009	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	117	173.6	-68.1	-94.9	0	0	0	109.3	V101 L105 L256 A261 L281 L303 I304 H305 P309	V101-F258 HydrophobicContact CB-CD1 3.81Å; V101-F258 HydrophobicContact CB-CE1 4.07Å; V101-F258 HydrophobicContact CB-CG 4.43Å; V101-F258 HydrophobicContact CG1-CD1 3.91Å; V101-F258 HydrophobicContact CG1-CE1 3.99Å; V101-F258 HydrophobicContact CG2-CD1 4.32Å; V101-F258 HydrophobicContact CG2-CE1 4.15Å; L105-F258 HydrophobicContact CB-CE1 4.06Å; L105-F258 HydrophobicContact CB-CZ 4.34Å; L105-F258 HydrophobicContact CD2-CE1 4.45Å; L105-F258 HydrophobicContact CD2-CZ 3.97Å; L256-F258 HydrophobicContact CB-CE2 4Å; L256-F258 HydrophobicContact CD1-CE2 4.48Å; F258-A261 HydrophobicContact CB-CB 4.45Å; F258-A261 HydrophobicContact CD1-CB 4.03Å; F258-L281 HydrophobicContact CE2-CD1 4.16Å; F258-L281 HydrophobicContact CZ-CD1 4.26Å; F258-L281 HydrophobicContact CZ-CD2 4.37Å; F258-L281 HydrophobicContact CZ-CG 4.42Å; F258-L303 PolarHBondContact N-O 3.13Å; F258-I304 HydrophobicContact CB-CG1 4.36Å; F258-I304 HydrophobicContact CB-CG2 4.45Å; F258-I304 HydrophobicContact CD2-CG1 3.92Å; F258-I304 HydrophobicContact CG-CG1 4.5Å; F258-H305 PolarHBondContact O-N 3.09Å; F258-P309 HydrophobicContact CD2-CG 4.28Å; F258-P309 HydrophobicContact CE1-CB 4.44Å; F258-P309 HydrophobicContact CE1-CG 4.42Å; F258-P309 HydrophobicContact CE2-CG 3.96Å; F258-P309 HydrophobicContact CZ-CB 4.3Å; F258-P309 HydrophobicContact CZ-CG 4.02Å
259	Q	92.8	Very high	89	Confident	56 Å²	56	40.7 Å²	40.7	26%	0.262	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	95.9	-178.5	-66.7	-179.4	-9.5	0	0	109.3	T100 V101 Q102 E257 A261	T100-Q259 HydrophobicContact CG2-CG 4.13Å; V101-Q259 PolarHBondContact O-N 3.31Å; Q102-Q259 HydrophobicContact CG-CB 3.99Å; E257-Q259 VanDerWaalsContact CD-NE2 3.35Å; E257-Q259 HydrophobicContact CG-CG 4.06Å; E257-Q259 PolarHBondContact OE1-NE2 2.95Å; Q259-A261 PolarHBondContact O-N 3.02Å; Q259-A261 VanDerWaalsContact O-N 3.1Å
260	D	87	Confident	88.4	Confident	35 Å²	35	40.1 Å²	40.1	19%	0.187	22%	0.219	C	C	.	.	S	Bend	trans	49	41.2	179.1	-68.8	-39.1	0	0	0	113.2	H305 Y399	D260-H305 VanDerWaalsContact CG-ND1 3.26Å; D260-H305 PolarHBondContact N-O 2.86Å; D260-H305 IonicContact OD1-CE1 3.46Å; D260-H305 PolarHBondContact OD1-CE1 3.46Å; D260-H305 IonicContact OD1-CG 3.48Å; D260-H305 IonicContact OD1-ND1 3.67Å; D260-H305 PolarHBondContact OD1-ND1 3.37Å; D260-H305 IonicContact OD2-CE1 2.82Å; D260-H305 IonicContact OD2-ND1 2.7Å; D260-H305 PolarHBondContact OD2-ND1 2.93Å; D260-Y399 PolarHBondContact OD2-OH 3.2Å
261	A	88.5	Confident	88.1	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.008	22%	0.215	C	C	.	.			trans	-56.4	147.5	-177.7	0	0	0	0	0	111.6	F258 Q259	F258-A261 HydrophobicContact CB-CB 4.45Å; F258-A261 HydrophobicContact CD1-CB 4.03Å; Q259-A261 PolarHBondContact O-N 3.02Å; Q259-A261 VanDerWaalsContact O-N 3.1Å
262	P	90.1	Very high	87.8	Confident	37 Å²	37	38.1 Å²	38.1	24%	0.24	21%	0.214	C	C	.	.			trans	-68.3	143.7	-171.5	31.4	-35.1	0	0	0	110.8	Q102 G103 V104 K278	Q102-P262 WeakPolarHBondContact O-CD 3.24Å; G103-P262 WeakPolarHBondContact O-CD 3.39Å; V104-P262 HydrophobicContact CG2-CG 3.6Å; P262-K278 HydrophobicContact CB-CD 4.22Å; P262-K278 HydrophobicContact CG-CD 4.39Å; P262-K278 WeakPolarHBondContact O-CB 3.31Å; P262-K278 PolarHBondContact O-N 3.4Å
263	W	90.7	Very high	87.5	Confident	68 Å²	68	38.9 Å²	38.9	26%	0.258	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	172.3	-177.8	52.4	-93.9	0	0	0	109.9	Y265 K275 E276 V307	W263-Y265 AromaticContact CH2-CE2 3.77Å; W263-Y265 HydrophobicContact CH2-CE2 3.77Å; W263-Y265 AromaticContact CH2-CZ 3.78Å; W263-Y265 HydrophobicContact CZ3-CD1 4.32Å; W263-Y265 AromaticContact CZ3-CD2 3.78Å; W263-Y265 HydrophobicContact CZ3-CD2 3.78Å; W263-Y265 HydrophobicContact CZ3-CE1 4.03Å; W263-Y265 AromaticContact CZ3-CE2 3.44Å; W263-Y265 HydrophobicContact CZ3-CE2 3.44Å; W263-Y265 VanDerWaalsContact CZ3-CE2 3.44Å; W263-Y265 HydrophobicContact CZ3-CG 4.21Å; W263-Y265 AromaticContact CZ3-CZ 3.57Å; W263-K275 HydrophobicContact CD2-CB 4.25Å; W263-K275 HydrophobicContact CD2-CD 4.05Å; W263-K275 HydrophobicContact CD2-CG 4.19Å; W263-K275 HydrophobicContact CE3-CB 3.92Å; W263-K275 HydrophobicContact CE3-CD 3.99Å; W263-K275 HydrophobicContact CE3-CG 3.69Å; W263-K275 HydrophobicContact CH2-CD 3.84Å; W263-K275 HydrophobicContact CH2-CG 4.12Å; W263-K275 HydrophobicContact CZ2-CD 3.87Å; W263-K275 HydrophobicContact CZ3-CB 4.4Å; W263-K275 HydrophobicContact CZ3-CD 3.9Å; W263-K275 HydrophobicContact CZ3-CG 3.67Å; W263-E276 CarbonylContact C-O 3.53Å; W263-E276 VanDerWaalsContact CA-O 3.24Å; W263-E276 WeakPolarHBondContact CA-O 3.38Å; W263-E276 VanDerWaalsContact CB-O 3.25Å; W263-E276 WeakPolarHBondContact CB-O 3.34Å; W263-V307 HydrophobicContact CB-CB 4.19Å; W263-V307 HydrophobicContact CB-CG1 4.15Å; W263-V307 HydrophobicContact CB-CG2 4.26Å; W263-V307 HydrophobicContact CD2-CG2 4.4Å; W263-V307 HydrophobicContact CG-CB 4.25Å; W263-V307 HydrophobicContact CG-CG2 3.83Å
264	H	89.2	Confident	87	Confident	79 Å²	79	40.1 Å²	40.1	37%	0.366	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	162.9	173.1	63.4	-63	0	0	0	110.1	V266 E276	H264-V266 VanDerWaalsContact NE2-CG2 3.33Å; H264-V266 WeakPolarHBondContact NE2-CG2 3.3Å; H264-E276 PolarHBondContact N-O 3.17Å; H264-E276 PolarHBondContact ND1-O 2.61Å; H264-E276 PolarHBondContact O-N 3.38Å
265	Y	86.9	Confident	86.6	Confident	111 Å²	111	40 Å²	40	44%	0.435	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.8	175.5	-76.3	-69.1	0	0	0	110.9	W263 I273 K274 K275	W263-Y265 AromaticContact CH2-CE2 3.77Å; W263-Y265 HydrophobicContact CH2-CE2 3.77Å; W263-Y265 AromaticContact CH2-CZ 3.78Å; W263-Y265 HydrophobicContact CZ3-CD1 4.32Å; W263-Y265 AromaticContact CZ3-CD2 3.78Å; W263-Y265 HydrophobicContact CZ3-CD2 3.78Å; W263-Y265 HydrophobicContact CZ3-CE1 4.03Å; W263-Y265 AromaticContact CZ3-CE2 3.44Å; W263-Y265 HydrophobicContact CZ3-CE2 3.44Å; W263-Y265 VanDerWaalsContact CZ3-CE2 3.44Å; W263-Y265 HydrophobicContact CZ3-CG 4.21Å; W263-Y265 AromaticContact CZ3-CZ 3.57Å; Y265-I273 HydrophobicContact CD1-CB 4.33Å; Y265-I273 HydrophobicContact CD1-CD1 3.56Å; Y265-I273 HydrophobicContact CD1-CG1 4.06Å; Y265-I273 HydrophobicContact CE1-CD1 3.87Å; Y265-I273 HydrophobicContact CE1-CG1 4.45Å; Y265-I273 HydrophobicContact CG-CD1 3.92Å; Y265-K274 WeakPolarHBondContact CA-O 3.4Å; Y265-K275 HydrophobicContact CD1-CG 4.12Å; Y265-K275 HydrophobicContact CE1-CG 3.58Å; Y265-K275 WeakPolarHBondContact OH-CE 3.33Å
266	V	86.5	Confident	86.4	Confident	33 Å²	33	42 Å²	42	20%	0.2	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.1	177.3	-179.7	0	0	0	0	109.5	H264 I273 K274 E276	H264-V266 VanDerWaalsContact NE2-CG2 3.33Å; H264-V266 WeakPolarHBondContact NE2-CG2 3.3Å; V266-I273 CarbonylContact O-C 3.52Å; V266-I273 WeakPolarHBondContact O-CA 3.44Å; V266-K274 HydrophobicContact CB-CG 4.47Å; V266-K274 PolarHBondContact N-O 3.3Å; V266-K274 PolarHBondContact O-N 2.91Å; V266-E276 HydrophobicContact CB-CB 4.39Å; V266-E276 HydrophobicContact CG2-CB 3.78Å; V266-E276 HydrophobicContact CG2-CG 4.45Å; V266-E276 VanDerWaalsContact CG2-OE2 3.31Å; V266-E276 WeakPolarHBondContact CG2-OE2 3.24Å
267	P	84	Confident	86.1	Confident	98 Å²	98	42.2 Å²	42.2	64%	0.636	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	132.3	175.6	29	-33.8	0	0	0	111.4
268	L	75	Confident	86	Confident	81 Å²	81	46.1 Å²	46.1	42%	0.424	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-55.9	174.9	-89.6	161.9	0	0	0	111.6	S272 K274	L268-S272 PolarHBondContact N-O 2.95Å; L268-K274 HydrophobicContact CD1-CB 3.71Å; L268-K274 HydrophobicContact CD1-CD 4.1Å; L268-K274 HydrophobicContact CD1-CG 4.03Å; L268-K274 HydrophobicContact CD2-CD 3.97Å; L268-K274 HydrophobicContact CG-CB 4.2Å; L268-K274 HydrophobicContact CG-CD 3.94Å; L268-K274 HydrophobicContact CG-CG 3.95Å
269	S	70.3	Confident	85.9	Confident	23 Å²	23	46 Å²	46	16%	0.161	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	119	174.9	60.2	0	0	0	0	110.9	V271 S272	S269-V271 PolarHBondContact O-N 3.49Å; S269-S272 PolarHBondContact O-N 2.9Å
270	G	73.4	Confident	86.1	Confident	70 Å²	70	47.4 Å²	47.4	72%	0.722	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	-85.1	179.6	0	0	0	0	0	115.1
271	V	78.5	Confident	86.6	Confident	49 Å²	49	45.7 Å²	45.7	30%	0.297	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-9.3	-177	-62.7	0	0	0	0	114.2	S269 S420 F421 I521	S269-V271 PolarHBondContact O-N 3.49Å; V271-S420 CarbonylContact O-C 3.14Å; V271-S420 WeakPolarHBondContact O-CA 3.29Å; V271-F421 HydrophobicContact CB-CD2 4.2Å; V271-F421 HydrophobicContact CG2-CD2 4.15Å; V271-F421 PolarHBondContact O-N 3.38Å; V271-I521 HydrophobicContact CG2-CG1 4.46Å
272	S	82.7	Confident	87	Confident	13 Å²	13	46.9 Å²	46.9	9%	0.091	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.6	-178	-160	0	0	0	0	111.1	L268 S269 S519	L268-S272 PolarHBondContact N-O 2.95Å; S269-S272 PolarHBondContact O-N 2.9Å; S272-S519 VanDerWaalsContact CB-O 3.28Å; S272-S519 WeakPolarHBondContact CB-O 3.45Å; S272-S519 PolarHBondContact OG-O 2.93Å; S272-S519 VanDerWaalsContact OG-O 3.11Å
273	I	85.4	Confident	87.4	Confident	25 Å²	25	46.3 Å²	46.3	13%	0.128	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.9	172	59.2	171.7	0	0	0	110.1	Y265 V266 S420 F421	Y265-I273 HydrophobicContact CD1-CB 4.33Å; Y265-I273 HydrophobicContact CD1-CD1 3.56Å; Y265-I273 HydrophobicContact CD1-CG1 4.06Å; Y265-I273 HydrophobicContact CE1-CD1 3.87Å; Y265-I273 HydrophobicContact CE1-CG1 4.45Å; Y265-I273 HydrophobicContact CG-CD1 3.92Å; V266-I273 CarbonylContact O-C 3.52Å; V266-I273 WeakPolarHBondContact O-CA 3.44Å; I273-S420 WeakPolarHBondContact CD1-OG 3.29Å; I273-F421 WeakPolarHBondContact CG1-O 3.48Å; I273-F421 PolarHBondContact N-O 3.49Å
274	K	85.3	Confident	87.7	Confident	26 Å²	26	43.1 Å²	43.1	11%	0.113	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	152.4	169.7	63.9	175.2	-174.4	178	0	111	Y265 V266 L268 P332 E334	Y265-K274 WeakPolarHBondContact CA-O 3.4Å; V266-K274 HydrophobicContact CB-CG 4.47Å; V266-K274 PolarHBondContact N-O 3.3Å; V266-K274 PolarHBondContact O-N 2.91Å; L268-K274 HydrophobicContact CD1-CB 3.71Å; L268-K274 HydrophobicContact CD1-CD 4.1Å; L268-K274 HydrophobicContact CD1-CG 4.03Å; L268-K274 HydrophobicContact CD2-CD 3.97Å; L268-K274 HydrophobicContact CG-CB 4.2Å; L268-K274 HydrophobicContact CG-CD 3.94Å; L268-K274 HydrophobicContact CG-CG 3.95Å; K274-P332 HydrophobicContact CB-CG 3.99Å; K274-P332 HydrophobicContact CD-CG 3.92Å; K274-P332 HydrophobicContact CG-CG 4.49Å; K274-E334 IonicContact NZ-OE1 3.18Å; K274-E334 PolarHBondContact NZ-OE1 3.28Å; K274-E334 IonicContact NZ-OE2 2.99Å
275	K	87	Confident	88.1	Confident	17 Å²	17	39.9 Å²	39.9	7%	0.074	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	127.8	162.9	-62.4	-177	-174.7	158.3	0	107.5	W263 Y265 V307 D330 E402	W263-K275 HydrophobicContact CD2-CB 4.25Å; W263-K275 HydrophobicContact CD2-CD 4.05Å; W263-K275 HydrophobicContact CD2-CG 4.19Å; W263-K275 HydrophobicContact CE3-CB 3.92Å; W263-K275 HydrophobicContact CE3-CD 3.99Å; W263-K275 HydrophobicContact CE3-CG 3.69Å; W263-K275 HydrophobicContact CH2-CD 3.84Å; W263-K275 HydrophobicContact CH2-CG 4.12Å; W263-K275 HydrophobicContact CZ2-CD 3.87Å; W263-K275 HydrophobicContact CZ3-CB 4.4Å; W263-K275 HydrophobicContact CZ3-CD 3.9Å; W263-K275 HydrophobicContact CZ3-CG 3.67Å; Y265-K275 HydrophobicContact CD1-CG 4.12Å; Y265-K275 HydrophobicContact CE1-CG 3.58Å; Y265-K275 WeakPolarHBondContact OH-CE 3.33Å; K275-V307 HydrophobicContact CB-CG1 4.32Å; K275-V307 HydrophobicContact CB-CG2 4.14Å; K275-V307 HydrophobicContact CD-CG2 4.13Å; K275-D330 WeakPolarHBondContact CD-O 3.48Å; K275-D330 IonicContact NZ-OD1 2.95Å; K275-D330 PolarHBondContact NZ-OD1 3.34Å; K275-D330 IonicContact NZ-OD2 2.63Å; K275-D330 PolarHBondContact NZ-OD2 3.5Å; K275-E402 IonicContact NZ-OE1 3.67Å
276	E	89.9	Confident	88.6	Confident	42 Å²	42	34.6 Å²	34.6	20%	0.196	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.4	175.7	-173.2	168.2	160.7	0	0	108.5	W263 H264 V266	W263-E276 CarbonylContact C-O 3.53Å; W263-E276 VanDerWaalsContact CA-O 3.24Å; W263-E276 WeakPolarHBondContact CA-O 3.38Å; W263-E276 VanDerWaalsContact CB-O 3.25Å; W263-E276 WeakPolarHBondContact CB-O 3.34Å; H264-E276 PolarHBondContact N-O 3.17Å; H264-E276 PolarHBondContact ND1-O 2.61Å; H264-E276 PolarHBondContact O-N 3.38Å; V266-E276 HydrophobicContact CB-CB 4.39Å; V266-E276 HydrophobicContact CG2-CB 3.78Å; V266-E276 HydrophobicContact CG2-CG 4.45Å; V266-E276 VanDerWaalsContact CG2-OE2 3.31Å; V266-E276 WeakPolarHBondContact CG2-OE2 3.24Å
277	S	92.6	Very high	89	Confident	5 Å²	5	36.8 Å²	36.8	4%	0.035	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	140.8	176.9	-174.2	0	0	0	0	110	S279 A308	S277-S279 PolarHBondContact O-N 3.24Å; S277-S279 PolarHBondContact OG-N 3.06Å; S277-A308 WeakPolarHBondContact CB-O 3.23Å
278	K	93.5	Very high	89.5	Confident	98 Å²	98	33.3 Å²	33.3	43%	0.426	18%	0.175	S	C	.	.	S	Bend	trans	-73.3	-17.3	171.6	-67.2	-178.6	-176.7	177.8	0	111.8	V104 N106 P262	V104-K278 HydrophobicContact CG1-CB 4.12Å; V104-K278 VanDerWaalsContact CG1-O 3.31Å; V104-K278 WeakPolarHBondContact CG1-O 3.39Å; V104-K278 HydrophobicContact CG2-CB 3.75Å; V104-K278 HydrophobicContact CG2-CD 4.24Å; N106-K278 PolarHBondContact OD1-O 3.33Å; P262-K278 HydrophobicContact CB-CD 4.22Å; P262-K278 HydrophobicContact CG-CD 4.39Å; P262-K278 WeakPolarHBondContact O-CB 3.31Å; P262-K278 PolarHBondContact O-N 3.4Å
279	S	95.8	Very high	90.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.			trans	-84.8	142.1	178.1	-61.7	0	0	0	0	111.4	L105 S277 P309 F310	L105-S279 PolarHBondContact N-OG 3.02Å; L105-S279 CarbonylContact O-C 3.56Å; L105-S279 VanDerWaalsContact O-CA 3.24Å; L105-S279 WeakPolarHBondContact O-CA 3.46Å; L105-S279 VanDerWaalsContact O-CB 3.31Å; L105-S279 WeakPolarHBondContact O-CB 3.4Å; S277-S279 PolarHBondContact O-N 3.24Å; S277-S279 PolarHBondContact OG-N 3.06Å; S279-P309 WeakPolarHBondContact O-CA 3.44Å; S279-P309 WeakPolarHBondContact O-CB 3.47Å; S279-F310 PolarHBondContact O-N 2.95Å
280	R	96.5	Very high	91.6	Very high	84 Å²	84	28.4 Å²	28.4	32%	0.317	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134.1	-178.2	-61.2	-175.8	73.9	122.6	-0.8	110.9	L105 A107 I108 E282	L105-R280 PolarHBondContact O-N 3.28Å; A107-R280 PolarHBondContact N-O 2.85Å; I108-R280 HydrophobicContact CD1-CB 4.3Å; I108-R280 HydrophobicContact CG1-CB 4.21Å; R280-E282 IonicContact CZ-OE1 3.51Å; R280-E282 IonicContact NE-OE1 3.55Å; R280-E282 PolarHBondContact NE-OE1 3.34Å; R280-E282 IonicContact NH2-OE1 2.7Å; R280-E282 PolarHBondContact NH2-OE1 2.93Å; R280-E282 IonicContact NH2-OE2 3.99Å
281	L	97.4	Very high	92.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	100.7	173	-60.9	-179.3	0	0	0	108.4	L105 A107 L256 F258 V284 L302 P309 F310 M311 N312 I314	L105-L281 HydrophobicContact CD2-CD2 4.23Å; A107-L281 HydrophobicContact CB-CD2 3.97Å; L256-L281 HydrophobicContact CD1-CD1 4.06Å; L256-L281 HydrophobicContact CD1-CD2 4.04Å; F258-L281 HydrophobicContact CE2-CD1 4.16Å; F258-L281 HydrophobicContact CZ-CD1 4.26Å; F258-L281 HydrophobicContact CZ-CD2 4.37Å; F258-L281 HydrophobicContact CZ-CG 4.42Å; L281-V284 HydrophobicContact CB-CG2 4.48Å; L281-L302 HydrophobicContact CD1-CD1 4.4Å; L281-L302 HydrophobicContact CD1-CD2 3.97Å; L281-P309 HydrophobicContact CD1-CG 4.13Å; L281-P309 HydrophobicContact CG-CB 4.41Å; L281-P309 HydrophobicContact CG-CG 4.44Å; L281-F310 PolarHBondContact N-O 2.88Å; L281-M311 HydrophobicContact CD1-CG 4.48Å; L281-N312 PolarHBondContact O-N 3.4Å; L281-N312 VanDerWaalsContact O-N 3.11Å; L281-I314 HydrophobicContact CB-CG2 4.05Å
282	E	97.5	Very high	93.2	Very high	25 Å²	25	23.8 Å²	23.8	12%	0.117	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.9	-178.3	-60.1	-167.9	-124	0	0	111.6	A107 I108 G109 R280 V284 F310 N312	A107-E282 PolarHBondContact O-N 2.76Å; I108-E282 HydrophobicContact CG2-CB 4.33Å; G109-E282 PolarHBondContact N-O 2.94Å; R280-E282 IonicContact CZ-OE1 3.51Å; R280-E282 IonicContact NE-OE1 3.55Å; R280-E282 PolarHBondContact NE-OE1 3.34Å; R280-E282 IonicContact NH2-OE1 2.7Å; R280-E282 PolarHBondContact NH2-OE1 2.93Å; R280-E282 IonicContact NH2-OE2 3.99Å; E282-V284 WeakPolarHBondContact O-CG2 3.12Å; E282-V284 PolarHBondContact O-N 3.25Å; E282-F310 HydrophobicContact CG-CD1 4.19Å; E282-F310 HydrophobicContact CG-CE1 4.43Å; E282-N312 VanDerWaalsContact CA-O 3.25Å; E282-N312 WeakPolarHBondContact CA-O 3.41Å; E282-N312 HydrophobicContact CG-CB 4.2Å; E282-N312 PolarHBondContact OE2-ND2 2.86Å
283	H	97.6	Very high	93.6	Very high	26 Å²	26	29 Å²	29	12%	0.12	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.9	51.4	-177.4	-65.5	-70.9	0	0	0	112.5	Q114 I115 N312 Y313	Q114-H283 WeakPolarHBondContact CA-O 3.11Å; Q114-H283 WeakPolarHBondContact CB-O 3.1Å; Q114-H283 HydrophobicContact CG-CB 4.28Å; I115-H283 PolarHBondContact N-O 3.18Å; H283-N312 PolarHBondContact N-O 2.85Å; H283-N312 VanDerWaalsContact N-O 3.13Å; H283-Y313 VanDerWaalsContact CA-O 3.25Å; H283-Y313 WeakPolarHBondContact CA-O 3.46Å; H283-Y313 AromaticContact CE1-CD1 3.83Å; H283-Y313 AromaticContact CE1-CD2 3.4Å; H283-Y313 WeakPolarHBondContact CE1-CD2 3.26Å; H283-Y313 AromaticContact CE1-CG 3.3Å; H283-Y313 PolarHBondContact N-O 2.89Å; H283-Y313 VanDerWaalsContact ND1-CB 3.34Å; H283-Y313 WeakPolarHBondContact ND1-CB 3.3Å; H283-Y313 AromaticContact ND1-CG 3.67Å; H283-Y313 AromaticContact NE2-CD2 3.61Å; H283-Y313 AromaticContact NE2-CG 3.97Å
284	V	97.8	Very high	93.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.5	-177.2	-171.3	0	0	0	0	110.5	A107 I115 M117 L281 E282 I286 Y313 I314 D315	A107-V284 HydrophobicContact CB-CG2 3.95Å; I115-V284 HydrophobicContact CB-CG1 4.39Å; I115-V284 HydrophobicContact CB-CG2 4.34Å; I115-V284 HydrophobicContact CG2-CG1 4.34Å; I115-V284 WeakPolarHBondContact O-CA 3.46Å; M117-V284 HydrophobicContact CE-CG1 3.96Å; M117-V284 HydrophobicContact CG-CG1 4.35Å; M117-V284 HydrophobicContact SD-CG1 4.13Å; L281-V284 HydrophobicContact CB-CG2 4.48Å; E282-V284 WeakPolarHBondContact O-CG2 3.12Å; E282-V284 PolarHBondContact O-N 3.25Å; V284-I286 HydrophobicContact CG1-CD1 4.41Å; V284-I286 HydrophobicContact CG1-CG1 3.92Å; V284-Y313 PolarHBondContact N-O 3.38Å; V284-I314 HydrophobicContact CB-CG2 4.47Å; V284-I314 WeakPolarHBondContact O-CA 3.41Å; V284-D315 PolarHBondContact O-N 2.87Å
285	N	97.4	Very high	93.8	Very high	12 Å²	12	41.4 Å²	41.4	6%	0.064	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.3	173.1	-63.1	-23.6	0	0	0	109.4	Q114 I115 M117 W287 D315	Q114-N285 PolarHBondContact OE1-ND2 2.65Å; Q114-N285 PolarHBondContact OE1-OD1 3.37Å; Q114-N285 VanDerWaalsContact OE1-OD1 3.14Å; I115-N285 PolarHBondContact O-N 2.82Å; M117-N285 PolarHBondContact N-O 3Å; N285-W287 HydrophobicContact CB-CZ2 4.26Å; N285-D315 WeakPolarHBondContact OD1-CB 3.43Å
286	I	97.2	Very high	93.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	97.2	-178.5	-58.3	176.2	0	0	0	107.4	M117 W253 L256 V284 A289 A301 L302 D315 V316 K317	M117-I286 HydrophobicContact SD-CG1 4.3Å; W253-I286 HydrophobicContact CH2-CG2 4.16Å; W253-I286 HydrophobicContact CZ2-CG2 3.76Å; L256-I286 HydrophobicContact CD1-CD1 3.84Å; L256-I286 HydrophobicContact CG-CD1 4.46Å; V284-I286 HydrophobicContact CG1-CD1 4.41Å; V284-I286 HydrophobicContact CG1-CG1 3.92Å; I286-A289 HydrophobicContact CG2-CB 3.99Å; I286-A301 HydrophobicContact CG2-CB 4.31Å; I286-L302 HydrophobicContact CD1-CD1 4.1Å; I286-L302 HydrophobicContact CD1-CD2 3.56Å; I286-L302 HydrophobicContact CD1-CG 3.98Å; I286-D315 PolarHBondContact N-O 2.85Å; I286-V316 HydrophobicContact CB-CG2 4.38Å; I286-V316 WeakPolarHBondContact O-CA 3.41Å; I286-K317 PolarHBondContact O-N 3.05Å; I286-K317 VanDerWaalsContact O-N 3.11Å
287	W	95.4	Very high	93.8	Very high	79 Å²	79	43.5 Å²	43.5	30%	0.299	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.6	-173.3	-59.4	-11	0	0	0	111.1	M117 L118 W253 N285 A289 D315 K317	M117-W287 PolarHBondContact O-N 3.25Å; L118-W287 HydrophobicContact CD2-CB 4.42Å; L118-W287 HydrophobicContact CD2-CD2 4.19Å; L118-W287 HydrophobicContact CD2-CE3 3.62Å; L118-W287 HydrophobicContact CD2-CZ3 4.24Å; W253-W287 PolarHBondContact NE1-O 2.95Å; N285-W287 HydrophobicContact CB-CZ2 4.26Å; W287-A289 VanDerWaalsContact C-N 3.29Å; W287-A289 PolarHBondContact O-N 3.37Å; W287-D315 PolarHBondContact NE1-OD2 3.42Å; W287-K317 WeakPolarHBondContact CA-O 3.43Å
288	Y	93.7	Very high	93.6	Very high	25 Å²	25	43.7 Å²	43.7	10%	0.098	19%	0.194	C	C	.	.	S	Bend	trans	58	37.2	178.1	-56.9	-90.8	0	0	0	113.8	P119 P123 H128 H252 W253 K317 Y318	P119-Y288 HydrophobicContact CG-CD2 3.79Å; P119-Y288 HydrophobicContact CG-CG 3.99Å; P123-Y288 HydrophobicContact CB-CD1 4.46Å; P123-Y288 HydrophobicContact CB-CE1 3.74Å; P123-Y288 HydrophobicContact CG-CD1 3.79Å; P123-Y288 HydrophobicContact CG-CD2 4.13Å; P123-Y288 HydrophobicContact CG-CE1 3.46Å; P123-Y288 VanDerWaalsContact CG-CE1 3.46Å; P123-Y288 HydrophobicContact CG-CE2 3.85Å; P123-Y288 HydrophobicContact CG-CG 4.1Å; P123-Y288 VanDerWaalsContact CG-CZ 3.48Å; H128-Y288 AromaticContact CE1-CE1 3.51Å; H128-Y288 AromaticContact CE1-CZ 3.99Å; H128-Y288 AromaticContact NE2-CE1 3.32Å; H128-Y288 VanDerWaalsContact NE2-CE1 3.32Å; H128-Y288 WeakPolarHBondContact NE2-CE1 3.41Å; H128-Y288 AromaticContact NE2-CZ 3.37Å; H128-Y288 PolarHBondContact NE2-OH 3.44Å; H252-Y288 CarbonylContact C-O 3.47Å; H252-Y288 WeakPolarHBondContact CA-O 3.37Å; W253-Y288 PolarHBondContact N-O 3.44Å; Y288-K317 PolarHBondContact N-O 2.94Å; Y288-K317 VanDerWaalsContact N-O 3.07Å; Y288-Y318 HydrophobicContact CE1-CD2 4.36Å; Y288-Y318 HydrophobicContact CE1-CG 4.26Å; Y288-Y318 AromaticContact CE2-CD2 3.97Å; Y288-Y318 HydrophobicContact CE2-CD2 3.97Å; Y288-Y318 AromaticContact CZ-CD2 3.9Å
289	A	95.2	Very high	93.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-88.9	172.3	172.5	0	0	0	0	0	111.6	W253 I286 W287 A301 S319 A320	W253-A289 HydrophobicContact CD2-CB 4.17Å; W253-A289 HydrophobicContact CH2-CB 4.4Å; W253-A289 HydrophobicContact CZ2-CB 3.8Å; W253-A289 CarbonylContact O-C 3.51Å; W253-A289 VanDerWaalsContact O-C 3.3Å; W253-A289 WeakPolarHBondContact O-CA 3.46Å; I286-A289 HydrophobicContact CG2-CB 3.99Å; W287-A289 VanDerWaalsContact C-N 3.29Å; W287-A289 PolarHBondContact O-N 3.37Å; A289-A301 HydrophobicContact CB-CB 3.5Å; A289-S319 CarbonylContact O-C 3.58Å; A289-S319 VanDerWaalsContact O-CA 3.23Å; A289-S319 WeakPolarHBondContact O-CA 3.32Å; A289-A320 PolarHBondContact O-N 2.81Å
290	G	93.5	Very high	93.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.179	C	C	.	.			trans	107	24.2	171.2	0	0	0	0	0	116.8	W253 A298 T299 A320	W253-G290 PolarHBondContact O-N 3.22Å; G290-A298 CarbonylContact O-C 3.46Å; G290-A298 WeakPolarHBondContact O-CA 3.44Å; G290-A298 WeakPolarHBondContact O-CB 3.44Å; G290-T299 CarbonylContact C-O 3.3Å; G290-T299 WeakPolarHBondContact CA-O 3.33Å; G290-T299 PolarHBondContact O-N 2.98Å; G290-T299 VanDerWaalsContact O-O 3.06Å; G290-A320 WeakPolarHBondContact O-CB 3.4Å
291	Y	93.7	Very high	93.6	Very high	22 Å²	22	35.9 Å²	35.9	9%	0.086	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.3	168.7	172.4	-115.8	0	0	0	111.3	G96 P244 W249 W253 K254	G96-Y291 WeakPolarHBondContact CA-O 3.41Å; P244-Y291 HydrophobicContact CG-CD2 3.76Å; P244-Y291 HydrophobicContact CG-CE2 3.95Å; W249-Y291 HydrophobicContact CE3-CE1 4.41Å; W249-Y291 HydrophobicContact CE3-CE2 4.44Å; W249-Y291 AromaticContact CZ3-CE1 3.9Å; W249-Y291 HydrophobicContact CZ3-CE1 3.9Å; W249-Y291 HydrophobicContact CZ3-CE2 4.23Å; W249-Y291 AromaticContact CZ3-CZ 3.75Å; W253-Y291 CarbonylContact C-O 3.55Å; W253-Y291 PolarHBondContact O-N 3.26Å; K254-Y291 WeakPolarHBondContact CA-O 3.25Å; K254-Y291 WeakPolarHBondContact CB-O 3.46Å; K254-Y291 PolarHBondContact N-O 2.87Å
292	D	92.9	Very high	93.6	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	114.5	178.3	-171.5	-18	0	0	0	110.3	K254 E294 R295 A296 N297 T299	K254-D292 HydrophobicContact CD-CB 4.34Å; K254-D292 VanDerWaalsContact CE-OD2 3.27Å; K254-D292 WeakPolarHBondContact CE-OD2 3.49Å; K254-D292 HydrophobicContact CG-CB 4.15Å; K254-D292 IonicContact NZ-OD2 2.68Å; D292-E294 VanDerWaalsContact C-N 3.32Å; D292-E294 PolarHBondContact O-N 2.92Å; D292-E294 WeakPolarHBondContact OD1-CB 3.35Å; D292-E294 PolarHBondContact OD1-N 3.07Å; D292-R295 HydrophobicContact CB-CB 4.2Å; D292-R295 PolarHBondContact O-N 3.11Å; D292-R295 WeakPolarHBondContact OD2-CD 3.03Å; D292-R295 IonicContact OD2-NE 3.54Å; D292-A296 WeakPolarHBondContact O-CA 3.34Å; D292-A296 PolarHBondContact O-N 3.06Å; D292-N297 PolarHBondContact N-O 2.91Å; D292-N297 PolarHBondContact O-N 2.89Å; D292-T299 HydrophobicContact CB-CG2 4.17Å
293	R	89.7	Confident	93.6	Very high	123 Å²	123	36.1 Å²	36.1	46%	0.464	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-35.8	179.5	-172.8	-171.4	-67.2	172.3	-5.5	112	S95 G96 A296	S95-R293 PolarHBondContact O-NE 2.91Å; S95-R293 PolarHBondContact O-NH2 2.83Å; G96-R293 VanDerWaalsContact O-CB 3.3Å; G96-R293 WeakPolarHBondContact O-CB 3.45Å; G96-R293 PolarHBondContact O-N 2.89Å; R293-A296 PolarHBondContact O-N 2.9Å
294	E	88	Confident	93.5	Very high	156 Å²	156	34.9 Å²	34.9	73%	0.729	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-37.9	-177.2	-65	-179.5	170.5	0	0	111.3	D292	D292-E294 VanDerWaalsContact C-N 3.32Å; D292-E294 PolarHBondContact O-N 2.92Å; D292-E294 WeakPolarHBondContact OD1-CB 3.35Å; D292-E294 PolarHBondContact OD1-N 3.07Å
295	R	87.7	Confident	93.3	Very high	155 Å²	155	37.1 Å²	37.1	59%	0.585	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-6.9	177.1	-62.2	-179.8	179.3	161.2	5	113.2	D292 N297	D292-R295 HydrophobicContact CB-CB 4.2Å; D292-R295 PolarHBondContact O-N 3.11Å; D292-R295 WeakPolarHBondContact OD2-CD 3.03Å; D292-R295 IonicContact OD2-NE 3.54Å; R295-N297 HydrophobicContact CB-CB 4.25Å; R295-N297 WeakPolarHBondContact O-CB 3.39Å; R295-N297 PolarHBondContact O-N 2.78Å
296	A	86.9	Confident	92.9	Very high	48 Å²	48	36.8 Å²	36.8	40%	0.397	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.9	38.9	-170.8	0	0	0	0	0	112.7	P243 D292 R293	P243-A296 WeakPolarHBondContact CA-O 3.02Å; D292-A296 WeakPolarHBondContact O-CA 3.34Å; D292-A296 PolarHBondContact O-N 3.06Å; R293-A296 PolarHBondContact O-N 2.9Å
297	N	89.3	Confident	92.6	Very high	55 Å²	55	37 Å²	37	29%	0.294	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	150.3	-169	-159.6	-4.7	0	0	0	111.2	R144 D292 R295	R144-N297 PolarHBondContact NH1-OD1 3.33Å; D292-N297 PolarHBondContact N-O 2.91Å; D292-N297 PolarHBondContact O-N 2.89Å; R295-N297 HydrophobicContact CB-CB 4.25Å; R295-N297 WeakPolarHBondContact O-CB 3.39Å; R295-N297 PolarHBondContact O-N 2.78Å
298	A	89.9	Confident	92.5	Very high	8 Å²	8	33.6 Å²	33.6	7%	0.066	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	144.4	174.4	0	0	0	0	0	111	R144 G290 A320 Q321	R144-A298 PolarHBondContact NH1-O 2.79Å; R144-A298 PolarHBondContact NH2-O 3.03Å; G290-A298 CarbonylContact O-C 3.46Å; G290-A298 WeakPolarHBondContact O-CA 3.44Å; G290-A298 WeakPolarHBondContact O-CB 3.44Å; A298-A320 HydrophobicContact CB-CB 4.08Å; A298-Q321 PolarHBondContact O-OE1 2.74Å; A298-Q321 VanDerWaalsContact O-OE1 3.08Å
299	T	93.2	Very high	92.6	Very high	16 Å²	16	32.4 Å²	32.4	10%	0.098	16%	0.155	C	C	.	.			trans	-135.4	173.4	-176.2	-174.5	0	0	0	0	109.9	K254 G290 D292 Q321	K254-T299 HydrophobicContact CG-CG2 4.41Å; K254-T299 VanDerWaalsContact O-CG2 3.31Å; K254-T299 WeakPolarHBondContact O-CG2 3.43Å; G290-T299 CarbonylContact C-O 3.3Å; G290-T299 WeakPolarHBondContact CA-O 3.33Å; G290-T299 PolarHBondContact O-N 2.98Å; G290-T299 VanDerWaalsContact O-O 3.06Å; D292-T299 HydrophobicContact CB-CG2 4.17Å; T299-Q321 VanDerWaalsContact CA-OE1 3.25Å; T299-Q321 VanDerWaalsContact O-CB 3.27Å; T299-Q321 WeakPolarHBondContact O-CB 3.42Å
300	A	95.4	Very high	92.6	Very high	2 Å²	2	34.4 Å²	34.4	2%	0.017	16%	0.164	C	C	.	.			trans	-71.2	152.4	173.9	0	0	0	0	0	111.8	L303 D322 R325	A300-L303 HydrophobicContact CB-CB 4.45Å; A300-D322 CarbonylContact C-O 3.59Å; A300-D322 VanDerWaalsContact CA-O 3.24Å; A300-D322 WeakPolarHBondContact CA-O 3.49Å; A300-D322 HydrophobicContact CB-CB 4.01Å; A300-R325 HydrophobicContact CB-CB 3.55Å
301	A	97	Very high	92.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-67.4	-40.9	175.3	0	0	0	0	0	112.8	G255 L256 I286 A289 V316 S319 D322 G323	G255-A301 CarbonylContact C-O 3.58Å; G255-A301 VanDerWaalsContact CA-O 3.27Å; G255-A301 WeakPolarHBondContact CA-O 3.26Å; L256-A301 PolarHBondContact N-O 2.97Å; I286-A301 HydrophobicContact CG2-CB 4.31Å; A289-A301 HydrophobicContact CB-CB 3.5Å; A301-V316 HydrophobicContact CB-CG1 3.82Å; A301-S319 WeakPolarHBondContact CB-OG 3.5Å; A301-D322 PolarHBondContact N-O 2.82Å; A301-G323 WeakPolarHBondContact CB-O 3.33Å
302	L	97.7	Very high	92.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	103.4	167.1	-69.9	178.5	0	0	0	108.3	L256 L281 I286 I304 M311 I314 V316 G323 V324 R325	L256-L302 HydrophobicContact CB-CD2 3.7Å; L256-L302 HydrophobicContact CD1-CD2 3.71Å; L256-L302 HydrophobicContact CG-CD2 3.93Å; L281-L302 HydrophobicContact CD1-CD1 4.4Å; L281-L302 HydrophobicContact CD1-CD2 3.97Å; I286-L302 HydrophobicContact CD1-CD1 4.1Å; I286-L302 HydrophobicContact CD1-CD2 3.56Å; I286-L302 HydrophobicContact CD1-CG 3.98Å; L302-I304 HydrophobicContact CB-CD1 4.34Å; L302-M311 HydrophobicContact CD1-SD 3.89Å; L302-I314 HydrophobicContact CD1-CD1 3.77Å; L302-V316 HydrophobicContact CD1-CG2 4.04Å; L302-G323 PolarHBondContact N-O 3.41Å; L302-G323 VanDerWaalsContact N-O 3.07Å; L302-V324 HydrophobicContact CB-CB 4.48Å; L302-V324 HydrophobicContact CB-CG1 4.2Å; L302-V324 HydrophobicContact CB-CG2 4.33Å; L302-V324 HydrophobicContact CD1-CG2 3.98Å; L302-R325 PolarHBondContact O-N 2.97Å
303	L	97.1	Very high	93.1	Very high	30 Å²	30	39.2 Å²	39.2	16%	0.157	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	114.3	173.2	-179	61.9	0	0	0	109.1	L256 E257 F258 A300 R325	L256-L303 PolarHBondContact O-N 3.39Å; E257-L303 CarbonylContact C-O 3.53Å; E257-L303 VanDerWaalsContact CA-O 3.25Å; E257-L303 WeakPolarHBondContact CA-O 3.23Å; E257-L303 HydrophobicContact CG-CB 4.48Å; E257-L303 HydrophobicContact CG-CD2 4.2Å; E257-L303 HydrophobicContact CG-CG 4.44Å; F258-L303 PolarHBondContact N-O 3.13Å; A300-L303 HydrophobicContact CB-CB 4.45Å; L303-R325 HydrophobicContact CD1-CB 4.28Å; L303-R325 HydrophobicContact CD1-CG 4.25Å
304	I	95.9	Very high	93.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.7	-173.3	-63.6	153.8	0	0	0	108.9	F258 L302 A308 P309 M311 V324 R325 I326 T327	F258-I304 HydrophobicContact CB-CG1 4.36Å; F258-I304 HydrophobicContact CB-CG2 4.45Å; F258-I304 HydrophobicContact CD2-CG1 3.92Å; F258-I304 HydrophobicContact CG-CG1 4.5Å; L302-I304 HydrophobicContact CB-CD1 4.34Å; I304-A308 HydrophobicContact CD1-CB 4.48Å; I304-A308 HydrophobicContact CG2-CB 3.96Å; I304-P309 HydrophobicContact CD1-CG 4.21Å; I304-M311 HydrophobicContact CD1-CE 4.33Å; I304-M311 HydrophobicContact CD1-SD 4.43Å; I304-V324 HydrophobicContact CD1-CG1 4.36Å; I304-R325 PolarHBondContact N-O 2.89Å; I304-I326 HydrophobicContact CB-CB 4.46Å; I304-I326 HydrophobicContact CB-CG1 4.04Å; I304-I326 HydrophobicContact CB-CG2 4.33Å; I304-I326 HydrophobicContact CD1-CD1 4.35Å; I304-I326 HydrophobicContact CD1-CG1 3.87Å; I304-I326 HydrophobicContact CG2-CG1 4.43Å; I304-I326 HydrophobicContact CG2-CG2 4.08Å; I304-I326 CarbonylContact O-C 3.51Å; I304-I326 WeakPolarHBondContact O-CA 3.47Å; I304-T327 PolarHBondContact O-N 3.44Å; I304-T327 PolarHBondContact O-OG1 2.92Å
305	H	93.3	Very high	94	Very high	48 Å²	48	27 Å²	27	22%	0.222	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.6	168.4	-171.6	-87.3	0	0	0	109.7	F258 D260 T327 S328 Y399	F258-H305 PolarHBondContact O-N 3.09Å; D260-H305 VanDerWaalsContact CG-ND1 3.26Å; D260-H305 PolarHBondContact N-O 2.86Å; D260-H305 IonicContact OD1-CE1 3.46Å; D260-H305 PolarHBondContact OD1-CE1 3.46Å; D260-H305 IonicContact OD1-CG 3.48Å; D260-H305 IonicContact OD1-ND1 3.67Å; D260-H305 PolarHBondContact OD1-ND1 3.37Å; D260-H305 IonicContact OD2-CE1 2.82Å; D260-H305 IonicContact OD2-ND1 2.7Å; D260-H305 PolarHBondContact OD2-ND1 2.93Å; H305-T327 PolarHBondContact CD2-OG1 2.95Å; H305-S328 PolarHBondContact NE2-OG 3.49Å; H305-Y399 AromaticContact CE1-CZ 3.98Å; H305-Y399 PolarHBondContact CE1-OH 3.36Å; H305-Y399 VanDerWaalsContact CE1-OH 3.28Å
306	G	88.4	Confident	94.5	Very high	5 Å²	5	19.6 Å²	19.6	5%	0.052	11%	0.105	C	C	.	.	S	Bend	trans	85.9	-134.3	179.5	0	0	0	0	0	113.8	A308 T327 A329	G306-A308 PolarHBondContact O-N 3.14Å; G306-T327 PolarHBondContact N-O 2.93Å; G306-A329 WeakPolarHBondContact O-CA 3.48Å
307	V	90.3	Very high	94.9	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.024	10%	0.096	C	C	.	.	S	Bend	trans	-80.7	113.4	-175.4	-175.8	0	0	0	0	110.5	W263 K275	W263-V307 HydrophobicContact CB-CB 4.19Å; W263-V307 HydrophobicContact CB-CG1 4.15Å; W263-V307 HydrophobicContact CB-CG2 4.26Å; W263-V307 HydrophobicContact CD2-CG2 4.4Å; W263-V307 HydrophobicContact CG-CB 4.25Å; W263-V307 HydrophobicContact CG-CG2 3.83Å; K275-V307 HydrophobicContact CB-CG1 4.32Å; K275-V307 HydrophobicContact CB-CG2 4.14Å; K275-V307 HydrophobicContact CD-CG2 4.13Å
308	A	94	Very high	95	Very high	7 Å²	7	19.6 Å²	19.6	6%	0.058	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-64.9	143.2	-177.1	0	0	0	0	0	113.1	S277 I304 G306 M311 I326 V333	S277-A308 WeakPolarHBondContact CB-O 3.23Å; I304-A308 HydrophobicContact CD1-CB 4.48Å; I304-A308 HydrophobicContact CG2-CB 3.96Å; G306-A308 PolarHBondContact O-N 3.14Å; A308-M311 HydrophobicContact CB-CE 4.5Å; A308-I326 HydrophobicContact CB-CD1 4.1Å; A308-I326 HydrophobicContact CB-CG2 4.49Å; A308-V333 HydrophobicContact CB-CG1 4.38Å; A308-V333 HydrophobicContact CB-CG2 4.03Å
309	P	95.8	Very high	95.2	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	9%	0.089	C	C	.	.	P	Polyproline II helix	trans	-61.8	153.7	171.6	29	-35.6	0	0	0	110.7	F258 S279 L281 I304 M311	F258-P309 HydrophobicContact CD2-CG 4.28Å; F258-P309 HydrophobicContact CE1-CB 4.44Å; F258-P309 HydrophobicContact CE1-CG 4.42Å; F258-P309 HydrophobicContact CE2-CG 3.96Å; F258-P309 HydrophobicContact CZ-CB 4.3Å; F258-P309 HydrophobicContact CZ-CG 4.02Å; S279-P309 WeakPolarHBondContact O-CA 3.44Å; S279-P309 WeakPolarHBondContact O-CB 3.47Å; L281-P309 HydrophobicContact CD1-CG 4.13Å; L281-P309 HydrophobicContact CG-CB 4.41Å; L281-P309 HydrophobicContact CG-CG 4.44Å; I304-P309 HydrophobicContact CD1-CG 4.21Å; P309-M311 HydrophobicContact CG-CG 4.43Å; P309-M311 PolarHBondContact O-N 3.3Å
310	F	94.1	Very high	95.1	Very high	42 Å²	42	18.8 Å²	18.8	18%	0.184	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	120.2	169.9	-177	-108.5	0	0	0	109.2	S279 L281 E282 N312 E334	S279-F310 PolarHBondContact O-N 2.95Å; L281-F310 PolarHBondContact N-O 2.88Å; E282-F310 HydrophobicContact CG-CD1 4.19Å; E282-F310 HydrophobicContact CG-CE1 4.43Å; F310-N312 HydrophobicContact CD1-CB 4.17Å; F310-N312 HydrophobicContact CE1-CB 3.49Å; F310-N312 VanDerWaalsContact CE1-CB 3.49Å; F310-N312 HydrophobicContact CZ-CB 3.92Å; F310-E334 HydrophobicContact CD2-CB 4.33Å; F310-E334 HydrophobicContact CE2-CB 4.39Å
311	M	97	Very high	95	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	111	-177	-71.3	176.7	-78.7	0	0	110.4	L281 L302 I304 A308 P309 I314 V324 I326 V333 E334 I335 T336	L281-M311 HydrophobicContact CD1-CG 4.48Å; L302-M311 HydrophobicContact CD1-SD 3.89Å; I304-M311 HydrophobicContact CD1-CE 4.33Å; I304-M311 HydrophobicContact CD1-SD 4.43Å; A308-M311 HydrophobicContact CB-CE 4.5Å; P309-M311 HydrophobicContact CG-CG 4.43Å; P309-M311 PolarHBondContact O-N 3.3Å; M311-I314 HydrophobicContact CB-CD1 3.9Å; M311-I314 HydrophobicContact CB-CG1 4.35Å; M311-I314 HydrophobicContact CG-CD1 3.93Å; M311-I314 HydrophobicContact SD-CD1 3.74Å; M311-V324 HydrophobicContact CE-CG1 4.39Å; M311-V324 HydrophobicContact SD-CG1 4.28Å; M311-I326 HydrophobicContact CE-CD1 4.22Å; M311-V333 HydrophobicContact CE-CG1 4.26Å; M311-E334 PolarHBondContact N-O 3.42Å; M311-I335 HydrophobicContact CB-CG1 4.41Å; M311-I335 HydrophobicContact CE-CD1 4Å; M311-I335 HydrophobicContact CE-CG1 3.51Å; M311-I335 HydrophobicContact SD-CG1 4.25Å; M311-T336 PolarHBondContact O-N 3.33Å
312	N	97.6	Very high	95	Very high	20 Å²	20	19.5 Å²	19.5	11%	0.107	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	130.4	-178.1	-178.2	32.4	0	0	0	110.5	L281 E282 H283 F310 I314 T336 N337	L281-N312 PolarHBondContact O-N 3.4Å; L281-N312 VanDerWaalsContact O-N 3.11Å; E282-N312 VanDerWaalsContact CA-O 3.25Å; E282-N312 WeakPolarHBondContact CA-O 3.41Å; E282-N312 HydrophobicContact CG-CB 4.2Å; E282-N312 PolarHBondContact OE2-ND2 2.86Å; H283-N312 PolarHBondContact N-O 2.85Å; H283-N312 VanDerWaalsContact N-O 3.13Å; F310-N312 HydrophobicContact CD1-CB 4.17Å; F310-N312 HydrophobicContact CE1-CB 3.49Å; F310-N312 VanDerWaalsContact CE1-CB 3.49Å; F310-N312 HydrophobicContact CZ-CB 3.92Å; N312-I314 VanDerWaalsContact C-N 3.26Å; N312-I314 PolarHBondContact O-N 2.85Å; N312-T336 WeakPolarHBondContact CA-O 3.24Å; N312-T336 PolarHBondContact OD1-OG1 3.44Å; N312-T336 VanDerWaalsContact OD1-OG1 3.14Å; N312-N337 PolarHBondContact OD1-ND2 2.91Å
313	Y	97.9	Very high	94.9	Very high	104 Å²	104	19.5 Å²	19.5	41%	0.408	9%	0.09	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53	42	-174.2	-62.2	-82.1	0	0	0	113.6	H283 V284 T336 N337 S338	H283-Y313 VanDerWaalsContact CA-O 3.25Å; H283-Y313 WeakPolarHBondContact CA-O 3.46Å; H283-Y313 AromaticContact CE1-CD1 3.83Å; H283-Y313 AromaticContact CE1-CD2 3.4Å; H283-Y313 WeakPolarHBondContact CE1-CD2 3.26Å; H283-Y313 AromaticContact CE1-CG 3.3Å; H283-Y313 PolarHBondContact N-O 2.89Å; H283-Y313 VanDerWaalsContact ND1-CB 3.34Å; H283-Y313 WeakPolarHBondContact ND1-CB 3.3Å; H283-Y313 AromaticContact ND1-CG 3.67Å; H283-Y313 AromaticContact NE2-CD2 3.61Å; H283-Y313 AromaticContact NE2-CG 3.97Å; V284-Y313 PolarHBondContact N-O 3.38Å; Y313-T336 PolarHBondContact N-O 3.43Å; Y313-T336 VanDerWaalsContact N-O 3.13Å; Y313-N337 WeakPolarHBondContact CA-O 3.33Å; Y313-N337 HydrophobicContact CD1-CB 3.68Å; Y313-N337 HydrophobicContact CD2-CB 4.09Å; Y313-N337 HydrophobicContact CE1-CB 3.53Å; Y313-N337 HydrophobicContact CE2-CB 3.92Å; Y313-N337 HydrophobicContact CG-CB 3.96Å; Y313-S338 PolarHBondContact N-OG 2.88Å
314	I	97.7	Very high	95	Very high	2 Å²	2	18 Å²	18	1%	0.01	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.6	171.1	63.9	165	0	0	0	110.4	L281 V284 L302 M311 N312 V316 S338 T339	L281-I314 HydrophobicContact CB-CG2 4.05Å; V284-I314 HydrophobicContact CB-CG2 4.47Å; V284-I314 WeakPolarHBondContact O-CA 3.41Å; L302-I314 HydrophobicContact CD1-CD1 3.77Å; M311-I314 HydrophobicContact CB-CD1 3.9Å; M311-I314 HydrophobicContact CB-CG1 4.35Å; M311-I314 HydrophobicContact CG-CD1 3.93Å; M311-I314 HydrophobicContact SD-CD1 3.74Å; N312-I314 VanDerWaalsContact C-N 3.26Å; N312-I314 PolarHBondContact O-N 2.85Å; I314-V316 HydrophobicContact CD1-CG2 3.92Å; I314-V316 HydrophobicContact CG1-CG2 4.46Å; I314-S338 VanDerWaalsContact CG1-OG 3.27Å; I314-S338 WeakPolarHBondContact CG1-OG 3.19Å; I314-S338 PolarHBondContact N-OG 3.2Å; I314-S338 WeakPolarHBondContact O-CA 3.36Å; I314-S338 WeakPolarHBondContact O-CB 3.34Å; I314-T339 PolarHBondContact O-N 2.81Å
315	D	97.7	Very high	95	Very high	20 Å²	20	20.3 Å²	20.3	11%	0.107	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	101.4	174	-172	41.4	0	0	0	109.5	V284 N285 I286 W287 K317 T339	V284-D315 PolarHBondContact O-N 2.87Å; N285-D315 WeakPolarHBondContact OD1-CB 3.43Å; I286-D315 PolarHBondContact N-O 2.85Å; W287-D315 PolarHBondContact NE1-OD2 3.42Å; D315-K317 VanDerWaalsContact CG-NZ 3.26Å; D315-K317 WeakPolarHBondContact OD1-CE 2.72Å; D315-K317 IonicContact OD1-NZ 2.85Å; D315-K317 PolarHBondContact OD1-NZ 3.26Å; D315-K317 WeakPolarHBondContact OD2-CE 3.27Å; D315-K317 IonicContact OD2-NZ 3.44Å; D315-K317 PolarHBondContact OD2-NZ 3.12Å; D315-T339 WeakPolarHBondContact CA-O 3.3Å; D315-T339 WeakPolarHBondContact OD1-CB 3.46Å
316	V	97.9	Very high	95.1	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.2	-178.6	-177.2	0	0	0	0	109.1	I286 A301 L302 I314 V324 T339 I340 S341	I286-V316 HydrophobicContact CB-CG2 4.38Å; I286-V316 WeakPolarHBondContact O-CA 3.41Å; A301-V316 HydrophobicContact CB-CG1 3.82Å; L302-V316 HydrophobicContact CD1-CG2 4.04Å; I314-V316 HydrophobicContact CD1-CG2 3.92Å; I314-V316 HydrophobicContact CG1-CG2 4.46Å; V316-V324 HydrophobicContact CG2-CG2 4.49Å; V316-T339 PolarHBondContact N-O 2.86Å; V316-I340 HydrophobicContact CB-CG1 4.46Å; V316-I340 WeakPolarHBondContact O-CA 3.49Å; V316-S341 PolarHBondContact O-N 2.82Å
317	K	95.1	Very high	95.3	Very high	47 Å²	47	19 Å²	19	20%	0.204	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	149.6	-173.4	-69.5	-175.6	175	137	0	114	I286 W287 Y288 D315 S319 S341	I286-K317 PolarHBondContact O-N 3.05Å; I286-K317 VanDerWaalsContact O-N 3.11Å; W287-K317 WeakPolarHBondContact CA-O 3.43Å; Y288-K317 PolarHBondContact N-O 2.94Å; Y288-K317 VanDerWaalsContact N-O 3.07Å; D315-K317 VanDerWaalsContact CG-NZ 3.26Å; D315-K317 WeakPolarHBondContact OD1-CE 2.72Å; D315-K317 IonicContact OD1-NZ 2.85Å; D315-K317 PolarHBondContact OD1-NZ 3.26Å; D315-K317 WeakPolarHBondContact OD2-CE 3.27Å; D315-K317 IonicContact OD2-NZ 3.44Å; D315-K317 PolarHBondContact OD2-NZ 3.12Å; K317-S319 PolarHBondContact O-N 2.76Å; K317-S341 WeakPolarHBondContact CA-O 3.14Å; K317-S341 WeakPolarHBondContact CE-OG 3.18Å
318	Y	92.5	Very high	95.2	Very high	56 Å²	56	20.8 Å²	20.8	22%	0.22	10%	0.098	C	C	.	.			trans	57.4	37.9	172.5	-49.1	-63.6	0	0	0	112.7	H128 H252 Y288 Y342	H128-Y318 HydrophobicContact CB-CE1 4.37Å; H128-Y318 AromaticContact CD2-CE1 3.85Å; H128-Y318 AromaticContact CE1-CD1 3.22Å; H128-Y318 WeakPolarHBondContact CE1-CD1 3.45Å; H128-Y318 AromaticContact CE1-CE1 3.72Å; H128-Y318 AromaticContact CE1-CG 3.56Å; H128-Y318 AromaticContact CG-CD1 3.93Å; H128-Y318 AromaticContact CG-CE1 3.67Å; H128-Y318 AromaticContact ND1-CD1 3.37Å; H128-Y318 WeakPolarHBondContact ND1-CD1 3.41Å; H128-Y318 AromaticContact ND1-CE1 3.61Å; H128-Y318 AromaticContact NE2-CD1 3.72Å; H128-Y318 AromaticContact NE2-CE1 3.86Å; H128-Y318 AromaticContact NE2-CG 3.89Å; H252-Y318 PolarHBondContact CD2-O 3.08Å; H252-Y318 PolarHBondContact NE2-O 2.87Å; H252-Y318 VanDerWaalsContact NE2-O 3.16Å; Y288-Y318 HydrophobicContact CE1-CD2 4.36Å; Y288-Y318 HydrophobicContact CE1-CG 4.26Å; Y288-Y318 AromaticContact CE2-CD2 3.97Å; Y288-Y318 HydrophobicContact CE2-CD2 3.97Å; Y288-Y318 AromaticContact CZ-CD2 3.9Å; Y318-Y342 WeakPolarHBondContact CA-O 3.43Å; Y318-Y342 HydrophobicContact CE1-CD2 4.39Å; Y318-Y342 AromaticContact CE1-CG 3.94Å; Y318-Y342 HydrophobicContact CE1-CG 3.94Å; Y318-Y342 PolarHBondContact N-O 2.75Å
319	S	94	Very high	94.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.095	C	C	.	.			trans	-71.2	137.7	176.7	-47.8	0	0	0	0	110.2	A289 A301 K317 Q321 N343 R344	A289-S319 CarbonylContact O-C 3.58Å; A289-S319 VanDerWaalsContact O-CA 3.23Å; A289-S319 WeakPolarHBondContact O-CA 3.32Å; A301-S319 WeakPolarHBondContact CB-OG 3.5Å; K317-S319 PolarHBondContact O-N 2.76Å; S319-Q321 PolarHBondContact O-N 2.83Å; S319-N343 WeakPolarHBondContact CB-OD1 3.39Å; S319-N343 PolarHBondContact N-OD1 3.41Å; S319-N343 PolarHBondContact OG-OD1 3.42Å; S319-R344 PolarHBondContact O-N 3Å
320	A	91.8	Very high	94.2	Very high	7 Å²	7	20.9 Å²	20.9	6%	0.058	10%	0.098	C	C	.	.	S	Bend	trans	-65.2	-16.4	177	0	0	0	0	0	113.3	F246 H252 A289 G290 A298	F246-A320 HydrophobicContact CE1-CB 4.17Å; F246-A320 HydrophobicContact CZ-CB 3.66Å; H252-A320 HydrophobicContact CB-CB 4.41Å; A289-A320 PolarHBondContact O-N 2.81Å; G290-A320 WeakPolarHBondContact O-CB 3.4Å; A298-A320 HydrophobicContact CB-CB 4.08Å
321	Q	92.3	Very high	93.8	Very high	16 Å²	16	18.9 Å²	18.9	8%	0.075	9%	0.089	C	C	.	.	S	Bend	trans	-139.6	-126.7	171.5	-164	-164	-34.4	0	0	109.7	R144 A298 T299 S319 R344 G345	R144-Q321 VanDerWaalsContact NH2-OE1 3.15Å; A298-Q321 PolarHBondContact O-OE1 2.74Å; A298-Q321 VanDerWaalsContact O-OE1 3.08Å; T299-Q321 VanDerWaalsContact CA-OE1 3.25Å; T299-Q321 VanDerWaalsContact O-CB 3.27Å; T299-Q321 WeakPolarHBondContact O-CB 3.42Å; S319-Q321 PolarHBondContact O-N 2.83Å; Q321-R344 PolarHBondContact O-N 3.37Å; Q321-G345 VanDerWaalsContact C-N 3.33Å; Q321-G345 VanDerWaalsContact O-CA 3.29Å; Q321-G345 WeakPolarHBondContact O-CA 3.47Å; Q321-G345 PolarHBondContact O-N 3.34Å
322	D	96.1	Very high	93.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.094	C	C	.	.			trans	-73.4	144.8	-175.7	-53.4	-39.8	0	0	0	109.8	A300 A301 R325 G345 H346 V349	A300-D322 CarbonylContact C-O 3.59Å; A300-D322 VanDerWaalsContact CA-O 3.24Å; A300-D322 WeakPolarHBondContact CA-O 3.49Å; A300-D322 HydrophobicContact CB-CB 4.01Å; A301-D322 PolarHBondContact N-O 2.82Å; D322-R325 HydrophobicContact CB-CB 4.38Å; D322-R325 IonicContact OD2-CZ 2.87Å; D322-R325 IonicContact OD2-NH1 3.17Å; D322-R325 PolarHBondContact OD2-NH1 3.18Å; D322-G345 WeakPolarHBondContact OD1-CA 3.41Å; D322-H346 VanDerWaalsContact CA-O 3.31Å; D322-H346 WeakPolarHBondContact CA-O 3.46Å; D322-H346 IonicContact OD1-CD2 3.79Å; D322-H346 PolarHBondContact OD1-CD2 3.23Å; D322-H346 VanDerWaalsContact OD1-CD2 3.28Å; D322-H346 IonicContact OD1-CG 3.86Å; D322-H346 PolarHBondContact OD1-N 3.38Å; D322-V349 HydrophobicContact CB-CG2 4.38Å
323	G	96.9	Very high	93.3	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.089	C	C	.	.	S	Bend	trans	-66.5	-60.5	174	0	0	0	0	0	110.5	A301 L302 H346	A301-G323 WeakPolarHBondContact CB-O 3.33Å; L302-G323 PolarHBondContact N-O 3.41Å; L302-G323 VanDerWaalsContact N-O 3.07Å; G323-H346 PolarHBondContact N-O 3.48Å
324	V	97.8	Very high	93.1	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	123	178.3	-173.1	0	0	0	0	109.3	L302 I304 M311 V316 I326 I335 I340 G347 V348 V349	L302-V324 HydrophobicContact CB-CB 4.48Å; L302-V324 HydrophobicContact CB-CG1 4.2Å; L302-V324 HydrophobicContact CB-CG2 4.33Å; L302-V324 HydrophobicContact CD1-CG2 3.98Å; I304-V324 HydrophobicContact CD1-CG1 4.36Å; M311-V324 HydrophobicContact CE-CG1 4.39Å; M311-V324 HydrophobicContact SD-CG1 4.28Å; V316-V324 HydrophobicContact CG2-CG2 4.49Å; V324-I326 HydrophobicContact CG1-CD1 4.13Å; V324-I326 HydrophobicContact CG1-CG1 4.07Å; V324-I335 HydrophobicContact CG1-CD1 4.5Å; V324-I340 HydrophobicContact CG2-CD1 3.78Å; V324-I340 HydrophobicContact CG2-CG1 4.4Å; V324-G347 PolarHBondContact N-O 3.49Å; V324-V348 HydrophobicContact CB-CG2 4.46Å; V324-V348 CarbonylContact O-C 3.32Å; V324-V348 WeakPolarHBondContact O-CA 2.84Å; V324-V349 PolarHBondContact O-N 3.45Å
325	R	96.9	Very high	93.1	Very high	47 Å²	47	15.9 Å²	15.9	18%	0.177	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.7	176	-173.8	176	-169	136.1	-3.4	110.3	A300 L302 L303 I304 D322 T327 V349 E351	A300-R325 HydrophobicContact CB-CB 3.55Å; L302-R325 PolarHBondContact O-N 2.97Å; L303-R325 HydrophobicContact CD1-CB 4.28Å; L303-R325 HydrophobicContact CD1-CG 4.25Å; I304-R325 PolarHBondContact N-O 2.89Å; D322-R325 HydrophobicContact CB-CB 4.38Å; D322-R325 IonicContact OD2-CZ 2.87Å; D322-R325 IonicContact OD2-NH1 3.17Å; D322-R325 PolarHBondContact OD2-NH1 3.18Å; R325-T327 HydrophobicContact CG-CG2 4.21Å; R325-V349 WeakPolarHBondContact CA-O 3.32Å; R325-V349 HydrophobicContact CB-CB 4.5Å; R325-V349 HydrophobicContact CG-CB 4.22Å; R325-V349 HydrophobicContact CG-CG1 4.42Å; R325-E351 IonicContact CZ-OE1 2.72Å; R325-E351 IonicContact NE-OE1 2.72Å; R325-E351 PolarHBondContact NE-OE1 2.96Å; R325-E351 IonicContact NH2-OE1 3.12Å; R325-E351 PolarHBondContact NH2-OE1 3Å; R325-E351 IonicContact NH2-OE2 2.87Å; R325-E351 PolarHBondContact NH2-OE2 2.85Å
326	I	95.5	Very high	93.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.8	-180	-53.6	166.7	0	0	0	108	I304 A308 M311 V324 A329 V333 V349 V350 E351	I304-I326 HydrophobicContact CB-CB 4.46Å; I304-I326 HydrophobicContact CB-CG1 4.04Å; I304-I326 HydrophobicContact CB-CG2 4.33Å; I304-I326 HydrophobicContact CD1-CD1 4.35Å; I304-I326 HydrophobicContact CD1-CG1 3.87Å; I304-I326 HydrophobicContact CG2-CG1 4.43Å; I304-I326 HydrophobicContact CG2-CG2 4.08Å; I304-I326 CarbonylContact O-C 3.51Å; I304-I326 WeakPolarHBondContact O-CA 3.47Å; A308-I326 HydrophobicContact CB-CD1 4.1Å; A308-I326 HydrophobicContact CB-CG2 4.49Å; M311-I326 HydrophobicContact CE-CD1 4.22Å; V324-I326 HydrophobicContact CG1-CD1 4.13Å; V324-I326 HydrophobicContact CG1-CG1 4.07Å; I326-A329 HydrophobicContact CG2-CB 3.85Å; I326-V333 HydrophobicContact CD1-CB 4.19Å; I326-V333 HydrophobicContact CD1-CG1 3.27Å; I326-V333 HydrophobicContact CD1-CG2 3.83Å; I326-V333 HydrophobicContact CG2-CG2 4.28Å; I326-V349 PolarHBondContact N-O 3.48Å; I326-V350 HydrophobicContact CB-CG2 4.25Å; I326-V350 HydrophobicContact CD1-CG2 4.13Å; I326-V350 WeakPolarHBondContact O-CA 3.36Å; I326-E351 PolarHBondContact O-N 2.7Å
327	T	92.3	Very high	93.1	Very high	25 Å²	25	18.4 Å²	18.4	15%	0.153	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.2	-177	60.1	0	0	0	0	109.5	I304 H305 G306 R325 A329 E351	I304-T327 PolarHBondContact O-N 3.44Å; I304-T327 PolarHBondContact O-OG1 2.92Å; H305-T327 PolarHBondContact CD2-OG1 2.95Å; G306-T327 PolarHBondContact N-O 2.93Å; R325-T327 HydrophobicContact CG-CG2 4.21Å; T327-A329 VanDerWaalsContact C-N 3.31Å; T327-A329 PolarHBondContact O-N 3.1Å; T327-E351 HydrophobicContact CG2-CG 3.86Å; T327-E351 VanDerWaalsContact CG2-OE1 3.28Å; T327-E351 WeakPolarHBondContact CG2-OE1 3.28Å
328	S	88	Confident	93.2	Very high	42 Å²	42	16.2 Å²	16.2	29%	0.294	8%	0.084	S	C	.	.	S	Bend	trans	56.4	43	176.9	-53.2	0	0	0	0	113.1	H305 D330 E351 N352	H305-S328 PolarHBondContact NE2-OG 3.49Å; S328-D330 PolarHBondContact O-N 3.46Å; S328-D330 VanDerWaalsContact O-N 3.13Å; S328-E351 PolarHBondContact N-O 2.89Å; S328-N352 WeakPolarHBondContact CA-O 3.39Å
329	A	88.6	Confident	93.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.084	C	C	.	.			trans	-64.5	113.1	-175.8	0	0	0	0	0	112.3	G306 I326 T327 V333 V350 T353 T354 D355 G356	G306-A329 WeakPolarHBondContact O-CA 3.48Å; I326-A329 HydrophobicContact CG2-CB 3.85Å; T327-A329 VanDerWaalsContact C-N 3.31Å; T327-A329 PolarHBondContact O-N 3.1Å; A329-V333 HydrophobicContact CB-CG2 4.23Å; A329-V350 HydrophobicContact CB-CG1 4.41Å; A329-T353 PolarHBondContact O-OG1 2.89Å; A329-T354 PolarHBondContact O-N 3.16Å; A329-T354 PolarHBondContact O-OG1 3.42Å; A329-D355 PolarHBondContact O-N 2.97Å; A329-D355 VanDerWaalsContact O-N 3.16Å; A329-G356 PolarHBondContact O-N 2.89Å
330	D	81.4	Confident	93.7	Very high	11 Å²	11	15.3 Å²	15.3	6%	0.059	8%	0.084	C	C	.	.			trans	-104.4	7	-177.1	-175.3	23.3	0	0	0	113	K275 S328	K275-D330 WeakPolarHBondContact CD-O 3.48Å; K275-D330 IonicContact NZ-OD1 2.95Å; K275-D330 PolarHBondContact NZ-OD1 3.34Å; K275-D330 IonicContact NZ-OD2 2.63Å; K275-D330 PolarHBondContact NZ-OD2 3.5Å; S328-D330 PolarHBondContact O-N 3.46Å; S328-D330 VanDerWaalsContact O-N 3.13Å
331	G	85.6	Confident	93.9	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-150.1	165.8	173.7	0	0	0	0	0	111.2	V333 G356	G331-V333 PolarHBondContact O-N 3.11Å; G331-G356 WeakPolarHBondContact O-CA 3.5Å
332	P	89	Confident	94	Very high	15 Å²	15	18.6 Å²	18.6	10%	0.097	10%	0.096	C	C	.	.			trans	-57.9	136.5	-179.7	25.9	-33.3	0	0	0	111.2	K274 R357	K274-P332 HydrophobicContact CB-CG 3.99Å; K274-P332 HydrophobicContact CD-CG 3.92Å; K274-P332 HydrophobicContact CG-CG 4.49Å; P332-R357 HydrophobicContact CB-CB 4.46Å
333	V	94	Very high	93.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.8	174.7	177.8	0	0	0	0	107.7	A308 M311 I326 A329 G331 I335 R357 L358 F359	A308-V333 HydrophobicContact CB-CG1 4.38Å; A308-V333 HydrophobicContact CB-CG2 4.03Å; M311-V333 HydrophobicContact CE-CG1 4.26Å; I326-V333 HydrophobicContact CD1-CB 4.19Å; I326-V333 HydrophobicContact CD1-CG1 3.27Å; I326-V333 HydrophobicContact CD1-CG2 3.83Å; I326-V333 HydrophobicContact CG2-CG2 4.28Å; A329-V333 HydrophobicContact CB-CG2 4.23Å; G331-V333 PolarHBondContact O-N 3.11Å; V333-I335 HydrophobicContact CG1-CD1 4.41Å; V333-I335 HydrophobicContact CG1-CG1 4.3Å; V333-R357 PolarHBondContact N-O 3.26Å; V333-L358 HydrophobicContact CB-CD1 3.93Å; V333-L358 HydrophobicContact CG1-CD1 3.6Å; V333-F359 PolarHBondContact O-N 3.48Å
334	E	94.1	Very high	93.6	Very high	47 Å²	47	22.4 Å²	22.4	22%	0.22	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	111.3	-179.6	-65.2	175.1	-159.3	0	0	109	K274 F310 M311 F359	K274-E334 IonicContact NZ-OE1 3.18Å; K274-E334 PolarHBondContact NZ-OE1 3.28Å; K274-E334 IonicContact NZ-OE2 2.99Å; F310-E334 HydrophobicContact CD2-CB 4.33Å; F310-E334 HydrophobicContact CE2-CB 4.39Å; M311-E334 PolarHBondContact N-O 3.42Å; E334-F359 HydrophobicContact CG-CB 4.44Å
335	I	96.9	Very high	93.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	115.9	172.7	-60.4	170.5	0	0	0	107.5	M311 V324 V333 I340 V348 F359 I360 N361 T363	M311-I335 HydrophobicContact CB-CG1 4.41Å; M311-I335 HydrophobicContact CE-CD1 4Å; M311-I335 HydrophobicContact CE-CG1 3.51Å; M311-I335 HydrophobicContact SD-CG1 4.25Å; V324-I335 HydrophobicContact CG1-CD1 4.5Å; V333-I335 HydrophobicContact CG1-CD1 4.41Å; V333-I335 HydrophobicContact CG1-CG1 4.3Å; I335-I340 HydrophobicContact CG2-CD1 4.35Å; I335-V348 HydrophobicContact CD1-CG1 3.95Å; I335-V348 HydrophobicContact CD1-CG2 4.02Å; I335-F359 PolarHBondContact N-O 3.07Å; I335-I360 HydrophobicContact CB-CG1 4.38Å; I335-I360 WeakPolarHBondContact O-CA 3.3Å; I335-N361 PolarHBondContact O-N 2.83Å; I335-T363 HydrophobicContact CG2-CG2 4.05Å; I335-T363 PolarHBondContact O-OG1 2.72Å
336	T	97.6	Very high	93.3	Very high	17 Å²	17	20.6 Å²	20.6	10%	0.104	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	147.2	-174.2	61.3	0	0	0	0	112.5	M311 N312 Y313 S338 F359 N361	M311-T336 PolarHBondContact O-N 3.33Å; N312-T336 WeakPolarHBondContact CA-O 3.24Å; N312-T336 PolarHBondContact OD1-OG1 3.44Å; N312-T336 VanDerWaalsContact OD1-OG1 3.14Å; Y313-T336 PolarHBondContact N-O 3.43Å; Y313-T336 VanDerWaalsContact N-O 3.13Å; T336-S338 PolarHBondContact O-N 2.96Å; T336-S338 PolarHBondContact O-OG 3.07Å; T336-F359 HydrophobicContact CG2-CD1 4.35Å; T336-F359 HydrophobicContact CG2-CE1 4.21Å; T336-N361 VanDerWaalsContact CA-O 3.3Å; T336-N361 WeakPolarHBondContact CA-O 3.49Å; T336-N361 HydrophobicContact CG2-CB 4.21Å
337	N	97.9	Very high	93.4	Very high	56 Å²	56	20.6 Å²	20.6	30%	0.299	10%	0.104	S	C	.	.	S	Bend	trans	51	29.8	175.7	-52.6	-60	0	0	0	114.3	N312 Y313 N361 E362	N312-N337 PolarHBondContact OD1-ND2 2.91Å; Y313-N337 WeakPolarHBondContact CA-O 3.33Å; Y313-N337 HydrophobicContact CD1-CB 3.68Å; Y313-N337 HydrophobicContact CD2-CB 4.09Å; Y313-N337 HydrophobicContact CE1-CB 3.53Å; Y313-N337 HydrophobicContact CE2-CB 3.92Å; Y313-N337 HydrophobicContact CG-CB 3.96Å; N337-N361 PolarHBondContact N-O 3.07Å; N337-E362 VanDerWaalsContact CA-O 3.26Å; N337-E362 WeakPolarHBondContact CA-O 3.38Å; N337-E362 WeakPolarHBondContact OD1-CB 3.4Å
338	S	98.2	Very high	93.7	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.007	10%	0.096	C	C	.	.			trans	-111.5	161.5	-166.4	-66.3	0	0	0	0	111.9	Y313 I314 T336 T363 R364	Y313-S338 PolarHBondContact N-OG 2.88Å; I314-S338 VanDerWaalsContact CG1-OG 3.27Å; I314-S338 WeakPolarHBondContact CG1-OG 3.19Å; I314-S338 PolarHBondContact N-OG 3.2Å; I314-S338 WeakPolarHBondContact O-CA 3.36Å; I314-S338 WeakPolarHBondContact O-CB 3.34Å; T336-S338 PolarHBondContact O-N 2.96Å; T336-S338 PolarHBondContact O-OG 3.07Å; S338-T363 PolarHBondContact N-OG1 2.95Å; S338-T363 VanDerWaalsContact O-CA 3.31Å; S338-T363 WeakPolarHBondContact O-CA 3.45Å; S338-T363 WeakPolarHBondContact O-CG2 3.33Å; S338-R364 PolarHBondContact O-N 3.42Å
339	T	98.2	Very high	94.1	Very high	37 Å²	37	17.4 Å²	17.4	23%	0.227	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123.6	174.9	-58.9	0	0	0	0	109.5	I314 D315 V316 R364	I314-T339 PolarHBondContact O-N 2.81Å; D315-T339 WeakPolarHBondContact CA-O 3.3Å; D315-T339 WeakPolarHBondContact OD1-CB 3.46Å; V316-T339 PolarHBondContact N-O 2.86Å; T339-R364 WeakPolarHBondContact CA-O 3.48Å; T339-R364 HydrophobicContact CG2-CB 4.42Å
340	I	98.2	Very high	94.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	102.7	180	-57.7	168.4	0	0	0	106.9	V316 V324 I335 N343 G347 V348 R364 I365 E366 N368	V316-I340 HydrophobicContact CB-CG1 4.46Å; V316-I340 WeakPolarHBondContact O-CA 3.49Å; V324-I340 HydrophobicContact CG2-CD1 3.78Å; V324-I340 HydrophobicContact CG2-CG1 4.4Å; I335-I340 HydrophobicContact CG2-CD1 4.35Å; I340-N343 WeakPolarHBondContact CG2-ND2 3.16Å; I340-G347 WeakPolarHBondContact CG2-O 3.5Å; I340-V348 HydrophobicContact CD1-CG2 3.37Å; I340-R364 PolarHBondContact N-O 3.47Å; I340-I365 WeakPolarHBondContact O-CA 3.4Å; I340-E366 PolarHBondContact O-N 3.23Å; I340-N368 PolarHBondContact O-ND2 3.29Å
341	S	96.5	Very high	94.9	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.014	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	157.9	-167.9	59.8	0	0	0	0	114.4	V316 K317 N343 E366	V316-S341 PolarHBondContact O-N 2.82Å; K317-S341 WeakPolarHBondContact CA-O 3.14Å; K317-S341 WeakPolarHBondContact CE-OG 3.18Å; S341-N343 PolarHBondContact N-ND2 2.7Å; S341-N343 PolarHBondContact O-N 3.1Å; S341-N343 PolarHBondContact O-ND2 2.81Å; S341-E366 WeakPolarHBondContact CA-O 3.41Å; S341-E366 WeakPolarHBondContact CB-O 3.15Å
342	Y	93.8	Very high	95	Very high	91 Å²	91	21.9 Å²	21.9	36%	0.357	11%	0.105	S	C	.	.	S	Bend	trans	56.8	32.5	176.1	-57.2	-80.7	0	0	0	114.3	Y132 Y318 E366 F367	Y132-Y342 WeakPolarHBondContact OH-CD1 3.37Å; Y318-Y342 WeakPolarHBondContact CA-O 3.43Å; Y318-Y342 HydrophobicContact CE1-CD2 4.39Å; Y318-Y342 AromaticContact CE1-CG 3.94Å; Y318-Y342 HydrophobicContact CE1-CG 3.94Å; Y318-Y342 PolarHBondContact N-O 2.75Å; Y342-E366 PolarHBondContact N-O 3.08Å; Y342-F367 WeakPolarHBondContact CA-O 3.49Å; Y342-F367 HydrophobicContact CD1-CB 3.86Å; Y342-F367 HydrophobicContact CE1-CB 3.73Å; Y342-F367 HydrophobicContact CE1-CD2 4.23Å; Y342-F367 AromaticContact CE1-CG 3.95Å; Y342-F367 HydrophobicContact CE1-CG 3.95Å; Y342-F367 HydrophobicContact CE2-CD2 4.29Å; Y342-F367 HydrophobicContact CG-CB 4.35Å; Y342-F367 AromaticContact CZ-CD2 3.82Å; Y342-F367 PolarHBondContact N-O 3.38Å
343	N	94.1	Very high	94.8	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.016	10%	0.103	C	C	.	.			trans	-90.9	140.9	177.1	-56	-64.2	0	0	0	110.6	S319 I340 S341 G345 N368 F369	S319-N343 WeakPolarHBondContact CB-OD1 3.39Å; S319-N343 PolarHBondContact N-OD1 3.41Å; S319-N343 PolarHBondContact OG-OD1 3.42Å; I340-N343 WeakPolarHBondContact CG2-ND2 3.16Å; S341-N343 PolarHBondContact N-ND2 2.7Å; S341-N343 PolarHBondContact O-N 3.1Å; S341-N343 PolarHBondContact O-ND2 2.81Å; N343-G345 PolarHBondContact O-N 3.42Å; N343-N368 WeakPolarHBondContact CB-OD1 3.06Å; N343-N368 PolarHBondContact N-OD1 3.19Å; N343-N368 PolarHBondContact ND2-OD1 2.69Å; N343-F369 PolarHBondContact O-N 2.67Å
344	R	91.6	Very high	93.9	Very high	77 Å²	77	23.4 Å²	23.4	29%	0.291	12%	0.115	S	C	.	.	S	Bend	trans	-73.2	-11.9	179.8	-67.8	-172.9	71.4	88.5	-1.2	113.7	M178 S319 Q321 F369	M178-R344 PolarHBondContact O-NH2 2.77Å; S319-R344 PolarHBondContact O-N 3Å; Q321-R344 PolarHBondContact O-N 3.37Å; R344-F369 WeakPolarHBondContact O-CB 3.45Å; R344-F369 WeakPolarHBondContact O-CD1 3.36Å
345	G	93	Very high	93	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	-106.3	-149.4	172.3	0	0	0	0	0	112	Q321 D322 N343 F369 G370	Q321-G345 VanDerWaalsContact C-N 3.33Å; Q321-G345 VanDerWaalsContact O-CA 3.29Å; Q321-G345 WeakPolarHBondContact O-CA 3.47Å; Q321-G345 PolarHBondContact O-N 3.34Å; D322-G345 WeakPolarHBondContact OD1-CA 3.41Å; N343-G345 PolarHBondContact O-N 3.42Å; G345-F369 PolarHBondContact O-N 3.21Å; G345-G370 PolarHBondContact O-N 3.48Å
346	H	95.9	Very high	91.7	Very high	8 Å²	8	22 Å²	22	4%	0.037	11%	0.109	C	C	.	.			trans	-76.4	158.8	173.7	-57.8	-81.8	0	0	0	111	D322 G323 V349 D371	D322-H346 VanDerWaalsContact CA-O 3.31Å; D322-H346 WeakPolarHBondContact CA-O 3.46Å; D322-H346 IonicContact OD1-CD2 3.79Å; D322-H346 PolarHBondContact OD1-CD2 3.23Å; D322-H346 VanDerWaalsContact OD1-CD2 3.28Å; D322-H346 IonicContact OD1-CG 3.86Å; D322-H346 PolarHBondContact OD1-N 3.38Å; G323-H346 PolarHBondContact N-O 3.48Å; H346-V349 HydrophobicContact CB-CG2 3.36Å; H346-D371 WeakPolarHBondContact CA-O 2.99Å; H346-D371 IonicContact CE1-OD2 3.21Å; H346-D371 PolarHBondContact CE1-OD2 2.85Å; H346-D371 WeakPolarHBondContact ND1-CB 3.4Å; H346-D371 PolarHBondContact ND1-N 3.32Å; H346-D371 IonicContact ND1-OD2 2.93Å; H346-D371 PolarHBondContact ND1-OD2 2.9Å
347	G	97.1	Very high	91.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.113	C	C	.	.	S	Bend	trans	-68.8	-71	173	0	0	0	0	0	111.2	V324 I340 D371 G372	V324-G347 PolarHBondContact N-O 3.49Å; I340-G347 WeakPolarHBondContact CG2-O 3.5Å; G347-D371 PolarHBondContact N-O 2.9Å; G347-G372 CarbonylContact C-O 3.48Å; G347-G372 WeakPolarHBondContact CA-O 3.47Å; G347-G372 PolarHBondContact N-O 3.48Å
348	V	97.7	Very high	91	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.3	177.6	179.8	0	0	0	0	109.6	V324 I335 I340 V350 L358 I360 I365 G372 I373 Q374	V324-V348 HydrophobicContact CB-CG2 4.46Å; V324-V348 CarbonylContact O-C 3.32Å; V324-V348 WeakPolarHBondContact O-CA 2.84Å; I335-V348 HydrophobicContact CD1-CG1 3.95Å; I335-V348 HydrophobicContact CD1-CG2 4.02Å; I340-V348 HydrophobicContact CD1-CG2 3.37Å; V348-V350 HydrophobicContact CG1-CG2 4.21Å; V348-L358 HydrophobicContact CG1-CD2 4.28Å; V348-I360 HydrophobicContact CG1-CD1 4.49Å; V348-I365 HydrophobicContact CG2-CD1 3.85Å; V348-G372 PolarHBondContact N-O 2.81Å; V348-I373 CarbonylContact O-C 3.5Å; V348-I373 WeakPolarHBondContact O-CA 3.31Å; V348-Q374 PolarHBondContact O-N 3.11Å
349	V	96.8	Very high	90.9	Very high	1 Å²	1	24 Å²	24	1%	0.006	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.7	174.2	-174.9	0	0	0	0	108.7	D322 V324 R325 I326 H346 Q374	D322-V349 HydrophobicContact CB-CG2 4.38Å; V324-V349 PolarHBondContact O-N 3.45Å; R325-V349 WeakPolarHBondContact CA-O 3.32Å; R325-V349 HydrophobicContact CB-CB 4.5Å; R325-V349 HydrophobicContact CG-CB 4.22Å; R325-V349 HydrophobicContact CG-CG1 4.42Å; I326-V349 PolarHBondContact N-O 3.48Å; H346-V349 HydrophobicContact CB-CG2 3.36Å; V349-Q374 WeakPolarHBondContact CA-O 3.25Å; V349-Q374 HydrophobicContact CG1-CG 4.48Å; V349-Q374 HydrophobicContact CG2-CB 4.4Å
350	V	95.2	Very high	90.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	113.9	169	-179.4	0	0	0	0	108.2	I326 A329 V348 T353 L358 Q374 F375 R376	I326-V350 HydrophobicContact CB-CG2 4.25Å; I326-V350 HydrophobicContact CD1-CG2 4.13Å; I326-V350 WeakPolarHBondContact O-CA 3.36Å; A329-V350 HydrophobicContact CB-CG1 4.41Å; V348-V350 HydrophobicContact CG1-CG2 4.21Å; V350-T353 HydrophobicContact CG1-CG2 4.29Å; V350-L358 HydrophobicContact CB-CD2 4.32Å; V350-L358 HydrophobicContact CG2-CD1 4.08Å; V350-L358 HydrophobicContact CG2-CD2 3.7Å; V350-L358 HydrophobicContact CG2-CG 4.36Å; V350-Q374 PolarHBondContact N-O 2.96Å; V350-F375 HydrophobicContact CB-CD2 3.98Å; V350-F375 HydrophobicContact CG1-CD2 4.12Å; V350-F375 HydrophobicContact CG1-CE2 4.19Å; V350-F375 WeakPolarHBondContact O-CA 3.44Å; V350-R376 PolarHBondContact O-N 3.04Å
351	E	91.6	Very high	90.8	Very high	27 Å²	27	24 Å²	24	13%	0.126	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	153.7	-175.7	65.6	-175.8	168.9	0	0	112.3	R325 I326 T327 S328 T353 R376	R325-E351 IonicContact CZ-OE1 2.72Å; R325-E351 IonicContact NE-OE1 2.72Å; R325-E351 PolarHBondContact NE-OE1 2.96Å; R325-E351 IonicContact NH2-OE1 3.12Å; R325-E351 PolarHBondContact NH2-OE1 3Å; R325-E351 IonicContact NH2-OE2 2.87Å; R325-E351 PolarHBondContact NH2-OE2 2.85Å; I326-E351 PolarHBondContact O-N 2.7Å; T327-E351 HydrophobicContact CG2-CG 3.86Å; T327-E351 VanDerWaalsContact CG2-OE1 3.28Å; T327-E351 WeakPolarHBondContact CG2-OE1 3.28Å; S328-E351 PolarHBondContact N-O 2.89Å; E351-T353 PolarHBondContact O-N 3.41Å; E351-T353 VanDerWaalsContact O-N 3.14Å; E351-R376 CarbonylContact C-O 3.57Å; E351-R376 WeakPolarHBondContact CA-O 3.47Å; E351-R376 HydrophobicContact CB-CB 4.31Å
352	N	87.7	Confident	90.9	Very high	77 Å²	77	28.4 Å²	28.4	41%	0.412	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.6	32.3	-177.4	-62.8	-23	0	0	0	113.2	S328 T354 R376 L378	S328-N352 WeakPolarHBondContact CA-O 3.39Å; N352-T354 PolarHBondContact O-N 3.06Å; N352-R376 PolarHBondContact N-O 3.28Å; N352-L378 HydrophobicContact CB-CD1 4.18Å
353	T	85.7	Confident	91.1	Very high	9 Å²	9	24.1 Å²	24.1	6%	0.055	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	126.8	180	176.3	0	0	0	0	111.3	A329 V350 E351 G356 F375 P377 L378	A329-T353 PolarHBondContact O-OG1 2.89Å; V350-T353 HydrophobicContact CG1-CG2 4.29Å; E351-T353 PolarHBondContact O-N 3.41Å; E351-T353 VanDerWaalsContact O-N 3.14Å; T353-G356 VanDerWaalsContact OG1-C 3.23Å; T353-G356 WeakPolarHBondContact OG1-CA 3.34Å; T353-G356 PolarHBondContact OG1-N 2.99Å; T353-G356 PolarHBondContact OG1-O 3.29Å; T353-F375 HydrophobicContact CG2-CE1 4.5Å; T353-F375 HydrophobicContact CG2-CE2 3.81Å; T353-F375 HydrophobicContact CG2-CZ 3.7Å; T353-P377 HydrophobicContact CG2-CB 4.11Å; T353-L378 WeakPolarHBondContact O-CB 3.25Å; T353-L378 PolarHBondContact O-N 3.07Å
354	T	74.8	Confident	91.3	Very high	39 Å²	39	28.4 Å²	28.4	24%	0.239	13%	0.131	C	C	.	.	S	Bend	trans	-96.4	-35.4	179.7	53.9	0	0	0	0	112.2	A329 N352 L378	A329-T354 PolarHBondContact O-N 3.16Å; A329-T354 PolarHBondContact O-OG1 3.42Å; N352-T354 PolarHBondContact O-N 3.06Å; T354-L378 HydrophobicContact CG2-CB 4.47Å; T354-L378 HydrophobicContact CG2-CD2 3.64Å
355	D	75	Confident	91.7	Very high	16 Å²	16	24.9 Å²	24.9	9%	0.086	12%	0.117	C	C	.	.	S	Bend	trans	-125.7	-31.7	169.7	-167.1	62.7	0	0	0	112.1	A329 R357 K516 H518	A329-D355 PolarHBondContact O-N 2.97Å; A329-D355 VanDerWaalsContact O-N 3.16Å; D355-R357 PolarHBondContact O-N 2.98Å; D355-R357 IonicContact OD2-NH2 3.11Å; D355-K516 VanDerWaalsContact CB-NZ 3.31Å; D355-K516 WeakPolarHBondContact OD1-CE 3.26Å; D355-K516 IonicContact OD1-NZ 3.62Å; D355-K516 PolarHBondContact OD1-NZ 3.2Å; D355-H518 IonicContact OD1-CE1 3.9Å; D355-H518 PolarHBondContact OD1-CE1 3.26Å; D355-H518 IonicContact OD1-NE2 2.89Å
356	G	68.9	Low	91.8	Very high	2 Å²	2	26.3 Å²	26.3	2%	0.021	12%	0.124	C	C	.	.			trans	-54.3	94.5	-161.8	0	0	0	0	0	114.2	A329 G331 T353	A329-G356 PolarHBondContact O-N 2.89Å; G331-G356 WeakPolarHBondContact O-CA 3.5Å; T353-G356 VanDerWaalsContact OG1-C 3.23Å; T353-G356 WeakPolarHBondContact OG1-CA 3.34Å; T353-G356 PolarHBondContact OG1-N 2.99Å; T353-G356 PolarHBondContact OG1-O 3.29Å
357	R	86.7	Confident	91.8	Very high	50 Å²	50	29 Å²	29	19%	0.189	14%	0.136	C	C	.	.			trans	-66	125.4	164.9	-64.4	165	-84.1	165	-2.3	108	P332 V333 D355 F526 Y527	P332-R357 HydrophobicContact CB-CB 4.46Å; V333-R357 PolarHBondContact N-O 3.26Å; D355-R357 PolarHBondContact O-N 2.98Å; D355-R357 IonicContact OD2-NH2 3.11Å; R357-F526 HydrophobicContact CG-CE1 4.4Å; R357-F526 HydrophobicContact CG-CE2 4.08Å; R357-F526 HydrophobicContact CG-CZ 3.81Å; R357-Y527 WeakPolarHBondContact CG-O 3.3Å
358	L	94.8	Very high	91.7	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	112.1	176	-179.9	54.9	0	0	0	109.4	V333 V348 V350 I360 I373 F375 G528 L529 N530	V333-L358 HydrophobicContact CB-CD1 3.93Å; V333-L358 HydrophobicContact CG1-CD1 3.6Å; V348-L358 HydrophobicContact CG1-CD2 4.28Å; V350-L358 HydrophobicContact CB-CD2 4.32Å; V350-L358 HydrophobicContact CG2-CD1 4.08Å; V350-L358 HydrophobicContact CG2-CD2 3.7Å; V350-L358 HydrophobicContact CG2-CG 4.36Å; L358-I360 HydrophobicContact CD1-CD1 4.02Å; L358-I360 HydrophobicContact CD1-CG1 3.84Å; L358-I360 HydrophobicContact CD2-CD1 3.92Å; L358-I360 HydrophobicContact CG-CD1 3.93Å; L358-I360 HydrophobicContact CG-CG1 4.01Å; L358-I373 HydrophobicContact CD2-CG2 3.99Å; L358-F375 HydrophobicContact CB-CD2 4.02Å; L358-F375 HydrophobicContact CB-CE2 4Å; L358-F375 HydrophobicContact CD2-CD2 4.08Å; L358-G528 PolarHBondContact N-O 3.01Å; L358-L529 HydrophobicContact CB-CD1 3.86Å; L358-L529 HydrophobicContact CD2-CD1 3.72Å; L358-L529 HydrophobicContact CG-CD1 3.71Å; L358-N530 PolarHBondContact O-N 2.68Å
359	F	95.1	Very high	91.5	Very high	64 Å²	64	30.9 Å²	30.9	28%	0.281	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	115.5	172.4	-177.3	-111.7	0	0	0	109.8	V333 E334 I335 T336 N361 N530	V333-F359 PolarHBondContact O-N 3.48Å; E334-F359 HydrophobicContact CG-CB 4.44Å; I335-F359 PolarHBondContact N-O 3.07Å; T336-F359 HydrophobicContact CG2-CD1 4.35Å; T336-F359 HydrophobicContact CG2-CE1 4.21Å; F359-N361 HydrophobicContact CD1-CB 4.38Å; F359-N361 HydrophobicContact CE1-CB 3.58Å; F359-N361 HydrophobicContact CE2-CB 4.37Å; F359-N361 HydrophobicContact CZ-CB 3.58Å; F359-N530 WeakPolarHBondContact CA-O 3.45Å; F359-N530 HydrophobicContact CD2-CB 4.07Å; F359-N530 WeakPolarHBondContact CE2-ND2 3.11Å
360	I	97.3	Very high	91.3	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.8	176.9	-64.3	171.8	0	0	0	107.9	I335 V348 L358 T363 I365 I373 N530 V531 S532	I335-I360 HydrophobicContact CB-CG1 4.38Å; I335-I360 WeakPolarHBondContact O-CA 3.3Å; V348-I360 HydrophobicContact CG1-CD1 4.49Å; L358-I360 HydrophobicContact CD1-CD1 4.02Å; L358-I360 HydrophobicContact CD1-CG1 3.84Å; L358-I360 HydrophobicContact CD2-CD1 3.92Å; L358-I360 HydrophobicContact CG-CD1 3.93Å; L358-I360 HydrophobicContact CG-CG1 4.01Å; I360-T363 HydrophobicContact CG2-CG2 3.96Å; I360-I365 HydrophobicContact CD1-CD1 4.16Å; I360-I365 HydrophobicContact CG2-CD1 4.41Å; I360-I373 HydrophobicContact CD1-CD1 3.52Å; I360-I373 HydrophobicContact CD1-CG1 3.89Å; I360-I373 HydrophobicContact CD1-CG2 4.41Å; I360-N530 PolarHBondContact N-O 2.9Å; I360-V531 HydrophobicContact CB-CG1 4.44Å; I360-V531 HydrophobicContact CB-CG2 4.44Å; I360-V531 HydrophobicContact CG2-CG1 4.43Å; I360-V531 WeakPolarHBondContact O-CA 3.29Å; I360-S532 PolarHBondContact O-N 3.21Å
361	N	98	Very high	91.4	Very high	36 Å²	36	31.8 Å²	31.8	19%	0.193	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	143	-178.7	-169.5	34.6	0	0	0	112.5	I335 T336 N337 F359 T363 S532 N533	I335-N361 PolarHBondContact O-N 2.83Å; T336-N361 VanDerWaalsContact CA-O 3.3Å; T336-N361 WeakPolarHBondContact CA-O 3.49Å; T336-N361 HydrophobicContact CG2-CB 4.21Å; N337-N361 PolarHBondContact N-O 3.07Å; F359-N361 HydrophobicContact CD1-CB 4.38Å; F359-N361 HydrophobicContact CE1-CB 3.58Å; F359-N361 HydrophobicContact CE2-CB 4.37Å; F359-N361 HydrophobicContact CZ-CB 3.58Å; N361-T363 PolarHBondContact O-N 2.87Å; N361-T363 PolarHBondContact O-OG1 2.91Å; N361-S532 WeakPolarHBondContact CA-O 2.92Å; N361-S532 VanDerWaalsContact CG-OG 3.26Å; N361-S532 PolarHBondContact OD1-O 3.35Å; N361-S532 VanDerWaalsContact OD1-O 3.08Å; N361-S532 PolarHBondContact OD1-OG 3.44Å; N361-N533 PolarHBondContact OD1-ND2 2.84Å
362	E	98.2	Very high	91.6	Very high	96 Å²	96	30.5 Å²	30.5	45%	0.449	14%	0.144	S	C	.	.	S	Bend	trans	48.3	34.7	178.4	-62.9	-65.6	163.7	0	0	112.8	N337 S532 N533 S534	N337-E362 VanDerWaalsContact CA-O 3.26Å; N337-E362 WeakPolarHBondContact CA-O 3.38Å; N337-E362 WeakPolarHBondContact OD1-CB 3.4Å; E362-S532 PolarHBondContact N-O 3.29Å; E362-N533 WeakPolarHBondContact CA-O 3.23Å; E362-N533 HydrophobicContact CG-CB 4.25Å; E362-N533 WeakPolarHBondContact OE1-CB 3.18Å; E362-N533 PolarHBondContact OE1-ND2 2.83Å; E362-S534 PolarHBondContact N-OG 2.99Å
363	T	98.5	Very high	92.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.125	C	C	.	.			trans	-116.2	143.3	-169.7	-66.2	0	0	0	0	110.4	I335 S338 I360 N361 I365 S534 R535	I335-T363 HydrophobicContact CG2-CG2 4.05Å; I335-T363 PolarHBondContact O-OG1 2.72Å; S338-T363 PolarHBondContact N-OG1 2.95Å; S338-T363 VanDerWaalsContact O-CA 3.31Å; S338-T363 WeakPolarHBondContact O-CA 3.45Å; S338-T363 WeakPolarHBondContact O-CG2 3.33Å; I360-T363 HydrophobicContact CG2-CG2 3.96Å; N361-T363 PolarHBondContact O-N 2.87Å; N361-T363 PolarHBondContact O-OG1 2.91Å; T363-I365 HydrophobicContact CG2-CD1 4.4Å; T363-I365 HydrophobicContact CG2-CG1 3.99Å; T363-S534 PolarHBondContact N-OG 3.26Å; T363-S534 VanDerWaalsContact N-OG 3.13Å; T363-S534 WeakPolarHBondContact O-CA 3.46Å; T363-S534 WeakPolarHBondContact O-CB 3.48Å; T363-S534 PolarHBondContact O-OG 2.83Å; T363-R535 PolarHBondContact O-N 2.8Å
364	R	98.4	Very high	92.6	Very high	94 Å²	94	26.5 Å²	26.5	36%	0.355	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.7	178.4	-56.1	178.8	73.6	102.1	1.6	109.4	S338 T339 I340 E366	S338-R364 PolarHBondContact O-N 3.42Å; T339-R364 WeakPolarHBondContact CA-O 3.48Å; T339-R364 HydrophobicContact CG2-CB 4.42Å; I340-R364 PolarHBondContact N-O 3.47Å; R364-E366 IonicContact CZ-OE1 3.3Å; R364-E366 IonicContact NE-OE1 3.81Å; R364-E366 PolarHBondContact NE-OE1 2.87Å; R364-E366 IonicContact NE-OE2 3.15Å; R364-E366 IonicContact NH2-OE1 3.47Å; R364-E366 PolarHBondContact NH2-OE1 2.93Å; R364-E366 IonicContact NH2-OE2 2.77Å; R364-E366 PolarHBondContact NH2-OE2 2.89Å
365	I	98.4	Very high	93.6	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	93.8	177.3	-56	176.1	0	0	0	107.3	I340 V348 I360 T363 N368 G372 I373 R535 V536 C537 N539	I340-I365 WeakPolarHBondContact O-CA 3.4Å; V348-I365 HydrophobicContact CG2-CD1 3.85Å; I360-I365 HydrophobicContact CD1-CD1 4.16Å; I360-I365 HydrophobicContact CG2-CD1 4.41Å; T363-I365 HydrophobicContact CG2-CD1 4.4Å; T363-I365 HydrophobicContact CG2-CG1 3.99Å; I365-N368 WeakPolarHBondContact CG2-ND2 3.36Å; I365-G372 WeakPolarHBondContact CG2-O 3.41Å; I365-I373 HydrophobicContact CD1-CD1 3.82Å; I365-I373 HydrophobicContact CD1-CG1 3.5Å; I365-I373 VanDerWaalsContact CD1-CG1 3.5Å; I365-R535 PolarHBondContact N-O 3.19Å; I365-V536 WeakPolarHBondContact O-CA 3.36Å; I365-C537 PolarHBondContact O-N 3.2Å; I365-C537 VanDerWaalsContact O-N 3.08Å; I365-N539 PolarHBondContact O-ND2 3.13Å; I365-N539 VanDerWaalsContact O-ND2 3.16Å
366	E	97.1	Very high	94.3	Very high	31 Å²	31	26 Å²	26	15%	0.145	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	147.6	-167.9	57.9	-172.3	168.7	0	0	114.3	I340 S341 Y342 R364 N368 C537	I340-E366 PolarHBondContact O-N 3.23Å; S341-E366 WeakPolarHBondContact CA-O 3.41Å; S341-E366 WeakPolarHBondContact CB-O 3.15Å; Y342-E366 PolarHBondContact N-O 3.08Å; R364-E366 IonicContact CZ-OE1 3.3Å; R364-E366 IonicContact NE-OE1 3.81Å; R364-E366 PolarHBondContact NE-OE1 2.87Å; R364-E366 IonicContact NE-OE2 3.15Å; R364-E366 IonicContact NH2-OE1 3.47Å; R364-E366 PolarHBondContact NH2-OE1 2.93Å; R364-E366 IonicContact NH2-OE2 2.77Å; R364-E366 PolarHBondContact NH2-OE2 2.89Å; E366-N368 VanDerWaalsContact C-N 3.25Å; E366-N368 PolarHBondContact N-ND2 3.1Å; E366-N368 PolarHBondContact O-N 2.95Å; E366-N368 PolarHBondContact O-ND2 3.25Å; E366-C537 WeakPolarHBondContact CA-O 3.37Å; E366-C537 HydrophobicContact CB-CB 4.46Å; E366-C537 WeakPolarHBondContact CB-O 3.46Å
367	F	95.2	Very high	95.3	Very high	65 Å²	65	26.5 Å²	26.5	29%	0.285	12%	0.118	S	C	.	.	S	Bend	trans	58.4	30.5	177.4	-52.5	-78	0	0	0	114.7	Y342 C537 N538	Y342-F367 WeakPolarHBondContact CA-O 3.49Å; Y342-F367 HydrophobicContact CD1-CB 3.86Å; Y342-F367 HydrophobicContact CE1-CB 3.73Å; Y342-F367 HydrophobicContact CE1-CD2 4.23Å; Y342-F367 AromaticContact CE1-CG 3.95Å; Y342-F367 HydrophobicContact CE1-CG 3.95Å; Y342-F367 HydrophobicContact CE2-CD2 4.29Å; Y342-F367 HydrophobicContact CG-CB 4.35Å; Y342-F367 AromaticContact CZ-CD2 3.82Å; Y342-F367 PolarHBondContact N-O 3.38Å; F367-C537 PolarHBondContact N-O 2.91Å; F367-N538 WeakPolarHBondContact CA-O 3.44Å; F367-N538 HydrophobicContact CD1-CB 3.66Å; F367-N538 HydrophobicContact CE1-CB 3.54Å; F367-N538 WeakPolarHBondContact CE1-ND2 3.43Å; F367-N538 HydrophobicContact CG-CB 4.35Å; F367-N538 HydrophobicContact CZ-CB 4.13Å; F367-N538 VanDerWaalsContact CZ-ND2 3.32Å; F367-N538 WeakPolarHBondContact CZ-ND2 3.47Å
368	N	95	Very high	95	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.011	12%	0.122	C	C	.	.			trans	-84.5	145.5	171.2	-55.5	-74.7	0	0	0	110	I340 N343 I365 E366 N539 G540	I340-N368 PolarHBondContact O-ND2 3.29Å; N343-N368 WeakPolarHBondContact CB-OD1 3.06Å; N343-N368 PolarHBondContact N-OD1 3.19Å; N343-N368 PolarHBondContact ND2-OD1 2.69Å; I365-N368 WeakPolarHBondContact CG2-ND2 3.36Å; E366-N368 VanDerWaalsContact C-N 3.25Å; E366-N368 PolarHBondContact N-ND2 3.1Å; E366-N368 PolarHBondContact O-N 2.95Å; E366-N368 PolarHBondContact O-ND2 3.25Å; N368-N539 WeakPolarHBondContact CB-OD1 3.27Å; N368-N539 PolarHBondContact N-OD1 3.38Å; N368-N539 PolarHBondContact ND2-OD1 2.04Å; N368-N539 CarbonylContact O-C 3.59Å; N368-N539 WeakPolarHBondContact O-CA 3.36Å; N368-G540 PolarHBondContact O-N 3.43Å
369	F	92.3	Very high	93.9	Very high	36 Å²	36	29 Å²	29	16%	0.158	14%	0.135	C	C	.	.	S	Bend	trans	-71.2	-35.3	-176.1	-173.8	-109	0	0	0	112.7	Y132 R136 T143 N343 R344 G345 G540	Y132-F369 HydrophobicContact CD1-CD2 4.35Å; R136-F369 HydrophobicContact CB-CE1 3.98Å; R136-F369 HydrophobicContact CB-CE2 4.44Å; R136-F369 HydrophobicContact CB-CZ 3.6Å; T143-F369 HydrophobicContact CG2-CD1 4.38Å; N343-F369 PolarHBondContact O-N 2.67Å; R344-F369 WeakPolarHBondContact O-CB 3.45Å; R344-F369 WeakPolarHBondContact O-CD1 3.36Å; G345-F369 PolarHBondContact O-N 3.21Å; F369-G540 VanDerWaalsContact O-CA 3.3Å; F369-G540 WeakPolarHBondContact O-CA 3.35Å
370	G	93.5	Very high	92.6	Very high	5 Å²	5	28.7 Å²	28.7	5%	0.052	15%	0.149	C	C	.	.	S	Bend	trans	-88.4	-157.4	173.2	0	0	0	0	0	113	G345 G541	G345-G370 PolarHBondContact O-N 3.48Å; G370-G541 WeakPolarHBondContact O-CA 3.49Å; G370-G541 PolarHBondContact O-N 3.46Å
371	D	96.4	Very high	90.9	Very high	16 Å²	16	33 Å²	33	9%	0.086	17%	0.172	C	C	.	.			trans	-61.8	149.9	172.2	-54.3	-47.1	0	0	0	111.7	H346 G347 Q374 G541 S542	H346-D371 WeakPolarHBondContact CA-O 2.99Å; H346-D371 IonicContact CE1-OD2 3.21Å; H346-D371 PolarHBondContact CE1-OD2 2.85Å; H346-D371 WeakPolarHBondContact ND1-CB 3.4Å; H346-D371 PolarHBondContact ND1-N 3.32Å; H346-D371 IonicContact ND1-OD2 2.93Å; H346-D371 PolarHBondContact ND1-OD2 2.9Å; G347-D371 PolarHBondContact N-O 2.9Å; D371-Q374 HydrophobicContact CB-CB 4.47Å; D371-Q374 PolarHBondContact OD2-NE2 3.38Å; D371-G541 WeakPolarHBondContact OD1-CA 2.99Å; D371-S542 VanDerWaalsContact CA-O 3.26Å; D371-S542 WeakPolarHBondContact CA-O 3.39Å; D371-S542 PolarHBondContact OD1-N 3.12Å
372	G	97.3	Very high	89.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	-65.3	-63.4	172.4	0	0	0	0	0	110.8	G347 V348 I365 S542 G543	G347-G372 CarbonylContact C-O 3.48Å; G347-G372 WeakPolarHBondContact CA-O 3.47Å; G347-G372 PolarHBondContact N-O 3.48Å; V348-G372 PolarHBondContact N-O 2.81Å; I365-G372 WeakPolarHBondContact CG2-O 3.41Å; G372-S542 PolarHBondContact N-O 3.04Å; G372-G543 CarbonylContact C-O 3.55Å; G372-G543 VanDerWaalsContact CA-O 3.3Å; G372-G543 WeakPolarHBondContact CA-O 3.43Å; G372-G543 PolarHBondContact N-O 2.96Å
373	I	97.9	Very high	87.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126	174.1	-59.6	164.2	0	0	0	108.6	V348 L358 I360 I365 V531 V536 G543 I544 Y545	V348-I373 CarbonylContact O-C 3.5Å; V348-I373 WeakPolarHBondContact O-CA 3.31Å; L358-I373 HydrophobicContact CD2-CG2 3.99Å; I360-I373 HydrophobicContact CD1-CD1 3.52Å; I360-I373 HydrophobicContact CD1-CG1 3.89Å; I360-I373 HydrophobicContact CD1-CG2 4.41Å; I365-I373 HydrophobicContact CD1-CD1 3.82Å; I365-I373 HydrophobicContact CD1-CG1 3.5Å; I365-I373 VanDerWaalsContact CD1-CG1 3.5Å; I373-V531 HydrophobicContact CD1-CG2 3.86Å; I373-V536 HydrophobicContact CD1-CG2 4.03Å; I373-G543 PolarHBondContact N-O 2.98Å; I373-I544 HydrophobicContact CB-CG1 4.45Å; I373-I544 HydrophobicContact CB-CG2 4.45Å; I373-I544 HydrophobicContact CD1-CD1 4.31Å; I373-I544 HydrophobicContact CD1-CG1 4.18Å; I373-Y545 PolarHBondContact O-N 2.91Å
374	Q	95.4	Very high	85.7	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.009	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.3	170.8	176.3	169.4	86.4	0	0	109.3	V348 V349 V350 D371 Y545	V348-Q374 PolarHBondContact O-N 3.11Å; V349-Q374 WeakPolarHBondContact CA-O 3.25Å; V349-Q374 HydrophobicContact CG1-CG 4.48Å; V349-Q374 HydrophobicContact CG2-CB 4.4Å; V350-Q374 PolarHBondContact N-O 2.96Å; D371-Q374 HydrophobicContact CB-CB 4.47Å; D371-Q374 PolarHBondContact OD2-NE2 3.38Å; Q374-Y545 WeakPolarHBondContact CA-O 3.24Å; Q374-Y545 HydrophobicContact CG-CD1 4.06Å
375	F	95.2	Very high	83.8	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.1	-178.1	178.7	-88.5	0	0	0	111.5	V350 T353 L358 P377 Y545 L546 Q547 V549	V350-F375 HydrophobicContact CB-CD2 3.98Å; V350-F375 HydrophobicContact CG1-CD2 4.12Å; V350-F375 HydrophobicContact CG1-CE2 4.19Å; V350-F375 WeakPolarHBondContact O-CA 3.44Å; T353-F375 HydrophobicContact CG2-CE1 4.5Å; T353-F375 HydrophobicContact CG2-CE2 3.81Å; T353-F375 HydrophobicContact CG2-CZ 3.7Å; L358-F375 HydrophobicContact CB-CD2 4.02Å; L358-F375 HydrophobicContact CB-CE2 4Å; L358-F375 HydrophobicContact CD2-CD2 4.08Å; F375-P377 HydrophobicContact CE1-CB 4.45Å; F375-P377 HydrophobicContact CE1-CG 4.46Å; F375-Y545 PolarHBondContact N-O 3.13Å; F375-L546 HydrophobicContact CB-CD2 3.59Å; F375-L546 HydrophobicContact CD1-CD2 4.01Å; F375-L546 HydrophobicContact CG-CD2 4.19Å; F375-Q547 PolarHBondContact O-N 3.11Å; F375-V549 HydrophobicContact CD1-CG1 4Å; F375-V549 HydrophobicContact CE1-CG1 4.26Å
376	R	91.5	Very high	81.9	Confident	39 Å²	39	38.8 Å²	38.8	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	107.8	-177.6	-66	-171.1	160.7	138.8	-1.5	110.8	V350 E351 N352 Q547	V350-R376 PolarHBondContact O-N 3.04Å; E351-R376 CarbonylContact C-O 3.57Å; E351-R376 WeakPolarHBondContact CA-O 3.47Å; E351-R376 HydrophobicContact CB-CB 4.31Å; N352-R376 PolarHBondContact N-O 3.28Å; R376-Q547 HydrophobicContact CG-CB 4.12Å
377	P	88.2	Confident	80.1	Confident	13 Å²	13	40.8 Å²	40.8	8%	0.084	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	152.2	175	31.2	-31.9	0	0	0	112.6	T353 F375 Q547 D548	T353-P377 HydrophobicContact CG2-CB 4.11Å; F375-P377 HydrophobicContact CE1-CB 4.45Å; F375-P377 HydrophobicContact CE1-CG 4.46Å; P377-Q547 VanDerWaalsContact CD-O 3.27Å; P377-Q547 WeakPolarHBondContact CD-O 3.21Å; P377-D548 WeakPolarHBondContact CG-O 3.36Å
378	L	82	Confident	78.2	Confident	52 Å²	52	41.5 Å²	41.5	27%	0.272	22%	0.219	S	C	.	.			trans	-74.8	127.2	169.4	-170.9	69.1	0	0	0	109.6	N352 T353 T354 G380	N352-L378 HydrophobicContact CB-CD1 4.18Å; T353-L378 WeakPolarHBondContact O-CB 3.25Å; T353-L378 PolarHBondContact O-N 3.07Å; T354-L378 HydrophobicContact CG2-CB 4.47Å; T354-L378 HydrophobicContact CG2-CD2 3.64Å; L378-G380 VanDerWaalsContact C-N 3.34Å
379	L	71.3	Confident	76.3	Confident	53 Å²	53	49.7 Å²	49.7	28%	0.277	26%	0.257	S	S	.	.			trans	-85.4	-3.2	-179.4	-57.7	-179	0	0	0	113.8	L481 D548 F627	L379-L481 HydrophobicContact CB-CD1 3.96Å; L379-L481 HydrophobicContact CD1-CD1 3.99Å; L379-L481 HydrophobicContact CD2-CD1 4.1Å; L379-L481 HydrophobicContact CG-CD1 4.23Å; L379-L481 WeakPolarHBondContact O-CD2 3.34Å; L379-D548 HydrophobicContact CD1-CB 4.14Å; L379-D548 HydrophobicContact CD2-CB 4.23Å; L379-F627 HydrophobicContact CD1-CZ 4.2Å; L379-F627 HydrophobicContact CD2-CE1 4.31Å; L379-F627 HydrophobicContact CD2-CZ 4.34Å
380	G	67.6	Low	74.2	Confident	56 Å²	56	50.8 Å²	50.8	58%	0.577	27%	0.273	S	S	*	.	S	Bend	trans	-110.7	-168.4	-173.1	0	0	0	0	0	115.7	L378	L378-G380 VanDerWaalsContact C-N 3.34Å
381	L	61	Low	72	Confident	91 Å²	91	60.5 Å²	60.5	48%	0.476	31%	0.314	S	S	.	.			trans	-68.1	140.6	175.1	-68.5	169.6	0	0	0	110.9	Y383 V514	L381-Y383 WeakPolarHBondContact O-CD2 3.36Å; L381-V514 HydrophobicContact CD2-CB 4.11Å; L381-V514 HydrophobicContact CD2-CG1 4.36Å; L381-V514 HydrophobicContact CD2-CG2 4.06Å
382	S	62.1	Low	69.6	Low	20 Å²	20	63 Å²	63	14%	0.14	34%	0.343	C	S	.	.			trans	-73.2	134.4	173.9	-176.1	0	0	0	0	110.2	E402	S382-E402 WeakPolarHBondContact CB-OE2 3.21Å; S382-E402 PolarHBondContact O-N 3.14Å; S382-E402 VanDerWaalsContact OG-CD 3.32Å; S382-E402 PolarHBondContact OG-OE2 2.8Å
383	Y	60.4	Low	67.5	Low	130 Å²	130	73.3 Å²	73.3	51%	0.51	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.9	172.2	-69.1	-98.7	0	0	0	108.9	L381 E400 P401	L381-Y383 WeakPolarHBondContact O-CD2 3.36Å; Y383-E400 CarbonylContact C-O 3.52Å; Y383-E400 WeakPolarHBondContact CA-O 3.36Å; Y383-P401 HydrophobicContact CD1-CB 4.03Å; Y383-P401 HydrophobicContact CE1-CB 3.92Å; Y383-P401 HydrophobicContact CE1-CG 4.35Å
384	R	63.3	Low	65	Low	137 Å²	137	80 Å²	80	52%	0.517	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	135.7	176.5	176.5	-177.3	174.8	-173.7	-0.5	110	V386 Y399 E400 E402	R384-V386 PolarHBondContact O-N 3.21Å; R384-Y399 CarbonylContact O-C 3.52Å; R384-Y399 WeakPolarHBondContact O-CA 3.25Å; R384-E400 PolarHBondContact N-O 2.87Å; R384-E400 PolarHBondContact O-N 2.98Å; R384-E402 HydrophobicContact CB-CG 4Å
385	P	59.5	Low	62.9	Low	29 Å²	29	81.9 Å²	81.9	19%	0.188	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	126.1	165	26.9	-30.4	0	0	0	110.7	I397 Y399	P385-I397 HydrophobicContact CB-CG2 3.77Å; P385-Y399 HydrophobicContact CB-CD1 3.95Å; P385-Y399 HydrophobicContact CB-CE1 3.72Å; P385-Y399 HydrophobicContact CG-CE1 4.32Å
386	V	58.5	Low	60.9	Low	33 Å²	33	87.4 Å²	87.4	20%	0.2	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.5	165	-174.6	0	0	0	0	107.4	R384 I397 Y398 E400	R384-V386 PolarHBondContact O-N 3.21Å; V386-I397 WeakPolarHBondContact O-CA 3.31Å; V386-Y398 HydrophobicContact CB-CD1 4.24Å; V386-Y398 HydrophobicContact CB-CD2 4.35Å; V386-Y398 HydrophobicContact CB-CE1 3.77Å; V386-Y398 HydrophobicContact CB-CE2 3.93Å; V386-Y398 HydrophobicContact CB-CG 4.5Å; V386-Y398 HydrophobicContact CG1-CE1 3.66Å; V386-Y398 HydrophobicContact CG1-CE2 4.34Å; V386-Y398 WeakPolarHBondContact CG1-OH 3.26Å; V386-Y398 HydrophobicContact CG2-CE2 4.28Å; V386-Y398 PolarHBondContact N-O 2.92Å; V386-Y398 WeakPolarHBondContact O-CD1 3.34Å; V386-Y398 PolarHBondContact O-N 3.01Å; V386-E400 HydrophobicContact CG2-CB 4.05Å; V386-E400 HydrophobicContact CG2-CG 3.78Å
387	V	59.5	Low	59.2	Low	74 Å²	74	88.2 Å²	88.2	45%	0.448	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	110.6	173.1	-171.8	0	0	0	0	106.4	I397	V387-I397 HydrophobicContact CG2-CG1 4.23Å
388	D	55.3	Low	58.1	Low	80 Å²	80	92 Å²	92	43%	0.428	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.6	170.6	-151	-11.5	0	0	0	108.6	A390 I396 Y398	D388-A390 PolarHBondContact O-N 3.13Å; D388-A390 WeakPolarHBondContact OD1-CB 3.34Å; D388-A390 PolarHBondContact OD1-N 3.05Å; D388-I396 PolarHBondContact N-O 2.95Å; D388-Y398 HydrophobicContact CB-CE1 4.04Å
389	E	53.7	Low	57.2	Low	173 Å²	173	94.9 Å²	94.9	81%	0.808	49%	0.488	S	S	*	.			trans	-92.2	34.8	171.2	-69.3	-174.3	171.8	0	0	110.8	F391	E389-F391 PolarHBondContact O-N 3.17Å; E389-F391 VanDerWaalsContact O-N 3.12Å
390	A	48	Very low	57	Low	59 Å²	59	95.8 Å²	95.8	49%	0.488	49%	0.491	S	S	.	.			trans	-71.8	105.2	178.6	0	0	0	0	0	111.3	D388	D388-A390 PolarHBondContact O-N 3.13Å; D388-A390 WeakPolarHBondContact OD1-CB 3.34Å; D388-A390 PolarHBondContact OD1-N 3.05Å
391	F	48	Very low	56.9	Low	210 Å²	210	96.1 Å²	96.1	92%	0.921	48%	0.482	S	S	*	.	S	Bend	trans	60.9	76.4	166.7	-70.1	-89.6	0	0	0	117.2	E389	E389-F391 PolarHBondContact O-N 3.17Å; E389-F391 VanDerWaalsContact O-N 3.12Å
392	G	45.8	Very low	57.4	Low	68 Å²	68	93.6 Å²	93.6	70%	0.701	47%	0.468	S	S	*	.	S	Bend	trans	86.9	100.7	152.4	0	0	0	0	0	116.4	D394	G392-D394 VanDerWaalsContact C-N 3.29Å; G392-D394 PolarHBondContact O-N 3.49Å
393	R	53.4	Low	57.9	Low	217 Å²	217	98.8 Å²	98.8	82%	0.819	49%	0.493	S	S	*	.	S	Bend	trans	58.4	-18.7	159.7	-80.8	-172.6	179.2	-171.5	-0.3	121.5	Q78	Q78-R393 PolarHBondContact NE2-O 3.49Å
394	D	46	Very low	58.8	Low	140 Å²	140	93.4 Å²	93.4	75%	0.749	47%	0.474	S	S	*	.			trans	-105.9	98.4	170.2	-72.7	-19.4	0	0	0	110.3	G392 I396	G392-D394 VanDerWaalsContact C-N 3.29Å; G392-D394 PolarHBondContact O-N 3.49Å; D394-I396 PolarHBondContact O-N 3.42Å
395	S	50.7	Low	59.6	Low	41 Å²	41	90.3 Å²	90.3	29%	0.287	47%	0.465	S	S	.	.			trans	-69.8	113.6	173.5	54.3	0	0	0	0	109.8
396	I	54.2	Low	60.7	Low	120 Å²	120	90 Å²	90	62%	0.615	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.2	172.1	-59.5	174.8	0	0	0	107.6	D388 D394	D388-I396 PolarHBondContact N-O 2.95Å; D394-I396 PolarHBondContact O-N 3.42Å
397	I	55	Low	61.9	Low	57 Å²	57	89.8 Å²	89.8	29%	0.292	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.6	171.7	-51.6	-179.5	0	0	0	107.6	P385 V386 V387	P385-I397 HydrophobicContact CB-CG2 3.77Å; V386-I397 WeakPolarHBondContact O-CA 3.31Å; V387-I397 HydrophobicContact CG2-CG1 4.23Å
398	Y	65.3	Low	62.9	Low	93 Å²	93	87.2 Å²	87.2	37%	0.365	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	149.6	170.9	70.1	-86.3	0	0	0	110	V386 D388 E400	V386-Y398 HydrophobicContact CB-CD1 4.24Å; V386-Y398 HydrophobicContact CB-CD2 4.35Å; V386-Y398 HydrophobicContact CB-CE1 3.77Å; V386-Y398 HydrophobicContact CB-CE2 3.93Å; V386-Y398 HydrophobicContact CB-CG 4.5Å; V386-Y398 HydrophobicContact CG1-CE1 3.66Å; V386-Y398 HydrophobicContact CG1-CE2 4.34Å; V386-Y398 WeakPolarHBondContact CG1-OH 3.26Å; V386-Y398 HydrophobicContact CG2-CE2 4.28Å; V386-Y398 PolarHBondContact N-O 2.92Å; V386-Y398 WeakPolarHBondContact O-CD1 3.34Å; V386-Y398 PolarHBondContact O-N 3.01Å; D388-Y398 HydrophobicContact CB-CE1 4.04Å; Y398-E400 HydrophobicContact CD2-CG 3.98Å; Y398-E400 HydrophobicContact CE2-CG 3.5Å; Y398-E400 VanDerWaalsContact CE2-CG 3.5Å; Y398-E400 WeakPolarHBondContact CE2-OE1 3.41Å; Y398-E400 PolarHBondContact OH-OE1 3.41Å; Y398-E400 VanDerWaalsContact OH-OE1 3.1Å
399	Y	63.8	Low	63.9	Low	112 Å²	112	83.9 Å²	83.9	44%	0.439	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.7	-174.8	-63.3	-88.8	0	0	0	110.9	D260 H305 R384 P385	D260-Y399 PolarHBondContact OD2-OH 3.2Å; H305-Y399 AromaticContact CE1-CZ 3.98Å; H305-Y399 PolarHBondContact CE1-OH 3.36Å; H305-Y399 VanDerWaalsContact CE1-OH 3.28Å; R384-Y399 CarbonylContact O-C 3.52Å; R384-Y399 WeakPolarHBondContact O-CA 3.25Å; P385-Y399 HydrophobicContact CB-CD1 3.95Å; P385-Y399 HydrophobicContact CB-CE1 3.72Å; P385-Y399 HydrophobicContact CG-CE1 4.32Å
400	E	67.1	Low	65	Low	72 Å²	72	80.8 Å²	80.8	34%	0.336	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	144.9	171.8	-69.6	-174.8	175.5	0	0	110.4	Y383 R384 V386 Y398 E402	Y383-E400 CarbonylContact C-O 3.52Å; Y383-E400 WeakPolarHBondContact CA-O 3.36Å; R384-E400 PolarHBondContact N-O 2.87Å; R384-E400 PolarHBondContact O-N 2.98Å; V386-E400 HydrophobicContact CG2-CB 4.05Å; V386-E400 HydrophobicContact CG2-CG 3.78Å; Y398-E400 HydrophobicContact CD2-CG 3.98Å; Y398-E400 HydrophobicContact CE2-CG 3.5Å; Y398-E400 VanDerWaalsContact CE2-CG 3.5Å; Y398-E400 WeakPolarHBondContact CE2-OE1 3.41Å; Y398-E400 PolarHBondContact OH-OE1 3.41Å; Y398-E400 VanDerWaalsContact OH-OE1 3.1Å; E400-E402 PolarHBondContact O-N 2.96Å
401	P	65.5	Low	66.2	Low	61.5 Å²	61.5	80 Å²	80	40%	0.399	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	137.8	171.3	24.9	-31.5	0	0	0	110.3	Y383 I403	Y383-P401 HydrophobicContact CD1-CB 4.03Å; Y383-P401 HydrophobicContact CE1-CB 3.92Å; Y383-P401 HydrophobicContact CE1-CG 4.35Å; P401-I403 WeakPolarHBondContact O-CG1 3.1Å; P401-I403 PolarHBondContact O-N 2.97Å; P401-I403 VanDerWaalsContact O-N 3.08Å
402	E	69.7	Low	67.3	Low	38.5 Å²	38.5	74.8 Å²	74.8	18%	0.18	39%	0.391	C	S	.	.			trans	-57.9	115	174.4	-77.2	-170.6	134.4	0	0	109.8	K275 S382 R384 E400 P404 I424	K275-E402 IonicContact NZ-OE1 3.67Å; S382-E402 WeakPolarHBondContact CB-OE2 3.21Å; S382-E402 PolarHBondContact O-N 3.14Å; S382-E402 VanDerWaalsContact OG-CD 3.32Å; S382-E402 PolarHBondContact OG-OE2 2.8Å; R384-E402 HydrophobicContact CB-CG 4Å; E400-E402 PolarHBondContact O-N 2.96Å; E402-P404 WeakPolarHBondContact O-CD 3.42Å; E402-I424 HydrophobicContact CB-CD1 3.57Å; E402-I424 VanDerWaalsContact CD-CD1 3.48Å; E402-I424 HydrophobicContact CG-CD1 4.1Å; E402-I424 WeakPolarHBondContact OE2-CD1 3.39Å
403	I	74.2	Confident	68.6	Low	130 Å²	130	77 Å²	77	67%	0.667	39%	0.39	S	S	*	.			trans	-74.8	125.4	-175.9	-54.1	173.7	0	0	0	108.5	P401 E405	P401-I403 WeakPolarHBondContact O-CG1 3.1Å; P401-I403 PolarHBondContact O-N 2.97Å; P401-I403 VanDerWaalsContact O-N 3.08Å; I403-E405 PolarHBondContact O-N 3.02Å
404	P	79.2	Confident	69.6	Low	16.5 Å²	16.5	69.1 Å²	69.1	11%	0.107	36%	0.364	C	S	.	.			trans	-57.5	135.8	172.4	-20.3	30.8	0	0	0	111.3	E402 I406 I424 S426 V514	E402-P404 WeakPolarHBondContact O-CD 3.42Å; P404-I406 PolarHBondContact O-N 3.14Å; P404-I424 HydrophobicContact CB-CG2 4.25Å; P404-I424 HydrophobicContact CG-CG2 4.38Å; P404-S426 WeakPolarHBondContact CB-OG 3.34Å; P404-V514 HydrophobicContact CG-CG1 4.29Å; P404-V514 HydrophobicContact CG-CG2 4.43Å
405	E	79.5	Confident	71.2	Confident	71 Å²	71	66.9 Å²	66.9	33%	0.332	35%	0.352	S	S	.	.	S	Bend	trans	-65.7	-27.4	-179.9	-63.7	-179.2	-171.5	0	0	112.5	I403 R418 R423 I424	I403-E405 PolarHBondContact O-N 3.02Å; E405-R418 IonicContact OE1-CZ 3.34Å; E405-R418 VanDerWaalsContact OE1-CZ 3.26Å; E405-R418 IonicContact OE1-NE 2.71Å; E405-R418 IonicContact OE1-NH1 3.13Å; E405-R418 PolarHBondContact OE1-NH1 3.09Å; E405-R418 IonicContact OE1-NH2 2.76Å; E405-R418 IonicContact OE2-NH1 3.42Å; E405-R423 IonicContact OE1-NE 2.98Å; E405-R423 IonicContact OE2-CZ 3.43Å; E405-R423 IonicContact OE2-NE 2.7Å; E405-R423 PolarHBondContact OE2-NE 3.11Å; E405-R423 IonicContact OE2-NH2 3.11Å; E405-R423 PolarHBondContact OE2-NH2 2.85Å; E405-I424 PolarHBondContact N-O 3.24Å
406	I	83.7	Confident	72.3	Confident	24 Å²	24	69.7 Å²	69.7	12%	0.123	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	144.1	-175.3	-166.8	160.7	0	0	0	109	P404 I408 A411 V413 L414 V425 S426	P404-I406 PolarHBondContact O-N 3.14Å; I406-I408 HydrophobicContact CG2-CG2 4.25Å; I406-A411 HydrophobicContact CD1-CB 3.51Å; I406-A411 VanDerWaalsContact CD1-CB 3.46Å; I406-A411 VanDerWaalsContact CD1-O 3.32Å; I406-A411 WeakPolarHBondContact CD1-O 3.42Å; I406-A411 HydrophobicContact CG1-CB 3.75Å; I406-A411 WeakPolarHBondContact CG1-O 3.29Å; I406-V413 VanDerWaalsContact CD1-O 3.32Å; I406-V413 WeakPolarHBondContact CD1-O 3.36Å; I406-L414 HydrophobicContact CG2-CD2 3.62Å; I406-V425 HydrophobicContact CG2-CB 4.13Å; I406-V425 HydrophobicContact CG2-CG1 3.78Å; I406-S426 PolarHBondContact O-N 3.04Å; I406-S426 PolarHBondContact O-OG 3.3Å
407	D	82.7	Confident	73.4	Confident	28 Å²	28	68.1 Å²	68.1	15%	0.15	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	111	158.4	173.9	23.5	0	0	0	108.7	C409 T410 A411 S426 A427 Q428	D407-C409 PolarHBondContact O-N 2.91Å; D407-C409 VanDerWaalsContact O-N 3.12Å; D407-C409 WeakPolarHBondContact OD1-CB 3.38Å; D407-C409 PolarHBondContact OD1-N 2.89Å; D407-T410 WeakPolarHBondContact CB-OG1 3.48Å; D407-T410 PolarHBondContact O-N 3.25Å; D407-T410 PolarHBondContact O-OG1 2.83Å; D407-T410 WeakPolarHBondContact OD2-CG2 3.5Å; D407-T410 PolarHBondContact OD2-OG1 3.36Å; D407-A411 PolarHBondContact O-N 2.87Å; D407-S426 CarbonylContact C-O 3.31Å; D407-S426 VanDerWaalsContact CA-O 3.29Å; D407-S426 WeakPolarHBondContact CA-O 3.36Å; D407-A427 VanDerWaalsContact OD1-CA 3.3Å; D407-A427 WeakPolarHBondContact OD1-CA 3.32Å; D407-Q428 PolarHBondContact OD1-N 3.11Å
408	I	80.3	Confident	74.6	Confident	20 Å²	20	69.5 Å²	69.5	10%	0.103	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.4	-176.2	68.3	-178.1	0	0	0	112.1	I406 T410 A411 H412 V425 S426 A427 P443 I496 M515	I406-I408 HydrophobicContact CG2-CG2 4.25Å; I408-T410 VanDerWaalsContact C-N 3.32Å; I408-T410 PolarHBondContact O-N 3.1Å; I408-A411 VanDerWaalsContact CA-O 3.31Å; I408-A411 WeakPolarHBondContact CA-O 3.39Å; I408-H412 PolarHBondContact O-CE1 2.98Å; I408-H412 PolarHBondContact O-ND1 3Å; I408-V425 HydrophobicContact CG2-CB 4.01Å; I408-V425 HydrophobicContact CG2-CG1 4.5Å; I408-V425 HydrophobicContact CG2-CG2 4.36Å; I408-S426 WeakPolarHBondContact CG1-O 3.34Å; I408-S426 PolarHBondContact N-O 2.58Å; I408-A427 HydrophobicContact CD1-CB 3.71Å; I408-A427 HydrophobicContact CG1-CB 3.62Å; I408-P443 HydrophobicContact CB-CG 4.41Å; I408-P443 WeakPolarHBondContact O-CG 3.41Å; I408-I496 HydrophobicContact CD1-CB 4.41Å; I408-I496 HydrophobicContact CD1-CG2 4.07Å; I408-M515 HydrophobicContact CD1-CE 3.98Å
409	C	76.2	Confident	75.2	Confident	10 Å²	10	73.1 Å²	73.1	7%	0.068	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.7	176.8	-59.7	0	0	0	0	113.3	D407 Q428 C444	D407-C409 PolarHBondContact O-N 2.91Å; D407-C409 VanDerWaalsContact O-N 3.12Å; D407-C409 WeakPolarHBondContact OD1-CB 3.38Å; D407-C409 PolarHBondContact OD1-N 2.89Å; C409-Q428 WeakPolarHBondContact CB-O 3.24Å; C409-Q428 PolarHBondContact SG-O 2.78Å; C409-C444 WeakPolarHBondContact CA-SG 3.17Å; C409-C444 HydrophobicContact CB-CB 3.42Å; C409-C444 VanDerWaalsContact CB-CB 3.48Å; C409-C444 WeakPolarHBondContact CB-SG 3.36Å; C409-C444 WeakPolarHBondContact SG-CB 3.25Å; C409-C444 CovalentContact SG-SG 2.03Å; C409-C444 PolarHBondContact SG-SG 2.97Å
410	T	76.8	Confident	76	Confident	109 Å²	109	69.1 Å²	69.1	67%	0.669	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-31.4	178.5	55.3	0	0	0	0	112.9	D407 I408	D407-T410 WeakPolarHBondContact CB-OG1 3.48Å; D407-T410 PolarHBondContact O-N 3.25Å; D407-T410 PolarHBondContact O-OG1 2.83Å; D407-T410 WeakPolarHBondContact OD2-CG2 3.5Å; D407-T410 PolarHBondContact OD2-OG1 3.36Å; I408-T410 VanDerWaalsContact C-N 3.32Å; I408-T410 PolarHBondContact O-N 3.1Å
411	A	73	Confident	76.8	Confident	41.5 Å²	41.5	67.6 Å²	67.6	34%	0.343	38%	0.375	S	S	.	.			trans	-141	130.4	-179.8	0	0	0	0	0	111.3	I406 D407 I408	I406-A411 HydrophobicContact CD1-CB 3.51Å; I406-A411 VanDerWaalsContact CD1-CB 3.46Å; I406-A411 VanDerWaalsContact CD1-O 3.32Å; I406-A411 WeakPolarHBondContact CD1-O 3.42Å; I406-A411 HydrophobicContact CG1-CB 3.75Å; I406-A411 WeakPolarHBondContact CG1-O 3.29Å; D407-A411 PolarHBondContact O-N 2.87Å; I408-A411 VanDerWaalsContact CA-O 3.31Å; I408-A411 WeakPolarHBondContact CA-O 3.39Å
412	H	72	Confident	77.7	Confident	101 Å²	101	65.8 Å²	65.8	47%	0.468	36%	0.363	S	S	.	.			trans	-102.8	-7.1	-165.4	-48.7	-33.3	0	0	0	114.3	I408 P443	I408-H412 PolarHBondContact O-CE1 2.98Å; I408-H412 PolarHBondContact O-ND1 3Å; H412-P443 HydrophobicContact CB-CG 4.42Å; H412-P443 WeakPolarHBondContact CE1-CD 3.23Å; H412-P443 WeakPolarHBondContact ND1-CD 3.42Å; H412-P443 VanDerWaalsContact ND1-CG 3.26Å; H412-P443 WeakPolarHBondContact ND1-CG 3.23Å
413	V	72	Confident	78.4	Confident	114 Å²	114	64.5 Å²	64.5	69%	0.691	36%	0.357	S	S	*	.	S	Bend	trans	-118.4	117.1	-178.5	-177.2	0	0	0	0	108.1	I406	I406-V413 VanDerWaalsContact CD1-O 3.32Å; I406-V413 WeakPolarHBondContact CD1-O 3.36Å
414	L	75.7	Confident	78.8	Confident	51.5 Å²	51.5	59.4 Å²	59.4	27%	0.27	33%	0.33	S	S	.	.			trans	-60	143.5	171.1	-76.5	168.4	0	0	0	110.4	I406 P416 V425	I406-L414 HydrophobicContact CG2-CD2 3.62Å; L414-P416 VanDerWaalsContact O-CD 3.27Å; L414-P416 WeakPolarHBondContact O-CD 3.38Å; L414-V425 HydrophobicContact CD2-CG1 3.72Å
415	N	78.1	Confident	79.2	Confident	93.5 Å²	93.5	58.7 Å²	58.7	50%	0.5	33%	0.326	S	S	.	.			trans	-49.1	114.4	179.4	-179.9	-4.8	0	0	0	110.6	A417 R418 R423	N415-A417 PolarHBondContact O-N 2.95Å; N415-A417 VanDerWaalsContact OD1-CB 3.25Å; N415-A417 WeakPolarHBondContact OD1-CB 3.41Å; N415-A417 PolarHBondContact OD1-N 3.13Å; N415-R418 PolarHBondContact O-N 2.97Å; N415-R423 VanDerWaalsContact N-NH2 3.17Å; N415-R423 PolarHBondContact O-NH1 2.82Å; N415-R423 VanDerWaalsContact O-NH1 3.1Å; N415-R423 PolarHBondContact O-NH2 3.18Å
416	P	74.8	Confident	79.5	Confident	99.5 Å²	99.5	55.7 Å²	55.7	65%	0.646	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-17.6	-175.4	27	-33.8	0	0	0	113	L414 R418	L414-P416 VanDerWaalsContact O-CD 3.27Å; L414-P416 WeakPolarHBondContact O-CD 3.38Å; P416-R418 VanDerWaalsContact C-N 3.32Å
417	A	77.8	Confident	79.5	Confident	87.5 Å²	87.5	54.6 Å²	54.6	72%	0.723	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-34.1	176.3	0	0	0	0	0	112.1	N415 K419	N415-A417 PolarHBondContact O-N 2.95Å; N415-A417 VanDerWaalsContact OD1-CB 3.25Å; N415-A417 WeakPolarHBondContact OD1-CB 3.41Å; N415-A417 PolarHBondContact OD1-N 3.13Å; A417-K419 PolarHBondContact O-N 2.82Å
418	R	80	Confident	79.3	Confident	85.5 Å²	85.5	56.4 Å²	56.4	32%	0.323	31%	0.314	S	S	.	.			trans	-95.7	97.2	174.8	-174.1	179.1	173.3	-173.9	-3.4	109.7	E405 N415 P416 S420 P422 R423	E405-R418 IonicContact OE1-CZ 3.34Å; E405-R418 VanDerWaalsContact OE1-CZ 3.26Å; E405-R418 IonicContact OE1-NE 2.71Å; E405-R418 IonicContact OE1-NH1 3.13Å; E405-R418 PolarHBondContact OE1-NH1 3.09Å; E405-R418 IonicContact OE1-NH2 2.76Å; E405-R418 IonicContact OE2-NH1 3.42Å; N415-R418 PolarHBondContact O-N 2.97Å; P416-R418 VanDerWaalsContact C-N 3.32Å; R418-S420 VanDerWaalsContact C-N 3.3Å; R418-P422 PolarHBondContact NH2-O 3.02Å; R418-R423 PolarHBondContact O-NH1 3.15Å
419	K	76.9	Confident	79	Confident	168 Å²	168	55.9 Å²	55.9	73%	0.73	31%	0.312	S	S	*	.			trans	-83	-3.4	177.3	-63.1	-176.5	-180	178.7	0	114	A417	A417-K419 PolarHBondContact O-N 2.82Å
420	S	81.1	Confident	78.6	Confident	29 Å²	29	57.5 Å²	57.5	20%	0.203	32%	0.321	C	S	.	.			trans	-95.5	146.5	-172.1	58.7	0	0	0	0	114.1	V271 I273 R418 R423	V271-S420 CarbonylContact O-C 3.14Å; V271-S420 WeakPolarHBondContact O-CA 3.29Å; I273-S420 WeakPolarHBondContact CD1-OG 3.29Å; R418-S420 VanDerWaalsContact C-N 3.3Å; S420-R423 WeakPolarHBondContact O-CG 3.45Å
421	F	83.5	Confident	77.7	Confident	40.5 Å²	40.5	57.3 Å²	57.3	18%	0.178	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-114.8	149.5	176.2	-71.6	-95	0	0	0	111.1	V271 I273 R423 I517 S519	V271-F421 HydrophobicContact CB-CD2 4.2Å; V271-F421 HydrophobicContact CG2-CD2 4.15Å; V271-F421 PolarHBondContact O-N 3.38Å; I273-F421 WeakPolarHBondContact CG1-O 3.48Å; I273-F421 PolarHBondContact N-O 3.49Å; F421-R423 HydrophobicContact CD1-CB 4.28Å; F421-R423 HydrophobicContact CD1-CG 3.84Å; F421-R423 HydrophobicContact CE1-CB 4.47Å; F421-R423 HydrophobicContact CE1-CG 4.11Å; F421-R423 HydrophobicContact CG-CG 4.32Å; F421-I517 HydrophobicContact CD1-CG2 4.12Å; F421-I517 WeakPolarHBondContact CD1-O 3.44Å; F421-I517 HydrophobicContact CE1-CB 4.49Å; F421-I517 HydrophobicContact CE1-CG2 3.89Å; F421-S519 VanDerWaalsContact CD2-CB 3.49Å
422	P	83.7	Confident	76.7	Confident	23.5 Å²	23.5	61.3 Å²	61.3	15%	0.153	34%	0.337	C	S	.	.			cis	-79.1	155.6	16.4	29.9	-34.7	0	0	0	114.5	R418 K516 I517	R418-P422 PolarHBondContact NH2-O 3.02Å; P422-K516 HydrophobicContact CB-CG 4.16Å; P422-I517 CarbonylContact C-O 3.51Å; P422-I517 WeakPolarHBondContact CA-O 3.4Å; P422-I517 WeakPolarHBondContact CB-O 3.4Å
423	R	84.6	Confident	75.7	Confident	11.5 Å²	11.5	58.1 Å²	58.1	4%	0.043	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.6	174.2	-58.5	-169.1	75.2	160.6	1.8	109.5	E405 N415 R418 S420 F421 I517	E405-R423 IonicContact OE1-NE 2.98Å; E405-R423 IonicContact OE2-CZ 3.43Å; E405-R423 IonicContact OE2-NE 2.7Å; E405-R423 PolarHBondContact OE2-NE 3.11Å; E405-R423 IonicContact OE2-NH2 3.11Å; E405-R423 PolarHBondContact OE2-NH2 2.85Å; N415-R423 VanDerWaalsContact N-NH2 3.17Å; N415-R423 PolarHBondContact O-NH1 2.82Å; N415-R423 VanDerWaalsContact O-NH1 3.1Å; N415-R423 PolarHBondContact O-NH2 3.18Å; R418-R423 PolarHBondContact O-NH1 3.15Å; S420-R423 WeakPolarHBondContact O-CG 3.45Å; F421-R423 HydrophobicContact CD1-CB 4.28Å; F421-R423 HydrophobicContact CD1-CG 3.84Å; F421-R423 HydrophobicContact CE1-CB 4.47Å; F421-R423 HydrophobicContact CE1-CG 4.11Å; F421-R423 HydrophobicContact CG-CG 4.32Å; R423-I517 PolarHBondContact N-O 3.01Å; R423-I517 PolarHBondContact O-N 2.92Å
424	I	83.8	Confident	74.4	Confident	22 Å²	22	55.9 Å²	55.9	11%	0.113	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.4	178.8	-56.8	171.1	0	0	0	107.3	E402 P404 E405 V514 M515 K516	E402-I424 HydrophobicContact CB-CD1 3.57Å; E402-I424 VanDerWaalsContact CD-CD1 3.48Å; E402-I424 HydrophobicContact CG-CD1 4.1Å; E402-I424 WeakPolarHBondContact OE2-CD1 3.39Å; P404-I424 HydrophobicContact CB-CG2 4.25Å; P404-I424 HydrophobicContact CG-CG2 4.38Å; E405-I424 PolarHBondContact N-O 3.24Å; I424-V514 HydrophobicContact CG2-CG1 3.78Å; I424-M515 WeakPolarHBondContact CA-O 3.37Å; I424-K516 HydrophobicContact CG1-CB 4.49Å; I424-K516 HydrophobicContact CG1-CG 4.19Å
425	V	87	Confident	73	Confident	3 Å²	3	57 Å²	57	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	143.2	-179.8	-56.2	0	0	0	0	108.7	I406 I408 L414 M515 I517	I406-V425 HydrophobicContact CG2-CB 4.13Å; I406-V425 HydrophobicContact CG2-CG1 3.78Å; I408-V425 HydrophobicContact CG2-CB 4.01Å; I408-V425 HydrophobicContact CG2-CG1 4.5Å; I408-V425 HydrophobicContact CG2-CG2 4.36Å; L414-V425 HydrophobicContact CD2-CG1 3.72Å; V425-M515 HydrophobicContact CG2-CB 3.98Å; V425-M515 HydrophobicContact CG2-CE 4.05Å; V425-M515 PolarHBondContact N-O 3Å; V425-M515 PolarHBondContact O-N 3.27Å; V425-I517 HydrophobicContact CG1-CD1 4.29Å; V425-I517 HydrophobicContact CG2-CD1 3.72Å; V425-I517 HydrophobicContact CG2-CG1 4.31Å
426	S	86.2	Confident	71.3	Confident	8 Å²	8	58.4 Å²	58.4	6%	0.056	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	156.8	169.3	49.8	0	0	0	0	110.5	P404 I406 D407 I408 V513	P404-S426 WeakPolarHBondContact CB-OG 3.34Å; I406-S426 PolarHBondContact O-N 3.04Å; I406-S426 PolarHBondContact O-OG 3.3Å; D407-S426 CarbonylContact C-O 3.31Å; D407-S426 VanDerWaalsContact CA-O 3.29Å; D407-S426 WeakPolarHBondContact CA-O 3.36Å; I408-S426 WeakPolarHBondContact CG1-O 3.34Å; I408-S426 PolarHBondContact N-O 2.58Å; S426-V513 CarbonylContact C-O 3.5Å; S426-V513 WeakPolarHBondContact CA-O 3.43Å
427	A	83.2	Confident	69.7	Low	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	105	164	0	0	0	0	0	106.3	D407 I408 L498 R512 V513 M515	D407-A427 VanDerWaalsContact OD1-CA 3.3Å; D407-A427 WeakPolarHBondContact OD1-CA 3.32Å; I408-A427 HydrophobicContact CD1-CB 3.71Å; I408-A427 HydrophobicContact CG1-CB 3.62Å; A427-L498 HydrophobicContact CB-CD1 3.52Å; A427-L498 VanDerWaalsContact CB-CD1 3.49Å; A427-L498 HydrophobicContact CB-CG 3.79Å; A427-R512 WeakPolarHBondContact O-CA 3.39Å; A427-V513 HydrophobicContact CB-CB 4.44Å; A427-V513 PolarHBondContact N-O 2.79Å; A427-V513 PolarHBondContact O-N 2.89Å; A427-M515 HydrophobicContact CB-CE 4.33Å
428	Q	78.5	Confident	68	Low	65.5 Å²	65.5	60.7 Å²	60.7	31%	0.306	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.9	-177.2	-171.2	172.7	-18	0	0	110.7	D407 C409 T430 S511 R512	D407-Q428 PolarHBondContact OD1-N 3.11Å; C409-Q428 WeakPolarHBondContact CB-O 3.24Å; C409-Q428 PolarHBondContact SG-O 2.78Å; Q428-T430 HydrophobicContact CG-CG2 4.02Å; Q428-T430 VanDerWaalsContact NE2-CG2 3.34Å; Q428-S511 WeakPolarHBondContact CA-O 3.46Å; Q428-R512 HydrophobicContact CB-CG 4.48Å; Q428-R512 HydrophobicContact CG-CB 4.36Å; Q428-R512 HydrophobicContact CG-CG 4.45Å
429	L	74.1	Confident	66.3	Low	9 Å²	9	59.7 Å²	59.7	5%	0.047	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	111.2	171.1	-72.3	166.4	0	0	0	107.9	C444 L453 L498 Y500 E510 S511	L429-C444 HydrophobicContact CD2-CB 4.2Å; L429-L453 HydrophobicContact CD1-CD1 3.69Å; L429-L453 HydrophobicContact CD1-CD2 4.34Å; L429-L498 HydrophobicContact CD1-CB 3.98Å; L429-L498 HydrophobicContact CD1-CD1 3.73Å; L429-L498 HydrophobicContact CD1-CG 4.47Å; L429-L498 HydrophobicContact CG-CD1 4.08Å; L429-Y500 HydrophobicContact CD1-CE2 3.98Å; L429-E510 WeakPolarHBondContact O-CA 3.27Å; L429-S511 PolarHBondContact N-O 2.84Å; L429-S511 PolarHBondContact O-N 3.12Å; L429-S511 VanDerWaalsContact O-N 3.13Å
430	T	68	Low	65	Low	43.5 Å²	43.5	58.2 Å²	58.2	27%	0.267	37%	0.373	S	S	.	.			trans	-103.8	161.7	174.4	55.3	0	0	0	0	110.6	Q428 T432 S433	Q428-T430 HydrophobicContact CG-CG2 4.02Å; Q428-T430 VanDerWaalsContact NE2-CG2 3.34Å; T430-T432 PolarHBondContact O-N 2.9Å; T430-T432 PolarHBondContact OG1-OG1 2.98Å; T430-S433 PolarHBondContact O-N 3.05Å; T430-S433 PolarHBondContact O-OG 2.98Å
431	N	58.8	Low	63.6	Low	105.5 Å²	105.5	64.6 Å²	64.6	56%	0.564	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-23	179.9	-110.3	-11.3	0	0	0	114.1	R508	N431-R508 WeakPolarHBondContact OD1-CB 3.49Å
432	T	50	Low	62.3	Low	126 Å²	126	65.1 Å²	65.1	77%	0.773	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-0.8	-176.6	48.5	0	0	0	0	114.6	T430 G434	T430-T432 PolarHBondContact O-N 2.9Å; T430-T432 PolarHBondContact OG1-OG1 2.98Å; T432-G434 PolarHBondContact O-N 3.08Å
433	S	51.2	Low	61.3	Low	33 Å²	33	64.4 Å²	64.4	23%	0.231	40%	0.396	C	S	.	.			trans	-76.8	66.6	174.7	56.6	0	0	0	0	110.9	T430 L435	T430-S433 PolarHBondContact O-N 3.05Å; T430-S433 PolarHBondContact O-OG 2.98Å; S433-L435 PolarHBondContact O-N 2.96Å
434	G	45.1	Very low	60.3	Low	69 Å²	69	64 Å²	64	71%	0.711	40%	0.395	S	S	*	.			trans	-69.7	71.5	161.1	0	0	0	0	0	109	T432 T436	T432-G434 PolarHBondContact O-N 3.08Å; G434-T436 PolarHBondContact O-N 2.89Å; G434-T436 VanDerWaalsContact O-N 3.08Å
435	L	46.7	Very low	59.2	Low	75 Å²	75	66 Å²	66	39%	0.393	40%	0.401	S	S	.	.			trans	-67.2	114.1	170.8	-97.4	99.3	0	0	0	108.1	S433 T437 C444	S433-L435 PolarHBondContact O-N 2.96Å; L435-T437 PolarHBondContact O-N 3.17Å; L435-C444 WeakPolarHBondContact CD2-O 3.22Å
436	T	42.6	Very low	57.5	Low	122 Å²	122	70.2 Å²	70.2	75%	0.748	42%	0.423	S	S	*	.			trans	-45.6	133.9	177.5	47.7	0	0	0	0	111.8	G434 A438	G434-T436 PolarHBondContact O-N 2.89Å; G434-T436 VanDerWaalsContact O-N 3.08Å; T436-A438 PolarHBondContact O-N 2.78Å
437	T	41.9	Very low	55.9	Low	146.5 Å²	146.5	72.2 Å²	72.2	90%	0.899	44%	0.435	S	S	*	.	S	Bend	trans	-60.8	87.5	170.7	48.1	0	0	0	0	112.3	L435	L435-T437 PolarHBondContact O-N 3.17Å
438	A	41.4	Very low	54.3	Low	89 Å²	89	75.4 Å²	75.4	74%	0.736	46%	0.455	S	S	*	.			trans	177.3	113.2	170.6	0	0	0	0	0	113.9	T436	T436-A438 PolarHBondContact O-N 2.78Å
439	G	43.6	Very low	53	Low	65 Å²	65	74.5 Å²	74.5	67%	0.67	45%	0.451	S	S	*	.	S	Bend	trans	33.8	124.7	168.8	0	0	0	0	0	115.4	Q441	G439-Q441 PolarHBondContact O-N 3.33Å
440	D	50.9	Low	52	Low	136 Å²	136	77.1 Å²	77.1	73%	0.727	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	18.1	155.6	-72.5	-16.2	0	0	0	121.4	L466	D440-L466 HydrophobicContact CB-CD1 3.93Å
441	Q	51	Low	51.4	Low	163 Å²	163	79 Å²	79	76%	0.762	47%	0.474	S	S	*	.			trans	-117.7	81.5	171.9	-69.2	-175.1	-5.9	0	0	111.8	G439	G439-Q441 PolarHBondContact O-N 3.33Å
442	W	55.5	Low	51.8	Low	51 Å²	51	74.5 Å²	74.5	19%	0.193	45%	0.451	C	S	.	.			trans	-79.5	137.1	169.1	-126.4	67.2	0	0	0	110.3	Y445 Y456 W495 G497 K499	W442-Y445 AromaticContact CD1-CD1 3.52Å; W442-Y445 AromaticContact CD1-CE1 3.58Å; W442-Y445 AromaticContact CD2-CD1 3.88Å; W442-Y445 HydrophobicContact CD2-CD1 3.88Å; W442-Y445 AromaticContact CD2-CE1 3.69Å; W442-Y445 HydrophobicContact CD2-CE1 3.69Å; W442-Y445 AromaticContact CE2-CD1 3.64Å; W442-Y445 AromaticContact CE2-CE1 3.03Å; W442-Y445 AromaticContact CE2-CZ 3.64Å; W442-Y445 HydrophobicContact CE3-CD1 4.26Å; W442-Y445 HydrophobicContact CE3-CE1 4.08Å; W442-Y445 HydrophobicContact CG-CD1 4.44Å; W442-Y445 HydrophobicContact CH2-CD1 4.43Å; W442-Y445 AromaticContact CH2-CE1 3.51Å; W442-Y445 HydrophobicContact CH2-CE1 3.51Å; W442-Y445 HydrophobicContact CZ2-CD1 4.06Å; W442-Y445 AromaticContact CZ2-CE1 3.05Å; W442-Y445 HydrophobicContact CZ2-CE1 3.05Å; W442-Y445 AromaticContact CZ2-CZ 3.53Å; W442-Y445 WeakPolarHBondContact CZ2-OH 3.03Å; W442-Y445 HydrophobicContact CZ3-CD1 4.46Å; W442-Y445 AromaticContact CZ3-CE1 3.94Å; W442-Y445 HydrophobicContact CZ3-CE1 3.94Å; W442-Y445 AromaticContact NE1-CD1 3.42Å; W442-Y445 AromaticContact NE1-CE1 3.13Å; W442-Y445 VanDerWaalsContact NE1-CE1 3.34Å; W442-Y445 AromaticContact NE1-CZ 3.63Å; W442-Y456 VanDerWaalsContact CH2-CB 3.45Å; W442-Y456 AromaticContact CH2-CD1 3.76Å; W442-Y456 HydrophobicContact CH2-CD1 3.76Å; W442-Y456 AromaticContact CH2-CD2 3.71Å; W442-Y456 HydrophobicContact CH2-CD2 3.71Å; W442-Y456 HydrophobicContact CH2-CE1 4.21Å; W442-Y456 HydrophobicContact CH2-CE2 4.17Å; W442-Y456 AromaticContact CH2-CG 3.53Å; W442-Y456 HydrophobicContact CH2-CG 3.97Å; W442-Y456 HydrophobicContact CZ2-CG 4.26Å; W442-Y456 HydrophobicContact CZ3-CD1 4.34Å; W442-Y456 AromaticContact CZ3-CD2 3.99Å; W442-Y456 HydrophobicContact CZ3-CD2 3.99Å; W442-Y456 AromaticContact CZ3-CG 3.76Å; W442-Y456 HydrophobicContact CZ3-CG 3.76Å; W442-W495 HydrophobicContact CE3-CB 4.19Å; W442-W495 HydrophobicContact CE3-CE3 4.32Å; W442-W495 HydrophobicContact CZ3-CB 3.96Å; W442-G497 VanDerWaalsContact CH2-N 3.33Å; W442-K499 HydrophobicContact CH2-CB 3.67Å; W442-K499 HydrophobicContact CH2-CD 3.7Å; W442-K499 HydrophobicContact CH2-CG 4.22Å; W442-K499 HydrophobicContact CZ2-CB 4.28Å; W442-K499 HydrophobicContact CZ2-CD 3.73Å; W442-K499 HydrophobicContact CZ2-CG 4.41Å; W442-K499 HydrophobicContact CZ3-CB 4.11Å
443	P	63.5	Low	53.1	Low	9.5 Å²	9.5	68.9 Å²	68.9	6%	0.062	42%	0.416	C	S	.	.	S	Bend		-133	-15.9	85.9	37.5	-28.8	0	0	0	115.9	I408 H412 I496 G497 L498	I408-P443 HydrophobicContact CB-CG 4.41Å; I408-P443 WeakPolarHBondContact O-CG 3.41Å; H412-P443 HydrophobicContact CB-CG 4.42Å; H412-P443 WeakPolarHBondContact CE1-CD 3.23Å; H412-P443 WeakPolarHBondContact ND1-CD 3.42Å; H412-P443 VanDerWaalsContact ND1-CG 3.26Å; H412-P443 WeakPolarHBondContact ND1-CG 3.23Å; P443-I496 WeakPolarHBondContact CB-O 3.45Å; P443-G497 CarbonylContact O-C 3.49Å; P443-G497 VanDerWaalsContact O-C 3.23Å; P443-G497 WeakPolarHBondContact O-CA 3.19Å; P443-L498 PolarHBondContact O-N 3.13Å
444	C	64	Low	54.5	Low	2 Å²	2	68.2 Å²	68.2	1%	0.014	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.7	178.9	-62.3	0	0	0	0	111	C409 L429 L435 L498	C409-C444 WeakPolarHBondContact CA-SG 3.17Å; C409-C444 HydrophobicContact CB-CB 3.42Å; C409-C444 VanDerWaalsContact CB-CB 3.48Å; C409-C444 WeakPolarHBondContact CB-SG 3.36Å; C409-C444 WeakPolarHBondContact SG-CB 3.25Å; C409-C444 CovalentContact SG-SG 2.03Å; C409-C444 PolarHBondContact SG-SG 2.97Å; L429-C444 HydrophobicContact CD2-CB 4.2Å; L435-C444 WeakPolarHBondContact CD2-O 3.22Å; C444-L498 CarbonylContact C-O 3.47Å; C444-L498 VanDerWaalsContact CA-O 3.3Å; C444-L498 WeakPolarHBondContact CA-O 3.27Å; C444-L498 HydrophobicContact CB-CB 4.39Å
445	Y	59.9	Low	56.5	Low	63.5 Å²	63.5	65.2 Å²	65.2	25%	0.249	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	145.9	179.8	75.3	-68	0	0	0	113.2	W442 V447 L498 K499 Y500	W442-Y445 AromaticContact CD1-CD1 3.52Å; W442-Y445 AromaticContact CD1-CE1 3.58Å; W442-Y445 AromaticContact CD2-CD1 3.88Å; W442-Y445 HydrophobicContact CD2-CD1 3.88Å; W442-Y445 AromaticContact CD2-CE1 3.69Å; W442-Y445 HydrophobicContact CD2-CE1 3.69Å; W442-Y445 AromaticContact CE2-CD1 3.64Å; W442-Y445 AromaticContact CE2-CE1 3.03Å; W442-Y445 AromaticContact CE2-CZ 3.64Å; W442-Y445 HydrophobicContact CE3-CD1 4.26Å; W442-Y445 HydrophobicContact CE3-CE1 4.08Å; W442-Y445 HydrophobicContact CG-CD1 4.44Å; W442-Y445 HydrophobicContact CH2-CD1 4.43Å; W442-Y445 AromaticContact CH2-CE1 3.51Å; W442-Y445 HydrophobicContact CH2-CE1 3.51Å; W442-Y445 HydrophobicContact CZ2-CD1 4.06Å; W442-Y445 AromaticContact CZ2-CE1 3.05Å; W442-Y445 HydrophobicContact CZ2-CE1 3.05Å; W442-Y445 AromaticContact CZ2-CZ 3.53Å; W442-Y445 WeakPolarHBondContact CZ2-OH 3.03Å; W442-Y445 HydrophobicContact CZ3-CD1 4.46Å; W442-Y445 AromaticContact CZ3-CE1 3.94Å; W442-Y445 HydrophobicContact CZ3-CE1 3.94Å; W442-Y445 AromaticContact NE1-CD1 3.42Å; W442-Y445 AromaticContact NE1-CE1 3.13Å; W442-Y445 VanDerWaalsContact NE1-CE1 3.34Å; W442-Y445 AromaticContact NE1-CZ 3.63Å; Y445-V447 HydrophobicContact CD2-CG2 3.43Å; Y445-V447 HydrophobicContact CE2-CG2 3.17Å; Y445-V447 HydrophobicContact CG-CG2 4.5Å; Y445-V447 PolarHBondContact O-N 3.04Å; Y445-L498 WeakPolarHBondContact CD1-O 3.28Å; Y445-L498 PolarHBondContact N-O 2.93Å; Y445-K499 HydrophobicContact CD1-CB 4Å; Y445-K499 HydrophobicContact CD1-CG 4.18Å; Y445-K499 HydrophobicContact CE1-CB 3.35Å; Y445-K499 VanDerWaalsContact CE1-CB 3.44Å; Y445-K499 HydrophobicContact CE1-CD 3.55Å; Y445-K499 HydrophobicContact CE1-CG 3.25Å; Y445-K499 HydrophobicContact CE2-CD 4.4Å; Y445-K499 HydrophobicContact CE2-CG 4.17Å; Y445-K499 VanDerWaalsContact CZ-CD 3.44Å; Y445-K499 VanDerWaalsContact CZ-CE 3.49Å; Y445-K499 VanDerWaalsContact CZ-CG 3.47Å; Y445-K499 WeakPolarHBondContact OH-CD 3.45Å; Y445-K499 WeakPolarHBondContact OH-CE 3.27Å; Y445-K499 WeakPolarHBondContact OH-CG 3.5Å; Y445-K499 PolarHBondContact OH-NZ 3.18Å; Y445-Y500 PolarHBondContact O-N 3.32Å
446	L	51.3	Low	58.3	Low	91.5 Å²	91.5	62.1 Å²	62.1	48%	0.479	36%	0.359	S	S	.	.			trans	-98.8	101.8	175.1	-175	72.2	0	0	0	107.8	T448 Y500	L446-T448 HydrophobicContact CG-CG2 4.44Å; L446-Y500 HydrophobicContact CD1-CD2 3.4Å; L446-Y500 VanDerWaalsContact CD1-CD2 3.46Å; L446-Y500 HydrophobicContact CD1-CE2 3.48Å; L446-Y500 HydrophobicContact CD1-CG 4.06Å; L446-Y500 HydrophobicContact CG-CD2 4.47Å
447	V	51.7	Low	60.3	Low	51.5 Å²	51.5	56.5 Å²	56.5	31%	0.312	33%	0.325	S	S	.	.			trans	-86.6	126.1	153.5	-167.7	0	0	0	0	105.2	Y445 I449 Y500 D502 L503	Y445-V447 HydrophobicContact CD2-CG2 3.43Å; Y445-V447 HydrophobicContact CE2-CG2 3.17Å; Y445-V447 HydrophobicContact CG-CG2 4.5Å; Y445-V447 PolarHBondContact O-N 3.04Å; V447-I449 PolarHBondContact O-N 2.97Å; V447-Y500 WeakPolarHBondContact O-CB 3.42Å; V447-D502 CarbonylContact C-O 3.52Å; V447-D502 WeakPolarHBondContact CG1-O 3.39Å; V447-L503 HydrophobicContact CG1-CD2 3.68Å; V447-L503 HydrophobicContact CG1-CG 4.17Å
448	T	50.7	Low	62.2	Low	66 Å²	66	49.7 Å²	49.7	41%	0.405	28%	0.283	S	S	.	.	S	Bend	trans	-42.9	138.5	179	49.6	0	0	0	0	112	L446 D502 L503	L446-T448 HydrophobicContact CG-CG2 4.44Å; T448-D502 CarbonylContact C-O 3.53Å; T448-D502 CarbonylContact O-C 3.56Å; T448-L503 HydrophobicContact CG2-CD2 4.47Å; T448-L503 CarbonylContact O-C 3.45Å; T448-L503 WeakPolarHBondContact O-CA 3.44Å; T448-L503 PolarHBondContact O-N 3.37Å; T448-L503 WeakPolarHBondContact OG1-CD2 3.09Å
449	I	51.7	Low	64	Low	46.5 Å²	46.5	48.1 Å²	48.1	24%	0.238	26%	0.261	C	S	.	.			trans	-143.5	131.2	162.1	-55.7	150.2	0	0	0	113.3	V447 D502 L503 N504 T505 T506	V447-I449 PolarHBondContact O-N 2.97Å; I449-D502 CarbonylContact C-O 3.42Å; I449-D502 VanDerWaalsContact C-O 3.29Å; I449-D502 PolarHBondContact N-O 2.86Å; I449-L503 CarbonylContact O-C 3.45Å; I449-L503 VanDerWaalsContact O-C 3.25Å; I449-N504 WeakPolarHBondContact CG2-O 3.37Å; I449-N504 CarbonylContact O-C 3.55Å; I449-N504 VanDerWaalsContact O-CA 3.31Å; I449-N504 WeakPolarHBondContact O-CA 3.4Å; I449-N504 PolarHBondContact O-N 2.94Å; I449-T505 WeakPolarHBondContact CG1-O 3.37Å; I449-T505 WeakPolarHBondContact CG2-O 3.32Å; I449-T505 PolarHBondContact O-N 3.41Å; I449-T506 HydrophobicContact CD1-CG2 4Å
450	D	52.3	Low	65.2	Low	65 Å²	65	49.5 Å²	49.5	35%	0.348	25%	0.246	S	C	.	.			trans	135.9	165.8	167	-143.2	3.8	0	0	0	114.2	S452 Y500 D502	D450-S452 VanDerWaalsContact C-N 3.27Å; D450-S452 PolarHBondContact O-N 3.17Å; D450-S452 VanDerWaalsContact O-N 3.11Å; D450-Y500 VanDerWaalsContact O-CD1 3.23Å; D450-Y500 WeakPolarHBondContact O-CD1 3.43Å; D450-Y500 WeakPolarHBondContact O-CE1 3.46Å; D450-D502 HydrophobicContact CB-CB 3.74Å; D450-D502 WeakPolarHBondContact CB-O 3.47Å; D450-D502 PolarHBondContact N-O 3.47Å; D450-D502 WeakPolarHBondContact OD2-CB 3.3Å
451	D	55.6	Low	65.9	Low	83 Å²	83	49.5 Å²	49.5	44%	0.444	24%	0.24	S	C	.	.	S	Bend	trans	-61.6	29	-167.2	-97.3	-11.8	0	0	0	116.8	R509	D451-R509 VanDerWaalsContact CG-NH1 3.27Å; D451-R509 IonicContact OD1-CZ 2.85Å; D451-R509 IonicContact OD1-NH1 2.82Å; D451-R509 PolarHBondContact OD1-NH1 2.9Å; D451-R509 IonicContact OD2-NH1 3.35Å; D451-R509 PolarHBondContact OD2-NH1 2.97Å
452	S	66.8	Low	66.5	Low	11.5 Å²	11.5	53 Å²	53	8%	0.08	25%	0.246	C	C	.	.			trans	-122.7	57.8	-168.2	-54.3	0	0	0	0	111.6	D450 Y454 E501 R671	D450-S452 VanDerWaalsContact C-N 3.27Å; D450-S452 PolarHBondContact O-N 3.17Å; D450-S452 VanDerWaalsContact O-N 3.11Å; S452-Y454 VanDerWaalsContact CB-CE2 3.43Å; S452-Y454 WeakPolarHBondContact O-CD2 3.35Å; S452-Y454 VanDerWaalsContact O-CE2 3.25Å; S452-Y454 WeakPolarHBondContact O-CE2 3.45Å; S452-E501 PolarHBondContact O-N 3.07Å; S452-R671 PolarHBondContact OG-NH1 2.76Å
453	L	77.2	Confident	66.6	Low	7 Å²	7	57.5 Å²	57.5	4%	0.037	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	131.6	167.8	178.7	62.8	0	0	0	109.5	L429 P475 V476 L498 Y500 S511	L429-L453 HydrophobicContact CD1-CD1 3.69Å; L429-L453 HydrophobicContact CD1-CD2 4.34Å; L453-P475 CarbonylContact O-C 3.44Å; L453-P475 WeakPolarHBondContact O-CA 3.33Å; L453-V476 HydrophobicContact CB-CB 4.17Å; L453-V476 HydrophobicContact CD2-CB 3.72Å; L453-V476 HydrophobicContact CD2-CG1 3.75Å; L453-V476 HydrophobicContact CD2-CG2 4.19Å; L453-V476 HydrophobicContact CG-CB 3.75Å; L453-V476 HydrophobicContact CG-CG1 4.35Å; L453-V476 HydrophobicContact CG-CG2 3.99Å; L453-V476 PolarHBondContact O-N 3.05Å; L453-L498 HydrophobicContact CD1-CB 4.07Å; L453-L498 HydrophobicContact CD1-CD2 4.33Å; L453-L498 HydrophobicContact CG-CD2 4.49Å; L453-Y500 HydrophobicContact CB-CD1 4.31Å; L453-Y500 HydrophobicContact CB-CE1 3.85Å; L453-Y500 HydrophobicContact CB-CE2 4.42Å; L453-Y500 HydrophobicContact CD1-CD2 3.93Å; L453-Y500 HydrophobicContact CD1-CE1 4.32Å; L453-Y500 HydrophobicContact CD1-CE2 3.73Å; L453-Y500 HydrophobicContact CD1-CG 4.44Å; L453-S511 WeakPolarHBondContact CD2-OG 3.37Å
454	Y	81.9	Confident	66.2	Low	18 Å²	18	65 Å²	65	7%	0.071	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	139.7	179.8	-68.9	-90.8	0	0	0	111.9	S452 Y456 K473 I474 P475 L498 K499 E501 Y672	S452-Y454 VanDerWaalsContact CB-CE2 3.43Å; S452-Y454 WeakPolarHBondContact O-CD2 3.35Å; S452-Y454 VanDerWaalsContact O-CE2 3.25Å; S452-Y454 WeakPolarHBondContact O-CE2 3.45Å; Y454-Y456 HydrophobicContact CG-CE2 4.2Å; Y454-K473 HydrophobicContact CD1-CD 4.2Å; Y454-K473 HydrophobicContact CD1-CG 3.61Å; Y454-K473 VanDerWaalsContact CD1-CG 3.44Å; Y454-K473 HydrophobicContact CE1-CD 4.07Å; Y454-K473 HydrophobicContact CE1-CG 4.18Å; Y454-K473 HydrophobicContact CG-CG 4.15Å; Y454-I474 CarbonylContact C-O 3.53Å; Y454-I474 WeakPolarHBondContact CA-O 3.37Å; Y454-P475 HydrophobicContact CD1-CB 4.01Å; Y454-P475 HydrophobicContact CE1-CB 3.8Å; Y454-P475 HydrophobicContact CE1-CG 4.48Å; Y454-L498 CarbonylContact O-C 3.53Å; Y454-L498 WeakPolarHBondContact O-CA 3.26Å; Y454-K499 PolarHBondContact N-O 3.45Å; Y454-K499 PolarHBondContact O-N 3.04Å; Y454-E501 HydrophobicContact CD2-CB 4.47Å; Y454-E501 HydrophobicContact CE2-CB 4.35Å; Y454-Y672 AromaticContact CD1-CE1 3.91Å; Y454-Y672 HydrophobicContact CD1-CE1 3.91Å; Y454-Y672 AromaticContact CD1-CZ 3.82Å; Y454-Y672 WeakPolarHBondContact CD1-OH 3.47Å; Y454-Y672 AromaticContact CE1-CE1 3.36Å; Y454-Y672 HydrophobicContact CE1-CE1 3.36Å; Y454-Y672 HydrophobicContact CE1-CE2 4.26Å; Y454-Y672 AromaticContact CE1-CZ 3.15Å; Y454-Y672 WeakPolarHBondContact CE1-OH 3.42Å; Y454-Y672 AromaticContact CZ-CZ 3.66Å; Y454-Y672 PolarHBondContact OH-OH 2.95Å
455	L	85.6	Confident	65.8	Low	7 Å²	7	68.8 Å²	68.8	4%	0.037	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.5	164.9	178.6	71.4	0	0	0	109.6	V457 K473 I474 V476 I496 G497 L498 M515	L455-V457 HydrophobicContact CG-CG2 4.46Å; L455-K473 WeakPolarHBondContact O-CA 3.3Å; L455-I474 HydrophobicContact CB-CB 4.34Å; L455-I474 PolarHBondContact N-O 3.34Å; L455-I474 PolarHBondContact O-N 3.37Å; L455-V476 HydrophobicContact CB-CG2 4.01Å; L455-I496 HydrophobicContact CD1-CG2 3.92Å; L455-G497 CarbonylContact C-O 3.47Å; L455-G497 WeakPolarHBondContact CA-O 3.46Å; L455-L498 HydrophobicContact CB-CD2 4.12Å; L455-L498 HydrophobicContact CD1-CD2 3.99Å; L455-M515 HydrophobicContact CD1-CE 4.2Å; L455-M515 HydrophobicContact CD1-SD 3.96Å; L455-M515 HydrophobicContact CD2-SD 3.95Å
456	Y	84.8	Confident	66	Low	9 Å²	9	70.1 Å²	70.1	4%	0.035	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.7	177.5	-78.5	-108.3	0	0	0	109.6	W442 Y454 P470 Y472 K473 I496 G497 K499 E501	W442-Y456 VanDerWaalsContact CH2-CB 3.45Å; W442-Y456 AromaticContact CH2-CD1 3.76Å; W442-Y456 HydrophobicContact CH2-CD1 3.76Å; W442-Y456 AromaticContact CH2-CD2 3.71Å; W442-Y456 HydrophobicContact CH2-CD2 3.71Å; W442-Y456 HydrophobicContact CH2-CE1 4.21Å; W442-Y456 HydrophobicContact CH2-CE2 4.17Å; W442-Y456 AromaticContact CH2-CG 3.53Å; W442-Y456 HydrophobicContact CH2-CG 3.97Å; W442-Y456 HydrophobicContact CZ2-CG 4.26Å; W442-Y456 HydrophobicContact CZ3-CD1 4.34Å; W442-Y456 AromaticContact CZ3-CD2 3.99Å; W442-Y456 HydrophobicContact CZ3-CD2 3.99Å; W442-Y456 AromaticContact CZ3-CG 3.76Å; W442-Y456 HydrophobicContact CZ3-CG 3.76Å; Y454-Y456 HydrophobicContact CG-CE2 4.2Å; Y456-P470 HydrophobicContact CD1-CB 3.65Å; Y456-P470 HydrophobicContact CD1-CG 3.73Å; Y456-P470 HydrophobicContact CE1-CB 4.19Å; Y456-P470 HydrophobicContact CE1-CG 3.72Å; Y456-Y472 WeakPolarHBondContact CA-O 3.4Å; Y456-K473 HydrophobicContact CE1-CB 4.44Å; Y456-K473 HydrophobicContact CE1-CD 4.25Å; Y456-K473 HydrophobicContact CE1-CG 4.23Å; Y456-K473 HydrophobicContact CE2-CD 4.5Å; Y456-K473 HydrophobicContact CE2-CG 4.18Å; Y456-K473 VanDerWaalsContact OH-CD 3.28Å; Y456-K473 WeakPolarHBondContact OH-CD 3.27Å; Y456-K473 VanDerWaalsContact OH-CE 3.23Å; Y456-K473 WeakPolarHBondContact OH-CE 3.35Å; Y456-K473 PolarHBondContact OH-NZ 3.05Å; Y456-I496 WeakPolarHBondContact O-CA 3.5Å; Y456-G497 PolarHBondContact N-O 3.14Å; Y456-G497 PolarHBondContact O-N 3.23Å; Y456-K499 HydrophobicContact CD2-CB 3.7Å; Y456-K499 HydrophobicContact CD2-CD 4.37Å; Y456-K499 HydrophobicContact CE1-CD 4.3Å; Y456-K499 HydrophobicContact CE2-CB 3.49Å; Y456-K499 VanDerWaalsContact CE2-CB 3.42Å; Y456-K499 HydrophobicContact CE2-CD 3.63Å; Y456-K499 VanDerWaalsContact CE2-CD 3.49Å; Y456-K499 HydrophobicContact CE2-CG 3.95Å; Y456-E501 PolarHBondContact OH-OE1 3.11Å; Y456-E501 PolarHBondContact OH-OE2 3.06Å
457	V	85.1	Confident	66.9	Low	4.5 Å²	4.5	66.8 Å²	66.8	3%	0.027	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	120.9	171.5	-178.4	0	0	0	0	108.5	L455 R471 Y472 I485 A487 L494 I496	L455-V457 HydrophobicContact CG-CG2 4.46Å; V457-R471 WeakPolarHBondContact O-CA 3.42Å; V457-R471 WeakPolarHBondContact O-CB 3.41Å; V457-R471 PolarHBondContact O-N 2.85Å; V457-Y472 HydrophobicContact CB-CD2 4.19Å; V457-Y472 HydrophobicContact CG1-CD2 4.36Å; V457-Y472 PolarHBondContact N-O 3.01Å; V457-Y472 PolarHBondContact O-N 2.79Å; V457-Y472 VanDerWaalsContact O-N 3.12Å; V457-I485 HydrophobicContact CB-CD1 4.45Å; V457-I485 HydrophobicContact CG1-CD1 4.5Å; V457-I485 HydrophobicContact CG2-CD1 3.7Å; V457-A487 HydrophobicContact CG1-CB 4.24Å; V457-L494 HydrophobicContact CG1-CD1 4.3Å; V457-I496 HydrophobicContact CG2-CG2 4.49Å
458	C	81.3	Confident	67.8	Low	3.5 Å²	3.5	70.9 Å²	70.9	2%	0.024	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	121.3	-167.1	-86	0	0	0	0	111	C467 P470 W495	C458-C467 HydrophobicContact CB-CB 3.75Å; C458-C467 WeakPolarHBondContact CB-SG 3.2Å; C458-C467 WeakPolarHBondContact SG-CA 3.26Å; C458-C467 WeakPolarHBondContact SG-CB 3.31Å; C458-C467 CovalentContact SG-SG 2.01Å; C458-C467 PolarHBondContact SG-SG 3.16Å; C458-P470 WeakPolarHBondContact SG-CA 3.39Å; C458-P470 VanDerWaalsContact SG-CB 3.58Å; C458-W495 HydrophobicContact CB-CB 3.86Å; C458-W495 PolarHBondContact N-O 3.46Å; C458-W495 PolarHBondContact O-N 3.18Å
459	E	78.9	Confident	69	Low	56.5 Å²	56.5	75 Å²	75	26%	0.264	35%	0.354	S	S	.	.			trans	-81.5	144.2	174.6	-62.3	-172.7	151.1	0	0	110.7	K461 R471 A487 R488	E459-K461 PolarHBondContact O-N 3.06Å; E459-R471 VanDerWaalsContact CD-CD 3.4Å; E459-R471 HydrophobicContact CG-CB 4.25Å; E459-R471 WeakPolarHBondContact OE1-CD 3.11Å; E459-R471 IonicContact OE1-CZ 3.49Å; E459-R471 IonicContact OE1-NE 3.31Å; E459-R471 IonicContact OE1-NH1 2.9Å; E459-R471 PolarHBondContact OE1-NH1 3.14Å; E459-R471 IonicContact OE2-NH1 3.03Å; E459-A487 HydrophobicContact CG-CB 4.47Å; E459-R488 VanDerWaalsContact CD-O 3.31Å; E459-R488 WeakPolarHBondContact CG-O 3.3Å; E459-R488 PolarHBondContact OE1-N 2.83Å; E459-R488 VanDerWaalsContact OE1-O 3.11Å
460	Y	69.7	Low	70.3	Confident	94 Å²	94	74.6 Å²	74.6	37%	0.369	36%	0.355	S	S	.	.			trans	-64.3	117.3	171.9	-176.8	-104.8	0	0	0	110.8	G492 N493	Y460-G492 VanDerWaalsContact CG-CA 3.41Å; Y460-N493 WeakPolarHBondContact CB-O 3.35Å
461	K	65.2	Low	71.6	Confident	137 Å²	137	76 Å²	76	60%	0.596	36%	0.355	S	S	*	.			trans	-107.7	147	161.8	-67.7	-177.5	179.5	176.3	0	107.5	E459 L463	E459-K461 PolarHBondContact O-N 3.06Å; K461-L463 PolarHBondContact O-N 2.84Å
462	R	63.4	Low	73	Confident	236.5 Å²	236.5	74.7 Å²	74.7	89%	0.892	34%	0.344	S	S	*	.	S	Bend	trans	-57.2	-7.5	-176.1	-72.7	-175.1	-178.8	177.2	0.1	115.6
463	L	58	Low	73.8	Confident	145 Å²	145	77.8 Å²	77.8	76%	0.759	36%	0.356	S	S	*	.	S	Bend	trans	-101.4	133.1	-180	-74.4	148.8	0	0	0	109.2	K461 D465	K461-L463 PolarHBondContact O-N 2.84Å; L463-D465 PolarHBondContact O-N 3.19Å
464	N	54.4	Low	74.1	Confident	167.5 Å²	167.5	77.5 Å²	77.5	90%	0.896	36%	0.355	S	S	*	.			trans	-56.8	29.2	-178.6	-88.5	-3.6	0	0	0	115.9	L466	N464-L466 PolarHBondContact O-N 3.03Å
465	D	56.7	Low	74	Confident	80 Å²	80	77 Å²	77	43%	0.428	35%	0.354	S	S	.	.			trans	-85	100.5	179.3	-134.9	-15.7	0	0	0	108	L463 C467 K468 F469	L463-D465 PolarHBondContact O-N 3.19Å; D465-C467 PolarHBondContact O-N 2.99Å; D465-K468 HydrophobicContact CB-CB 4.24Å; D465-K468 HydrophobicContact CB-CD 4.41Å; D465-K468 WeakPolarHBondContact OD1-CB 3.4Å; D465-K468 WeakPolarHBondContact OD1-CD 3.39Å; D465-K468 WeakPolarHBondContact OD2-CD 3.45Å; D465-K468 IonicContact OD2-NZ 3.26Å; D465-K468 PolarHBondContact OD2-NZ 2.89Å; D465-F469 VanDerWaalsContact OD2-CD2 3.25Å; D465-F469 WeakPolarHBondContact OD2-CD2 3.42Å
466	L	63.3	Low	73.7	Confident	92.5 Å²	92.5	78.4 Å²	78.4	48%	0.484	36%	0.363	S	S	.	.			trans	-57.3	78.9	177.7	-72.9	157.8	0	0	0	111.2	D440 N464 K468 W495	D440-L466 HydrophobicContact CB-CD1 3.93Å; N464-L466 PolarHBondContact O-N 3.03Å; L466-K468 VanDerWaalsContact C-N 3.26Å; L466-K468 PolarHBondContact O-N 3.07Å; L466-K468 VanDerWaalsContact O-N 3.12Å; L466-W495 HydrophobicContact CD2-CH2 4.41Å; L466-W495 HydrophobicContact CD2-CZ2 4.35Å
467	C	71.3	Confident	73.2	Confident	22 Å²	22	82.9 Å²	82.9	15%	0.149	38%	0.38	C	S	.	.	S	Bend	trans	60.6	22.8	173.9	-165.3	0	0	0	0	115.1	C458 D465 F469 P470	C458-C467 HydrophobicContact CB-CB 3.75Å; C458-C467 WeakPolarHBondContact CB-SG 3.2Å; C458-C467 WeakPolarHBondContact SG-CA 3.26Å; C458-C467 WeakPolarHBondContact SG-CB 3.31Å; C458-C467 CovalentContact SG-SG 2.01Å; C458-C467 PolarHBondContact SG-SG 3.16Å; D465-C467 PolarHBondContact O-N 2.99Å; C467-F469 VanDerWaalsContact C-N 3.29Å; C467-F469 PolarHBondContact O-N 3.1Å; C467-P470 WeakPolarHBondContact O-CD 3.37Å
468	K	70.3	Confident	72.6	Confident	137 Å²	137	91.1 Å²	91.1	60%	0.596	42%	0.424	S	S	*	.	S	Bend	trans	-57.5	-36.2	179.5	-174.3	174.1	-179.9	173.5	0	113.8	D465 L466 P470	D465-K468 HydrophobicContact CB-CB 4.24Å; D465-K468 HydrophobicContact CB-CD 4.41Å; D465-K468 WeakPolarHBondContact OD1-CB 3.4Å; D465-K468 WeakPolarHBondContact OD1-CD 3.39Å; D465-K468 WeakPolarHBondContact OD2-CD 3.45Å; D465-K468 IonicContact OD2-NZ 3.26Å; D465-K468 PolarHBondContact OD2-NZ 2.89Å; L466-K468 VanDerWaalsContact C-N 3.26Å; L466-K468 PolarHBondContact O-N 3.07Å; L466-K468 VanDerWaalsContact O-N 3.12Å; K468-P470 WeakPolarHBondContact O-CD 3.27Å
469	F	74.5	Confident	72.2	Confident	151 Å²	151	93.5 Å²	93.5	66%	0.662	45%	0.448	S	S	*	.	S	Bend	trans	-115.8	83.4	174	-59.6	-74.9	0	0	0	109.4	D465 C467 R471	D465-F469 VanDerWaalsContact OD2-CD2 3.25Å; D465-F469 WeakPolarHBondContact OD2-CD2 3.42Å; C467-F469 VanDerWaalsContact C-N 3.29Å; C467-F469 PolarHBondContact O-N 3.1Å; F469-R471 PolarHBondContact O-N 3.44Å
470	P	78.9	Confident	72.1	Confident	39.5 Å²	39.5	92.7 Å²	92.7	26%	0.256	45%	0.446	S	S	.	.			trans	-62.1	141.2	177.8	28	-35.7	0	0	0	111.8	Y456 C458 C467 K468 Y472 K473	Y456-P470 HydrophobicContact CD1-CB 3.65Å; Y456-P470 HydrophobicContact CD1-CG 3.73Å; Y456-P470 HydrophobicContact CE1-CB 4.19Å; Y456-P470 HydrophobicContact CE1-CG 3.72Å; C458-P470 WeakPolarHBondContact SG-CA 3.39Å; C458-P470 VanDerWaalsContact SG-CB 3.58Å; C467-P470 WeakPolarHBondContact O-CD 3.37Å; K468-P470 WeakPolarHBondContact O-CD 3.27Å; P470-Y472 VanDerWaalsContact C-N 3.31Å; P470-K473 HydrophobicContact CG-CB 4.11Å
471	R	80.7	Confident	72.6	Confident	93.5 Å²	93.5	89.5 Å²	89.5	35%	0.353	44%	0.435	S	S	.	.	S	Bend	trans	-65.5	-41.9	170.2	179.4	173.7	167.8	157.8	0.3	109.8	V457 E459 F469 N486	V457-R471 WeakPolarHBondContact O-CA 3.42Å; V457-R471 WeakPolarHBondContact O-CB 3.41Å; V457-R471 PolarHBondContact O-N 2.85Å; E459-R471 VanDerWaalsContact CD-CD 3.4Å; E459-R471 HydrophobicContact CG-CB 4.25Å; E459-R471 WeakPolarHBondContact OE1-CD 3.11Å; E459-R471 IonicContact OE1-CZ 3.49Å; E459-R471 IonicContact OE1-NE 3.31Å; E459-R471 IonicContact OE1-NH1 2.9Å; E459-R471 PolarHBondContact OE1-NH1 3.14Å; E459-R471 IonicContact OE2-NH1 3.03Å; F469-R471 PolarHBondContact O-N 3.44Å; R471-N486 PolarHBondContact NE-O 2.77Å; R471-N486 VanDerWaalsContact NE-O 3.1Å; R471-N486 PolarHBondContact NH1-O 2.93Å; R471-N486 PolarHBondContact NH2-O 3.11Å
472	Y	84.6	Confident	73.5	Confident	55.5 Å²	55.5	85 Å²	85	22%	0.218	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.9	171.7	-57.3	-76.7	0	0	0	110.8	Y456 V457 P470 I485 N486 L630	Y456-Y472 WeakPolarHBondContact CA-O 3.4Å; V457-Y472 HydrophobicContact CB-CD2 4.19Å; V457-Y472 HydrophobicContact CG1-CD2 4.36Å; V457-Y472 PolarHBondContact N-O 3.01Å; V457-Y472 PolarHBondContact O-N 2.79Å; V457-Y472 VanDerWaalsContact O-N 3.12Å; P470-Y472 VanDerWaalsContact C-N 3.31Å; Y472-I485 HydrophobicContact CD1-CG2 4.42Å; Y472-I485 HydrophobicContact CD2-CB 4.17Å; Y472-I485 HydrophobicContact CD2-CD1 4.26Å; Y472-I485 HydrophobicContact CD2-CG2 4.3Å; Y472-I485 HydrophobicContact CE1-CG2 4.37Å; Y472-I485 HydrophobicContact CE2-CB 3.92Å; Y472-I485 HydrophobicContact CE2-CG2 4.25Å; Y472-I485 HydrophobicContact CG-CG2 4.4Å; Y472-N486 WeakPolarHBondContact CE2-O 3.34Å; Y472-N486 PolarHBondContact OH-O 3Å; Y472-L630 HydrophobicContact CD1-CD1 4.09Å; Y472-L630 HydrophobicContact CE1-CD1 4.37Å
473	K	83.6	Confident	74.6	Confident	76.5 Å²	76.5	74.6 Å²	74.6	33%	0.333	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	110.3	168.8	172.6	-178	172	177.2	0	107.1	Y454 L455 Y456 P470 E501	Y454-K473 HydrophobicContact CD1-CD 4.2Å; Y454-K473 HydrophobicContact CD1-CG 3.61Å; Y454-K473 VanDerWaalsContact CD1-CG 3.44Å; Y454-K473 HydrophobicContact CE1-CD 4.07Å; Y454-K473 HydrophobicContact CE1-CG 4.18Å; Y454-K473 HydrophobicContact CG-CG 4.15Å; L455-K473 WeakPolarHBondContact O-CA 3.3Å; Y456-K473 HydrophobicContact CE1-CB 4.44Å; Y456-K473 HydrophobicContact CE1-CD 4.25Å; Y456-K473 HydrophobicContact CE1-CG 4.23Å; Y456-K473 HydrophobicContact CE2-CD 4.5Å; Y456-K473 HydrophobicContact CE2-CG 4.18Å; Y456-K473 VanDerWaalsContact OH-CD 3.28Å; Y456-K473 WeakPolarHBondContact OH-CD 3.27Å; Y456-K473 VanDerWaalsContact OH-CE 3.23Å; Y456-K473 WeakPolarHBondContact OH-CE 3.35Å; Y456-K473 PolarHBondContact OH-NZ 3.05Å; P470-K473 HydrophobicContact CG-CB 4.11Å; K473-E501 WeakPolarHBondContact CE-OE2 3.05Å; K473-E501 IonicContact NZ-OE1 3.86Å; K473-E501 PolarHBondContact NZ-OE1 3.41Å; K473-E501 IonicContact NZ-OE2 2.83Å; K473-E501 PolarHBondContact NZ-OE2 3.26Å
474	I	83.6	Confident	75.8	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.8	-165.1	-53.9	177.4	0	0	0	109.7	Y454 L455 V476 L482 I485 L628 L630	Y454-I474 CarbonylContact C-O 3.53Å; Y454-I474 WeakPolarHBondContact CA-O 3.37Å; L455-I474 HydrophobicContact CB-CB 4.34Å; L455-I474 PolarHBondContact N-O 3.34Å; L455-I474 PolarHBondContact O-N 3.37Å; I474-V476 PolarHBondContact O-N 3.16Å; I474-L482 HydrophobicContact CD1-CD1 4.22Å; I474-L482 HydrophobicContact CG2-CD1 3.56Å; I474-L482 HydrophobicContact CG2-CD2 3.36Å; I474-L482 HydrophobicContact CG2-CG 4.08Å; I474-I485 HydrophobicContact CD1-CD1 4.38Å; I474-I485 HydrophobicContact CD1-CG2 4.36Å; I474-L628 HydrophobicContact CG2-CD2 4.24Å; I474-L630 HydrophobicContact CD1-CD1 3.9Å; I474-L630 HydrophobicContact CD1-CD2 4.29Å; I474-L630 HydrophobicContact CG1-CD1 4.44Å; I474-L630 HydrophobicContact CG1-CD2 4.03Å; I474-L630 HydrophobicContact CG2-CD2 4.3Å
475	P	80.1	Confident	77.3	Confident	7.5 Å²	7.5	65.1 Å²	65.1	5%	0.049	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	136.4	175.8	20.6	-20.8	0	0	0	110.3	L453 Y454 R477 L480 L628 Y672	L453-P475 CarbonylContact O-C 3.44Å; L453-P475 WeakPolarHBondContact O-CA 3.33Å; Y454-P475 HydrophobicContact CD1-CB 4.01Å; Y454-P475 HydrophobicContact CE1-CB 3.8Å; Y454-P475 HydrophobicContact CE1-CG 4.48Å; P475-R477 HydrophobicContact CB-CG 4.3Å; P475-L480 HydrophobicContact CB-CD2 4.31Å; P475-L480 HydrophobicContact CG-CD2 3.98Å; P475-L480 WeakPolarHBondContact O-CD2 3.42Å; P475-L628 VanDerWaalsContact CD-CD2 3.45Å; P475-L628 HydrophobicContact CG-CD2 3.52Å; P475-L628 VanDerWaalsContact CG-CD2 3.49Å; P475-Y672 WeakPolarHBondContact CA-OH 3.34Å; P475-Y672 HydrophobicContact CB-CD2 4.39Å; P475-Y672 HydrophobicContact CB-CE1 3.94Å; P475-Y672 HydrophobicContact CB-CE2 3.62Å; P475-Y672 WeakPolarHBondContact CB-OH 3.42Å; P475-Y672 HydrophobicContact CG-CD1 3.78Å; P475-Y672 HydrophobicContact CG-CD2 3.76Å; P475-Y672 HydrophobicContact CG-CE1 3.42Å; P475-Y672 VanDerWaalsContact CG-CE1 3.42Å; P475-Y672 HydrophobicContact CG-CE2 3.92Å; P475-Y672 HydrophobicContact CG-CG 3.9Å
476	V	78.4	Confident	78.5	Confident	36.5 Å²	36.5	63.9 Å²	63.9	22%	0.221	33%	0.327	C	S	.	.			trans	-95.6	111.3	169.4	-178	0	0	0	0	107.6	L453 L455 I474 L498 V513	L453-V476 HydrophobicContact CB-CB 4.17Å; L453-V476 HydrophobicContact CD2-CB 3.72Å; L453-V476 HydrophobicContact CD2-CG1 3.75Å; L453-V476 HydrophobicContact CD2-CG2 4.19Å; L453-V476 HydrophobicContact CG-CB 3.75Å; L453-V476 HydrophobicContact CG-CG1 4.35Å; L453-V476 HydrophobicContact CG-CG2 3.99Å; L453-V476 PolarHBondContact O-N 3.05Å; L455-V476 HydrophobicContact CB-CG2 4.01Å; I474-V476 PolarHBondContact O-N 3.16Å; V476-L498 HydrophobicContact CG2-CD2 3.85Å; V476-V513 HydrophobicContact CB-CG2 4.43Å; V476-V513 HydrophobicContact CG1-CG2 3.55Å; V476-V513 VanDerWaalsContact CG1-CG2 3.48Å; V476-V513 HydrophobicContact CG2-CG2 3.95Å
477	R	74.2	Confident	79.4	Confident	103.5 Å²	103.5	61.6 Å²	61.6	39%	0.391	32%	0.321	S	S	.	.			trans	-130.8	147.2	177	-68.5	-179.9	176.6	-174.1	-4	109.4	P475 G479 L480 D669	P475-R477 HydrophobicContact CB-CG 4.3Å; R477-G479 PolarHBondContact O-N 3.1Å; R477-L480 HydrophobicContact CB-CB 4.05Å; R477-L480 HydrophobicContact CB-CD2 4.29Å; R477-L480 WeakPolarHBondContact O-CB 3.41Å; R477-L480 PolarHBondContact O-N 3.1Å; R477-D669 IonicContact CZ-OD2 3.43Å; R477-D669 VanDerWaalsContact CZ-OD2 3.28Å; R477-D669 IonicContact NH1-OD2 3.21Å; R477-D669 PolarHBondContact NH1-OD2 3.13Å; R477-D669 IonicContact NH2-OD2 2.74Å; R477-D669 PolarHBondContact NH2-OD2 3.29Å
478	N	72.9	Confident	79.6	Confident	178 Å²	178	67.7 Å²	67.7	95%	0.952	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	130.8	179.4	-166	17.3	0	0	0	110.7	L480	N478-L480 VanDerWaalsContact C-N 3.28Å; N478-L480 PolarHBondContact O-N 3.23Å
479	G	72.6	Confident	79.8	Confident	53 Å²	53	65.3 Å²	65.3	55%	0.546	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	6.8	-179.2	0	0	0	0	0	116.1	R477	R477-G479 PolarHBondContact O-N 3.1Å
480	L	78	Confident	79.7	Confident	39 Å²	39	65.1 Å²	65.1	20%	0.204	34%	0.34	C	S	.	.			trans	-84.4	124.2	179.2	-165.3	75.3	0	0	0	111.4	P475 R477 N478 L482 Q626 L628	P475-L480 HydrophobicContact CB-CD2 4.31Å; P475-L480 HydrophobicContact CG-CD2 3.98Å; P475-L480 WeakPolarHBondContact O-CD2 3.42Å; R477-L480 HydrophobicContact CB-CB 4.05Å; R477-L480 HydrophobicContact CB-CD2 4.29Å; R477-L480 WeakPolarHBondContact O-CB 3.41Å; R477-L480 PolarHBondContact O-N 3.1Å; N478-L480 VanDerWaalsContact C-N 3.28Å; N478-L480 PolarHBondContact O-N 3.23Å; L480-L482 HydrophobicContact CD2-CD2 4.25Å; L480-Q626 CarbonylContact C-O 3.48Å; L480-L628 HydrophobicContact CD1-CB 3.87Å; L480-L628 HydrophobicContact CD2-CB 3.89Å; L480-L628 HydrophobicContact CD2-CD1 4.28Å; L480-L628 HydrophobicContact CD2-CD2 3.79Å; L480-L628 HydrophobicContact CD2-CG 4.03Å; L480-L628 HydrophobicContact CG-CB 3.95Å
481	L	80.7	Confident	79.2	Confident	27.5 Å²	27.5	66.8 Å²	66.8	14%	0.144	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-107.1	131.2	-178.8	-58.7	171.4	0	0	0	109.9	L379 Q626 F627 L628	L379-L481 HydrophobicContact CB-CD1 3.96Å; L379-L481 HydrophobicContact CD1-CD1 3.99Å; L379-L481 HydrophobicContact CD2-CD1 4.1Å; L379-L481 HydrophobicContact CG-CD1 4.23Å; L379-L481 WeakPolarHBondContact O-CD2 3.34Å; L481-Q626 WeakPolarHBondContact CA-O 3.39Å; L481-Q626 VanDerWaalsContact CB-O 3.26Å; L481-Q626 WeakPolarHBondContact CB-O 3.38Å; L481-Q626 HydrophobicContact CD1-CB 4.3Å; L481-Q626 HydrophobicContact CD1-CG 4.2Å; L481-Q626 PolarHBondContact N-O 3.25Å; L481-F627 HydrophobicContact CB-CD1 3.7Å; L481-F627 HydrophobicContact CB-CE1 3.91Å; L481-F627 HydrophobicContact CD1-CD1 4.22Å; L481-F627 HydrophobicContact CD1-CE1 3.69Å; L481-F627 HydrophobicContact CD1-CZ 4.23Å; L481-F627 HydrophobicContact CG-CE1 4.47Å; L481-F627 WeakPolarHBondContact O-CA 3.32Å; L481-L628 PolarHBondContact O-N 3.05Å; L481-L628 VanDerWaalsContact O-N 3.1Å
482	L	82.5	Confident	78.8	Confident	42.5 Å²	42.5	63.1 Å²	63.1	22%	0.223	36%	0.356	C	S	.	.			trans	-108.5	152.8	-174.2	-60.1	167.4	0	0	0	110.9	I474 L480 R550 L628 L630	I474-L482 HydrophobicContact CD1-CD1 4.22Å; I474-L482 HydrophobicContact CG2-CD1 3.56Å; I474-L482 HydrophobicContact CG2-CD2 3.36Å; I474-L482 HydrophobicContact CG2-CG 4.08Å; L480-L482 HydrophobicContact CD2-CD2 4.25Å; L482-R550 WeakPolarHBondContact O-CD 3.12Å; L482-R550 PolarHBondContact O-NE 3.43Å; L482-L628 HydrophobicContact CD2-CB 4Å; L482-L628 HydrophobicContact CD2-CD2 3.96Å; L482-L628 HydrophobicContact CD2-CG 4.4Å; L482-L630 HydrophobicContact CD2-CD2 4.32Å
483	P	86.4	Confident	78.2	Confident	19 Å²	19	65.6 Å²	65.6	12%	0.123	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-65.8	157.3	166.4	30.1	-34.9	0	0	0	110.3	I485 R550 V575 L628 L630	P483-I485 PolarHBondContact O-N 2.85Å; P483-R550 WeakPolarHBondContact CA-O 3.27Å; P483-V575 HydrophobicContact CB-CB 4.23Å; P483-V575 HydrophobicContact CB-CG1 4.33Å; P483-V575 HydrophobicContact CB-CG2 4.05Å; P483-V575 WeakPolarHBondContact CB-O 3.2Å; P483-V575 HydrophobicContact CG-CG2 4.23Å; P483-L628 VanDerWaalsContact CD-O 3.24Å; P483-L628 WeakPolarHBondContact CD-O 3.28Å; P483-L630 HydrophobicContact CG-CB 4.28Å; P483-L630 HydrophobicContact CG-CD1 3.89Å; P483-L630 HydrophobicContact CG-CG 3.81Å
484	S	84.6	Confident	77.9	Confident	50 Å²	50	65.1 Å²	65.1	35%	0.35	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-64.8	122.6	172.8	-75.8	0	0	0	0	110.9	R550 D551	S484-R550 PolarHBondContact N-O 2.84Å; S484-R550 VanDerWaalsContact N-O 3.12Å; S484-D551 WeakPolarHBondContact CB-OD1 3.39Å; S484-D551 PolarHBondContact OG-OD1 3.14Å
485	I	84.8	Confident	77.6	Confident	61.5 Å²	61.5	69.6 Å²	69.6	32%	0.315	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-94.6	137.8	-179.3	58.2	174.8	0	0	0	110.7	V457 Y472 I474 P483 L630	V457-I485 HydrophobicContact CB-CD1 4.45Å; V457-I485 HydrophobicContact CG1-CD1 4.5Å; V457-I485 HydrophobicContact CG2-CD1 3.7Å; Y472-I485 HydrophobicContact CD1-CG2 4.42Å; Y472-I485 HydrophobicContact CD2-CB 4.17Å; Y472-I485 HydrophobicContact CD2-CD1 4.26Å; Y472-I485 HydrophobicContact CD2-CG2 4.3Å; Y472-I485 HydrophobicContact CE1-CG2 4.37Å; Y472-I485 HydrophobicContact CE2-CB 3.92Å; Y472-I485 HydrophobicContact CE2-CG2 4.25Å; Y472-I485 HydrophobicContact CG-CG2 4.4Å; I474-I485 HydrophobicContact CD1-CD1 4.38Å; I474-I485 HydrophobicContact CD1-CG2 4.36Å; P483-I485 PolarHBondContact O-N 2.85Å; I485-L630 HydrophobicContact CG2-CD1 3.46Å
486	N	83.3	Confident	77.7	Confident	55 Å²	55	70.8 Å²	70.8	29%	0.294	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-101.5	138.6	173.8	-66.4	-51.5	0	0	0	108.9	R471 Y472 R552	R471-N486 PolarHBondContact NE-O 2.77Å; R471-N486 VanDerWaalsContact NE-O 3.1Å; R471-N486 PolarHBondContact NH1-O 2.93Å; R471-N486 PolarHBondContact NH2-O 3.11Å; Y472-N486 WeakPolarHBondContact CE2-O 3.34Å; Y472-N486 PolarHBondContact OH-O 3Å; N486-R552 PolarHBondContact ND2-NH2 3.01Å
487	A	80.6	Confident	77.7	Confident	44.5 Å²	44.5	69.1 Å²	69.1	37%	0.368	39%	0.386	S	S	.	.			trans	-131.2	135.4	169.9	0	0	0	0	0	109.2	V457 E459 L494	V457-A487 HydrophobicContact CG1-CB 4.24Å; E459-A487 HydrophobicContact CG-CB 4.47Å; A487-L494 HydrophobicContact CB-CD1 3.65Å; A487-L494 HydrophobicContact CB-CD2 4.38Å
488	R	77.2	Confident	78	Confident	151 Å²	151	64.2 Å²	64.2	57%	0.57	37%	0.367	S	S	*	.			trans	-101.2	136.1	177.8	-119.6	-179.7	-178.6	-175.8	-0.8	109	E459	E459-R488 VanDerWaalsContact CD-O 3.31Å; E459-R488 WeakPolarHBondContact CG-O 3.3Å; E459-R488 PolarHBondContact OE1-N 2.83Å; E459-R488 VanDerWaalsContact OE1-O 3.11Å
489	N	74	Confident	78.1	Confident	86.5 Å²	86.5	57.8 Å²	57.8	46%	0.463	33%	0.331	S	S	.	.			trans	-112.1	113.3	174.4	-171.8	0.8	0	0	0	109.7	G491 G492	N489-G491 VanDerWaalsContact C-N 3.29Å; N489-G491 PolarHBondContact O-N 2.88Å; N489-G491 PolarHBondContact OD1-N 3.02Å; N489-G492 VanDerWaalsContact CG-O 3.22Å; N489-G492 PolarHBondContact ND2-O 3.43Å; N489-G492 PolarHBondContact OD1-N 3.44Å; N489-G492 PolarHBondContact OD1-O 2.84Å
490	L	71.8	Confident	78.1	Confident	147 Å²	147	56.5 Å²	56.5	77%	0.77	31%	0.31	S	S	*	.	S	Bend	trans	-92.6	24.7	-179.5	-68.3	170.1	0	0	0	112.9
491	G	68.9	Low	77.6	Confident	73.5 Å²	73.5	57.5 Å²	57.5	76%	0.758	31%	0.314	S	S	*	.	S	Bend	trans	112	23.4	174.5	0	0	0	0	0	115.9	N489	N489-G491 VanDerWaalsContact C-N 3.29Å; N489-G491 PolarHBondContact O-N 2.88Å; N489-G491 PolarHBondContact OD1-N 3.02Å
492	G	71.4	Confident	76.8	Confident	17 Å²	17	61.3 Å²	61.3	18%	0.175	33%	0.334	C	S	.	.	S	Bend	trans	-135	-154	173.2	0	0	0	0	0	113.5	Y460 N489	Y460-G492 VanDerWaalsContact CG-CA 3.41Å; N489-G492 VanDerWaalsContact CG-O 3.22Å; N489-G492 PolarHBondContact ND2-O 3.43Å; N489-G492 PolarHBondContact OD1-N 3.44Å; N489-G492 PolarHBondContact OD1-O 2.84Å
493	N	71.8	Confident	75.4	Confident	107 Å²	107	65.2 Å²	65.2	57%	0.572	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-89.4	132.1	-179.8	-66.1	-14.3	0	0	0	111	Y460 W495	Y460-N493 WeakPolarHBondContact CB-O 3.35Å; N493-W495 HydrophobicContact CB-CZ2 4.26Å; N493-W495 VanDerWaalsContact O-CD1 3.25Å; N493-W495 PolarHBondContact O-NE1 3.39Å
494	L	77.3	Confident	73.7	Confident	67.5 Å²	67.5	70.7 Å²	70.7	35%	0.353	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-80.1	122.4	165.8	178.3	69.6	0	0	0	108.2	V457 A487 I496	V457-L494 HydrophobicContact CG1-CD1 4.3Å; A487-L494 HydrophobicContact CB-CD1 3.65Å; A487-L494 HydrophobicContact CB-CD2 4.38Å; L494-I496 HydrophobicContact CD2-CD1 4.02Å; L494-I496 HydrophobicContact CD2-CG1 4.35Å; L494-I496 HydrophobicContact CG-CD1 4.44Å; L494-I496 HydrophobicContact CG-CG1 4.23Å
495	W	77.5	Confident	71.8	Confident	95.5 Å²	95.5	73.3 Å²	73.3	36%	0.362	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	124	-179.5	-59.2	88.7	0	0	0	109.8	W442 C458 L466 N493	W442-W495 HydrophobicContact CE3-CB 4.19Å; W442-W495 HydrophobicContact CE3-CE3 4.32Å; W442-W495 HydrophobicContact CZ3-CB 3.96Å; C458-W495 HydrophobicContact CB-CB 3.86Å; C458-W495 PolarHBondContact N-O 3.46Å; C458-W495 PolarHBondContact O-N 3.18Å; L466-W495 HydrophobicContact CD2-CH2 4.41Å; L466-W495 HydrophobicContact CD2-CZ2 4.35Å; N493-W495 HydrophobicContact CB-CZ2 4.26Å; N493-W495 VanDerWaalsContact O-CD1 3.25Å; N493-W495 PolarHBondContact O-NE1 3.39Å
496	I	82.1	Confident	70	Confident	32.5 Å²	32.5	76.4 Å²	76.4	17%	0.167	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132.5	176	-57	174.1	0	0	0	107.2	I408 P443 L455 Y456 V457 L494 M515 I517	I408-I496 HydrophobicContact CD1-CB 4.41Å; I408-I496 HydrophobicContact CD1-CG2 4.07Å; P443-I496 WeakPolarHBondContact CB-O 3.45Å; L455-I496 HydrophobicContact CD1-CG2 3.92Å; Y456-I496 WeakPolarHBondContact O-CA 3.5Å; V457-I496 HydrophobicContact CG2-CG2 4.49Å; L494-I496 HydrophobicContact CD2-CD1 4.02Å; L494-I496 HydrophobicContact CD2-CG1 4.35Å; L494-I496 HydrophobicContact CG-CD1 4.44Å; L494-I496 HydrophobicContact CG-CG1 4.23Å; I496-M515 HydrophobicContact CG2-CE 3.89Å; I496-M515 HydrophobicContact CG2-SD 4.01Å; I496-I517 HydrophobicContact CD1-CD1 3.84Å
497	G	79.5	Confident	68.4	Low	0.5 Å²	0.5	77.1 Å²	77.1	1%	0.005	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	164.4	-173.8	0	0	0	0	0	115.7	W442 P443 L455 Y456	W442-G497 VanDerWaalsContact CH2-N 3.33Å; P443-G497 CarbonylContact O-C 3.49Å; P443-G497 VanDerWaalsContact O-C 3.23Å; P443-G497 WeakPolarHBondContact O-CA 3.19Å; L455-G497 CarbonylContact C-O 3.47Å; L455-G497 WeakPolarHBondContact CA-O 3.46Å; Y456-G497 PolarHBondContact N-O 3.14Å; Y456-G497 PolarHBondContact O-N 3.23Å
498	L	80.7	Confident	67	Low	0 Å²	0	84.7 Å²	84.7	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.2	178.4	-69.7	-177.9	0	0	0	111.3	A427 L429 P443 C444 Y445 L453 Y454 L455 V476 V513	A427-L498 HydrophobicContact CB-CD1 3.52Å; A427-L498 VanDerWaalsContact CB-CD1 3.49Å; A427-L498 HydrophobicContact CB-CG 3.79Å; L429-L498 HydrophobicContact CD1-CB 3.98Å; L429-L498 HydrophobicContact CD1-CD1 3.73Å; L429-L498 HydrophobicContact CD1-CG 4.47Å; L429-L498 HydrophobicContact CG-CD1 4.08Å; P443-L498 PolarHBondContact O-N 3.13Å; C444-L498 CarbonylContact C-O 3.47Å; C444-L498 VanDerWaalsContact CA-O 3.3Å; C444-L498 WeakPolarHBondContact CA-O 3.27Å; C444-L498 HydrophobicContact CB-CB 4.39Å; Y445-L498 WeakPolarHBondContact CD1-O 3.28Å; Y445-L498 PolarHBondContact N-O 2.93Å; L453-L498 HydrophobicContact CD1-CB 4.07Å; L453-L498 HydrophobicContact CD1-CD2 4.33Å; L453-L498 HydrophobicContact CG-CD2 4.49Å; Y454-L498 CarbonylContact O-C 3.53Å; Y454-L498 WeakPolarHBondContact O-CA 3.26Å; L455-L498 HydrophobicContact CB-CD2 4.12Å; L455-L498 HydrophobicContact CD1-CD2 3.99Å; V476-L498 HydrophobicContact CG2-CD2 3.85Å; L498-V513 HydrophobicContact CD1-CG2 4.47Å; L498-V513 HydrophobicContact CD2-CG2 4.21Å
499	K	74.1	Confident	66.1	Low	43 Å²	43	85.1 Å²	85.1	19%	0.187	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	137.3	-179.3	172.6	177.1	-176.5	173.6	0	111.1	W442 Y445 Y454 Y456 E501	W442-K499 HydrophobicContact CH2-CB 3.67Å; W442-K499 HydrophobicContact CH2-CD 3.7Å; W442-K499 HydrophobicContact CH2-CG 4.22Å; W442-K499 HydrophobicContact CZ2-CB 4.28Å; W442-K499 HydrophobicContact CZ2-CD 3.73Å; W442-K499 HydrophobicContact CZ2-CG 4.41Å; W442-K499 HydrophobicContact CZ3-CB 4.11Å; Y445-K499 HydrophobicContact CD1-CB 4Å; Y445-K499 HydrophobicContact CD1-CG 4.18Å; Y445-K499 HydrophobicContact CE1-CB 3.35Å; Y445-K499 VanDerWaalsContact CE1-CB 3.44Å; Y445-K499 HydrophobicContact CE1-CD 3.55Å; Y445-K499 HydrophobicContact CE1-CG 3.25Å; Y445-K499 HydrophobicContact CE2-CD 4.4Å; Y445-K499 HydrophobicContact CE2-CG 4.17Å; Y445-K499 VanDerWaalsContact CZ-CD 3.44Å; Y445-K499 VanDerWaalsContact CZ-CE 3.49Å; Y445-K499 VanDerWaalsContact CZ-CG 3.47Å; Y445-K499 WeakPolarHBondContact OH-CD 3.45Å; Y445-K499 WeakPolarHBondContact OH-CE 3.27Å; Y445-K499 WeakPolarHBondContact OH-CG 3.5Å; Y445-K499 PolarHBondContact OH-NZ 3.18Å; Y454-K499 PolarHBondContact N-O 3.45Å; Y454-K499 PolarHBondContact O-N 3.04Å; Y456-K499 HydrophobicContact CD2-CB 3.7Å; Y456-K499 HydrophobicContact CD2-CD 4.37Å; Y456-K499 HydrophobicContact CE1-CD 4.3Å; Y456-K499 HydrophobicContact CE2-CB 3.49Å; Y456-K499 VanDerWaalsContact CE2-CB 3.42Å; Y456-K499 HydrophobicContact CE2-CD 3.63Å; Y456-K499 VanDerWaalsContact CE2-CD 3.49Å; Y456-K499 HydrophobicContact CE2-CG 3.95Å; K499-E501 HydrophobicContact CD-CG 3.97Å; K499-E501 VanDerWaalsContact CE-OE1 3.31Å; K499-E501 WeakPolarHBondContact CE-OE1 3.28Å; K499-E501 HydrophobicContact CG-CG 4.2Å; K499-E501 IonicContact NZ-OE1 2.89Å; K499-E501 PolarHBondContact NZ-OE1 3Å
500	Y	73.5	Confident	65.9	Low	26 Å²	26	87.5 Å²	87.5	10%	0.102	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	140.6	160.8	-75.3	-90.8	0	0	0	111.1	L429 Y445 L446 V447 D450 L453	L429-Y500 HydrophobicContact CD1-CE2 3.98Å; Y445-Y500 PolarHBondContact O-N 3.32Å; L446-Y500 HydrophobicContact CD1-CD2 3.4Å; L446-Y500 VanDerWaalsContact CD1-CD2 3.46Å; L446-Y500 HydrophobicContact CD1-CE2 3.48Å; L446-Y500 HydrophobicContact CD1-CG 4.06Å; L446-Y500 HydrophobicContact CG-CD2 4.47Å; V447-Y500 WeakPolarHBondContact O-CB 3.42Å; D450-Y500 VanDerWaalsContact O-CD1 3.23Å; D450-Y500 WeakPolarHBondContact O-CD1 3.43Å; D450-Y500 WeakPolarHBondContact O-CE1 3.46Å; L453-Y500 HydrophobicContact CB-CD1 4.31Å; L453-Y500 HydrophobicContact CB-CE1 3.85Å; L453-Y500 HydrophobicContact CB-CE2 4.42Å; L453-Y500 HydrophobicContact CD1-CD2 3.93Å; L453-Y500 HydrophobicContact CD1-CE1 4.32Å; L453-Y500 HydrophobicContact CD1-CE2 3.73Å; L453-Y500 HydrophobicContact CD1-CG 4.44Å
501	E	66.1	Low	66.1	Low	61 Å²	61	81.6 Å²	81.6	29%	0.285	43%	0.425	S	S	.	.			trans	-126.7	86.8	172.5	-78.2	-171.5	-179.5	0	0	110.2	S452 Y454 Y456 K473 K499	S452-E501 PolarHBondContact O-N 3.07Å; Y454-E501 HydrophobicContact CD2-CB 4.47Å; Y454-E501 HydrophobicContact CE2-CB 4.35Å; Y456-E501 PolarHBondContact OH-OE1 3.11Å; Y456-E501 PolarHBondContact OH-OE2 3.06Å; K473-E501 WeakPolarHBondContact CE-OE2 3.05Å; K473-E501 IonicContact NZ-OE1 3.86Å; K473-E501 PolarHBondContact NZ-OE1 3.41Å; K473-E501 IonicContact NZ-OE2 2.83Å; K473-E501 PolarHBondContact NZ-OE2 3.26Å; K499-E501 HydrophobicContact CD-CG 3.97Å; K499-E501 VanDerWaalsContact CE-OE1 3.31Å; K499-E501 WeakPolarHBondContact CE-OE1 3.28Å; K499-E501 HydrophobicContact CG-CG 4.2Å; K499-E501 IonicContact NZ-OE1 2.89Å; K499-E501 PolarHBondContact NZ-OE1 3Å
502	D	64.2	Low	66.5	Low	107 Å²	107	84.6 Å²	84.6	57%	0.572	41%	0.413	S	S	*	.			trans	167.9	172	146.2	-94.5	-30.5	0	0	0	110.9	V447 T448 I449 D450	V447-D502 CarbonylContact C-O 3.52Å; V447-D502 WeakPolarHBondContact CG1-O 3.39Å; T448-D502 CarbonylContact C-O 3.53Å; T448-D502 CarbonylContact O-C 3.56Å; I449-D502 CarbonylContact C-O 3.42Å; I449-D502 VanDerWaalsContact C-O 3.29Å; I449-D502 PolarHBondContact N-O 2.86Å; D450-D502 HydrophobicContact CB-CB 3.74Å; D450-D502 WeakPolarHBondContact CB-O 3.47Å; D450-D502 PolarHBondContact N-O 3.47Å; D450-D502 WeakPolarHBondContact OD2-CB 3.3Å
503	L	53.8	Low	67	Low	125 Å²	125	85 Å²	85	65%	0.654	41%	0.412	S	S	*	.			trans	-115	3.2	-157.3	-86.5	157.2	0	0	0	118.9	V447 T448 I449	V447-L503 HydrophobicContact CG1-CD2 3.68Å; V447-L503 HydrophobicContact CG1-CG 4.17Å; T448-L503 HydrophobicContact CG2-CD2 4.47Å; T448-L503 CarbonylContact O-C 3.45Å; T448-L503 WeakPolarHBondContact O-CA 3.44Å; T448-L503 PolarHBondContact O-N 3.37Å; T448-L503 WeakPolarHBondContact OG1-CD2 3.09Å; I449-L503 CarbonylContact O-C 3.45Å; I449-L503 VanDerWaalsContact O-C 3.25Å
504	N	50.3	Low	67.5	Low	133.5 Å²	133.5	82.1 Å²	82.1	71%	0.714	40%	0.398	S	S	*	.			trans	-136.5	115.4	-172	-88.7	-21.8	0	0	0	118.1	I449	I449-N504 WeakPolarHBondContact CG2-O 3.37Å; I449-N504 CarbonylContact O-C 3.55Å; I449-N504 VanDerWaalsContact O-CA 3.31Å; I449-N504 WeakPolarHBondContact O-CA 3.4Å; I449-N504 PolarHBondContact O-N 2.94Å
505	T	44	Very low	67.8	Low	104.5 Å²	104.5	80.4 Å²	80.4	64%	0.641	39%	0.389	S	S	*	.	S	Bend	trans	94.4	125.8	174.8	70	0	0	0	0	123.1	I449 V507	I449-T505 WeakPolarHBondContact CG1-O 3.37Å; I449-T505 WeakPolarHBondContact CG2-O 3.32Å; I449-T505 PolarHBondContact O-N 3.41Å; T505-V507 PolarHBondContact O-N 3.15Å
506	T	47.7	Very low	68	Low	126 Å²	126	78.9 Å²	78.9	77%	0.773	39%	0.385	S	S	*	.			trans	-73.1	99.7	-166.9	53	0	0	0	0	116.5	I449	I449-T506 HydrophobicContact CD1-CG2 4Å
507	V	49	Very low	68.2	Low	71.5 Å²	71.5	79.1 Å²	79.1	43%	0.433	39%	0.386	S	S	.	.			trans	-114.4	113.2	167.4	-175.5	0	0	0	0	110.8	T505 R509	T505-V507 PolarHBondContact O-N 3.15Å; V507-R509 HydrophobicContact CG1-CB 4.48Å; V507-R509 HydrophobicContact CG1-CG 4.01Å; V507-R509 PolarHBondContact O-N 2.92Å
508	R	51.3	Low	68.3	Low	204 Å²	204	82 Å²	82	77%	0.77	40%	0.399	S	S	*	.			trans	-82.5	97.6	173.1	-71.4	179.8	176.6	178.1	-1.3	110.1	N431	N431-R508 WeakPolarHBondContact OD1-CB 3.49Å
509	R	59.6	Low	68.4	Low	159 Å²	159	84.1 Å²	84.1	60%	0.6	41%	0.414	S	S	*	.			trans	-123.7	126.7	170.7	-70.9	-174.5	175.8	167.5	0.3	110.6	D451 V507 S511	D451-R509 VanDerWaalsContact CG-NH1 3.27Å; D451-R509 IonicContact OD1-CZ 2.85Å; D451-R509 IonicContact OD1-NH1 2.82Å; D451-R509 PolarHBondContact OD1-NH1 2.9Å; D451-R509 IonicContact OD2-NH1 3.35Å; D451-R509 PolarHBondContact OD2-NH1 2.97Å; V507-R509 HydrophobicContact CG1-CB 4.48Å; V507-R509 HydrophobicContact CG1-CG 4.01Å; V507-R509 PolarHBondContact O-N 2.92Å; R509-S511 PolarHBondContact O-N 3.42Å; R509-S511 PolarHBondContact O-OG 2.66Å
510	E	70.2	Confident	68.6	Low	137 Å²	137	84.1 Å²	84.1	64%	0.64	42%	0.419	S	S	*	.			trans	-67.6	130.4	167.3	-65.5	-172.8	165.2	0	0	109	L429	L429-E510 WeakPolarHBondContact O-CA 3.27Å
511	S	74	Confident	68.6	Low	22.5 Å²	22.5	87.9 Å²	87.9	16%	0.157	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.7	179.9	-63.1	0	0	0	0	109.1	Q428 L429 L453 R509	Q428-S511 WeakPolarHBondContact CA-O 3.46Å; L429-S511 PolarHBondContact N-O 2.84Å; L429-S511 PolarHBondContact O-N 3.12Å; L429-S511 VanDerWaalsContact O-N 3.13Å; L453-S511 WeakPolarHBondContact CD2-OG 3.37Å; R509-S511 PolarHBondContact O-N 3.42Å; R509-S511 PolarHBondContact O-OG 2.66Å
512	R	78.9	Confident	68.8	Low	137 Å²	137	89.5 Å²	89.5	52%	0.517	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	115.8	176	-179.3	176.7	170.3	179.8	-2.2	108.8	A427 Q428 V514	A427-R512 WeakPolarHBondContact O-CA 3.39Å; Q428-R512 HydrophobicContact CB-CG 4.48Å; Q428-R512 HydrophobicContact CG-CB 4.36Å; Q428-R512 HydrophobicContact CG-CG 4.45Å; R512-V514 HydrophobicContact CG-CG2 4.16Å
513	V	81.7	Confident	68.8	Low	24 Å²	24	89.9 Å²	89.9	15%	0.145	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	129.4	170.6	-174.9	0	0	0	0	107.6	S426 A427 V476 L498 M515	S426-V513 CarbonylContact C-O 3.5Å; S426-V513 WeakPolarHBondContact CA-O 3.43Å; A427-V513 HydrophobicContact CB-CB 4.44Å; A427-V513 PolarHBondContact N-O 2.79Å; A427-V513 PolarHBondContact O-N 2.89Å; V476-V513 HydrophobicContact CB-CG2 4.43Å; V476-V513 HydrophobicContact CG1-CG2 3.55Å; V476-V513 VanDerWaalsContact CG1-CG2 3.48Å; V476-V513 HydrophobicContact CG2-CG2 3.95Å; L498-V513 HydrophobicContact CD1-CG2 4.47Å; L498-V513 HydrophobicContact CD2-CG2 4.21Å; V513-M515 HydrophobicContact CG1-CE 4.42Å; V513-M515 HydrophobicContact CG1-CG 3.94Å; V513-M515 HydrophobicContact CG1-SD 4.28Å
514	V	82.1	Confident	69.4	Low	46.5 Å²	46.5	90.3 Å²	90.3	28%	0.282	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.4	174.1	-177.9	0	0	0	0	108.2	L381 P404 I424 R512	L381-V514 HydrophobicContact CD2-CB 4.11Å; L381-V514 HydrophobicContact CD2-CG1 4.36Å; L381-V514 HydrophobicContact CD2-CG2 4.06Å; P404-V514 HydrophobicContact CG-CG1 4.29Å; P404-V514 HydrophobicContact CG-CG2 4.43Å; I424-V514 HydrophobicContact CG2-CG1 3.78Å; R512-V514 HydrophobicContact CG-CG2 4.16Å
515	M	82.7	Confident	70.3	Confident	31.5 Å²	31.5	86 Å²	86	16%	0.155	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134.9	-174.9	-62.2	172.1	-79.3	0	0	109.8	I408 I424 V425 A427 L455 I496 V513	I408-M515 HydrophobicContact CD1-CE 3.98Å; I424-M515 WeakPolarHBondContact CA-O 3.37Å; V425-M515 HydrophobicContact CG2-CB 3.98Å; V425-M515 HydrophobicContact CG2-CE 4.05Å; V425-M515 PolarHBondContact N-O 3Å; V425-M515 PolarHBondContact O-N 3.27Å; A427-M515 HydrophobicContact CB-CE 4.33Å; L455-M515 HydrophobicContact CD1-CE 4.2Å; L455-M515 HydrophobicContact CD1-SD 3.96Å; L455-M515 HydrophobicContact CD2-SD 3.95Å; I496-M515 HydrophobicContact CG2-CE 3.89Å; I496-M515 HydrophobicContact CG2-SD 4.01Å; V513-M515 HydrophobicContact CG1-CE 4.42Å; V513-M515 HydrophobicContact CG1-CG 3.94Å; V513-M515 HydrophobicContact CG1-SD 4.28Å
516	K	83.1	Confident	72	Confident	64.5 Å²	64.5	83.2 Å²	83.2	28%	0.28	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.3	171.4	-172.1	173.5	176.5	178.3	0	108.5	D355 P422 I424 H518	D355-K516 VanDerWaalsContact CB-NZ 3.31Å; D355-K516 WeakPolarHBondContact OD1-CE 3.26Å; D355-K516 IonicContact OD1-NZ 3.62Å; D355-K516 PolarHBondContact OD1-NZ 3.2Å; P422-K516 HydrophobicContact CB-CG 4.16Å; I424-K516 HydrophobicContact CG1-CB 4.49Å; I424-K516 HydrophobicContact CG1-CG 4.19Å; K516-H518 WeakPolarHBondContact CE-NE2 3.4Å
517	I	84.9	Confident	73.8	Confident	38 Å²	38	79.8 Å²	79.8	20%	0.195	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	124.7	-176	-59.3	173.4	0	0	0	108.8	F421 P422 R423 V425 I496	F421-I517 HydrophobicContact CD1-CG2 4.12Å; F421-I517 WeakPolarHBondContact CD1-O 3.44Å; F421-I517 HydrophobicContact CE1-CB 4.49Å; F421-I517 HydrophobicContact CE1-CG2 3.89Å; P422-I517 CarbonylContact C-O 3.51Å; P422-I517 WeakPolarHBondContact CA-O 3.4Å; P422-I517 WeakPolarHBondContact CB-O 3.4Å; R423-I517 PolarHBondContact N-O 3.01Å; R423-I517 PolarHBondContact O-N 2.92Å; V425-I517 HydrophobicContact CG1-CD1 4.29Å; V425-I517 HydrophobicContact CG2-CD1 3.72Å; V425-I517 HydrophobicContact CG2-CG1 4.31Å; I496-I517 HydrophobicContact CD1-CD1 3.84Å
518	H	82.8	Confident	75.7	Confident	60.5 Å²	60.5	76.5 Å²	76.5	28%	0.28	36%	0.361	S	S	.	.			trans	-105.7	148.6	170	-66.1	-101.1	0	0	0	109.7	D355 K516 F526	D355-H518 IonicContact OD1-CE1 3.9Å; D355-H518 PolarHBondContact OD1-CE1 3.26Å; D355-H518 IonicContact OD1-NE2 2.89Å; K516-H518 WeakPolarHBondContact CE-NE2 3.4Å; H518-F526 HydrophobicContact CB-CD2 4.2Å; H518-F526 HydrophobicContact CB-CE2 4.35Å; H518-F526 AromaticContact CD2-CE2 3.86Å; H518-F526 AromaticContact CE1-CE2 3.63Å; H518-F526 AromaticContact CG-CD2 3.93Å; H518-F526 AromaticContact CG-CE2 3.74Å; H518-F526 AromaticContact ND1-CD2 4Å; H518-F526 AromaticContact ND1-CE2 3.61Å; H518-F526 AromaticContact NE2-CE2 3.83Å
519	S	82	Confident	77.8	Confident	44.5 Å²	44.5	66.8 Å²	66.8	31%	0.311	32%	0.324	S	S	.	.			trans	-134.1	146	178.5	-172.6	0	0	0	0	110.4	S272 F421	S272-S519 VanDerWaalsContact CB-O 3.28Å; S272-S519 WeakPolarHBondContact CB-O 3.45Å; S272-S519 PolarHBondContact OG-O 2.93Å; S272-S519 VanDerWaalsContact OG-O 3.11Å; F421-S519 VanDerWaalsContact CD2-CB 3.49Å
520	S	77.8	Confident	79.5	Confident	43 Å²	43	60.4 Å²	60.4	30%	0.301	30%	0.302	S	S	.	.			trans	-145.2	145.8	177.7	118.6	0	0	0	0	109.5	D522 F524	S520-D522 PolarHBondContact OG-N 2.73Å; S520-F524 WeakPolarHBondContact OG-CB 3.37Å; S520-F524 PolarHBondContact OG-N 2.84Å; S520-F524 VanDerWaalsContact OG-N 3.09Å; S520-F524 PolarHBondContact OG-O 2.74Å
521	I	74.5	Confident	80.8	Confident	106 Å²	106	53.9 Å²	53.9	54%	0.544	27%	0.272	S	S	.	.	S	Bend	trans	-87.4	-37.3	178.3	-60.1	178	0	0	0	111	V271 N523	V271-I521 HydrophobicContact CG2-CG1 4.46Å; I521-N523 VanDerWaalsContact C-N 3.29Å; I521-N523 PolarHBondContact O-N 2.4Å
522	D	69.3	Low	81.9	Confident	94 Å²	94	53.5 Å²	53.5	50%	0.503	27%	0.269	S	S	.	.	S	Bend	trans	-91.2	26.6	-168.1	-50.6	-54.9	0	0	0	114.1	S520 F524	S520-D522 PolarHBondContact OG-N 2.73Å; D522-F524 HydrophobicContact CB-CD2 3.69Å; D522-F524 HydrophobicContact CB-CE1 4.47Å; D522-F524 HydrophobicContact CB-CE2 3.47Å; D522-F524 VanDerWaalsContact CB-CE2 3.47Å; D522-F524 HydrophobicContact CB-CG 4.36Å; D522-F524 HydrophobicContact CB-CZ 3.95Å; D522-F524 PolarHBondContact O-N 3.27Å; D522-F524 VanDerWaalsContact O-N 3.11Å; D522-F524 WeakPolarHBondContact OD2-CE2 3.38Å
523	N	63.9	Low	82.8	Confident	114.5 Å²	114.5	49.9 Å²	49.9	61%	0.612	26%	0.26	S	S	*	.			trans	53	25.6	-169.9	-63.9	-52.1	0	0	0	113.5	I521 V525	I521-N523 VanDerWaalsContact C-N 3.29Å; I521-N523 PolarHBondContact O-N 2.4Å; N523-V525 PolarHBondContact O-N 3.11Å; N523-V525 VanDerWaalsContact O-N 3.09Å
524	F	67.4	Low	83.6	Confident	135 Å²	135	48.8 Å²	48.8	59%	0.592	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-62.5	118	174.2	-69.9	-56.6	0	0	0	108.9	S520 D522	S520-F524 WeakPolarHBondContact OG-CB 3.37Å; S520-F524 PolarHBondContact OG-N 2.84Å; S520-F524 VanDerWaalsContact OG-N 3.09Å; S520-F524 PolarHBondContact OG-O 2.74Å; D522-F524 HydrophobicContact CB-CD2 3.69Å; D522-F524 HydrophobicContact CB-CE1 4.47Å; D522-F524 HydrophobicContact CB-CE2 3.47Å; D522-F524 VanDerWaalsContact CB-CE2 3.47Å; D522-F524 HydrophobicContact CB-CG 4.36Å; D522-F524 HydrophobicContact CB-CZ 3.95Å; D522-F524 PolarHBondContact O-N 3.27Å; D522-F524 VanDerWaalsContact O-N 3.11Å; D522-F524 WeakPolarHBondContact OD2-CE2 3.38Å
525	V	70	Confident	84.3	Confident	42.5 Å²	42.5	53 Å²	53	26%	0.258	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-74.7	139.5	177.1	173.8	0	0	0	0	108.8	N523 Y527	N523-V525 PolarHBondContact O-N 3.11Å; N523-V525 VanDerWaalsContact O-N 3.09Å; V525-Y527 HydrophobicContact CB-CE1 4.25Å; V525-Y527 HydrophobicContact CB-CE2 3.87Å; V525-Y527 HydrophobicContact CG1-CD1 4.1Å; V525-Y527 HydrophobicContact CG1-CD2 4.43Å; V525-Y527 HydrophobicContact CG1-CE1 3.81Å; V525-Y527 HydrophobicContact CG1-CE2 4.21Å; V525-Y527 VanDerWaalsContact CG1-CZ 3.49Å; V525-Y527 WeakPolarHBondContact O-CD2 3.29Å; V525-Y527 VanDerWaalsContact O-CE2 3.27Å; V525-Y527 WeakPolarHBondContact O-CE2 3.4Å; V525-Y527 PolarHBondContact O-N 2.81Å
526	F	78.1	Confident	85.1	Confident	46 Å²	46	51.5 Å²	51.5	20%	0.202	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-76	121.3	172.6	-168.8	-92.4	0	0	0	110.3	R357 H518	R357-F526 HydrophobicContact CG-CE1 4.4Å; R357-F526 HydrophobicContact CG-CE2 4.08Å; R357-F526 HydrophobicContact CG-CZ 3.81Å; H518-F526 HydrophobicContact CB-CD2 4.2Å; H518-F526 HydrophobicContact CB-CE2 4.35Å; H518-F526 AromaticContact CD2-CE2 3.86Å; H518-F526 AromaticContact CE1-CE2 3.63Å; H518-F526 AromaticContact CG-CD2 3.93Å; H518-F526 AromaticContact CG-CE2 3.74Å; H518-F526 AromaticContact ND1-CD2 4Å; H518-F526 AromaticContact ND1-CE2 3.61Å; H518-F526 AromaticContact NE2-CE2 3.83Å
527	Y	86.5	Confident	85.8	Confident	55 Å²	55	48.9 Å²	48.9	22%	0.216	25%	0.246	C	C	.	.			trans	-115.1	134.3	176.8	-58.1	-77	0	0	0	109.6	R357 V525 N530 R552 A554	R357-Y527 WeakPolarHBondContact CG-O 3.3Å; V525-Y527 HydrophobicContact CB-CE1 4.25Å; V525-Y527 HydrophobicContact CB-CE2 3.87Å; V525-Y527 HydrophobicContact CG1-CD1 4.1Å; V525-Y527 HydrophobicContact CG1-CD2 4.43Å; V525-Y527 HydrophobicContact CG1-CE1 3.81Å; V525-Y527 HydrophobicContact CG1-CE2 4.21Å; V525-Y527 VanDerWaalsContact CG1-CZ 3.49Å; V525-Y527 WeakPolarHBondContact O-CD2 3.29Å; V525-Y527 VanDerWaalsContact O-CE2 3.27Å; V525-Y527 WeakPolarHBondContact O-CE2 3.4Å; V525-Y527 PolarHBondContact O-N 2.81Å; Y527-N530 HydrophobicContact CD2-CB 4.41Å; Y527-N530 HydrophobicContact CG-CB 4.28Å; Y527-R552 CarbonylContact C-O 3.52Å; Y527-R552 VanDerWaalsContact CA-O 3.3Å; Y527-R552 WeakPolarHBondContact CA-O 3.36Å; Y527-R552 HydrophobicContact CD1-CB 4.14Å; Y527-R552 HydrophobicContact CD1-CG 3.82Å; Y527-R552 HydrophobicContact CE1-CG 4.01Å; Y527-A554 HydrophobicContact CD1-CB 3.57Å; Y527-A554 HydrophobicContact CE1-CB 3.53Å; Y527-A554 VanDerWaalsContact CE1-CB 3.48Å; Y527-A554 HydrophobicContact CG-CB 4.4Å
528	G	89.5	Confident	86.3	Confident	1.5 Å²	1.5	50.2 Å²	50.2	2%	0.015	25%	0.254	C	S	.	.	S	Bend	trans	-72.5	-60	168	0	0	0	0	0	109.8	L358 R552	L358-G528 PolarHBondContact N-O 3.01Å; G528-R552 PolarHBondContact N-O 2.99Å
529	L	94.8	Very high	86.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.3	171	175	62.8	0	0	0	110.2	L358 V531 I544 L546 T553 A554	L358-L529 HydrophobicContact CB-CD1 3.86Å; L358-L529 HydrophobicContact CD2-CD1 3.72Å; L358-L529 HydrophobicContact CG-CD1 3.71Å; L529-V531 HydrophobicContact CD1-CG2 3.64Å; L529-V531 HydrophobicContact CD2-CG2 4.16Å; L529-V531 HydrophobicContact CG-CG2 3.9Å; L529-I544 HydrophobicContact CD2-CG2 3.73Å; L529-L546 HydrophobicContact CB-CD2 4.42Å; L529-L546 HydrophobicContact CD2-CD1 4.35Å; L529-L546 HydrophobicContact CD2-CD2 3.66Å; L529-L546 HydrophobicContact CD2-CG 4.38Å; L529-T553 HydrophobicContact CB-CG2 4.2Å; L529-T553 HydrophobicContact CD2-CG2 4.17Å; L529-T553 HydrophobicContact CG-CG2 4.34Å; L529-T553 CarbonylContact O-C 3.4Å; L529-T553 VanDerWaalsContact O-CA 3.27Å; L529-T553 WeakPolarHBondContact O-CA 3.36Å; L529-A554 PolarHBondContact O-N 2.92Å
530	N	95.3	Very high	87.3	Confident	25.5 Å²	25.5	46.2 Å²	46.2	14%	0.136	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	112.1	169.6	-178.6	13.5	0	0	0	109.8	L358 F359 I360 Y527 S532 A554	L358-N530 PolarHBondContact O-N 2.68Å; F359-N530 WeakPolarHBondContact CA-O 3.45Å; F359-N530 HydrophobicContact CD2-CB 4.07Å; F359-N530 WeakPolarHBondContact CE2-ND2 3.11Å; I360-N530 PolarHBondContact N-O 2.9Å; Y527-N530 HydrophobicContact CD2-CB 4.41Å; Y527-N530 HydrophobicContact CG-CB 4.28Å; N530-S532 PolarHBondContact OD1-OG 3.43Å; N530-S532 VanDerWaalsContact OD1-OG 3.1Å; N530-A554 WeakPolarHBondContact CA-O 3.44Å
531	V	97.4	Very high	88	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.9	175.2	-173	0	0	0	0	108	I360 I373 L529 I544 A554 L555 N556 V558	I360-V531 HydrophobicContact CB-CG1 4.44Å; I360-V531 HydrophobicContact CB-CG2 4.44Å; I360-V531 HydrophobicContact CG2-CG1 4.43Å; I360-V531 WeakPolarHBondContact O-CA 3.29Å; I373-V531 HydrophobicContact CD1-CG2 3.86Å; L529-V531 HydrophobicContact CD1-CG2 3.64Å; L529-V531 HydrophobicContact CD2-CG2 4.16Å; L529-V531 HydrophobicContact CG-CG2 3.9Å; V531-I544 HydrophobicContact CG2-CD1 4.25Å; V531-A554 PolarHBondContact N-O 3.45Å; V531-L555 HydrophobicContact CB-CD2 3.81Å; V531-L555 HydrophobicContact CG2-CD2 3.98Å; V531-L555 WeakPolarHBondContact O-CA 3.33Å; V531-N556 PolarHBondContact O-N 2.92Å; V531-V558 HydrophobicContact CB-CG2 4.09Å; V531-V558 HydrophobicContact CG1-CG1 4.08Å; V531-V558 HydrophobicContact CG1-CG2 3.78Å; V531-V558 WeakPolarHBondContact O-CG2 3.37Å
532	S	96.7	Very high	89	Confident	14.5 Å²	14.5	39.3 Å²	39.3	10%	0.101	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.7	-179	-3.3	0	0	0	0	112	I360 N361 E362 N530 S534 N556	I360-S532 PolarHBondContact O-N 3.21Å; N361-S532 WeakPolarHBondContact CA-O 2.92Å; N361-S532 VanDerWaalsContact CG-OG 3.26Å; N361-S532 PolarHBondContact OD1-O 3.35Å; N361-S532 VanDerWaalsContact OD1-O 3.08Å; N361-S532 PolarHBondContact OD1-OG 3.44Å; E362-S532 PolarHBondContact N-O 3.29Å; N530-S532 PolarHBondContact OD1-OG 3.43Å; N530-S532 VanDerWaalsContact OD1-OG 3.1Å; S532-S534 WeakPolarHBondContact O-CB 3.43Å; S532-S534 PolarHBondContact O-N 2.83Å; S532-S534 PolarHBondContact O-OG 3.14Å; S532-N556 CarbonylContact C-O 3.53Å; S532-N556 VanDerWaalsContact CA-O 3.24Å; S532-N556 WeakPolarHBondContact CA-O 3.29Å
533	N	98	Very high	90.3	Very high	60.5 Å²	60.5	34.8 Å²	34.8	32%	0.324	17%	0.174	S	C	.	.	S	Bend	trans	47.9	32.5	174.3	-50.9	-50.5	0	0	0	114.6	N361 E362 N556 N557	N361-N533 PolarHBondContact OD1-ND2 2.84Å; E362-N533 WeakPolarHBondContact CA-O 3.23Å; E362-N533 HydrophobicContact CG-CB 4.25Å; E362-N533 WeakPolarHBondContact OE1-CB 3.18Å; E362-N533 PolarHBondContact OE1-ND2 2.83Å; N533-N556 PolarHBondContact N-O 3.25Å; N533-N557 VanDerWaalsContact CA-O 3.24Å; N533-N557 WeakPolarHBondContact CA-O 3.38Å; N533-N557 PolarHBondContact N-O 3.05Å; N533-N557 WeakPolarHBondContact OD1-CB 3.15Å; N533-N557 PolarHBondContact OD1-ND2 2.95Å
534	S	98.3	Very high	92	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	15%	0.145	C	C	.	.			trans	-119	162.3	-169.3	-66.3	0	0	0	0	111	E362 T363 S532 V558 T559	E362-S534 PolarHBondContact N-OG 2.99Å; T363-S534 PolarHBondContact N-OG 3.26Å; T363-S534 VanDerWaalsContact N-OG 3.13Å; T363-S534 WeakPolarHBondContact O-CA 3.46Å; T363-S534 WeakPolarHBondContact O-CB 3.48Å; T363-S534 PolarHBondContact O-OG 2.83Å; S532-S534 WeakPolarHBondContact O-CB 3.43Å; S532-S534 PolarHBondContact O-N 2.83Å; S532-S534 PolarHBondContact O-OG 3.14Å; S534-V558 WeakPolarHBondContact O-CA 3.36Å; S534-V558 WeakPolarHBondContact O-CG1 3.24Å; S534-T559 PolarHBondContact O-N 3.18Å
535	R	98	Very high	93.4	Very high	133.5 Å²	133.5	24.2 Å²	24.2	50%	0.504	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.5	178.2	-61.1	-169.6	178.7	179.6	-0.3	109.9	T363 I365 T559	T363-R535 PolarHBondContact O-N 2.8Å; I365-R535 PolarHBondContact N-O 3.19Å; R535-T559 CarbonylContact C-O 3.39Å; R535-T559 WeakPolarHBondContact CA-O 3.24Å
536	V	98.1	Very high	94.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	90.2	178.6	-171.3	0	0	0	0	108.4	I365 I373 G543 I544 T559 I560 S561 N563	I365-V536 WeakPolarHBondContact O-CA 3.36Å; I373-V536 HydrophobicContact CD1-CG2 4.03Å; V536-G543 VanDerWaalsContact CG1-O 3.25Å; V536-G543 WeakPolarHBondContact CG1-O 3.39Å; V536-I544 HydrophobicContact CG1-CG1 4.48Å; V536-I544 HydrophobicContact CG2-CG1 4.44Å; V536-T559 PolarHBondContact N-O 3.3Å; V536-I560 HydrophobicContact CB-CG1 4.46Å; V536-I560 WeakPolarHBondContact O-CA 3.43Å; V536-S561 PolarHBondContact O-N 3.39Å; V536-N563 PolarHBondContact O-ND2 3.14Å; V536-N563 VanDerWaalsContact O-ND2 3.15Å
537	C	97.6	Very high	95.3	Very high	9.5 Å²	9.5	22.2 Å²	22.2	6%	0.064	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.5	-162.3	-60	0	0	0	0	114.1	I365 E366 F367 N539 S561	I365-C537 PolarHBondContact O-N 3.2Å; I365-C537 VanDerWaalsContact O-N 3.08Å; E366-C537 WeakPolarHBondContact CA-O 3.37Å; E366-C537 HydrophobicContact CB-CB 4.46Å; E366-C537 WeakPolarHBondContact CB-O 3.46Å; F367-C537 PolarHBondContact N-O 2.91Å; C537-N539 PolarHBondContact N-ND2 3.21Å; C537-N539 PolarHBondContact O-N 3.24Å; C537-N539 VanDerWaalsContact O-N 3.1Å; C537-N539 PolarHBondContact O-ND2 3.01Å; C537-S561 CarbonylContact C-O 3.36Å; C537-S561 WeakPolarHBondContact CA-O 3.23Å; C537-S561 WeakPolarHBondContact CB-O 3.17Å; C537-S561 PolarHBondContact SG-OG 2.87Å
538	N	96.4	Very high	95.5	Very high	67 Å²	67	20.6 Å²	20.6	36%	0.358	11%	0.105	S	C	.	.	S	Bend	trans	54	31.6	171.3	-58.6	-36.5	0	0	0	114.5	F367 S561 G562	F367-N538 WeakPolarHBondContact CA-O 3.44Å; F367-N538 HydrophobicContact CD1-CB 3.66Å; F367-N538 HydrophobicContact CE1-CB 3.54Å; F367-N538 WeakPolarHBondContact CE1-ND2 3.43Å; F367-N538 HydrophobicContact CG-CB 4.35Å; F367-N538 HydrophobicContact CZ-CB 4.13Å; F367-N538 VanDerWaalsContact CZ-ND2 3.32Å; F367-N538 WeakPolarHBondContact CZ-ND2 3.47Å; N538-S561 PolarHBondContact N-O 3.38Å; N538-G562 WeakPolarHBondContact CA-O 3.35Å
539	N	95.4	Very high	95.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.105	C	C	.	.			trans	-83.8	145.6	174.6	-55.8	-76.5	0	0	0	109.9	I365 N368 C537 G541 N563 Q564	I365-N539 PolarHBondContact O-ND2 3.13Å; I365-N539 VanDerWaalsContact O-ND2 3.16Å; N368-N539 WeakPolarHBondContact CB-OD1 3.27Å; N368-N539 PolarHBondContact N-OD1 3.38Å; N368-N539 PolarHBondContact ND2-OD1 2.04Å; N368-N539 CarbonylContact O-C 3.59Å; N368-N539 WeakPolarHBondContact O-CA 3.36Å; C537-N539 PolarHBondContact N-ND2 3.21Å; C537-N539 PolarHBondContact O-N 3.24Å; C537-N539 VanDerWaalsContact O-N 3.1Å; C537-N539 PolarHBondContact O-ND2 3.01Å; N539-G541 VanDerWaalsContact C-N 3.29Å; N539-G541 PolarHBondContact O-N 3.28Å; N539-N563 WeakPolarHBondContact CB-OD1 3.29Å; N539-N563 PolarHBondContact N-OD1 3.23Å; N539-N563 PolarHBondContact ND2-OD1 3.1Å; N539-N563 CarbonylContact O-C 3.58Å; N539-N563 WeakPolarHBondContact O-CA 3.43Å; N539-Q564 PolarHBondContact O-N 3.08Å
540	G	91.1	Very high	95.2	Very high	20 Å²	20	23.8 Å²	23.8	21%	0.206	12%	0.117	C	C	.	.	S	Bend	trans	-66	-31.8	177.5	0	0	0	0	0	112.1	R136 N368 F369 Q564	R136-G540 PolarHBondContact NH1-O 3.47Å; N368-G540 PolarHBondContact O-N 3.43Å; F369-G540 VanDerWaalsContact O-CA 3.3Å; F369-G540 WeakPolarHBondContact O-CA 3.35Å; G540-Q564 CarbonylContact O-C 3.59Å; G540-Q564 WeakPolarHBondContact O-CB 3.35Å
541	G	92.3	Very high	94.9	Very high	4.5 Å²	4.5	23.6 Å²	23.6	5%	0.046	12%	0.116	C	C	.	.	S	Bend	trans	-85.7	-157.5	173.2	0	0	0	0	0	114.1	G370 D371 N539 Q564 H565	G370-G541 WeakPolarHBondContact O-CA 3.49Å; G370-G541 PolarHBondContact O-N 3.46Å; D371-G541 WeakPolarHBondContact OD1-CA 2.99Å; N539-G541 VanDerWaalsContact C-N 3.29Å; N539-G541 PolarHBondContact O-N 3.28Å; G541-Q564 PolarHBondContact O-N 2.74Å; G541-H565 WeakPolarHBondContact O-CB 3.48Å; G541-H565 PolarHBondContact O-N 3.18Å
542	S	95.4	Very high	94.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.122	C	C	.	.			trans	-69.6	153.7	169.1	-67.5	0	0	0	0	109.5	D371 G372 H565 A567	D371-S542 VanDerWaalsContact CA-O 3.26Å; D371-S542 WeakPolarHBondContact CA-O 3.39Å; D371-S542 PolarHBondContact OD1-N 3.12Å; G372-S542 PolarHBondContact N-O 3.04Å; S542-H565 PolarHBondContact OG-CD2 3.27Å; S542-A567 WeakPolarHBondContact CA-O 3.19Å; S542-A567 WeakPolarHBondContact CB-O 3.29Å; S542-A567 PolarHBondContact OG-O 3.19Å
543	G	97	Very high	94.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	-62.5	-62.8	172.6	0	0	0	0	0	110	G372 I373 V536 N563 A567 G568	G372-G543 CarbonylContact C-O 3.55Å; G372-G543 VanDerWaalsContact CA-O 3.3Å; G372-G543 WeakPolarHBondContact CA-O 3.43Å; G372-G543 PolarHBondContact N-O 2.96Å; I373-G543 PolarHBondContact N-O 2.98Å; V536-G543 VanDerWaalsContact CG1-O 3.25Å; V536-G543 WeakPolarHBondContact CG1-O 3.39Å; G543-N563 VanDerWaalsContact CA-CG 3.46Å; G543-N563 WeakPolarHBondContact CA-OD1 3.16Å; G543-A567 PolarHBondContact N-O 3.01Å; G543-G568 CarbonylContact C-O 3.37Å; G543-G568 VanDerWaalsContact CA-O 3.25Å; G543-G568 WeakPolarHBondContact CA-O 3.41Å; G543-G568 PolarHBondContact N-O 3.28Å; G543-G568 VanDerWaalsContact N-O 3.12Å
544	I	98	Very high	94.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	114.7	176	-56	-178	0	0	0	108.1	I373 L529 V531 V536 L546 L555 I560 G568 V569 H570	I373-I544 HydrophobicContact CB-CG1 4.45Å; I373-I544 HydrophobicContact CB-CG2 4.45Å; I373-I544 HydrophobicContact CD1-CD1 4.31Å; I373-I544 HydrophobicContact CD1-CG1 4.18Å; L529-I544 HydrophobicContact CD2-CG2 3.73Å; V531-I544 HydrophobicContact CG2-CD1 4.25Å; V536-I544 HydrophobicContact CG1-CG1 4.48Å; V536-I544 HydrophobicContact CG2-CG1 4.44Å; I544-L546 HydrophobicContact CG2-CD1 4.27Å; I544-L546 HydrophobicContact CG2-CD2 4.35Å; I544-L546 HydrophobicContact CG2-CG 4.12Å; I544-L555 HydrophobicContact CD1-CD1 4.2Å; I544-L555 HydrophobicContact CD1-CD2 3.53Å; I544-I560 HydrophobicContact CD1-CD1 3.67Å; I544-I560 HydrophobicContact CG1-CD1 4.12Å; I544-G568 PolarHBondContact N-O 3.16Å; I544-V569 CarbonylContact O-C 3.58Å; I544-V569 WeakPolarHBondContact O-CA 3.27Å; I544-H570 PolarHBondContact O-N 3.29Å
545	Y	97.3	Very high	94.4	Very high	27 Å²	27	21.6 Å²	21.6	11%	0.106	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.2	175.1	178.9	-113.4	0	0	0	110.9	I373 Q374 F375 Q547 H570 F572	I373-Y545 PolarHBondContact O-N 2.91Å; Q374-Y545 WeakPolarHBondContact CA-O 3.24Å; Q374-Y545 HydrophobicContact CG-CD1 4.06Å; F375-Y545 PolarHBondContact N-O 3.13Å; Y545-Q547 HydrophobicContact CE1-CB 4.12Å; Y545-Q547 PolarHBondContact OH-OE1 2.85Å; Y545-H570 CarbonylContact C-O 3.51Å; Y545-H570 WeakPolarHBondContact CA-O 3.48Å; Y545-H570 HydrophobicContact CD2-CB 4.03Å; Y545-H570 AromaticContact CD2-CG 3.82Å; Y545-H570 AromaticContact CD2-ND1 3.47Å; Y545-H570 WeakPolarHBondContact CD2-ND1 3.01Å; Y545-H570 AromaticContact CE2-CE1 3.83Å; Y545-H570 AromaticContact CE2-ND1 3.61Å; Y545-F572 HydrophobicContact CE2-CB 4.01Å
546	L	95.5	Very high	94.3	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.6	-177.9	-66.4	178.3	0	0	0	109.2	F375 L529 I544 V549 T553 H570 I571 F572	F375-L546 HydrophobicContact CB-CD2 3.59Å; F375-L546 HydrophobicContact CD1-CD2 4.01Å; F375-L546 HydrophobicContact CG-CD2 4.19Å; L529-L546 HydrophobicContact CB-CD2 4.42Å; L529-L546 HydrophobicContact CD2-CD1 4.35Å; L529-L546 HydrophobicContact CD2-CD2 3.66Å; L529-L546 HydrophobicContact CD2-CG 4.38Å; I544-L546 HydrophobicContact CG2-CD1 4.27Å; I544-L546 HydrophobicContact CG2-CD2 4.35Å; I544-L546 HydrophobicContact CG2-CG 4.12Å; L546-V549 HydrophobicContact CB-CG1 3.78Å; L546-V549 HydrophobicContact CB-CG2 4.05Å; L546-V549 HydrophobicContact CD1-CG1 4.36Å; L546-V549 HydrophobicContact CD2-CG1 4.24Å; L546-V549 HydrophobicContact CD2-CG2 3.95Å; L546-V549 HydrophobicContact CG-CG1 4.36Å; L546-V549 HydrophobicContact CG-CG2 4.32Å; L546-T553 HydrophobicContact CD1-CG2 3.65Å; L546-T553 WeakPolarHBondContact CD1-OG1 3.46Å; L546-H570 PolarHBondContact N-O 3Å; L546-I571 HydrophobicContact CB-CB 4.35Å; L546-I571 HydrophobicContact CB-CG1 4.05Å; L546-I571 HydrophobicContact CB-CG2 4.22Å; L546-I571 HydrophobicContact CD1-CD1 3.81Å; L546-I571 HydrophobicContact CD1-CG1 3.88Å; L546-I571 HydrophobicContact CG-CG1 4.42Å; L546-I571 CarbonylContact O-C 3.56Å; L546-I571 WeakPolarHBondContact O-CA 3.31Å; L546-F572 PolarHBondContact O-N 3.25Å
547	Q	92.9	Very high	94.2	Very high	46 Å²	46	21.1 Å²	21.1	22%	0.215	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.3	177.1	-171.7	179.6	-17.9	0	0	110.9	F375 R376 P377 Y545 V549 F572	F375-Q547 PolarHBondContact O-N 3.11Å; R376-Q547 HydrophobicContact CG-CB 4.12Å; P377-Q547 VanDerWaalsContact CD-O 3.27Å; P377-Q547 WeakPolarHBondContact CD-O 3.21Å; Y545-Q547 HydrophobicContact CE1-CB 4.12Å; Y545-Q547 PolarHBondContact OH-OE1 2.85Å; Q547-V549 PolarHBondContact O-N 3.15Å; Q547-V549 VanDerWaalsContact O-N 3.13Å; Q547-F572 VanDerWaalsContact CA-O 3.31Å; Q547-F572 WeakPolarHBondContact CA-O 3.4Å; Q547-F572 WeakPolarHBondContact CG-O 3.5Å
548	D	91	Very high	94.3	Very high	20.5 Å²	20.5	20.7 Å²	20.7	11%	0.11	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.9	34	171.1	-67.2	-44.2	0	0	0	114.3	P377 L379 F572 F627	P377-D548 WeakPolarHBondContact CG-O 3.36Å; L379-D548 HydrophobicContact CD1-CB 4.14Å; L379-D548 HydrophobicContact CD2-CB 4.23Å; D548-F572 PolarHBondContact N-O 2.99Å; D548-F627 HydrophobicContact CB-CE2 4.4Å; D548-F627 HydrophobicContact CB-CZ 3.86Å; D548-F627 VanDerWaalsContact OD1-CE2 3.29Å; D548-F627 WeakPolarHBondContact OD1-CE2 3.39Å
549	V	90.9	Very high	94.4	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.024	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	135.7	-175.3	-124	0	0	0	0	112.1	F375 L546 Q547 D551 I571 G574 V575 G576	F375-V549 HydrophobicContact CD1-CG1 4Å; F375-V549 HydrophobicContact CE1-CG1 4.26Å; L546-V549 HydrophobicContact CB-CG1 3.78Å; L546-V549 HydrophobicContact CB-CG2 4.05Å; L546-V549 HydrophobicContact CD1-CG1 4.36Å; L546-V549 HydrophobicContact CD2-CG1 4.24Å; L546-V549 HydrophobicContact CD2-CG2 3.95Å; L546-V549 HydrophobicContact CG-CG1 4.36Å; L546-V549 HydrophobicContact CG-CG2 4.32Å; Q547-V549 PolarHBondContact O-N 3.15Å; Q547-V549 VanDerWaalsContact O-N 3.13Å; V549-D551 VanDerWaalsContact CG1-O 3.24Å; V549-D551 WeakPolarHBondContact CG1-O 3.32Å; V549-I571 HydrophobicContact CG2-CG2 3.74Å; V549-G574 CarbonylContact O-C 3.58Å; V549-G574 VanDerWaalsContact O-CA 3.26Å; V549-G574 WeakPolarHBondContact O-CA 3.26Å; V549-V575 CarbonylContact O-C 3.55Å; V549-V575 PolarHBondContact O-N 3.06Å; V549-G576 PolarHBondContact O-N 2.84Å
550	R	87.8	Confident	94.5	Very high	66 Å²	66	18.8 Å²	18.8	25%	0.249	10%	0.097	C	C	.	.			trans	-114.4	-27.1	176.7	-64.6	176.9	-1	-162.8	-10.1	113.7	L482 P483 S484 V575 F627	L482-R550 WeakPolarHBondContact O-CD 3.12Å; L482-R550 PolarHBondContact O-NE 3.43Å; P483-R550 WeakPolarHBondContact CA-O 3.27Å; S484-R550 PolarHBondContact N-O 2.84Å; S484-R550 VanDerWaalsContact N-O 3.12Å; R550-V575 CarbonylContact C-O 3.45Å; R550-V575 WeakPolarHBondContact CA-O 3.14Å; R550-V575 HydrophobicContact CG-CG2 4.12Å; R550-F627 HydrophobicContact CG-CE1 4.15Å
551	D	88.6	Confident	94.8	Very high	21.5 Å²	21.5	18.9 Å²	18.9	12%	0.115	9%	0.094	C	C	.	.	S	Bend	trans	-86	161.7	180	-62.7	-60.4	0	0	0	111	S484 V549 T553	S484-D551 WeakPolarHBondContact CB-OD1 3.39Å; S484-D551 PolarHBondContact OG-OD1 3.14Å; V549-D551 VanDerWaalsContact CG1-O 3.24Å; V549-D551 WeakPolarHBondContact CG1-O 3.32Å; D551-T553 PolarHBondContact O-N 2.87Å
552	R	91.1	Very high	95	Very high	30.5 Å²	30.5	19.4 Å²	19.4	12%	0.115	10%	0.1	C	C	.	.	P	Polyproline II helix	trans	-67.4	130.3	176.7	-175.9	170.6	-63.9	163.3	3.6	110.5	N486 Y527 G528 D577 W579	N486-R552 PolarHBondContact ND2-NH2 3.01Å; Y527-R552 CarbonylContact C-O 3.52Å; Y527-R552 VanDerWaalsContact CA-O 3.3Å; Y527-R552 WeakPolarHBondContact CA-O 3.36Å; Y527-R552 HydrophobicContact CD1-CB 4.14Å; Y527-R552 HydrophobicContact CD1-CG 3.82Å; Y527-R552 HydrophobicContact CE1-CG 4.01Å; G528-R552 PolarHBondContact N-O 2.99Å; R552-D577 CarbonylContact C-O 3.51Å; R552-D577 WeakPolarHBondContact CA-O 3.44Å; R552-D577 HydrophobicContact CB-CB 4.09Å; R552-D577 HydrophobicContact CG-CB 3.77Å; R552-D577 IonicContact CZ-OD2 3.02Å; R552-D577 IonicContact NE-OD2 3.4Å; R552-D577 PolarHBondContact NE-OD2 3.25Å; R552-D577 VanDerWaalsContact NE-OD2 3.11Å; R552-D577 IonicContact NH2-OD2 3.18Å; R552-D577 PolarHBondContact NH2-OD2 3.14Å; R552-W579 VanDerWaalsContact NH1-CZ2 3.27Å
553	T	94.7	Very high	95	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.012	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131	168	-65.4	0	0	0	0	109.2	L529 L546 D551 L555 D577 L578 W579	L529-T553 HydrophobicContact CB-CG2 4.2Å; L529-T553 HydrophobicContact CD2-CG2 4.17Å; L529-T553 HydrophobicContact CG-CG2 4.34Å; L529-T553 CarbonylContact O-C 3.4Å; L529-T553 VanDerWaalsContact O-CA 3.27Å; L529-T553 WeakPolarHBondContact O-CA 3.36Å; L546-T553 HydrophobicContact CD1-CG2 3.65Å; L546-T553 WeakPolarHBondContact CD1-OG1 3.46Å; D551-T553 PolarHBondContact O-N 2.87Å; T553-L555 HydrophobicContact CG2-CD2 4.44Å; T553-D577 PolarHBondContact N-O 2.81Å; T553-L578 HydrophobicContact CG2-CD1 3.87Å; T553-W579 PolarHBondContact O-N 3.04Å
554	A	95.4	Very high	94.8	Very high	0.5 Å²	0.5	24.1 Å²	24.1	0%	0.004	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.9	176.4	0	0	0	0	0	111.7	Y527 L529 N530 V531 W579	Y527-A554 HydrophobicContact CD1-CB 3.57Å; Y527-A554 HydrophobicContact CE1-CB 3.53Å; Y527-A554 VanDerWaalsContact CE1-CB 3.48Å; Y527-A554 HydrophobicContact CG-CB 4.4Å; L529-A554 PolarHBondContact O-N 2.92Å; N530-A554 WeakPolarHBondContact CA-O 3.44Å; V531-A554 PolarHBondContact N-O 3.45Å; A554-W579 CarbonylContact C-O 3.22Å; A554-W579 WeakPolarHBondContact CA-O 3.16Å
555	L	97.3	Very high	94.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	112.5	172.9	-53	-178.7	0	0	0	107.7	V531 I544 T553 V558 I560 V569 W579 I580 N581	V531-L555 HydrophobicContact CB-CD2 3.81Å; V531-L555 HydrophobicContact CG2-CD2 3.98Å; V531-L555 WeakPolarHBondContact O-CA 3.33Å; I544-L555 HydrophobicContact CD1-CD1 4.2Å; I544-L555 HydrophobicContact CD1-CD2 3.53Å; T553-L555 HydrophobicContact CG2-CD2 4.44Å; L555-V558 HydrophobicContact CB-CG2 4.13Å; L555-I560 HydrophobicContact CD1-CD1 3.99Å; L555-V569 HydrophobicContact CD1-CG1 4.37Å; L555-V569 HydrophobicContact CD1-CG2 3.66Å; L555-W579 PolarHBondContact N-O 3.08Å; L555-I580 HydrophobicContact CB-CG2 4.34Å; L555-I580 HydrophobicContact CD1-CD1 4.36Å; L555-I580 HydrophobicContact CD1-CG1 4.17Å; L555-I580 WeakPolarHBondContact O-CA 3.39Å; L555-N581 PolarHBondContact O-N 3.23Å
556	N	96.2	Very high	94.1	Very high	45.5 Å²	45.5	26.9 Å²	26.9	24%	0.243	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	117.2	-178.1	-61.1	-54.6	0	0	0	110.2	V531 S532 N533 V558 N581	V531-N556 PolarHBondContact O-N 2.92Å; S532-N556 CarbonylContact C-O 3.53Å; S532-N556 VanDerWaalsContact CA-O 3.24Å; S532-N556 WeakPolarHBondContact CA-O 3.29Å; N533-N556 PolarHBondContact N-O 3.25Å; N556-V558 PolarHBondContact O-N 3.36Å; N556-N581 WeakPolarHBondContact CA-O 3.23Å; N556-N581 WeakPolarHBondContact OD1-CB 3.3Å; N556-N581 PolarHBondContact OD1-ND2 3.33Å
557	N	97.3	Very high	94.1	Very high	78.5 Å²	78.5	26.9 Å²	26.9	42%	0.42	14%	0.138	S	C	.	.	S	Bend	trans	55.8	49.1	-178.3	-167.8	30.8	0	0	0	112.7	N533 N581 N582 S583	N533-N557 VanDerWaalsContact CA-O 3.24Å; N533-N557 WeakPolarHBondContact CA-O 3.38Å; N533-N557 PolarHBondContact N-O 3.05Å; N533-N557 WeakPolarHBondContact OD1-CB 3.15Å; N533-N557 PolarHBondContact OD1-ND2 2.95Å; N557-N581 PolarHBondContact N-O 3.37Å; N557-N582 VanDerWaalsContact CA-O 3.31Å; N557-N582 WeakPolarHBondContact CA-O 3.25Å; N557-S583 PolarHBondContact N-OG 2.82Å
558	V	98	Very high	94.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.128	C	C	.	.			trans	-107.7	138.3	-178.8	-173.1	0	0	0	0	109.9	V531 S534 L555 N556 I560 S583 F584	V531-V558 HydrophobicContact CB-CG2 4.09Å; V531-V558 HydrophobicContact CG1-CG1 4.08Å; V531-V558 HydrophobicContact CG1-CG2 3.78Å; V531-V558 WeakPolarHBondContact O-CG2 3.37Å; S534-V558 WeakPolarHBondContact O-CA 3.36Å; S534-V558 WeakPolarHBondContact O-CG1 3.24Å; L555-V558 HydrophobicContact CB-CG2 4.13Å; N556-V558 PolarHBondContact O-N 3.36Å; V558-I560 HydrophobicContact CG1-CD1 4.15Å; V558-I560 HydrophobicContact CG1-CG1 3.73Å; V558-S583 PolarHBondContact N-OG 3.24Å; V558-S583 VanDerWaalsContact N-OG 3.13Å; V558-S583 CarbonylContact O-C 3.55Å; V558-S583 VanDerWaalsContact O-CA 3.3Å; V558-S583 WeakPolarHBondContact O-CA 3.39Å; V558-S583 WeakPolarHBondContact O-CB 3.31Å; V558-F584 PolarHBondContact O-N 3.24Å
559	T	98.3	Very high	94.6	Very high	27.5 Å²	27.5	23.7 Å²	23.7	17%	0.169	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.2	169	-53	0	0	0	0	109.4	S534 R535 V536 F584 M586	S534-T559 PolarHBondContact O-N 3.18Å; R535-T559 CarbonylContact C-O 3.39Å; R535-T559 WeakPolarHBondContact CA-O 3.24Å; V536-T559 PolarHBondContact N-O 3.3Å; T559-F584 CarbonylContact C-O 3.56Å; T559-F584 WeakPolarHBondContact CA-O 3.29Å; T559-F584 HydrophobicContact CG2-CB 4.35Å; T559-M586 HydrophobicContact CG2-CE 4.01Å
560	I	98.3	Very high	94.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	103.6	178.9	-55.9	179.5	0	0	0	107.8	V536 I544 L555 V558 N563 V569 F584 I585 M586 N588	V536-I560 HydrophobicContact CB-CG1 4.46Å; V536-I560 WeakPolarHBondContact O-CA 3.43Å; I544-I560 HydrophobicContact CD1-CD1 3.67Å; I544-I560 HydrophobicContact CG1-CD1 4.12Å; L555-I560 HydrophobicContact CD1-CD1 3.99Å; V558-I560 HydrophobicContact CG1-CD1 4.15Å; V558-I560 HydrophobicContact CG1-CG1 3.73Å; I560-N563 WeakPolarHBondContact CG2-ND2 3.43Å; I560-V569 HydrophobicContact CD1-CG2 3.35Å; I560-F584 PolarHBondContact N-O 3.03Å; I560-I585 HydrophobicContact CB-CG1 4.37Å; I560-I585 HydrophobicContact CB-CG2 4.48Å; I560-I585 HydrophobicContact CD1-CG1 4.47Å; I560-I585 CarbonylContact O-C 3.51Å; I560-I585 VanDerWaalsContact O-CA 3.32Å; I560-I585 WeakPolarHBondContact O-CA 3.32Å; I560-M586 PolarHBondContact O-N 2.84Å; I560-N588 PolarHBondContact O-ND2 2.78Å
561	S	97.9	Very high	95.3	Very high	21 Å²	21	21.4 Å²	21.4	15%	0.147	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	149.4	-173	63.4	0	0	0	0	116.1	V536 C537 N538 N563 M586	V536-S561 PolarHBondContact O-N 3.39Å; C537-S561 CarbonylContact C-O 3.36Å; C537-S561 WeakPolarHBondContact CA-O 3.23Å; C537-S561 WeakPolarHBondContact CB-O 3.17Å; C537-S561 PolarHBondContact SG-OG 2.87Å; N538-S561 PolarHBondContact N-O 3.38Å; S561-N563 VanDerWaalsContact C-N 3.26Å; S561-N563 PolarHBondContact N-ND2 3.14Å; S561-N563 PolarHBondContact O-N 2.83Å; S561-N563 VanDerWaalsContact O-N 3.14Å; S561-N563 PolarHBondContact O-ND2 3.07Å; S561-M586 WeakPolarHBondContact CA-O 3.48Å; S561-M586 WeakPolarHBondContact CB-O 3.48Å
562	G	96.1	Very high	95.5	Very high	15.5 Å²	15.5	23.9 Å²	23.9	16%	0.16	13%	0.125	C	C	.	.			trans	69.5	14.1	174.3	0	0	0	0	0	114.9	N538 Q564 M586 D587	N538-G562 WeakPolarHBondContact CA-O 3.35Å; G562-Q564 WeakPolarHBondContact O-CG 3.48Å; G562-M586 PolarHBondContact N-O 3.02Å; G562-D587 WeakPolarHBondContact CA-O 3.39Å; G562-D587 PolarHBondContact N-O 3.25Å
563	N	96.5	Very high	95.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.119	C	C	.	.			trans	-78	139.4	179.5	-56	-75.1	0	0	0	110.5	V536 N539 G543 I560 S561 N588 W589	V536-N563 PolarHBondContact O-ND2 3.14Å; V536-N563 VanDerWaalsContact O-ND2 3.15Å; N539-N563 WeakPolarHBondContact CB-OD1 3.29Å; N539-N563 PolarHBondContact N-OD1 3.23Å; N539-N563 PolarHBondContact ND2-OD1 3.1Å; N539-N563 CarbonylContact O-C 3.58Å; N539-N563 WeakPolarHBondContact O-CA 3.43Å; G543-N563 VanDerWaalsContact CA-CG 3.46Å; G543-N563 WeakPolarHBondContact CA-OD1 3.16Å; I560-N563 WeakPolarHBondContact CG2-ND2 3.43Å; S561-N563 VanDerWaalsContact C-N 3.26Å; S561-N563 PolarHBondContact N-ND2 3.14Å; S561-N563 PolarHBondContact O-N 2.83Å; S561-N563 VanDerWaalsContact O-N 3.14Å; S561-N563 PolarHBondContact O-ND2 3.07Å; N563-N588 WeakPolarHBondContact CB-OD1 3.3Å; N563-N588 PolarHBondContact N-OD1 2.79Å; N563-N588 PolarHBondContact ND2-OD1 3.22Å; N563-N588 VanDerWaalsContact ND2-OD1 3.16Å; N563-W589 PolarHBondContact O-N 2.9Å
564	Q	92.2	Very high	95.2	Very high	99.5 Å²	99.5	22.4 Å²	22.4	47%	0.465	12%	0.119	S	C	.	.			trans	-105.1	19.4	-160.4	-57.7	-173.7	4.8	0	0	115.5	R136 N539 G540 G541 G562	R136-Q564 PolarHBondContact NH1-O 2.98Å; R136-Q564 PolarHBondContact NH2-O 3.05Å; N539-Q564 PolarHBondContact O-N 3.08Å; G540-Q564 CarbonylContact O-C 3.59Å; G540-Q564 WeakPolarHBondContact O-CB 3.35Å; G541-Q564 PolarHBondContact O-N 2.74Å; G562-Q564 WeakPolarHBondContact O-CG 3.48Å
565	H	90.4	Very high	94.9	Very high	47.5 Å²	47.5	22.4 Å²	22.4	22%	0.22	12%	0.119	C	C	.	.	S	Bend	trans	-119.2	-156.3	178.7	-160.9	43.7	0	0	0	112.8	V138 D139 G541 S542 A567 G590	V138-H565 VanDerWaalsContact CG2-CE1 3.45Å; V138-H565 WeakPolarHBondContact CG2-CE1 3.48Å; D139-H565 IonicContact OD1-CE1 2.71Å; D139-H565 PolarHBondContact OD1-CE1 3.24Å; D139-H565 IonicContact OD1-NE2 3.77Å; D139-H565 PolarHBondContact OD1-NE2 3.18Å; G541-H565 WeakPolarHBondContact O-CB 3.48Å; G541-H565 PolarHBondContact O-N 3.18Å; S542-H565 PolarHBondContact OG-CD2 3.27Å; H565-A567 VanDerWaalsContact C-N 3.33Å; H565-A567 PolarHBondContact O-N 3.26Å; H565-G590 WeakPolarHBondContact O-CA 3.39Å; H565-G590 PolarHBondContact O-N 2.85Å; H565-G590 VanDerWaalsContact O-N 3.09Å
566	T	90.1	Very high	94.5	Very high	38 Å²	38	22.5 Å²	22.5	23%	0.233	12%	0.12	C	C	.	.	S	Bend	trans	-55.9	-37	-171.8	-52	0	0	0	0	114.7	G590 D591	T566-G590 CarbonylContact O-C 3.51Å; T566-G590 VanDerWaalsContact O-CA 3.26Å; T566-G590 WeakPolarHBondContact O-CA 3.46Å; T566-D591 PolarHBondContact O-N 2.85Å
567	A	94.9	Very high	94.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	162.5	174	0	0	0	0	0	113.3	S542 G543 H565 V569 H570 D591 N594	S542-A567 WeakPolarHBondContact CA-O 3.19Å; S542-A567 WeakPolarHBondContact CB-O 3.29Å; S542-A567 PolarHBondContact OG-O 3.19Å; G543-A567 PolarHBondContact N-O 3.01Å; H565-A567 VanDerWaalsContact C-N 3.33Å; H565-A567 PolarHBondContact O-N 3.26Å; A567-V569 WeakPolarHBondContact CB-O 3.44Å; A567-H570 HydrophobicContact CB-CB 4.08Å; A567-D591 CarbonylContact C-O 3.56Å; A567-D591 WeakPolarHBondContact CA-O 3.35Å; A567-D591 HydrophobicContact CB-CB 4.17Å; A567-D591 VanDerWaalsContact CB-O 3.26Å; A567-D591 WeakPolarHBondContact CB-O 3.27Å; A567-N594 HydrophobicContact CB-CB 3.72Å
568	G	96.9	Very high	94.2	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	-51.9	165.4	0	0	0	0	0	111.1	G543 I544 D591 G592	G543-G568 CarbonylContact C-O 3.37Å; G543-G568 VanDerWaalsContact CA-O 3.25Å; G543-G568 WeakPolarHBondContact CA-O 3.41Å; G543-G568 PolarHBondContact N-O 3.28Å; G543-G568 VanDerWaalsContact N-O 3.12Å; I544-G568 PolarHBondContact N-O 3.16Å; G568-D591 PolarHBondContact N-O 3.4Å; G568-G592 CarbonylContact C-O 3.59Å; G568-G592 WeakPolarHBondContact CA-O 3.16Å; G568-G592 PolarHBondContact N-O 3Å
569	V	98	Very high	94.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	114.6	169.9	-177.5	0	0	0	0	108.7	I544 L555 I560 A567 I571 I585 G592 V593 N594	I544-V569 CarbonylContact O-C 3.58Å; I544-V569 WeakPolarHBondContact O-CA 3.27Å; L555-V569 HydrophobicContact CD1-CG1 4.37Å; L555-V569 HydrophobicContact CD1-CG2 3.66Å; I560-V569 HydrophobicContact CD1-CG2 3.35Å; A567-V569 WeakPolarHBondContact CB-O 3.44Å; V569-I571 HydrophobicContact CG1-CG1 4.43Å; V569-I585 HydrophobicContact CG2-CD1 4.09Å; V569-G592 PolarHBondContact N-O 3.19Å; V569-V593 HydrophobicContact CB-CB 4.48Å; V569-V593 HydrophobicContact CB-CG1 4.26Å; V569-V593 HydrophobicContact CB-CG2 4.2Å; V569-V593 HydrophobicContact CG1-CG1 4.46Å; V569-V593 HydrophobicContact CG2-CG2 4.42Å; V569-V593 CarbonylContact O-C 3.53Å; V569-V593 WeakPolarHBondContact O-CA 3.44Å; V569-N594 PolarHBondContact O-N 3.09Å
570	H	97.1	Very high	94.1	Very high	17 Å²	17	20.2 Å²	20.2	8%	0.079	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.1	-178.1	-175.5	-164.4	0	0	0	110.1	I544 Y545 L546 A567 N594	I544-H570 PolarHBondContact O-N 3.29Å; Y545-H570 CarbonylContact C-O 3.51Å; Y545-H570 WeakPolarHBondContact CA-O 3.48Å; Y545-H570 HydrophobicContact CD2-CB 4.03Å; Y545-H570 AromaticContact CD2-CG 3.82Å; Y545-H570 AromaticContact CD2-ND1 3.47Å; Y545-H570 WeakPolarHBondContact CD2-ND1 3.01Å; Y545-H570 AromaticContact CE2-CE1 3.83Å; Y545-H570 AromaticContact CE2-ND1 3.61Å; L546-H570 PolarHBondContact N-O 3Å; A567-H570 HydrophobicContact CB-CB 4.08Å; H570-N594 CarbonylContact C-O 3.48Å; H570-N594 WeakPolarHBondContact CA-O 3.29Å
571	I	95.7	Very high	94	Very high	4.5 Å²	4.5	21.8 Å²	21.8	2%	0.023	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119.5	173.9	-50.3	-167.4	0	0	0	109.1	L546 V549 V569 L578 N594 V595 S596	L546-I571 HydrophobicContact CB-CB 4.35Å; L546-I571 HydrophobicContact CB-CG1 4.05Å; L546-I571 HydrophobicContact CB-CG2 4.22Å; L546-I571 HydrophobicContact CD1-CD1 3.81Å; L546-I571 HydrophobicContact CD1-CG1 3.88Å; L546-I571 HydrophobicContact CG-CG1 4.42Å; L546-I571 CarbonylContact O-C 3.56Å; L546-I571 WeakPolarHBondContact O-CA 3.31Å; V549-I571 HydrophobicContact CG2-CG2 3.74Å; V569-I571 HydrophobicContact CG1-CG1 4.43Å; I571-L578 HydrophobicContact CD1-CB 4.18Å; I571-L578 HydrophobicContact CD1-CD1 4.05Å; I571-L578 HydrophobicContact CD1-CD2 3.78Å; I571-L578 HydrophobicContact CD1-CG 4.21Å; I571-N594 PolarHBondContact N-O 2.96Å; I571-V595 HydrophobicContact CB-CB 4.43Å; I571-V595 HydrophobicContact CB-CG1 4.09Å; I571-V595 HydrophobicContact CB-CG2 4.21Å; I571-V595 HydrophobicContact CD1-CG2 4.13Å; I571-V595 HydrophobicContact CG1-CG2 4.12Å; I571-V595 HydrophobicContact CG2-CG1 4.42Å; I571-S596 PolarHBondContact O-N 3.33Å
572	F	92.9	Very high	93.9	Very high	74 Å²	74	24.2 Å²	24.2	33%	0.325	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	110.2	-178.5	-170.2	-98.4	0	0	0	111	Y545 L546 Q547 D548	Y545-F572 HydrophobicContact CE2-CB 4.01Å; L546-F572 PolarHBondContact O-N 3.25Å; Q547-F572 VanDerWaalsContact CA-O 3.31Å; Q547-F572 WeakPolarHBondContact CA-O 3.4Å; Q547-F572 WeakPolarHBondContact CG-O 3.5Å; D548-F572 PolarHBondContact N-O 2.99Å
573	G	90.3	Very high	94	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.9	172.5	-176.2	0	0	0	0	0	114.2	S596 H597	G573-S596 WeakPolarHBondContact CA-O 3.35Å; G573-S596 PolarHBondContact N-O 3.2Å; G573-H597 WeakPolarHBondContact O-CB 3.39Å
574	G	89.4	Confident	94	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.2	-166.6	-179.1	0	0	0	0	0	115.4	V549 H597 C598	V549-G574 CarbonylContact O-C 3.58Å; V549-G574 VanDerWaalsContact O-CA 3.26Å; V549-G574 WeakPolarHBondContact O-CA 3.26Å; G574-H597 WeakPolarHBondContact O-CB 3.26Å; G574-C598 PolarHBondContact O-N 2.95Å; G574-C598 VanDerWaalsContact O-N 3.08Å
575	V	89.5	Confident	94.3	Very high	0.5 Å²	0.5	22.8 Å²	22.8	0%	0.003	11%	0.11	C	C	.	.			trans	-150.2	60.4	-179.5	-12.2	0	0	0	0	110.5	P483 V549 R550 C598 G599 F627 P629	P483-V575 HydrophobicContact CB-CB 4.23Å; P483-V575 HydrophobicContact CB-CG1 4.33Å; P483-V575 HydrophobicContact CB-CG2 4.05Å; P483-V575 WeakPolarHBondContact CB-O 3.2Å; P483-V575 HydrophobicContact CG-CG2 4.23Å; V549-V575 CarbonylContact O-C 3.55Å; V549-V575 PolarHBondContact O-N 3.06Å; R550-V575 CarbonylContact C-O 3.45Å; R550-V575 WeakPolarHBondContact CA-O 3.14Å; R550-V575 HydrophobicContact CG-CG2 4.12Å; V575-C598 HydrophobicContact CG1-CB 3.7Å; V575-G599 CarbonylContact C-O 3.58Å; V575-G599 VanDerWaalsContact CA-O 3.29Å; V575-G599 WeakPolarHBondContact CA-O 3.39Å; V575-F627 HydrophobicContact CB-CB 4.2Å; V575-F627 HydrophobicContact CG1-CB 3.87Å; V575-F627 HydrophobicContact CG1-CD1 3.74Å; V575-F627 HydrophobicContact CG1-CG 4.33Å; V575-F627 HydrophobicContact CG2-CD1 4.03Å; V575-P629 HydrophobicContact CG1-CB 4.13Å; V575-P629 HydrophobicContact CG2-CB 4.13Å
576	G	88	Confident	94.7	Very high	3.5 Å²	3.5	22.4 Å²	22.4	4%	0.036	11%	0.108	C	C	.	.			trans	-118	162.7	-173.7	0	0	0	0	0	113.8	V549 H597 G599	V549-G576 PolarHBondContact O-N 2.84Å; G576-H597 PolarHBondContact O-NE2 2.78Å; G576-G599 PolarHBondContact N-O 2.96Å
577	D	93.1	Very high	95	Very high	32.5 Å²	32.5	24.1 Å²	24.1	17%	0.174	12%	0.116	C	C	.	.			trans	-84.5	140.1	173.8	-67.7	-18.8	0	0	0	110	R552 T553 S601	R552-D577 CarbonylContact C-O 3.51Å; R552-D577 WeakPolarHBondContact CA-O 3.44Å; R552-D577 HydrophobicContact CB-CB 4.09Å; R552-D577 HydrophobicContact CG-CB 3.77Å; R552-D577 IonicContact CZ-OD2 3.02Å; R552-D577 IonicContact NE-OD2 3.4Å; R552-D577 PolarHBondContact NE-OD2 3.25Å; R552-D577 VanDerWaalsContact NE-OD2 3.11Å; R552-D577 IonicContact NH2-OD2 3.18Å; R552-D577 PolarHBondContact NH2-OD2 3.14Å; T553-D577 PolarHBondContact N-O 2.81Å; D577-S601 CarbonylContact C-O 3.5Å; D577-S601 VanDerWaalsContact CA-O 3.23Å; D577-S601 WeakPolarHBondContact CA-O 3.22Å; D577-S601 WeakPolarHBondContact CB-O 3.4Å; D577-S601 WeakPolarHBondContact OD1-CB 3.34Å; D577-S601 PolarHBondContact OD1-N 3.21Å
578	L	95.4	Very high	95.1	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.7	174.6	172.2	62.7	0	0	0	110	T553 I571 I580 V593 V595 S601 L602 V603	T553-L578 HydrophobicContact CG2-CD1 3.87Å; I571-L578 HydrophobicContact CD1-CB 4.18Å; I571-L578 HydrophobicContact CD1-CD1 4.05Å; I571-L578 HydrophobicContact CD1-CD2 3.78Å; I571-L578 HydrophobicContact CD1-CG 4.21Å; L578-I580 HydrophobicContact CD1-CD1 4.39Å; L578-I580 HydrophobicContact CD1-CG1 4.03Å; L578-I580 HydrophobicContact CD2-CD1 4.14Å; L578-I580 HydrophobicContact CD2-CG1 4.46Å; L578-I580 HydrophobicContact CG-CD1 4.31Å; L578-I580 HydrophobicContact CG-CG1 4.08Å; L578-V593 HydrophobicContact CD2-CG1 4.13Å; L578-V595 HydrophobicContact CD2-CG2 3.68Å; L578-S601 PolarHBondContact N-O 3.06Å; L578-L602 HydrophobicContact CB-CG 4.35Å; L578-L602 CarbonylContact O-C 3.57Å; L578-L602 VanDerWaalsContact O-CA 3.32Å; L578-L602 WeakPolarHBondContact O-CA 3.37Å; L578-V603 PolarHBondContact O-N 2.9Å
579	W	95.7	Very high	94.9	Very high	68 Å²	68	28 Å²	28	26%	0.258	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.2	176.7	-69.1	4.9	0	0	0	110.5	R552 T553 A554 L555 V603	R552-W579 VanDerWaalsContact NH1-CZ2 3.27Å; T553-W579 PolarHBondContact O-N 3.04Å; A554-W579 CarbonylContact C-O 3.22Å; A554-W579 WeakPolarHBondContact CA-O 3.16Å; L555-W579 PolarHBondContact N-O 3.08Å; W579-V603 CarbonylContact C-O 3.53Å; W579-V603 WeakPolarHBondContact CA-O 3.27Å; W579-V603 HydrophobicContact CG-CB 4.4Å
580	I	97.3	Very high	94.6	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.2	177.4	-49.6	-177.9	0	0	0	108	L555 L578 I585 V593 V603 V604 N605 T607	L555-I580 HydrophobicContact CB-CG2 4.34Å; L555-I580 HydrophobicContact CD1-CD1 4.36Å; L555-I580 HydrophobicContact CD1-CG1 4.17Å; L555-I580 WeakPolarHBondContact O-CA 3.39Å; L578-I580 HydrophobicContact CD1-CD1 4.39Å; L578-I580 HydrophobicContact CD1-CG1 4.03Å; L578-I580 HydrophobicContact CD2-CD1 4.14Å; L578-I580 HydrophobicContact CD2-CG1 4.46Å; L578-I580 HydrophobicContact CG-CD1 4.31Å; L578-I580 HydrophobicContact CG-CG1 4.08Å; I580-I585 HydrophobicContact CD1-CD1 4.08Å; I580-I585 HydrophobicContact CG2-CD1 4.14Å; I580-V593 HydrophobicContact CD1-CG1 4.3Å; I580-V593 HydrophobicContact CD1-CG2 3.79Å; I580-V603 PolarHBondContact N-O 3.01Å; I580-V604 HydrophobicContact CB-CG2 4.42Å; I580-V604 HydrophobicContact CD1-CG2 4.42Å; I580-V604 WeakPolarHBondContact O-CA 3.25Å; I580-N605 PolarHBondContact O-N 3.27Å; I580-T607 HydrophobicContact CG2-CG2 3.76Å; I580-T607 PolarHBondContact O-OG1 2.84Å
581	N	95.9	Very high	94.6	Very high	34.5 Å²	34.5	27.3 Å²	27.3	18%	0.184	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.1	-176.4	-59.1	-48.2	0	0	0	110.8	L555 N556 N557 S583 N605	L555-N581 PolarHBondContact O-N 3.23Å; N556-N581 WeakPolarHBondContact CA-O 3.23Å; N556-N581 WeakPolarHBondContact OD1-CB 3.3Å; N556-N581 PolarHBondContact OD1-ND2 3.33Å; N557-N581 PolarHBondContact N-O 3.37Å; N581-S583 PolarHBondContact O-N 3.1Å; N581-S583 PolarHBondContact O-OG 3.17Å; N581-N605 CarbonylContact C-O 3.53Å; N581-N605 VanDerWaalsContact CA-O 3.28Å; N581-N605 WeakPolarHBondContact CA-O 3.4Å
582	N	96.2	Very high	94.6	Very high	72 Å²	72	27.1 Å²	27.1	39%	0.385	13%	0.127	S	C	.	.	S	Bend	trans	50	34.9	170.8	-61.7	-19.2	0	0	0	113.9	N557 N605 G606 T607 T647	N557-N582 VanDerWaalsContact CA-O 3.31Å; N557-N582 WeakPolarHBondContact CA-O 3.25Å; N582-N605 PolarHBondContact N-O 2.81Å; N582-G606 VanDerWaalsContact CA-O 3.26Å; N582-G606 WeakPolarHBondContact CA-O 3.45Å; N582-T607 PolarHBondContact N-OG1 3.16Å; N582-T647 WeakPolarHBondContact OD1-CB 3.3Å; N582-T647 WeakPolarHBondContact OD1-CG2 3.38Å; N582-T647 PolarHBondContact OD1-OG1 3.22Å
583	S	97.8	Very high	94.9	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.007	11%	0.111	C	C	.	.			trans	-109.1	161.8	-171.1	-65.2	0	0	0	0	112.1	N557 V558 N581 T607 Q608	N557-S583 PolarHBondContact N-OG 2.82Å; V558-S583 PolarHBondContact N-OG 3.24Å; V558-S583 VanDerWaalsContact N-OG 3.13Å; V558-S583 CarbonylContact O-C 3.55Å; V558-S583 VanDerWaalsContact O-CA 3.3Å; V558-S583 WeakPolarHBondContact O-CA 3.39Å; V558-S583 WeakPolarHBondContact O-CB 3.31Å; N581-S583 PolarHBondContact O-N 3.1Å; N581-S583 PolarHBondContact O-OG 3.17Å; S583-T607 PolarHBondContact N-OG1 3.26Å; S583-T607 CarbonylContact O-C 3.42Å; S583-T607 VanDerWaalsContact O-CA 3.31Å; S583-T607 WeakPolarHBondContact O-CA 3.43Å; S583-T607 VanDerWaalsContact O-CG2 3.28Å; S583-T607 WeakPolarHBondContact O-CG2 3.28Å; S583-Q608 PolarHBondContact O-N 2.86Å
584	F	98.1	Very high	95.2	Very high	83 Å²	83	24.3 Å²	24.3	36%	0.364	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	112.5	176.6	-63.8	-86.2	0	0	0	109.2	V558 T559 I560 M586 Q608	V558-F584 PolarHBondContact O-N 3.24Å; T559-F584 CarbonylContact C-O 3.56Å; T559-F584 WeakPolarHBondContact CA-O 3.29Å; T559-F584 HydrophobicContact CG2-CB 4.35Å; I560-F584 PolarHBondContact N-O 3.03Å; F584-M586 HydrophobicContact CB-CE 4.04Å; F584-M586 HydrophobicContact CB-SD 4.48Å; F584-Q608 WeakPolarHBondContact CA-O 3.33Å; F584-Q608 HydrophobicContact CD1-CB 3.92Å; F584-Q608 HydrophobicContact CD1-CG 4.44Å; F584-Q608 HydrophobicContact CE1-CB 4.26Å
585	I	98.3	Very high	95.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	97.7	-179.6	-55.3	179.9	0	0	0	107.9	I560 V569 I580 G592 V593 T607 Q608 I609 S610 N612	I560-I585 HydrophobicContact CB-CG1 4.37Å; I560-I585 HydrophobicContact CB-CG2 4.48Å; I560-I585 HydrophobicContact CD1-CG1 4.47Å; I560-I585 CarbonylContact O-C 3.51Å; I560-I585 VanDerWaalsContact O-CA 3.32Å; I560-I585 WeakPolarHBondContact O-CA 3.32Å; V569-I585 HydrophobicContact CG2-CD1 4.09Å; I580-I585 HydrophobicContact CD1-CD1 4.08Å; I580-I585 HydrophobicContact CG2-CD1 4.14Å; I585-G592 VanDerWaalsContact CG2-O 3.31Å; I585-G592 WeakPolarHBondContact CG2-O 3.37Å; I585-V593 HydrophobicContact CD1-CG2 3.49Å; I585-V593 VanDerWaalsContact CD1-CG2 3.49Å; I585-V593 HydrophobicContact CG2-CG2 4.47Å; I585-T607 HydrophobicContact CD1-CG2 4.49Å; I585-Q608 PolarHBondContact N-O 3.1Å; I585-I609 HydrophobicContact CB-CG1 4.44Å; I585-I609 HydrophobicContact CB-CG2 4.44Å; I585-I609 CarbonylContact O-C 3.58Å; I585-I609 VanDerWaalsContact O-CA 3.29Å; I585-I609 WeakPolarHBondContact O-CA 3.29Å; I585-S610 PolarHBondContact O-N 2.87Å; I585-N612 PolarHBondContact O-ND2 3.06Å
586	M	97.8	Very high	95.6	Very high	39.5 Å²	39.5	25.1 Å²	25.1	20%	0.195	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	155.2	-166.4	61.8	-171.5	164.7	0	0	115.3	T559 I560 S561 G562 F584 N588 S610 R611	T559-M586 HydrophobicContact CG2-CE 4.01Å; I560-M586 PolarHBondContact O-N 2.84Å; S561-M586 WeakPolarHBondContact CA-O 3.48Å; S561-M586 WeakPolarHBondContact CB-O 3.48Å; G562-M586 PolarHBondContact N-O 3.02Å; F584-M586 HydrophobicContact CB-CE 4.04Å; F584-M586 HydrophobicContact CB-SD 4.48Å; M586-N588 PolarHBondContact N-ND2 3.24Å; M586-N588 PolarHBondContact O-N 3.2Å; M586-N588 VanDerWaalsContact O-N 3.08Å; M586-N588 PolarHBondContact O-ND2 3.14Å; M586-S610 CarbonylContact C-O 3.51Å; M586-S610 WeakPolarHBondContact CA-O 3.33Å; M586-S610 VanDerWaalsContact CB-O 3.29Å; M586-S610 WeakPolarHBondContact CB-O 3.46Å; M586-S610 WeakPolarHBondContact CB-OG 3.37Å; M586-R611 PolarHBondContact SD-NH2 3.08Å
587	D	97.1	Very high	95.8	Very high	73.5 Å²	73.5	25 Å²	25	39%	0.393	12%	0.119	S	C	.	.	S	Bend	trans	57.4	26.6	173.8	-52.8	-66.9	0	0	0	113.2	G562 S610 R611	G562-D587 WeakPolarHBondContact CA-O 3.39Å; G562-D587 PolarHBondContact N-O 3.25Å; D587-S610 PolarHBondContact N-O 2.89Å; D587-S610 VanDerWaalsContact N-O 3.16Å; D587-R611 WeakPolarHBondContact CA-O 3.29Å; D587-R611 PolarHBondContact N-O 3.27Å; D587-R611 VanDerWaalsContact OD1-CB 3.29Å; D587-R611 WeakPolarHBondContact OD1-CB 3.43Å; D587-R611 IonicContact OD1-CZ 3.23Å; D587-R611 IonicContact OD1-NE 3.71Å; D587-R611 PolarHBondContact OD1-NE 2.92Å; D587-R611 IonicContact OD1-NH2 3.56Å; D587-R611 IonicContact OD2-CZ 2.68Å; D587-R611 IonicContact OD2-NE 3.02Å; D587-R611 PolarHBondContact OD2-NE 3.15Å; D587-R611 IonicContact OD2-NH2 2.91Å; D587-R611 PolarHBondContact OD2-NH2 3.14Å
588	N	96.6	Very high	95.5	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	11%	0.112	C	C	.	.			trans	-82.4	149.4	174.8	-57.6	-76.5	0	0	0	110.5	I560 N563 M586 N612 R613	I560-N588 PolarHBondContact O-ND2 2.78Å; N563-N588 WeakPolarHBondContact CB-OD1 3.3Å; N563-N588 PolarHBondContact N-OD1 2.79Å; N563-N588 PolarHBondContact ND2-OD1 3.22Å; N563-N588 VanDerWaalsContact ND2-OD1 3.16Å; M586-N588 PolarHBondContact N-ND2 3.24Å; M586-N588 PolarHBondContact O-N 3.2Å; M586-N588 VanDerWaalsContact O-N 3.08Å; M586-N588 PolarHBondContact O-ND2 3.14Å; N588-N612 WeakPolarHBondContact CB-OD1 3.37Å; N588-N612 PolarHBondContact N-OD1 3.33Å; N588-N612 PolarHBondContact ND2-OD1 3.11Å; N588-N612 WeakPolarHBondContact O-CA 3.23Å; N588-R613 PolarHBondContact O-N 3.06Å; N588-R613 VanDerWaalsContact O-N 3.12Å
589	W	92.6	Very high	95.2	Very high	82 Å²	82	23.5 Å²	23.5	31%	0.311	11%	0.111	S	C	.	.	S	Bend	trans	-71.3	-33.6	-176.3	-170.7	86.6	0	0	0	113.3	K155 W156 T195 N563 R613	K155-W589 HydrophobicContact CB-CZ2 4.33Å; W156-W589 HydrophobicContact CB-CH2 4.11Å; W156-W589 HydrophobicContact CB-CZ2 3.98Å; W156-W589 WeakPolarHBondContact O-CH2 3.44Å; W156-W589 WeakPolarHBondContact O-CZ2 3.4Å; T195-W589 HydrophobicContact CG2-CH2 3.7Å; T195-W589 HydrophobicContact CG2-CZ2 4.07Å; T195-W589 HydrophobicContact CG2-CZ3 4.45Å; N563-W589 PolarHBondContact O-N 2.9Å; W589-R613 VanDerWaalsContact O-CB 3.22Å; W589-R613 WeakPolarHBondContact O-CB 3.28Å
590	G	92.3	Very high	94.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-96.9	-141.7	173.6	0	0	0	0	0	112.7	H565 T566 M614	H565-G590 WeakPolarHBondContact O-CA 3.39Å; H565-G590 PolarHBondContact O-N 2.85Å; H565-G590 VanDerWaalsContact O-N 3.09Å; T566-G590 CarbonylContact O-C 3.51Å; T566-G590 VanDerWaalsContact O-CA 3.26Å; T566-G590 WeakPolarHBondContact O-CA 3.46Å; G590-M614 PolarHBondContact O-N 2.99Å
591	D	95.6	Very high	94.6	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.011	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	156.9	173.4	-63.2	-41.2	0	0	0	110.4	T566 A567 G568 N594 M614 R615	T566-D591 PolarHBondContact O-N 2.85Å; A567-D591 CarbonylContact C-O 3.56Å; A567-D591 WeakPolarHBondContact CA-O 3.35Å; A567-D591 HydrophobicContact CB-CB 4.17Å; A567-D591 VanDerWaalsContact CB-O 3.26Å; A567-D591 WeakPolarHBondContact CB-O 3.27Å; G568-D591 PolarHBondContact N-O 3.4Å; D591-N594 HydrophobicContact CB-CB 4.13Å; D591-N594 PolarHBondContact OD2-ND2 3.13Å; D591-M614 WeakPolarHBondContact OD1-CB 3.33Å; D591-R615 CarbonylContact C-O 3.56Å; D591-R615 VanDerWaalsContact CA-O 3.25Å; D591-R615 WeakPolarHBondContact CA-O 3.43Å; D591-R615 VanDerWaalsContact OD1-CB 3.29Å; D591-R615 WeakPolarHBondContact OD1-CB 3.42Å; D591-R615 PolarHBondContact OD1-N 3.05Å
592	G	97.3	Very high	94.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	-55.3	167.1	0	0	0	0	0	110.2	G568 V569 I585 R615 G616	G568-G592 CarbonylContact C-O 3.59Å; G568-G592 WeakPolarHBondContact CA-O 3.16Å; G568-G592 PolarHBondContact N-O 3Å; V569-G592 PolarHBondContact N-O 3.19Å; I585-G592 VanDerWaalsContact CG2-O 3.31Å; I585-G592 WeakPolarHBondContact CG2-O 3.37Å; G592-R615 PolarHBondContact N-O 3.25Å; G592-G616 CarbonylContact C-O 3.55Å; G592-G616 VanDerWaalsContact CA-O 3.26Å; G592-G616 WeakPolarHBondContact CA-O 3.29Å; G592-G616 PolarHBondContact N-O 3.11Å; G592-G616 VanDerWaalsContact N-O 3.16Å
593	V	98	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.1	177.4	-179.1	0	0	0	0	109.2	V569 L578 I580 I585 V595 I609 G616 F617 A618	V569-V593 HydrophobicContact CB-CB 4.48Å; V569-V593 HydrophobicContact CB-CG1 4.26Å; V569-V593 HydrophobicContact CB-CG2 4.2Å; V569-V593 HydrophobicContact CG1-CG1 4.46Å; V569-V593 HydrophobicContact CG2-CG2 4.42Å; V569-V593 CarbonylContact O-C 3.53Å; V569-V593 WeakPolarHBondContact O-CA 3.44Å; L578-V593 HydrophobicContact CD2-CG1 4.13Å; I580-V593 HydrophobicContact CD1-CG1 4.3Å; I580-V593 HydrophobicContact CD1-CG2 3.79Å; I585-V593 HydrophobicContact CD1-CG2 3.49Å; I585-V593 VanDerWaalsContact CD1-CG2 3.49Å; I585-V593 HydrophobicContact CG2-CG2 4.47Å; V593-V595 HydrophobicContact CG1-CG2 3.93Å; V593-I609 HydrophobicContact CG2-CD1 4.35Å; V593-G616 PolarHBondContact N-O 3.03Å; V593-F617 HydrophobicContact CB-CD2 3.62Å; V593-F617 HydrophobicContact CB-CE2 4.2Å; V593-F617 HydrophobicContact CB-CG 4.45Å; V593-F617 HydrophobicContact CG1-CD2 3.68Å; V593-F617 HydrophobicContact CG1-CE2 3.7Å; V593-F617 HydrophobicContact CG2-CD2 4.33Å; V593-F617 CarbonylContact O-C 3.56Å; V593-F617 WeakPolarHBondContact O-CA 3.41Å; V593-A618 PolarHBondContact O-N 3.1Å
594	N	96.1	Very high	94.5	Very high	14.5 Å²	14.5	17 Å²	17	8%	0.078	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	117	174.3	-170.7	-38.3	0	0	0	109.6	A567 V569 H570 I571 D591 S596 A618	A567-N594 HydrophobicContact CB-CB 3.72Å; V569-N594 PolarHBondContact O-N 3.09Å; H570-N594 CarbonylContact C-O 3.48Å; H570-N594 WeakPolarHBondContact CA-O 3.29Å; I571-N594 PolarHBondContact N-O 2.96Å; D591-N594 HydrophobicContact CB-CB 4.13Å; D591-N594 PolarHBondContact OD2-ND2 3.13Å; N594-S596 PolarHBondContact OD1-OG 3.29Å; N594-A618 WeakPolarHBondContact CA-O 3.29Å
595	V	95.7	Very high	94.3	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117.9	178.9	-178.3	0	0	0	0	109.8	I571 L578 V593 L602 A618 F619 H620	I571-V595 HydrophobicContact CB-CB 4.43Å; I571-V595 HydrophobicContact CB-CG1 4.09Å; I571-V595 HydrophobicContact CB-CG2 4.21Å; I571-V595 HydrophobicContact CD1-CG2 4.13Å; I571-V595 HydrophobicContact CG1-CG2 4.12Å; I571-V595 HydrophobicContact CG2-CG1 4.42Å; L578-V595 HydrophobicContact CD2-CG2 3.68Å; V593-V595 HydrophobicContact CG1-CG2 3.93Å; V595-L602 HydrophobicContact CB-CD2 3.97Å; V595-L602 HydrophobicContact CG1-CD2 3.85Å; V595-L602 HydrophobicContact CG2-CD2 3.96Å; V595-A618 PolarHBondContact N-O 2.89Å; V595-F619 HydrophobicContact CB-CD2 4.2Å; V595-F619 HydrophobicContact CG1-CD2 4.1Å; V595-F619 HydrophobicContact CG1-CE2 4.35Å; V595-F619 CarbonylContact O-C 3.6Å; V595-F619 WeakPolarHBondContact O-CA 3.33Å; V595-H620 PolarHBondContact O-N 3.11Å
596	S	92.9	Very high	94.1	Very high	18 Å²	18	15.6 Å²	15.6	13%	0.126	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	84.5	-178.4	-68.3	0	0	0	0	110.8	I571 G573 N594 H620	I571-S596 PolarHBondContact O-N 3.33Å; G573-S596 WeakPolarHBondContact CA-O 3.35Å; G573-S596 PolarHBondContact N-O 3.2Å; N594-S596 PolarHBondContact OD1-OG 3.29Å; S596-H620 VanDerWaalsContact CA-O 3.29Å; S596-H620 WeakPolarHBondContact CA-O 3.34Å
597	H	91.3	Very high	94.1	Very high	1.5 Å²	1.5	13.8 Å²	13.8	1%	0.007	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	177.6	-174.8	75.7	9.7	0	0	0	113.4	G573 G574 G576 G599 F619 H620 R622	G573-H597 WeakPolarHBondContact O-CB 3.39Å; G574-H597 WeakPolarHBondContact O-CB 3.26Å; G576-H597 PolarHBondContact O-NE2 2.78Å; H597-G599 VanDerWaalsContact CE1-C 3.48Å; H597-G599 PolarHBondContact CE1-O 2.83Å; H597-G599 PolarHBondContact ND1-N 3.12Å; H597-G599 PolarHBondContact NE2-O 2.81Å; H597-G599 PolarHBondContact O-N 2.92Å; H597-F619 AromaticContact CE1-CE2 3.74Å; H597-F619 AromaticContact ND1-CE2 3.68Å; H597-H620 PolarHBondContact N-O 3.12Å; H597-R622 CarbonylContact C-O 3.5Å; H597-R622 PolarHBondContact O-N 3.04Å; H597-R622 VanDerWaalsContact O-N 3.16Å
598	C	87.9	Confident	94.1	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.014	7%	0.066	C	C	.	.	S	Bend	trans	-69.9	-30.6	-171.1	-66.3	0	0	0	0	114.6	G574 V575 H621 R622 M624 F627 P629 F664	G574-C598 PolarHBondContact O-N 2.95Å; G574-C598 VanDerWaalsContact O-N 3.08Å; V575-C598 HydrophobicContact CG1-CB 3.7Å; C598-H621 PolarHBondContact O-CE1 3.19Å; C598-H621 VanDerWaalsContact O-CE1 3.25Å; C598-H621 PolarHBondContact O-ND1 3.17Å; C598-H621 VanDerWaalsContact O-ND1 3.12Å; C598-R622 WeakPolarHBondContact CA-O 3.35Å; C598-R622 PolarHBondContact N-O 3.27Å; C598-R622 PolarHBondContact SG-O 3.13Å; C598-M624 PolarHBondContact SG-N 2.99Å; C598-M624 VanDerWaalsContact SG-N 3.36Å; C598-F627 HydrophobicContact CB-CB 4.29Å; C598-P629 HydrophobicContact CB-CG 4.3Å; C598-F664 WeakPolarHBondContact O-CE2 3.38Å
599	G	87.9	Confident	94.1	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.065	C	C	.	.			trans	158.1	-173.3	-177.4	0	0	0	0	0	112	V575 G576 H597	V575-G599 CarbonylContact C-O 3.58Å; V575-G599 VanDerWaalsContact CA-O 3.29Å; V575-G599 WeakPolarHBondContact CA-O 3.39Å; G576-G599 PolarHBondContact N-O 2.96Å; H597-G599 VanDerWaalsContact CE1-C 3.48Å; H597-G599 PolarHBondContact CE1-O 2.83Å; H597-G599 PolarHBondContact ND1-N 3.12Å; H597-G599 PolarHBondContact NE2-O 2.81Å; H597-G599 PolarHBondContact O-N 2.92Å
600	G	89	Confident	94.3	Very high	4.5 Å²	4.5	8.5 Å²	8.5	5%	0.046	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.7	-172.2	-171.6	0	0	0	0	0	111.9	K631 F632 E633	G600-K631 WeakPolarHBondContact CA-O 3.31Å; G600-K631 PolarHBondContact N-O 2.95Å; G600-F632 WeakPolarHBondContact O-CA 3.37Å; G600-E633 PolarHBondContact O-N 3.28Å
601	S	92.1	Very high	94.6	Very high	7.33333 Å²	7.33333	12.8 Å²	12.8	5%	0.051	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.7	173.5	-175.3	0	0	0	0	111	D577 L578 E633	D577-S601 CarbonylContact C-O 3.5Å; D577-S601 VanDerWaalsContact CA-O 3.23Å; D577-S601 WeakPolarHBondContact CA-O 3.22Å; D577-S601 WeakPolarHBondContact CB-O 3.4Å; D577-S601 WeakPolarHBondContact OD1-CB 3.34Å; D577-S601 PolarHBondContact OD1-N 3.21Å; L578-S601 PolarHBondContact N-O 3.06Å; S601-E633 CarbonylContact C-O 3.39Å; S601-E633 VanDerWaalsContact CA-CG 3.47Å; S601-E633 WeakPolarHBondContact CA-O 3.36Å; S601-E633 WeakPolarHBondContact CB-OE1 3.33Å; S601-E633 WeakPolarHBondContact OG-CG 3.31Å; S601-E633 PolarHBondContact OG-OE1 3.47Å; S601-E633 PolarHBondContact OG-OE2 3.18Å
602	L	95.3	Very high	94.6	Very high	1.66667 Å²	1.66667	12.7 Å²	12.7	1%	0.009	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	114.6	177.7	-63.8	102.4	0	0	0	108.1	L578 V595 F617 F619 E633 V634 V635	L578-L602 HydrophobicContact CB-CG 4.35Å; L578-L602 CarbonylContact O-C 3.57Å; L578-L602 VanDerWaalsContact O-CA 3.32Å; L578-L602 WeakPolarHBondContact O-CA 3.37Å; V595-L602 HydrophobicContact CB-CD2 3.97Å; V595-L602 HydrophobicContact CG1-CD2 3.85Å; V595-L602 HydrophobicContact CG2-CD2 3.96Å; L602-F617 HydrophobicContact CD2-CZ 3.99Å; L602-F619 HydrophobicContact CD1-CD2 4.17Å; L602-F619 HydrophobicContact CD1-CE2 4.21Å; L602-F619 HydrophobicContact CD2-CD2 3.79Å; L602-F619 HydrophobicContact CD2-CE2 4.39Å; L602-E633 WeakPolarHBondContact CD1-O 3.22Å; L602-E633 PolarHBondContact N-O 3.08Å; L602-V634 HydrophobicContact CB-CG1 4.34Å; L602-V634 HydrophobicContact CB-CG2 4.38Å; L602-V634 HydrophobicContact CD1-CG2 4.09Å; L602-V634 CarbonylContact O-C 3.43Å; L602-V634 WeakPolarHBondContact O-CA 3.44Å; L602-V635 PolarHBondContact O-N 3.02Å
603	V	96	Very high	94.5	Very high	25 Å²	25	19.8 Å²	19.8	15%	0.152	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.2	-175.7	-174.8	0	0	0	0	109.7	L578 W579 I580 N605 V635	L578-V603 PolarHBondContact O-N 2.9Å; W579-V603 CarbonylContact C-O 3.53Å; W579-V603 WeakPolarHBondContact CA-O 3.27Å; W579-V603 HydrophobicContact CG-CB 4.4Å; I580-V603 PolarHBondContact N-O 3.01Å; V603-N605 WeakPolarHBondContact CG1-ND2 3.02Å; V603-V635 CarbonylContact C-O 3.5Å; V603-V635 WeakPolarHBondContact CA-O 3.42Å; V603-V635 HydrophobicContact CG1-CG1 4.4Å; V603-V635 HydrophobicContact CG2-CB 4.36Å
604	V	96.5	Very high	94.3	Very high	2.33333 Å²	2.33333	22.4 Å²	22.4	1%	0.014	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.1	176.7	-177.1	0	0	0	0	109	I580 T607 I609 F617 V635 F636 K637	I580-V604 HydrophobicContact CB-CG2 4.42Å; I580-V604 HydrophobicContact CD1-CG2 4.42Å; I580-V604 WeakPolarHBondContact O-CA 3.25Å; V604-T607 HydrophobicContact CG1-CG2 4.1Å; V604-I609 HydrophobicContact CG1-CD1 4.36Å; V604-F617 HydrophobicContact CG2-CE2 4.36Å; V604-V635 PolarHBondContact N-O 2.82Å; V604-F636 HydrophobicContact CB-CD1 3.71Å; V604-F636 HydrophobicContact CB-CE1 3.66Å; V604-F636 HydrophobicContact CB-CG 4.24Å; V604-F636 HydrophobicContact CB-CZ 4.14Å; V604-F636 HydrophobicContact CG1-CD1 3.94Å; V604-F636 HydrophobicContact CG1-CE1 3.79Å; V604-F636 HydrophobicContact CG2-CD1 4.31Å; V604-F636 HydrophobicContact CG2-CE1 3.79Å; V604-F636 HydrophobicContact CG2-CE2 4.35Å; V604-F636 HydrophobicContact CG2-CZ 3.81Å; V604-F636 WeakPolarHBondContact O-CA 3.33Å; V604-K637 PolarHBondContact O-N 3.04Å
605	N	94.4	Very high	94.2	Very high	42.6667 Å²	42.6667	23.8 Å²	23.8	23%	0.228	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.8	-177.3	-145.3	4.7	0	0	0	111.3	I580 N581 N582 V603 T607 K637	I580-N605 PolarHBondContact O-N 3.27Å; N581-N605 CarbonylContact C-O 3.53Å; N581-N605 VanDerWaalsContact CA-O 3.28Å; N581-N605 WeakPolarHBondContact CA-O 3.4Å; N582-N605 PolarHBondContact N-O 2.81Å; V603-N605 WeakPolarHBondContact CG1-ND2 3.02Å; N605-T607 PolarHBondContact O-N 3.24Å; N605-T607 PolarHBondContact O-OG1 3.1Å; N605-K637 WeakPolarHBondContact CA-O 3.35Å; N605-K637 WeakPolarHBondContact OD1-CB 3.5Å; N605-K637 PolarHBondContact OD1-O 3.14Å
606	G	94.2	Very high	94.2	Very high	11 Å²	11	23.8 Å²	23.8	11%	0.113	11%	0.11	C	C	.	.	S	Bend	trans	56.1	22.8	177.2	0	0	0	0	0	115.5	N582 T647 A648 T649	N582-G606 VanDerWaalsContact CA-O 3.26Å; N582-G606 WeakPolarHBondContact CA-O 3.45Å; G606-T647 WeakPolarHBondContact CA-OG1 3.31Å; G606-A648 CarbonylContact C-O 3.5Å; G606-A648 WeakPolarHBondContact CA-O 3.32Å; G606-T649 WeakPolarHBondContact CA-OG1 3.21Å; G606-T649 PolarHBondContact N-OG1 2.84Å
607	T	96.8	Very high	94.5	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.104	C	C	.	.			trans	-110.1	140	-166.5	-65.6	0	0	0	0	110.1	I580 N582 S583 I585 V604 N605 I609 T649 Y650	I580-T607 HydrophobicContact CG2-CG2 3.76Å; I580-T607 PolarHBondContact O-OG1 2.84Å; N582-T607 PolarHBondContact N-OG1 3.16Å; S583-T607 PolarHBondContact N-OG1 3.26Å; S583-T607 CarbonylContact O-C 3.42Å; S583-T607 VanDerWaalsContact O-CA 3.31Å; S583-T607 WeakPolarHBondContact O-CA 3.43Å; S583-T607 VanDerWaalsContact O-CG2 3.28Å; S583-T607 WeakPolarHBondContact O-CG2 3.28Å; I585-T607 HydrophobicContact CD1-CG2 4.49Å; V604-T607 HydrophobicContact CG1-CG2 4.1Å; N605-T607 PolarHBondContact O-N 3.24Å; N605-T607 PolarHBondContact O-OG1 3.1Å; T607-I609 HydrophobicContact CG2-CG1 3.94Å; T607-T649 PolarHBondContact N-OG1 2.93Å; T607-T649 WeakPolarHBondContact O-CA 3.34Å; T607-T649 WeakPolarHBondContact O-CG2 3.43Å; T607-Y650 PolarHBondContact O-N 3.14Å; T607-Y650 VanDerWaalsContact O-N 3.13Å
608	Q	96.8	Very high	94.7	Very high	45.6667 Å²	45.6667	22.9 Å²	22.9	21%	0.213	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119.7	173.6	177.6	170.4	-5.1	0	0	109.9	S583 F584 I585 S610 Y650	S583-Q608 PolarHBondContact O-N 2.86Å; F584-Q608 WeakPolarHBondContact CA-O 3.33Å; F584-Q608 HydrophobicContact CD1-CB 3.92Å; F584-Q608 HydrophobicContact CD1-CG 4.44Å; F584-Q608 HydrophobicContact CE1-CB 4.26Å; I585-Q608 PolarHBondContact N-O 3.1Å; Q608-S610 PolarHBondContact NE2-OG 2.85Å; Q608-Y650 CarbonylContact C-O 3.59Å; Q608-Y650 WeakPolarHBondContact CA-O 3.43Å
609	I	97.8	Very high	95.1	Very high	0.333333 Å²	0.333333	22.8 Å²	22.8	0%	0.002	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	97	177.3	-51.8	-179.9	0	0	0	108.5	I585 V593 V604 T607 N612 G616 F617 F636 Y650 V651 N652 N654	I585-I609 HydrophobicContact CB-CG1 4.44Å; I585-I609 HydrophobicContact CB-CG2 4.44Å; I585-I609 CarbonylContact O-C 3.58Å; I585-I609 VanDerWaalsContact O-CA 3.29Å; I585-I609 WeakPolarHBondContact O-CA 3.29Å; V593-I609 HydrophobicContact CG2-CD1 4.35Å; V604-I609 HydrophobicContact CG1-CD1 4.36Å; T607-I609 HydrophobicContact CG2-CG1 3.94Å; I609-N612 WeakPolarHBondContact CG2-ND2 3.48Å; I609-G616 VanDerWaalsContact CG2-CA 3.49Å; I609-G616 VanDerWaalsContact CG2-O 3.27Å; I609-G616 WeakPolarHBondContact CG2-O 3.37Å; I609-F617 HydrophobicContact CD1-CB 4.49Å; I609-F636 HydrophobicContact CD1-CE1 4.35Å; I609-Y650 PolarHBondContact N-O 3.08Å; I609-V651 WeakPolarHBondContact O-CA 3.31Å; I609-N652 PolarHBondContact O-N 3.25Å; I609-N652 VanDerWaalsContact O-N 3.15Å; I609-N654 PolarHBondContact O-ND2 2.95Å; I609-N654 VanDerWaalsContact O-ND2 3.12Å
610	S	97.1	Very high	95.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.2	-162.4	72.4	0	0	0	0	116.1	I585 M586 D587 Q608 N612 N652	I585-S610 PolarHBondContact O-N 2.87Å; M586-S610 CarbonylContact C-O 3.51Å; M586-S610 WeakPolarHBondContact CA-O 3.33Å; M586-S610 VanDerWaalsContact CB-O 3.29Å; M586-S610 WeakPolarHBondContact CB-O 3.46Å; M586-S610 WeakPolarHBondContact CB-OG 3.37Å; D587-S610 PolarHBondContact N-O 2.89Å; D587-S610 VanDerWaalsContact N-O 3.16Å; Q608-S610 PolarHBondContact NE2-OG 2.85Å; S610-N612 PolarHBondContact N-ND2 3.29Å; S610-N612 PolarHBondContact O-N 2.97Å; S610-N612 VanDerWaalsContact O-N 3.12Å; S610-N612 PolarHBondContact O-ND2 3.09Å; S610-N652 CarbonylContact C-O 3.52Å; S610-N652 WeakPolarHBondContact CA-O 3.35Å; S610-N652 WeakPolarHBondContact CB-O 3.44Å; S610-N652 WeakPolarHBondContact CB-OD1 3.38Å
611	R	97	Very high	95.3	Very high	90.3333 Å²	90.3333	27.1 Å²	27.1	34%	0.341	12%	0.122	S	C	.	.	S	Bend	trans	54	27.3	174.7	-60.2	-175.4	-57	-78.4	-7.6	114.7	M586 D587 N652 E653	M586-R611 PolarHBondContact SD-NH2 3.08Å; D587-R611 WeakPolarHBondContact CA-O 3.29Å; D587-R611 PolarHBondContact N-O 3.27Å; D587-R611 VanDerWaalsContact OD1-CB 3.29Å; D587-R611 WeakPolarHBondContact OD1-CB 3.43Å; D587-R611 IonicContact OD1-CZ 3.23Å; D587-R611 IonicContact OD1-NE 3.71Å; D587-R611 PolarHBondContact OD1-NE 2.92Å; D587-R611 IonicContact OD1-NH2 3.56Å; D587-R611 IonicContact OD2-CZ 2.68Å; D587-R611 IonicContact OD2-NE 3.02Å; D587-R611 PolarHBondContact OD2-NE 3.15Å; D587-R611 IonicContact OD2-NH2 2.91Å; D587-R611 PolarHBondContact OD2-NH2 3.14Å; R611-N652 PolarHBondContact N-O 2.95Å; R611-N652 VanDerWaalsContact N-O 3.09Å; R611-E653 WeakPolarHBondContact CA-O 3.45Å; R611-E653 WeakPolarHBondContact CD-OE2 3.41Å; R611-E653 HydrophobicContact CG-CB 3.79Å; R611-E653 VanDerWaalsContact CG-OE2 3.23Å; R611-E653 WeakPolarHBondContact CG-OE2 3.36Å; R611-E653 IonicContact NH1-OE2 3.8Å
612	N	96.8	Very high	95	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.138	C	C	.	.			trans	-75.6	144.8	170.9	-55.4	-76.3	0	0	0	108.8	I585 N588 I609 S610 M614 N654 S655	I585-N612 PolarHBondContact O-ND2 3.06Å; N588-N612 WeakPolarHBondContact CB-OD1 3.37Å; N588-N612 PolarHBondContact N-OD1 3.33Å; N588-N612 PolarHBondContact ND2-OD1 3.11Å; N588-N612 WeakPolarHBondContact O-CA 3.23Å; I609-N612 WeakPolarHBondContact CG2-ND2 3.48Å; S610-N612 PolarHBondContact N-ND2 3.29Å; S610-N612 PolarHBondContact O-N 2.97Å; S610-N612 VanDerWaalsContact O-N 3.12Å; S610-N612 PolarHBondContact O-ND2 3.09Å; N612-M614 VanDerWaalsContact C-N 3.32Å; N612-M614 PolarHBondContact O-N 2.89Å; N612-N654 WeakPolarHBondContact CB-OD1 3.28Å; N612-N654 PolarHBondContact N-OD1 2.92Å; N612-N654 PolarHBondContact ND2-OD1 3.05Å; N612-N654 WeakPolarHBondContact O-CA 3.39Å; N612-S655 PolarHBondContact O-N 3.1Å
613	R	93.8	Very high	94.1	Very high	150 Å²	150	36.8 Å²	36.8	57%	0.566	16%	0.162	S	C	*	.	S	Bend	trans	-74	-20.6	-177	-101.6	-174.3	-175.7	175.5	-0.9	112.7	N588 W589 S655	N588-R613 PolarHBondContact O-N 3.06Å; N588-R613 VanDerWaalsContact O-N 3.12Å; W589-R613 VanDerWaalsContact O-CB 3.22Å; W589-R613 WeakPolarHBondContact O-CB 3.28Å; R613-S655 WeakPolarHBondContact O-CB 3.34Å
614	M	93.6	Very high	93.2	Very high	53.3333 Å²	53.3333	37.8 Å²	37.8	26%	0.263	17%	0.165	S	C	.	.	S	Bend	trans	-106.4	-134.1	168.7	-55.2	-172.4	81.3	0	0	110.8	D194 G590 D591 N612 S655 W656	D194-M614 HydrophobicContact CB-CE 3.47Å; D194-M614 VanDerWaalsContact CB-CE 3.47Å; D194-M614 HydrophobicContact CB-SD 4.06Å; D194-M614 WeakPolarHBondContact OD1-CE 3.45Å; D194-M614 VanDerWaalsContact OD2-CE 3.3Å; D194-M614 WeakPolarHBondContact OD2-CE 3.3Å; G590-M614 PolarHBondContact O-N 2.99Å; D591-M614 WeakPolarHBondContact OD1-CB 3.33Å; N612-M614 VanDerWaalsContact C-N 3.32Å; N612-M614 PolarHBondContact O-N 2.89Å; M614-S655 PolarHBondContact O-N 3.09Å; M614-W656 VanDerWaalsContact C-CB 3.46Å; M614-W656 HydrophobicContact CB-CB 4.37Å; M614-W656 WeakPolarHBondContact O-CB 3.24Å; M614-W656 PolarHBondContact O-N 2.91Å; M614-W656 VanDerWaalsContact O-N 3.09Å
615	R	95.1	Very high	92	Very high	44.6667 Å²	44.6667	47.6 Å²	47.6	17%	0.169	21%	0.208	C	C	.	.			trans	-80.6	160.3	-178.7	-63.6	163.6	-150	141.5	0.8	110.3	D591 G592 W656 G657 L660	D591-R615 CarbonylContact C-O 3.56Å; D591-R615 VanDerWaalsContact CA-O 3.25Å; D591-R615 WeakPolarHBondContact CA-O 3.43Å; D591-R615 VanDerWaalsContact OD1-CB 3.29Å; D591-R615 WeakPolarHBondContact OD1-CB 3.42Å; D591-R615 PolarHBondContact OD1-N 3.05Å; G592-R615 PolarHBondContact N-O 3.25Å; R615-W656 HydrophobicContact CG-CB 4.49Å; R615-W656 WeakPolarHBondContact CG-O 3.38Å; R615-G657 WeakPolarHBondContact CA-O 3.37Å; R615-L660 VanDerWaalsContact CZ-CD2 3.45Å
616	G	96.6	Very high	91.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.216	C	C	.	.	S	Bend	trans	-65.8	-58	166.7	0	0	0	0	0	110.7	G592 V593 I609 G657 G658	G592-G616 CarbonylContact C-O 3.55Å; G592-G616 VanDerWaalsContact CA-O 3.26Å; G592-G616 WeakPolarHBondContact CA-O 3.29Å; G592-G616 PolarHBondContact N-O 3.11Å; G592-G616 VanDerWaalsContact N-O 3.16Å; V593-G616 PolarHBondContact N-O 3.03Å; I609-G616 VanDerWaalsContact CG2-CA 3.49Å; I609-G616 VanDerWaalsContact CG2-O 3.27Å; I609-G616 WeakPolarHBondContact CG2-O 3.37Å; G616-G657 PolarHBondContact N-O 3.17Å; G616-G658 WeakPolarHBondContact CA-O 3.37Å; G616-G658 PolarHBondContact N-O 2.93Å
617	F	97.7	Very high	90.8	Very high	0.333333 Å²	0.333333	49.6 Å²	49.6	0%	0.001	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.7	-179.3	179.3	-83.8	0	0	0	110.3	V593 L602 V604 I609 F619 V634 F636 G658 I659 L660 I661	V593-F617 HydrophobicContact CB-CD2 3.62Å; V593-F617 HydrophobicContact CB-CE2 4.2Å; V593-F617 HydrophobicContact CB-CG 4.45Å; V593-F617 HydrophobicContact CG1-CD2 3.68Å; V593-F617 HydrophobicContact CG1-CE2 3.7Å; V593-F617 HydrophobicContact CG2-CD2 4.33Å; V593-F617 CarbonylContact O-C 3.56Å; V593-F617 WeakPolarHBondContact O-CA 3.41Å; L602-F617 HydrophobicContact CD2-CZ 3.99Å; V604-F617 HydrophobicContact CG2-CE2 4.36Å; I609-F617 HydrophobicContact CD1-CB 4.49Å; F617-F619 HydrophobicContact CE1-CB 3.79Å; F617-F619 HydrophobicContact CZ-CB 4.37Å; F617-V634 HydrophobicContact CE1-CG1 4.19Å; F617-V634 HydrophobicContact CZ-CG1 4.34Å; F617-F636 HydrophobicContact CB-CZ 3.92Å; F617-F636 HydrophobicContact CD1-CE2 4.12Å; F617-F636 AromaticContact CD1-CZ 3.88Å; F617-F636 HydrophobicContact CD1-CZ 3.88Å; F617-F636 HydrophobicContact CD2-CE2 4.42Å; F617-F636 AromaticContact CD2-CZ 3.65Å; F617-F636 HydrophobicContact CD2-CZ 3.65Å; F617-F636 HydrophobicContact CE1-CE2 4.16Å; F617-F636 HydrophobicContact CE1-CZ 4.25Å; F617-F636 HydrophobicContact CE2-CE2 4.47Å; F617-F636 HydrophobicContact CE2-CZ 4.06Å; F617-F636 HydrophobicContact CG-CE2 4.26Å; F617-F636 AromaticContact CG-CZ 3.56Å; F617-F636 HydrophobicContact CG-CZ 3.56Å; F617-F636 HydrophobicContact CZ-CE2 4.35Å; F617-F636 HydrophobicContact CZ-CZ 4.35Å; F617-G658 PolarHBondContact N-O 2.84Å; F617-I659 HydrophobicContact CB-CG1 4.25Å; F617-I659 HydrophobicContact CD1-CG2 4.1Å; F617-I659 CarbonylContact O-C 3.57Å; F617-I659 WeakPolarHBondContact O-CA 3.17Å; F617-L660 PolarHBondContact O-N 2.97Å; F617-I661 HydrophobicContact CD1-CD1 4.28Å; F617-I661 HydrophobicContact CE1-CD1 3.89Å
618	A	96.2	Very high	90.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	125.5	174.3	0	0	0	0	0	110.2	V593 N594 V595 L660	V593-A618 PolarHBondContact O-N 3.1Å; N594-A618 WeakPolarHBondContact CA-O 3.29Å; V595-A618 PolarHBondContact N-O 2.89Å; A618-L660 CarbonylContact C-O 3.54Å; A618-L660 WeakPolarHBondContact CA-O 3.35Å; A618-L660 HydrophobicContact CB-CB 4.44Å
619	F	95.5	Very high	89.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.5	167.3	173	-94	0	0	0	109.6	V595 H597 L602 F617 H621 F632 V634 L660 I661 G662 F664	V595-F619 HydrophobicContact CB-CD2 4.2Å; V595-F619 HydrophobicContact CG1-CD2 4.1Å; V595-F619 HydrophobicContact CG1-CE2 4.35Å; V595-F619 CarbonylContact O-C 3.6Å; V595-F619 WeakPolarHBondContact O-CA 3.33Å; H597-F619 AromaticContact CE1-CE2 3.74Å; H597-F619 AromaticContact ND1-CE2 3.68Å; L602-F619 HydrophobicContact CD1-CD2 4.17Å; L602-F619 HydrophobicContact CD1-CE2 4.21Å; L602-F619 HydrophobicContact CD2-CD2 3.79Å; L602-F619 HydrophobicContact CD2-CE2 4.39Å; F617-F619 HydrophobicContact CE1-CB 3.79Å; F617-F619 HydrophobicContact CZ-CB 4.37Å; F619-H621 HydrophobicContact CE1-CB 4Å; F619-H621 HydrophobicContact CZ-CB 4.27Å; F619-F632 HydrophobicContact CD1-CE2 4.16Å; F619-F632 AromaticContact CD1-CZ 3.94Å; F619-F632 HydrophobicContact CD1-CZ 4.04Å; F619-F632 HydrophobicContact CD2-CE2 4.46Å; F619-F632 HydrophobicContact CE1-CD2 4.48Å; F619-F632 AromaticContact CE1-CE2 3.37Å; F619-F632 HydrophobicContact CE1-CE2 3.37Å; F619-F632 VanDerWaalsContact CE1-CE2 3.46Å; F619-F632 AromaticContact CE1-CZ 3.53Å; F619-F632 HydrophobicContact CE1-CZ 3.53Å; F619-F632 VanDerWaalsContact CE1-CZ 3.47Å; F619-F632 AromaticContact CE2-CE2 3.85Å; F619-F632 HydrophobicContact CE2-CE2 4.04Å; F619-F632 HydrophobicContact CZ-CD2 4.21Å; F619-F632 AromaticContact CZ-CE2 3.32Å; F619-F632 HydrophobicContact CZ-CE2 3.32Å; F619-F632 AromaticContact CZ-CZ 3.97Å; F619-F632 HydrophobicContact CZ-CZ 3.97Å; F619-V634 HydrophobicContact CG-CG2 4.48Å; F619-L660 PolarHBondContact N-O 3.17Å; F619-I661 HydrophobicContact CB-CD1 4.18Å; F619-I661 HydrophobicContact CD1-CG2 4.12Å; F619-G662 VanDerWaalsContact O-CA 3.3Å; F619-G662 WeakPolarHBondContact O-CA 3.37Å; F619-G662 PolarHBondContact O-N 2.99Å; F619-F664 HydrophobicContact CE1-CB 4.28Å; F619-F664 HydrophobicContact CZ-CD2 4.47Å
620	H	92.5	Very high	89	Confident	61.6667 Å²	61.6667	51.6 Å²	51.6	29%	0.285	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.5	173.9	-61.5	-33	0	0	0	109.3	V595 S596 H597 R622 G662	V595-H620 PolarHBondContact O-N 3.11Å; S596-H620 VanDerWaalsContact CA-O 3.29Å; S596-H620 WeakPolarHBondContact CA-O 3.34Å; H597-H620 PolarHBondContact N-O 3.12Å; H620-R622 PolarHBondContact O-N 3.21Å; H620-G662 WeakPolarHBondContact CA-O 3.47Å
621	H	89.4	Confident	88.5	Confident	32.6667 Å²	32.6667	55.7 Å²	55.7	15%	0.151	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.9	172.6	178.8	67.4	0	0	0	109.4	C598 F619 G662 N663 F664 C665	C598-H621 PolarHBondContact O-CE1 3.19Å; C598-H621 VanDerWaalsContact O-CE1 3.25Å; C598-H621 PolarHBondContact O-ND1 3.17Å; C598-H621 VanDerWaalsContact O-ND1 3.12Å; F619-H621 HydrophobicContact CE1-CB 4Å; F619-H621 HydrophobicContact CZ-CB 4.27Å; H621-G662 PolarHBondContact N-O 3.39Å; H621-N663 WeakPolarHBondContact CB-O 3.32Å; H621-F664 HydrophobicContact CB-CB 4.5Å; H621-F664 AromaticContact CE1-CD2 3.88Å; H621-F664 AromaticContact CE1-CE2 3.93Å; H621-F664 AromaticContact ND1-CD2 3.59Å; H621-F664 AromaticContact ND1-CE2 3.95Å; H621-C665 PolarHBondContact CD2-O 3.07Å; H621-C665 PolarHBondContact CE1-O 3.15Å; H621-C665 PolarHBondContact NE2-O 3.21Å; H621-C665 VanDerWaalsContact NE2-O 3.12Å
622	R	84.7	Confident	88.2	Confident	103.333 Å²	103.333	51.4 Å²	51.4	39%	0.39	23%	0.228	S	C	.	.			trans	-130.2	108.3	174.2	-174.4	178.5	-174.1	179.4	2	109.4	H597 C598 H620 M624	H597-R622 CarbonylContact C-O 3.5Å; H597-R622 PolarHBondContact O-N 3.04Å; H597-R622 VanDerWaalsContact O-N 3.16Å; C598-R622 WeakPolarHBondContact CA-O 3.35Å; C598-R622 PolarHBondContact N-O 3.27Å; C598-R622 PolarHBondContact SG-O 3.13Å; H620-R622 PolarHBondContact O-N 3.21Å; R622-M624 HydrophobicContact CG-CG 4.39Å; R622-M624 PolarHBondContact O-N 2.95Å
623	E	76.8	Confident	88	Confident	109 Å²	109	52.7 Å²	52.7	51%	0.509	23%	0.234	S	C	.	.			trans	-75.8	123.2	175	-164.8	179.8	169.4	0	0	110.4	T667	E623-T667 HydrophobicContact CG-CG2 4.37Å; E623-T667 VanDerWaalsContact OE1-CB 3.27Å; E623-T667 WeakPolarHBondContact OE1-CB 3.11Å; E623-T667 WeakPolarHBondContact OE1-CG2 3.38Å; E623-T667 PolarHBondContact OE1-N 3.02Å; E623-T667 PolarHBondContact OE1-OG1 3.26Å; E623-T667 WeakPolarHBondContact OE2-CG2 3.29Å; E623-T667 PolarHBondContact OE2-N 3.27Å
624	M	77	Confident	88.1	Confident	46.3333 Å²	46.3333	45.6 Å²	45.6	23%	0.228	21%	0.207	C	C	.	.			trans	-124.5	127.1	171.8	-71.2	-136.7	-82.4	0	0	108.2	C598 R622 Q626 F627	C598-M624 PolarHBondContact SG-N 2.99Å; C598-M624 VanDerWaalsContact SG-N 3.36Å; R622-M624 HydrophobicContact CG-CG 4.39Å; R622-M624 PolarHBondContact O-N 2.95Å; M624-Q626 HydrophobicContact CB-CG 4.44Å; M624-Q626 PolarHBondContact O-N 3.01Å; M624-F627 HydrophobicContact CB-CD2 4.01Å; M624-F627 HydrophobicContact CE-CD2 3.84Å; M624-F627 HydrophobicContact CE-CE2 3.89Å; M624-F627 PolarHBondContact O-N 3.07Å; M624-F627 HydrophobicContact SD-CE2 4.4Å
625	K	72.7	Confident	88.3	Confident	208 Å²	208	43.7 Å²	43.7	90%	0.904	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-25.5	-174	-68.5	-175.5	178.3	180	0	114.5
626	Q	78.9	Confident	88.4	Confident	86.3333 Å²	86.3333	41.6 Å²	41.6	40%	0.403	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-21.4	-178.6	43.4	-174.6	13	0	0	113.7	L480 L481 M624	L480-Q626 CarbonylContact C-O 3.48Å; L481-Q626 WeakPolarHBondContact CA-O 3.39Å; L481-Q626 VanDerWaalsContact CB-O 3.26Å; L481-Q626 WeakPolarHBondContact CB-O 3.38Å; L481-Q626 HydrophobicContact CD1-CB 4.3Å; L481-Q626 HydrophobicContact CD1-CG 4.2Å; L481-Q626 PolarHBondContact N-O 3.25Å; M624-Q626 HydrophobicContact CB-CG 4.44Å; M624-Q626 PolarHBondContact O-N 3.01Å
627	F	83.8	Confident	88.2	Confident	9.66667 Å²	9.66667	46.7 Å²	46.7	4%	0.042	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-111.9	132.3	-173.3	-64.7	-69.9	0	0	0	112.5	L379 L481 D548 R550 V575 C598 M624	L379-F627 HydrophobicContact CD1-CZ 4.2Å; L379-F627 HydrophobicContact CD2-CE1 4.31Å; L379-F627 HydrophobicContact CD2-CZ 4.34Å; L481-F627 HydrophobicContact CB-CD1 3.7Å; L481-F627 HydrophobicContact CB-CE1 3.91Å; L481-F627 HydrophobicContact CD1-CD1 4.22Å; L481-F627 HydrophobicContact CD1-CE1 3.69Å; L481-F627 HydrophobicContact CD1-CZ 4.23Å; L481-F627 HydrophobicContact CG-CE1 4.47Å; L481-F627 WeakPolarHBondContact O-CA 3.32Å; D548-F627 HydrophobicContact CB-CE2 4.4Å; D548-F627 HydrophobicContact CB-CZ 3.86Å; D548-F627 VanDerWaalsContact OD1-CE2 3.29Å; D548-F627 WeakPolarHBondContact OD1-CE2 3.39Å; R550-F627 HydrophobicContact CG-CE1 4.15Å; V575-F627 HydrophobicContact CB-CB 4.2Å; V575-F627 HydrophobicContact CG1-CB 3.87Å; V575-F627 HydrophobicContact CG1-CD1 3.74Å; V575-F627 HydrophobicContact CG1-CG 4.33Å; V575-F627 HydrophobicContact CG2-CD1 4.03Å; C598-F627 HydrophobicContact CB-CB 4.29Å; M624-F627 HydrophobicContact CB-CD2 4.01Å; M624-F627 HydrophobicContact CE-CD2 3.84Å; M624-F627 HydrophobicContact CE-CE2 3.89Å; M624-F627 PolarHBondContact O-N 3.07Å; M624-F627 HydrophobicContact SD-CE2 4.4Å
628	L	83.3	Confident	87.9	Confident	23.3333 Å²	23.3333	46.8 Å²	46.8	12%	0.122	21%	0.214	C	C	.	.			trans	-113.2	111.4	176.8	-175.9	73.2	0	0	0	111.9	I474 P475 L480 L481 L482 P483 L630 Y672	I474-L628 HydrophobicContact CG2-CD2 4.24Å; P475-L628 VanDerWaalsContact CD-CD2 3.45Å; P475-L628 HydrophobicContact CG-CD2 3.52Å; P475-L628 VanDerWaalsContact CG-CD2 3.49Å; L480-L628 HydrophobicContact CD1-CB 3.87Å; L480-L628 HydrophobicContact CD2-CB 3.89Å; L480-L628 HydrophobicContact CD2-CD1 4.28Å; L480-L628 HydrophobicContact CD2-CD2 3.79Å; L480-L628 HydrophobicContact CD2-CG 4.03Å; L480-L628 HydrophobicContact CG-CB 3.95Å; L481-L628 PolarHBondContact O-N 3.05Å; L481-L628 VanDerWaalsContact O-N 3.1Å; L482-L628 HydrophobicContact CD2-CB 4Å; L482-L628 HydrophobicContact CD2-CD2 3.96Å; L482-L628 HydrophobicContact CD2-CG 4.4Å; P483-L628 VanDerWaalsContact CD-O 3.24Å; P483-L628 WeakPolarHBondContact CD-O 3.28Å; L628-L630 HydrophobicContact CD2-CD2 4.37Å; L628-L630 PolarHBondContact O-N 2.86Å; L628-Y672 HydrophobicContact CD1-CD1 3.46Å; L628-Y672 VanDerWaalsContact CD1-CD1 3.46Å; L628-Y672 HydrophobicContact CD1-CE1 3.86Å; L628-Y672 HydrophobicContact CD1-CG 4.2Å; L628-Y672 HydrophobicContact CD2-CD1 3.89Å; L628-Y672 HydrophobicContact CD2-CE1 3.78Å; L628-Y672 HydrophobicContact CD2-CE2 4.43Å; L628-Y672 HydrophobicContact CD2-CG 4.24Å; L628-Y672 HydrophobicContact CG-CD1 3.9Å; L628-Y672 HydrophobicContact CG-CE1 3.78Å
629	P	85.6	Confident	87.5	Confident	22.6667 Å²	22.6667	51.7 Å²	51.7	15%	0.147	23%	0.232	C	C	.	.			trans	-73.5	129.1	174.8	30.2	-33.4	0	0	0	111.1	V575 C598 Y672 V674	V575-P629 HydrophobicContact CG1-CB 4.13Å; V575-P629 HydrophobicContact CG2-CB 4.13Å; C598-P629 HydrophobicContact CB-CG 4.3Å; P629-Y672 WeakPolarHBondContact O-CE1 3.34Å; P629-V674 HydrophobicContact CG-CG2 4.16Å
630	L	84	Confident	87.1	Confident	42.3333 Å²	42.3333	53 Å²	53	22%	0.222	24%	0.24	C	C	.	.	S	Bend	trans	-88.8	-18	174.5	-60.8	-179.4	0	0	0	113.1	Y472 I474 L482 P483 I485 L628 Y672	Y472-L630 HydrophobicContact CD1-CD1 4.09Å; Y472-L630 HydrophobicContact CE1-CD1 4.37Å; I474-L630 HydrophobicContact CD1-CD1 3.9Å; I474-L630 HydrophobicContact CD1-CD2 4.29Å; I474-L630 HydrophobicContact CG1-CD1 4.44Å; I474-L630 HydrophobicContact CG1-CD2 4.03Å; I474-L630 HydrophobicContact CG2-CD2 4.3Å; L482-L630 HydrophobicContact CD2-CD2 4.32Å; P483-L630 HydrophobicContact CG-CB 4.28Å; P483-L630 HydrophobicContact CG-CD1 3.89Å; P483-L630 HydrophobicContact CG-CG 3.81Å; I485-L630 HydrophobicContact CG2-CD1 3.46Å; L628-L630 HydrophobicContact CD2-CD2 4.37Å; L628-L630 PolarHBondContact O-N 2.86Å; L630-Y672 WeakPolarHBondContact CD2-OH 3.13Å
631	K	86.5	Confident	86.1	Confident	85 Å²	85	54.4 Å²	54.4	37%	0.37	26%	0.263	S	S	.	.			trans	-153.3	155.9	-179.1	163.3	178.5	-178.1	-176.6	0	109.3	G600 E633	G600-K631 WeakPolarHBondContact CA-O 3.31Å; G600-K631 PolarHBondContact N-O 2.95Å; K631-E633 HydrophobicContact CD-CB 4.43Å; K631-E633 HydrophobicContact CD-CG 4.47Å; K631-E633 WeakPolarHBondContact CE-OE1 3.41Å; K631-E633 VanDerWaalsContact CE-OE2 3.29Å; K631-E633 WeakPolarHBondContact CE-OE2 3.46Å; K631-E633 VanDerWaalsContact NZ-CD 3.35Å; K631-E633 IonicContact NZ-OE1 3.51Å; K631-E633 PolarHBondContact NZ-OE1 2.87Å; K631-E633 IonicContact NZ-OE2 3.5Å; K631-E633 PolarHBondContact NZ-OE2 3.04Å
632	F	91	Very high	85.5	Confident	1 Å²	1	61.4 Å²	61.4	0%	0.004	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	115	168.1	178.3	-101.9	0	0	0	109.3	G600 F619 V634 F664 V674 P677 R678 V679	G600-F632 WeakPolarHBondContact O-CA 3.37Å; F619-F632 HydrophobicContact CD1-CE2 4.16Å; F619-F632 AromaticContact CD1-CZ 3.94Å; F619-F632 HydrophobicContact CD1-CZ 4.04Å; F619-F632 HydrophobicContact CD2-CE2 4.46Å; F619-F632 HydrophobicContact CE1-CD2 4.48Å; F619-F632 AromaticContact CE1-CE2 3.37Å; F619-F632 HydrophobicContact CE1-CE2 3.37Å; F619-F632 VanDerWaalsContact CE1-CE2 3.46Å; F619-F632 AromaticContact CE1-CZ 3.53Å; F619-F632 HydrophobicContact CE1-CZ 3.53Å; F619-F632 VanDerWaalsContact CE1-CZ 3.47Å; F619-F632 AromaticContact CE2-CE2 3.85Å; F619-F632 HydrophobicContact CE2-CE2 4.04Å; F619-F632 HydrophobicContact CZ-CD2 4.21Å; F619-F632 AromaticContact CZ-CE2 3.32Å; F619-F632 HydrophobicContact CZ-CE2 3.32Å; F619-F632 AromaticContact CZ-CZ 3.97Å; F619-F632 HydrophobicContact CZ-CZ 3.97Å; F632-V634 HydrophobicContact CE2-CG2 3.91Å; F632-V634 HydrophobicContact CZ-CG2 3.97Å; F632-F664 HydrophobicContact CB-CD1 4.25Å; F632-F664 HydrophobicContact CB-CD2 4.27Å; F632-F664 HydrophobicContact CB-CE1 3.78Å; F632-F664 HydrophobicContact CB-CE2 3.81Å; F632-F664 HydrophobicContact CB-CG 4.37Å; F632-F664 HydrophobicContact CB-CZ 3.78Å; F632-F664 VanDerWaalsContact CB-CZ 3.47Å; F632-F664 HydrophobicContact CD1-CB 4.05Å; F632-F664 AromaticContact CD1-CD1 3.59Å; F632-F664 HydrophobicContact CD1-CD1 3.59Å; F632-F664 AromaticContact CD1-CD2 3.77Å; F632-F664 HydrophobicContact CD1-CD2 4.07Å; F632-F664 AromaticContact CD1-CE1 3.9Å; F632-F664 HydrophobicContact CD1-CE1 3.99Å; F632-F664 HydrophobicContact CD1-CE2 4.29Å; F632-F664 AromaticContact CD1-CG 3.56Å; F632-F664 HydrophobicContact CD1-CG 3.87Å; F632-F664 VanDerWaalsContact CD1-CG 3.47Å; F632-F664 HydrophobicContact CD1-CZ 4.33Å; F632-F664 AromaticContact CD2-CD2 3.55Å; F632-F664 HydrophobicContact CD2-CD2 3.55Å; F632-F664 AromaticContact CD2-CE2 3.76Å; F632-F664 HydrophobicContact CD2-CE2 3.76Å; F632-F664 HydrophobicContact CD2-CG 4.15Å; F632-F664 HydrophobicContact CD2-CZ 4.39Å; F632-F664 HydrophobicContact CE1-CB 3.91Å; F632-F664 AromaticContact CE1-CD1 4Å; F632-F664 HydrophobicContact CE1-CD1 4.09Å; F632-F664 HydrophobicContact CE1-CD2 4.21Å; F632-F664 AromaticContact CE1-CG 3.72Å; F632-F664 HydrophobicContact CE1-CG 3.97Å; F632-F664 HydrophobicContact CE2-CB 4.37Å; F632-F664 AromaticContact CE2-CD2 3.81Å; F632-F664 HydrophobicContact CE2-CD2 3.81Å; F632-F664 HydrophobicContact CE2-CE2 4.26Å; F632-F664 HydrophobicContact CE2-CG 4.23Å; F632-F664 HydrophobicContact CG-CB 4.5Å; F632-F664 AromaticContact CG-CD1 3.92Å; F632-F664 HydrophobicContact CG-CD1 3.92Å; F632-F664 AromaticContact CG-CD2 3.68Å; F632-F664 HydrophobicContact CG-CD2 3.68Å; F632-F664 VanDerWaalsContact CG-CD2 3.49Å; F632-F664 AromaticContact CG-CE1 3.86Å; F632-F664 HydrophobicContact CG-CE1 3.96Å; F632-F664 AromaticContact CG-CE2 3.74Å; F632-F664 HydrophobicContact CG-CE2 3.74Å; F632-F664 AromaticContact CG-CG 3.75Å; F632-F664 HydrophobicContact CG-CG 3.96Å; F632-F664 AromaticContact CG-CZ 3.84Å; F632-F664 HydrophobicContact CG-CZ 3.84Å; F632-F664 HydrophobicContact CZ-CB 3.94Å; F632-F664 HydrophobicContact CZ-CD2 4.18Å; F632-F664 HydrophobicContact CZ-CG 4.14Å; F632-V674 HydrophobicContact CB-CG1 4.26Å; F632-P677 HydrophobicContact CB-CB 4.21Å; F632-P677 HydrophobicContact CD1-CB 3.73Å; F632-P677 HydrophobicContact CE1-CB 4.36Å; F632-P677 HydrophobicContact CG-CB 4.05Å; F632-P677 WeakPolarHBondContact O-CA 3.38Å; F632-R678 PolarHBondContact O-N 3.22Å; F632-V679 HydrophobicContact CE1-CG2 4.38Å
633	E	93.7	Very high	85.2	Confident	27.6667 Å²	27.6667	58.9 Å²	58.9	13%	0.129	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	130.5	177.8	86	-178.8	-178.6	0	0	110.6	G600 S601 L602 K631 V635 R678	G600-E633 PolarHBondContact O-N 3.28Å; S601-E633 CarbonylContact C-O 3.39Å; S601-E633 VanDerWaalsContact CA-CG 3.47Å; S601-E633 WeakPolarHBondContact CA-O 3.36Å; S601-E633 WeakPolarHBondContact CB-OE1 3.33Å; S601-E633 WeakPolarHBondContact OG-CG 3.31Å; S601-E633 PolarHBondContact OG-OE1 3.47Å; S601-E633 PolarHBondContact OG-OE2 3.18Å; L602-E633 WeakPolarHBondContact CD1-O 3.22Å; L602-E633 PolarHBondContact N-O 3.08Å; K631-E633 HydrophobicContact CD-CB 4.43Å; K631-E633 HydrophobicContact CD-CG 4.47Å; K631-E633 WeakPolarHBondContact CE-OE1 3.41Å; K631-E633 VanDerWaalsContact CE-OE2 3.29Å; K631-E633 WeakPolarHBondContact CE-OE2 3.46Å; K631-E633 VanDerWaalsContact NZ-CD 3.35Å; K631-E633 IonicContact NZ-OE1 3.51Å; K631-E633 PolarHBondContact NZ-OE1 2.87Å; K631-E633 IonicContact NZ-OE2 3.5Å; K631-E633 PolarHBondContact NZ-OE2 3.04Å; E633-V635 HydrophobicContact CB-CG2 4.41Å; E633-V635 HydrophobicContact CG-CG2 3.35Å; E633-R678 CarbonylContact C-O 3.32Å; E633-R678 VanDerWaalsContact CA-O 3.26Å; E633-R678 WeakPolarHBondContact CA-O 3.39Å; E633-R678 HydrophobicContact CB-CG 3.93Å; E633-R678 HydrophobicContact CG-CG 3.88Å; E633-R678 IonicContact OE1-CZ 3.76Å; E633-R678 VanDerWaalsContact OE1-CZ 3.25Å; E633-R678 IonicContact OE1-NE 3.6Å; E633-R678 PolarHBondContact OE1-NE 3.08Å; E633-R678 IonicContact OE1-NH2 3.09Å; E633-R678 PolarHBondContact OE1-NH2 3.06Å; E633-R678 IonicContact OE2-CZ 3.64Å; E633-R678 IonicContact OE2-NE 3.1Å; E633-R678 PolarHBondContact OE2-NE 3.4Å; E633-R678 IonicContact OE2-NH2 2.64Å; E633-R678 PolarHBondContact OE2-NH2 3.16Å
634	V	96	Very high	85.2	Confident	0.666667 Å²	0.666667	60 Å²	60	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118	168.5	-176.3	0	0	0	0	108	L602 F617 F619 F632 F636 I661 R678 V679 V680	L602-V634 HydrophobicContact CB-CG1 4.34Å; L602-V634 HydrophobicContact CB-CG2 4.38Å; L602-V634 HydrophobicContact CD1-CG2 4.09Å; L602-V634 CarbonylContact O-C 3.43Å; L602-V634 WeakPolarHBondContact O-CA 3.44Å; F617-V634 HydrophobicContact CE1-CG1 4.19Å; F617-V634 HydrophobicContact CZ-CG1 4.34Å; F619-V634 HydrophobicContact CG-CG2 4.48Å; F632-V634 HydrophobicContact CE2-CG2 3.91Å; F632-V634 HydrophobicContact CZ-CG2 3.97Å; V634-F636 HydrophobicContact CG1-CD2 4.2Å; V634-F636 HydrophobicContact CG1-CE2 3.86Å; V634-I661 HydrophobicContact CB-CD1 4.24Å; V634-I661 HydrophobicContact CG1-CD1 3.76Å; V634-I661 HydrophobicContact CG1-CG1 4.38Å; V634-I661 HydrophobicContact CG2-CD1 4.43Å; V634-R678 PolarHBondContact N-O 3.06Å; V634-V679 HydrophobicContact CB-CG1 4.35Å; V634-V679 HydrophobicContact CB-CG2 4.41Å; V634-V679 CarbonylContact O-C 3.48Å; V634-V679 VanDerWaalsContact O-CA 3.28Å; V634-V679 WeakPolarHBondContact O-CA 3.34Å; V634-V680 PolarHBondContact O-N 3.17Å
635	V	97	Very high	85.3	Confident	12 Å²	12	64.8 Å²	64.8	7%	0.073	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	117.6	-170.9	178.2	0	0	0	0	109.9	L602 V603 V604 E633 K637 V680	L602-V635 PolarHBondContact O-N 3.02Å; V603-V635 CarbonylContact C-O 3.5Å; V603-V635 WeakPolarHBondContact CA-O 3.42Å; V603-V635 HydrophobicContact CG1-CG1 4.4Å; V603-V635 HydrophobicContact CG2-CB 4.36Å; V604-V635 PolarHBondContact N-O 2.82Å; E633-V635 HydrophobicContact CB-CG2 4.41Å; E633-V635 HydrophobicContact CG-CG2 3.35Å; V635-K637 HydrophobicContact CG1-CD 4.27Å; V635-K637 HydrophobicContact CG1-CG 3.86Å; V635-V680 CarbonylContact C-O 3.55Å; V635-V680 VanDerWaalsContact CA-O 3.32Å; V635-V680 WeakPolarHBondContact CA-O 3.44Å; V635-V680 HydrophobicContact CG1-CB 4.47Å; V635-V680 HydrophobicContact CG2-CB 4.36Å; V635-V680 HydrophobicContact CG2-CG2 4.45Å
636	F	97	Very high	85.7	Confident	0.666667 Å²	0.666667	60.7 Å²	60.7	0%	0.003	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	125.1	167.1	-75	-105.6	0	0	0	109	V604 I609 F617 V634 T649 I659 V680 V681 A682 V684	V604-F636 HydrophobicContact CB-CD1 3.71Å; V604-F636 HydrophobicContact CB-CE1 3.66Å; V604-F636 HydrophobicContact CB-CG 4.24Å; V604-F636 HydrophobicContact CB-CZ 4.14Å; V604-F636 HydrophobicContact CG1-CD1 3.94Å; V604-F636 HydrophobicContact CG1-CE1 3.79Å; V604-F636 HydrophobicContact CG2-CD1 4.31Å; V604-F636 HydrophobicContact CG2-CE1 3.79Å; V604-F636 HydrophobicContact CG2-CE2 4.35Å; V604-F636 HydrophobicContact CG2-CZ 3.81Å; V604-F636 WeakPolarHBondContact O-CA 3.33Å; I609-F636 HydrophobicContact CD1-CE1 4.35Å; F617-F636 HydrophobicContact CB-CZ 3.92Å; F617-F636 HydrophobicContact CD1-CE2 4.12Å; F617-F636 AromaticContact CD1-CZ 3.88Å; F617-F636 HydrophobicContact CD1-CZ 3.88Å; F617-F636 HydrophobicContact CD2-CE2 4.42Å; F617-F636 AromaticContact CD2-CZ 3.65Å; F617-F636 HydrophobicContact CD2-CZ 3.65Å; F617-F636 HydrophobicContact CE1-CE2 4.16Å; F617-F636 HydrophobicContact CE1-CZ 4.25Å; F617-F636 HydrophobicContact CE2-CE2 4.47Å; F617-F636 HydrophobicContact CE2-CZ 4.06Å; F617-F636 HydrophobicContact CG-CE2 4.26Å; F617-F636 AromaticContact CG-CZ 3.56Å; F617-F636 HydrophobicContact CG-CZ 3.56Å; F617-F636 HydrophobicContact CZ-CE2 4.35Å; F617-F636 HydrophobicContact CZ-CZ 4.35Å; V634-F636 HydrophobicContact CG1-CD2 4.2Å; V634-F636 HydrophobicContact CG1-CE2 3.86Å; F636-T649 HydrophobicContact CD1-CG2 4.31Å; F636-I659 HydrophobicContact CD1-CD1 3.76Å; F636-I659 HydrophobicContact CD2-CD1 4Å; F636-I659 HydrophobicContact CE1-CD1 3.67Å; F636-I659 HydrophobicContact CE1-CG1 4.33Å; F636-I659 HydrophobicContact CE2-CD1 3.93Å; F636-I659 HydrophobicContact CE2-CG2 4.38Å; F636-I659 HydrophobicContact CG-CD1 3.93Å; F636-I659 HydrophobicContact CZ-CD1 3.76Å; F636-I659 HydrophobicContact CZ-CG1 4.22Å; F636-V680 PolarHBondContact N-O 3.18Å; F636-V681 HydrophobicContact CB-CG1 4.4Å; F636-V681 HydrophobicContact CB-CG2 4.45Å; F636-A682 PolarHBondContact O-N 3.27Å; F636-V684 HydrophobicContact CB-CG2 3.72Å
637	K	93.5	Very high	86.1	Confident	108 Å²	108	59.7 Å²	59.7	47%	0.47	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.9	174.2	-64.2	-177	178.7	-175.1	0	109.5	V604 N605 V635 T649 A682	V604-K637 PolarHBondContact O-N 3.04Å; N605-K637 WeakPolarHBondContact CA-O 3.35Å; N605-K637 WeakPolarHBondContact OD1-CB 3.5Å; N605-K637 PolarHBondContact OD1-O 3.14Å; V635-K637 HydrophobicContact CG1-CD 4.27Å; V635-K637 HydrophobicContact CG1-CG 3.86Å; K637-T649 WeakPolarHBondContact O-CB 3.43Å; K637-T649 PolarHBondContact O-OG1 3.12Å; K637-A682 CarbonylContact C-O 3.54Å; K637-A682 WeakPolarHBondContact CA-O 3.33Å
638	G	91	Very high	86.5	Confident	3.33333 Å²	3.33333	60.2 Å²	60.2	3%	0.034	32%	0.316	C	S	.	.			trans	-112.8	-153.3	167.5	0	0	0	0	0	111.9	P640 A682 Y683	G638-P640 WeakPolarHBondContact O-CD 3.4Å; G638-A682 PolarHBondContact N-O 2.96Å; G638-Y683 CarbonylContact C-O 3.52Å; G638-Y683 VanDerWaalsContact CA-O 3.25Å; G638-Y683 WeakPolarHBondContact CA-O 3.27Å
639	R	88.3	Confident	87.1	Confident	101.333 Å²	101.333	59.1 Å²	59.1	38%	0.382	31%	0.311	S	S	.	.			trans	-99.8	117.3	-170.7	-178.4	-179.6	69.9	171.3	-0.3	110.9	N643 Y646 A648 Y683	R639-N643 VanDerWaalsContact CG-O 3.28Å; R639-N643 WeakPolarHBondContact CG-O 3.38Å; R639-Y646 WeakPolarHBondContact CB-O 3.38Å; R639-Y646 WeakPolarHBondContact CD-O 3.4Å; R639-Y646 VanDerWaalsContact CG-O 3.22Å; R639-Y646 WeakPolarHBondContact CG-O 3.38Å; R639-A648 HydrophobicContact CB-CB 4.03Å; R639-Y683 PolarHBondContact N-O 3.17Å
640	P	85.6	Confident	87.6	Confident	27 Å²	27	61.3 Å²	61.3	18%	0.175	32%	0.317	C	S	.	.			trans	-61.5	140.6	168.3	-17.3	30	0	0	0	110.8	G638 L642 N643 Y646 Y683	G638-P640 WeakPolarHBondContact O-CD 3.4Å; P640-L642 PolarHBondContact O-N 3.13Å; P640-L642 VanDerWaalsContact O-N 3.09Å; P640-N643 HydrophobicContact CB-CB 4.29Å; P640-N643 HydrophobicContact CG-CB 4.4Å; P640-N643 PolarHBondContact O-N 3.12Å; P640-Y646 HydrophobicContact CG-CD2 4.35Å; P640-Y683 HydrophobicContact CB-CD1 4.16Å; P640-Y683 HydrophobicContact CB-CD2 4.39Å; P640-Y683 HydrophobicContact CB-CE1 4.06Å; P640-Y683 HydrophobicContact CB-CE2 4.32Å; P640-Y683 HydrophobicContact CB-CG 4.31Å; P640-Y683 HydrophobicContact CG-CD1 4.36Å; P640-Y683 HydrophobicContact CG-CD2 3.88Å; P640-Y683 HydrophobicContact CG-CE1 4.4Å; P640-Y683 HydrophobicContact CG-CE2 3.94Å; P640-Y683 HydrophobicContact CG-CG 4.17Å
641	A	73.4	Confident	88.2	Confident	93 Å²	93	59.3 Å²	59.3	77%	0.769	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-28.1	-174.1	0	0	0	0	0	114.9
642	L	75.4	Confident	88.6	Confident	178.333 Å²	178.333	56.3 Å²	56.3	93%	0.934	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-2.8	-177.9	-69.2	167.8	0	0	0	113.8	P640	P640-L642 PolarHBondContact O-N 3.13Å; P640-L642 VanDerWaalsContact O-N 3.09Å
643	N	79.3	Confident	88.9	Confident	51.3333 Å²	51.3333	60.1 Å²	60.1	28%	0.275	31%	0.312	S	S	.	.			trans	-124.1	103.3	-174.4	-165.7	-26.5	0	0	0	111.2	R639 P640 D645 Y646	R639-N643 VanDerWaalsContact CG-O 3.28Å; R639-N643 WeakPolarHBondContact CG-O 3.38Å; P640-N643 HydrophobicContact CB-CB 4.29Å; P640-N643 HydrophobicContact CG-CB 4.4Å; P640-N643 PolarHBondContact O-N 3.12Å; N643-D645 VanDerWaalsContact C-N 3.26Å; N643-D645 PolarHBondContact O-N 3.2Å; N643-D645 WeakPolarHBondContact OD1-CB 3.36Å; N643-D645 PolarHBondContact OD1-N 3.14Å; N643-D645 PolarHBondContact OD1-OD2 2.88Å; N643-Y646 HydrophobicContact CB-CD2 4.05Å; N643-Y646 HydrophobicContact CB-CE2 4.44Å; N643-Y646 VanDerWaalsContact ND2-CE2 3.33Å; N643-Y646 WeakPolarHBondContact ND2-CE2 3.32Å
644	N	77.2	Confident	89	Confident	131 Å²	131	58.8 Å²	58.8	70%	0.701	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-9	179	-72.3	-19	0	0	0	113.7	Y646	N644-Y646 PolarHBondContact O-N 2.92Å
645	D	78.9	Confident	88.9	Confident	147.333 Å²	147.333	61.1 Å²	61.1	79%	0.788	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-18.2	-179.9	-56.8	-26.1	0	0	0	112.1	N643	N643-D645 VanDerWaalsContact C-N 3.26Å; N643-D645 PolarHBondContact O-N 3.2Å; N643-D645 WeakPolarHBondContact OD1-CB 3.36Å; N643-D645 PolarHBondContact OD1-N 3.14Å; N643-D645 PolarHBondContact OD1-OD2 2.88Å
646	Y	80.8	Confident	88.6	Confident	123 Å²	123	63 Å²	63	48%	0.482	33%	0.328	S	S	.	.	S	Bend	trans	-93.7	136.1	177.9	-68.9	-85.8	0	0	0	111.6	R639 P640 N643 N644	R639-Y646 WeakPolarHBondContact CB-O 3.38Å; R639-Y646 WeakPolarHBondContact CD-O 3.4Å; R639-Y646 VanDerWaalsContact CG-O 3.22Å; R639-Y646 WeakPolarHBondContact CG-O 3.38Å; P640-Y646 HydrophobicContact CG-CD2 4.35Å; N643-Y646 HydrophobicContact CB-CD2 4.05Å; N643-Y646 HydrophobicContact CB-CE2 4.44Å; N643-Y646 VanDerWaalsContact ND2-CE2 3.33Å; N643-Y646 WeakPolarHBondContact ND2-CE2 3.32Å; N644-Y646 PolarHBondContact O-N 2.92Å
647	T	87.4	Confident	88.4	Confident	64.3333 Å²	64.3333	63.1 Å²	63.1	40%	0.395	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-74.5	137.7	171.1	40.5	0	0	0	0	110.3	N582 G606	N582-T647 WeakPolarHBondContact OD1-CB 3.3Å; N582-T647 WeakPolarHBondContact OD1-CG2 3.38Å; N582-T647 PolarHBondContact OD1-OG1 3.22Å; G606-T647 WeakPolarHBondContact CA-OG1 3.31Å
648	A	91	Very high	88.5	Confident	20.3333 Å²	20.3333	58 Å²	58	17%	0.168	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-72.5	143.8	179.9	0	0	0	0	0	110.8	G606 R639 Y650	G606-A648 CarbonylContact C-O 3.5Å; G606-A648 WeakPolarHBondContact CA-O 3.32Å; R639-A648 HydrophobicContact CB-CB 4.03Å; A648-Y650 HydrophobicContact CB-CD2 4.23Å; A648-Y650 HydrophobicContact CB-CE1 4.49Å; A648-Y650 HydrophobicContact CB-CE2 3.41Å; A648-Y650 VanDerWaalsContact CB-CE2 3.42Å; A648-Y650 WeakPolarHBondContact CB-OH 3.44Å
649	T	96.2	Very high	88.8	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.7	176.1	-67.3	0	0	0	0	108.4	G606 T607 F636 K637 V684 E685	G606-T649 WeakPolarHBondContact CA-OG1 3.21Å; G606-T649 PolarHBondContact N-OG1 2.84Å; T607-T649 PolarHBondContact N-OG1 2.93Å; T607-T649 WeakPolarHBondContact O-CA 3.34Å; T607-T649 WeakPolarHBondContact O-CG2 3.43Å; F636-T649 HydrophobicContact CD1-CG2 4.31Å; K637-T649 WeakPolarHBondContact O-CB 3.43Å; K637-T649 PolarHBondContact O-OG1 3.12Å; T649-V684 HydrophobicContact CG2-CG1 4.28Å; T649-V684 HydrophobicContact CG2-CG2 4.3Å; T649-E685 PolarHBondContact O-N 3.03Å; T649-E685 VanDerWaalsContact O-N 3.11Å
650	Y	96.3	Very high	89.2	Confident	68.6667 Å²	68.6667	53.4 Å²	53.4	27%	0.269	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.7	-175.4	-63.4	-81.2	0	0	0	110	T607 Q608 I609 A648 E685	T607-Y650 PolarHBondContact O-N 3.14Å; T607-Y650 VanDerWaalsContact O-N 3.13Å; Q608-Y650 CarbonylContact C-O 3.59Å; Q608-Y650 WeakPolarHBondContact CA-O 3.43Å; I609-Y650 PolarHBondContact N-O 3.08Å; A648-Y650 HydrophobicContact CB-CD2 4.23Å; A648-Y650 HydrophobicContact CB-CE1 4.49Å; A648-Y650 HydrophobicContact CB-CE2 3.41Å; A648-Y650 VanDerWaalsContact CB-CE2 3.42Å; A648-Y650 WeakPolarHBondContact CB-OH 3.44Å; Y650-E685 WeakPolarHBondContact CA-O 3.39Å; Y650-E685 HydrophobicContact CD1-CB 3.7Å; Y650-E685 HydrophobicContact CD1-CG 4.41Å; Y650-E685 HydrophobicContact CE1-CB 3.97Å; Y650-E685 HydrophobicContact CE1-CG 4.19Å; Y650-E685 WeakPolarHBondContact CE1-OE2 3.36Å
651	V	97.1	Very high	89.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	93.4	168.5	-178.2	0	0	0	0	107	I609 I659 V684 E685 F686 V687 N689	I609-V651 WeakPolarHBondContact O-CA 3.31Å; V651-I659 HydrophobicContact CG1-CG1 4.36Å; V651-I659 HydrophobicContact CG2-CD1 4.21Å; V651-I659 HydrophobicContact CG2-CG1 4.26Å; V651-V684 HydrophobicContact CG2-CG1 4.19Å; V651-E685 PolarHBondContact N-O 3.04Å; V651-F686 HydrophobicContact CB-CD1 3.98Å; V651-F686 HydrophobicContact CB-CE1 4.14Å; V651-F686 HydrophobicContact CG1-CD1 4.29Å; V651-F686 HydrophobicContact CG1-CE1 4.4Å; V651-F686 HydrophobicContact CG2-CE1 4.43Å; V651-F686 WeakPolarHBondContact O-CA 3.37Å; V651-V687 PolarHBondContact O-N 3.15Å; V651-N689 PolarHBondContact O-ND2 2.97Å; V651-N689 PolarHBondContact O-OD1 2.86Å
652	N	95.4	Very high	90.2	Very high	21.3333 Å²	21.3333	48 Å²	48	11%	0.114	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.9	-165.6	63.7	-37.6	0	0	0	115	I609 S610 R611 N654 V687	I609-N652 PolarHBondContact O-N 3.25Å; I609-N652 VanDerWaalsContact O-N 3.15Å; S610-N652 CarbonylContact C-O 3.52Å; S610-N652 WeakPolarHBondContact CA-O 3.35Å; S610-N652 WeakPolarHBondContact CB-O 3.44Å; S610-N652 WeakPolarHBondContact CB-OD1 3.38Å; R611-N652 PolarHBondContact N-O 2.95Å; R611-N652 VanDerWaalsContact N-O 3.09Å; N652-N654 PolarHBondContact N-ND2 3.08Å; N652-N654 PolarHBondContact O-N 2.89Å; N652-N654 PolarHBondContact O-ND2 3.43Å; N652-V687 CarbonylContact C-O 3.54Å; N652-V687 WeakPolarHBondContact CA-O 3.36Å; N652-V687 HydrophobicContact CB-CB 3.95Å; N652-V687 WeakPolarHBondContact CB-O 3.4Å
653	E	95.7	Very high	90.5	Very high	82.6667 Å²	82.6667	43.3 Å²	43.3	39%	0.386	22%	0.223	S	C	.	.	S	Bend	trans	56.4	19	174.2	-58.1	177.7	176.1	0	0	114.9	R611 V687 G688 R690	R611-E653 WeakPolarHBondContact CA-O 3.45Å; R611-E653 WeakPolarHBondContact CD-OE2 3.41Å; R611-E653 HydrophobicContact CG-CB 3.79Å; R611-E653 VanDerWaalsContact CG-OE2 3.23Å; R611-E653 WeakPolarHBondContact CG-OE2 3.36Å; R611-E653 IonicContact NH1-OE2 3.8Å; E653-V687 PolarHBondContact N-O 2.83Å; E653-G688 WeakPolarHBondContact CA-O 3.42Å; E653-R690 PolarHBondContact O-NH2 3.12Å
654	N	96.2	Very high	90.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.21	C	C	.	.			trans	-73.1	136.9	174.9	-58.9	-70.8	0	0	0	109.2	I609 N612 N652 W656 G657 N689 R690	I609-N654 PolarHBondContact O-ND2 2.95Å; I609-N654 VanDerWaalsContact O-ND2 3.12Å; N612-N654 WeakPolarHBondContact CB-OD1 3.28Å; N612-N654 PolarHBondContact N-OD1 2.92Å; N612-N654 PolarHBondContact ND2-OD1 3.05Å; N612-N654 WeakPolarHBondContact O-CA 3.39Å; N652-N654 PolarHBondContact N-ND2 3.08Å; N652-N654 PolarHBondContact O-N 2.89Å; N652-N654 PolarHBondContact O-ND2 3.43Å; N654-W656 VanDerWaalsContact C-N 3.33Å; N654-W656 PolarHBondContact O-N 3.04Å; N654-G657 WeakPolarHBondContact CB-O 3.31Å; N654-N689 PolarHBondContact N-OD1 3.16Å; N654-N689 PolarHBondContact ND2-OD1 2.93Å; N654-N689 VanDerWaalsContact ND2-OD1 3.14Å; N654-R690 PolarHBondContact O-N 3.19Å
655	S	93.6	Very high	91.2	Very high	48 Å²	48	35.9 Å²	35.9	34%	0.336	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-16	-167.5	-59.1	0	0	0	0	113.6	N612 R613 M614 R690	N612-S655 PolarHBondContact O-N 3.1Å; R613-S655 WeakPolarHBondContact O-CB 3.34Å; M614-S655 PolarHBondContact O-N 3.09Å; S655-R690 CarbonylContact C-O 3.48Å
656	W	91.9	Very high	91.1	Very high	53.3333 Å²	53.3333	29.6 Å²	29.6	20%	0.202	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	39.3	-177.5	-159	-94.3	0	0	0	112.3	M614 R615 N654 Y691 H692 R1092	M614-W656 VanDerWaalsContact C-CB 3.46Å; M614-W656 HydrophobicContact CB-CB 4.37Å; M614-W656 WeakPolarHBondContact O-CB 3.24Å; M614-W656 PolarHBondContact O-N 2.91Å; M614-W656 VanDerWaalsContact O-N 3.09Å; R615-W656 HydrophobicContact CG-CB 4.49Å; R615-W656 WeakPolarHBondContact CG-O 3.38Å; N654-W656 VanDerWaalsContact C-N 3.33Å; N654-W656 PolarHBondContact O-N 3.04Å; W656-Y691 HydrophobicContact CD2-CD1 4.36Å; W656-Y691 AromaticContact CE3-CD1 3.84Å; W656-Y691 HydrophobicContact CE3-CD1 3.84Å; W656-Y691 HydrophobicContact CE3-CE1 4.33Å; W656-Y691 AromaticContact CH2-CD1 3.77Å; W656-Y691 HydrophobicContact CH2-CD1 3.85Å; W656-Y691 AromaticContact CH2-CE1 3.51Å; W656-Y691 HydrophobicContact CH2-CE1 3.51Å; W656-Y691 HydrophobicContact CZ2-CD1 4.38Å; W656-Y691 HydrophobicContact CZ2-CE1 4.09Å; W656-Y691 AromaticContact CZ3-CD1 3.52Å; W656-Y691 HydrophobicContact CZ3-CD1 3.52Å; W656-Y691 VanDerWaalsContact CZ3-CD1 3.42Å; W656-Y691 AromaticContact CZ3-CE1 3.56Å; W656-Y691 HydrophobicContact CZ3-CE1 3.56Å; W656-Y691 VanDerWaalsContact CZ3-CE1 3.47Å; W656-Y691 HydrophobicContact CZ3-CG 4.41Å; W656-H692 AromaticContact CD1-CD2 3.42Å; W656-H692 VanDerWaalsContact CD1-CD2 3.45Å; W656-H692 AromaticContact CD1-CG 3.88Å; W656-H692 AromaticContact CD1-ND1 3.75Å; W656-H692 AromaticContact CD2-CD2 3.53Å; W656-H692 VanDerWaalsContact CD2-CD2 3.48Å; W656-H692 AromaticContact CD2-CE1 3.91Å; W656-H692 AromaticContact CD2-ND1 3.49Å; W656-H692 AromaticContact CE2-CD2 3.12Å; W656-H692 AromaticContact CE2-CE1 3.16Å; W656-H692 AromaticContact CE2-ND1 3.2Å; W656-H692 AromaticContact CE2-NE2 3.4Å; W656-H692 AromaticContact CG-CD2 3.71Å; W656-H692 AromaticContact CG-ND1 3.87Å; W656-H692 AromaticContact CH2-CE1 3.69Å; W656-H692 AromaticContact CH2-NE2 3.85Å; W656-H692 AromaticContact CZ2-CD2 3.52Å; W656-H692 AromaticContact CZ2-CE1 3.06Å; W656-H692 WeakPolarHBondContact CZ2-CE1 3.31Å; W656-H692 AromaticContact CZ2-ND1 3.56Å; W656-H692 AromaticContact CZ2-NE2 3.34Å; W656-H692 WeakPolarHBondContact CZ2-NE2 3.37Å; W656-H692 AromaticContact NE1-CD2 3.35Å; W656-H692 PolarHBondContact NE1-CD2 3.05Å; W656-H692 AromaticContact NE1-CE1 3.39Å; W656-H692 PolarHBondContact NE1-CE1 3.13Å; W656-H692 AromaticContact NE1-CG 3.83Å; W656-H692 AromaticContact NE1-ND1 3.33Å; W656-H692 PolarHBondContact NE1-ND1 3.32Å; W656-H692 AromaticContact NE1-NE2 3.38Å; W656-H692 PolarHBondContact NE1-NE2 2.9Å; W656-H692 WeakPolarHBondContact O-CB 3.33Å; W656-R1092 VanDerWaalsContact CH2-NH1 3.25Å; W656-R1092 VanDerWaalsContact CH2-NH2 3.32Å; W656-R1092 VanDerWaalsContact CZ3-NH1 3.33Å
657	G	92.7	Very high	90.5	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.01	15%	0.145	C	C	.	.			trans	90.7	177.1	-179.5	0	0	0	0	0	114.3	R615 G616 N654 R690 H692 P693	R615-G657 WeakPolarHBondContact CA-O 3.37Å; G616-G657 PolarHBondContact N-O 3.17Å; N654-G657 WeakPolarHBondContact CB-O 3.31Å; G657-R690 PolarHBondContact N-O 2.95Å; G657-H692 WeakPolarHBondContact CA-O 3.36Å; G657-P693 CarbonylContact C-O 3.55Å; G657-P693 VanDerWaalsContact CA-O 3.28Å; G657-P693 WeakPolarHBondContact CA-O 3.3Å
658	G	95.8	Very high	88.8	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.01	16%	0.162	C	C	.	.	S	Bend	trans	-96.8	-94.4	-173	0	0	0	0	0	112.8	G616 F617 P693 A694	G616-G658 WeakPolarHBondContact CA-O 3.37Å; G616-G658 PolarHBondContact N-O 2.93Å; F617-G658 PolarHBondContact N-O 2.84Å; G658-P693 PolarHBondContact N-O 3.12Å; G658-A694 CarbonylContact C-O 3.44Å; G658-A694 WeakPolarHBondContact CA-O 3.37Å
659	I	97.3	Very high	87.3	Confident	1.66667 Å²	1.66667	29.4 Å²	29.4	1%	0.009	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126	-178.1	-62.5	176.1	0	0	0	109.6	F617 F636 V651 I661 F686 A694 F695 E696	F617-I659 HydrophobicContact CB-CG1 4.25Å; F617-I659 HydrophobicContact CD1-CG2 4.1Å; F617-I659 CarbonylContact O-C 3.57Å; F617-I659 WeakPolarHBondContact O-CA 3.17Å; F636-I659 HydrophobicContact CD1-CD1 3.76Å; F636-I659 HydrophobicContact CD2-CD1 4Å; F636-I659 HydrophobicContact CE1-CD1 3.67Å; F636-I659 HydrophobicContact CE1-CG1 4.33Å; F636-I659 HydrophobicContact CE2-CD1 3.93Å; F636-I659 HydrophobicContact CE2-CG2 4.38Å; F636-I659 HydrophobicContact CG-CD1 3.93Å; F636-I659 HydrophobicContact CZ-CD1 3.76Å; F636-I659 HydrophobicContact CZ-CG1 4.22Å; V651-I659 HydrophobicContact CG1-CG1 4.36Å; V651-I659 HydrophobicContact CG2-CD1 4.21Å; V651-I659 HydrophobicContact CG2-CG1 4.26Å; I659-I661 HydrophobicContact CG2-CD1 3.94Å; I659-I661 HydrophobicContact CG2-CG1 3.99Å; I659-F686 HydrophobicContact CB-CE1 4.38Å; I659-F686 HydrophobicContact CD1-CE1 3.68Å; I659-F686 HydrophobicContact CD1-CZ 3.69Å; I659-F686 HydrophobicContact CG1-CE1 3.85Å; I659-F686 HydrophobicContact CG1-CZ 4.34Å; I659-A694 PolarHBondContact N-O 2.89Å; I659-F695 HydrophobicContact CB-CD2 4.06Å; I659-F695 HydrophobicContact CG2-CD2 4.07Å; I659-F695 HydrophobicContact CG2-CE2 4.18Å; I659-F695 CarbonylContact O-C 3.31Å; I659-F695 WeakPolarHBondContact O-CA 3.43Å; I659-E696 PolarHBondContact O-N 3.16Å
660	L	96.5	Very high	85.2	Confident	8 Å²	8	36.6 Å²	36.6	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.6	170.5	176.5	64.3	0	0	0	110.2	R615 F617 A618 F619 E696 H698	R615-L660 VanDerWaalsContact CZ-CD2 3.45Å; F617-L660 PolarHBondContact O-N 2.97Å; A618-L660 CarbonylContact C-O 3.54Å; A618-L660 WeakPolarHBondContact CA-O 3.35Å; A618-L660 HydrophobicContact CB-CB 4.44Å; F619-L660 PolarHBondContact N-O 3.17Å; L660-E696 WeakPolarHBondContact CA-O 3.46Å; L660-E696 HydrophobicContact CD1-CB 3.81Å; L660-E696 HydrophobicContact CD1-CG 3.61Å; L660-H698 WeakPolarHBondContact CD1-NE2 3.37Å
661	I	95.7	Very high	83.3	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	112.5	173	-57.5	-161.3	0	0	0	108.8	F617 F619 V634 I659 V679 F695 E696 Y697 H698	F617-I661 HydrophobicContact CD1-CD1 4.28Å; F617-I661 HydrophobicContact CE1-CD1 3.89Å; F619-I661 HydrophobicContact CB-CD1 4.18Å; F619-I661 HydrophobicContact CD1-CG2 4.12Å; V634-I661 HydrophobicContact CB-CD1 4.24Å; V634-I661 HydrophobicContact CG1-CD1 3.76Å; V634-I661 HydrophobicContact CG1-CG1 4.38Å; V634-I661 HydrophobicContact CG2-CD1 4.43Å; I659-I661 HydrophobicContact CG2-CD1 3.94Å; I659-I661 HydrophobicContact CG2-CG1 3.99Å; I661-V679 HydrophobicContact CD1-CB 4.45Å; I661-V679 HydrophobicContact CD1-CG1 3.36Å; I661-V679 HydrophobicContact CD1-CG2 4.24Å; I661-V679 HydrophobicContact CG1-CG1 4.23Å; I661-V679 HydrophobicContact CG2-CG2 4.13Å; I661-F695 HydrophobicContact CD1-CE2 4.2Å; I661-F695 HydrophobicContact CG1-CE2 4.39Å; I661-E696 PolarHBondContact N-O 3.01Å; I661-Y697 HydrophobicContact CB-CD2 3.95Å; I661-Y697 HydrophobicContact CB-CE2 4.47Å; I661-Y697 HydrophobicContact CG1-CD2 4.45Å; I661-Y697 HydrophobicContact CG2-CD2 3.81Å; I661-Y697 HydrophobicContact CG2-CE2 4.02Å; I661-Y697 CarbonylContact O-C 3.57Å; I661-Y697 WeakPolarHBondContact O-CA 3.28Å; I661-H698 PolarHBondContact O-N 3.01Å
662	G	84.7	Confident	81.5	Confident	4.66667 Å²	4.66667	41.1 Å²	41.1	5%	0.048	22%	0.216	C	C	.	.			trans	-103.4	167.7	-177.1	0	0	0	0	0	115.2	F619 H620 H621 F664	F619-G662 VanDerWaalsContact O-CA 3.3Å; F619-G662 WeakPolarHBondContact O-CA 3.37Å; F619-G662 PolarHBondContact O-N 2.99Å; H620-G662 WeakPolarHBondContact CA-O 3.47Å; H621-G662 PolarHBondContact N-O 3.39Å; G662-F664 PolarHBondContact O-N 2.96Å
663	N	81.6	Confident	80	Confident	80.6667 Å²	80.6667	42.6 Å²	42.6	43%	0.431	23%	0.225	S	C	.	.			trans	-74.8	102.6	-140.4	64.5	-25	0	0	0	111.9	H621 C665 H698	H621-N663 WeakPolarHBondContact CB-O 3.32Å; N663-C665 PolarHBondContact O-N 3.09Å; N663-C665 VanDerWaalsContact O-N 3.15Å; N663-H698 VanDerWaalsContact CA-O 3.3Å; N663-H698 WeakPolarHBondContact CA-O 3.37Å; N663-H698 HydrophobicContact CB-CB 4.2Å; N663-H698 WeakPolarHBondContact CB-O 3.41Å; N663-H698 PolarHBondContact N-O 2.99Å
664	F	85.2	Confident	79	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.018	21%	0.21	C	C	.	.			trans	-74.2	103	173.9	178.9	-98.4	0	0	0	110.7	C598 F619 H621 F632 G662 T666 V674 P677 C700 P706	C598-F664 WeakPolarHBondContact O-CE2 3.38Å; F619-F664 HydrophobicContact CE1-CB 4.28Å; F619-F664 HydrophobicContact CZ-CD2 4.47Å; H621-F664 HydrophobicContact CB-CB 4.5Å; H621-F664 AromaticContact CE1-CD2 3.88Å; H621-F664 AromaticContact CE1-CE2 3.93Å; H621-F664 AromaticContact ND1-CD2 3.59Å; H621-F664 AromaticContact ND1-CE2 3.95Å; F632-F664 HydrophobicContact CB-CD1 4.25Å; F632-F664 HydrophobicContact CB-CD2 4.27Å; F632-F664 HydrophobicContact CB-CE1 3.78Å; F632-F664 HydrophobicContact CB-CE2 3.81Å; F632-F664 HydrophobicContact CB-CG 4.37Å; F632-F664 HydrophobicContact CB-CZ 3.78Å; F632-F664 VanDerWaalsContact CB-CZ 3.47Å; F632-F664 HydrophobicContact CD1-CB 4.05Å; F632-F664 AromaticContact CD1-CD1 3.59Å; F632-F664 HydrophobicContact CD1-CD1 3.59Å; F632-F664 AromaticContact CD1-CD2 3.77Å; F632-F664 HydrophobicContact CD1-CD2 4.07Å; F632-F664 AromaticContact CD1-CE1 3.9Å; F632-F664 HydrophobicContact CD1-CE1 3.99Å; F632-F664 HydrophobicContact CD1-CE2 4.29Å; F632-F664 AromaticContact CD1-CG 3.56Å; F632-F664 HydrophobicContact CD1-CG 3.87Å; F632-F664 VanDerWaalsContact CD1-CG 3.47Å; F632-F664 HydrophobicContact CD1-CZ 4.33Å; F632-F664 AromaticContact CD2-CD2 3.55Å; F632-F664 HydrophobicContact CD2-CD2 3.55Å; F632-F664 AromaticContact CD2-CE2 3.76Å; F632-F664 HydrophobicContact CD2-CE2 3.76Å; F632-F664 HydrophobicContact CD2-CG 4.15Å; F632-F664 HydrophobicContact CD2-CZ 4.39Å; F632-F664 HydrophobicContact CE1-CB 3.91Å; F632-F664 AromaticContact CE1-CD1 4Å; F632-F664 HydrophobicContact CE1-CD1 4.09Å; F632-F664 HydrophobicContact CE1-CD2 4.21Å; F632-F664 AromaticContact CE1-CG 3.72Å; F632-F664 HydrophobicContact CE1-CG 3.97Å; F632-F664 HydrophobicContact CE2-CB 4.37Å; F632-F664 AromaticContact CE2-CD2 3.81Å; F632-F664 HydrophobicContact CE2-CD2 3.81Å; F632-F664 HydrophobicContact CE2-CE2 4.26Å; F632-F664 HydrophobicContact CE2-CG 4.23Å; F632-F664 HydrophobicContact CG-CB 4.5Å; F632-F664 AromaticContact CG-CD1 3.92Å; F632-F664 HydrophobicContact CG-CD1 3.92Å; F632-F664 AromaticContact CG-CD2 3.68Å; F632-F664 HydrophobicContact CG-CD2 3.68Å; F632-F664 VanDerWaalsContact CG-CD2 3.49Å; F632-F664 AromaticContact CG-CE1 3.86Å; F632-F664 HydrophobicContact CG-CE1 3.96Å; F632-F664 AromaticContact CG-CE2 3.74Å; F632-F664 HydrophobicContact CG-CE2 3.74Å; F632-F664 AromaticContact CG-CG 3.75Å; F632-F664 HydrophobicContact CG-CG 3.96Å; F632-F664 AromaticContact CG-CZ 3.84Å; F632-F664 HydrophobicContact CG-CZ 3.84Å; F632-F664 HydrophobicContact CZ-CB 3.94Å; F632-F664 HydrophobicContact CZ-CD2 4.18Å; F632-F664 HydrophobicContact CZ-CG 4.14Å; G662-F664 PolarHBondContact O-N 2.96Å; F664-T666 HydrophobicContact CE1-CG2 3.66Å; F664-T666 HydrophobicContact CE2-CG2 4.16Å; F664-T666 HydrophobicContact CZ-CG2 3.78Å; F664-V674 HydrophobicContact CE1-CB 4.33Å; F664-V674 HydrophobicContact CZ-CB 4.16Å; F664-V674 HydrophobicContact CZ-CG2 4.23Å; F664-P677 HydrophobicContact CD1-CB 4Å; F664-P677 HydrophobicContact CD1-CG 4.1Å; F664-P677 HydrophobicContact CE1-CB 3.91Å; F664-P677 HydrophobicContact CE1-CG 4.01Å; F664-P677 HydrophobicContact CG-CB 4.48Å; F664-P677 HydrophobicContact CZ-CB 4.4Å; F664-C700 VanDerWaalsContact O-CB 3.32Å; F664-C700 WeakPolarHBondContact O-CB 3.36Å; F664-P706 HydrophobicContact CE1-CG 3.79Å
665	C	85.4	Confident	77.9	Confident	21.6667 Å²	21.6667	50.5 Å²	50.5	15%	0.146	25%	0.253	C	S	.	.			trans	-112.1	138.4	171.9	-66.7	0	0	0	0	110	H621 N663 C700	H621-C665 PolarHBondContact CD2-O 3.07Å; H621-C665 PolarHBondContact CE1-O 3.15Å; H621-C665 PolarHBondContact NE2-O 3.21Å; H621-C665 VanDerWaalsContact NE2-O 3.12Å; N663-C665 PolarHBondContact O-N 3.09Å; N663-C665 VanDerWaalsContact O-N 3.15Å; C665-C700 VanDerWaalsContact CA-SG 3.54Å; C665-C700 WeakPolarHBondContact CA-SG 3.28Å; C665-C700 HydrophobicContact CB-CB 4.2Å; C665-C700 WeakPolarHBondContact CB-SG 3.43Å; C665-C700 VanDerWaalsContact SG-CA 3.56Å; C665-C700 WeakPolarHBondContact SG-CB 3.23Å; C665-C700 CovalentContact SG-SG 2.04Å; C665-C700 PolarHBondContact SG-SG 2.93Å
666	T	77	Confident	77.5	Confident	15.6667 Å²	15.6667	51 Å²	51	10%	0.096	25%	0.252	C	S	.	.			trans	-92.4	149	172	60.8	0	0	0	0	110.6	F664 V673 V674 Q705 P706	F664-T666 HydrophobicContact CE1-CG2 3.66Å; F664-T666 HydrophobicContact CE2-CG2 4.16Å; F664-T666 HydrophobicContact CZ-CG2 3.78Å; T666-V673 HydrophobicContact CG2-CG1 4.43Å; T666-V674 HydrophobicContact CG2-CB 4.16Å; T666-V674 HydrophobicContact CG2-CG2 4.2Å; T666-Q705 PolarHBondContact O-NE2 3.18Å; T666-Q705 PolarHBondContact O-OE1 3.12Å; T666-Q705 PolarHBondContact OG1-OE1 2.96Å; T666-P706 HydrophobicContact CG2-CG 3.97Å; T666-P706 VanDerWaalsContact OG1-CD 3.24Å; T666-P706 WeakPolarHBondContact OG1-CD 3.41Å
667	T	67.7	Low	77.6	Confident	57.3333 Å²	57.3333	48.4 Å²	48.4	35%	0.352	24%	0.242	S	C	.	.			trans	-60.7	143.9	176	60.3	0	0	0	0	110.9	E623 D669	E623-T667 HydrophobicContact CG-CG2 4.37Å; E623-T667 VanDerWaalsContact OE1-CB 3.27Å; E623-T667 WeakPolarHBondContact OE1-CB 3.11Å; E623-T667 WeakPolarHBondContact OE1-CG2 3.38Å; E623-T667 PolarHBondContact OE1-N 3.02Å; E623-T667 PolarHBondContact OE1-OG1 3.26Å; E623-T667 WeakPolarHBondContact OE2-CG2 3.29Å; E623-T667 PolarHBondContact OE2-N 3.27Å; T667-D669 PolarHBondContact O-N 3.1Å; T667-D669 VanDerWaalsContact O-N 3.09Å
668	A	52.6	Low	77.6	Confident	90 Å²	90	53.3 Å²	53.3	74%	0.744	26%	0.26	S	S	*	.	S	Bend	trans	-66.1	-3.1	180	0	0	0	0	0	114.3	K670	A668-K670 VanDerWaalsContact C-N 3.3Å; A668-K670 WeakPolarHBondContact O-CG 3.48Å; A668-K670 PolarHBondContact O-N 3.14Å
669	D	59.3	Low	77.7	Confident	56 Å²	56	53.3 Å²	53.3	30%	0.299	26%	0.26	S	S	.	.			trans	-68	93.4	173.9	-165.5	2.5	0	0	0	108.8	R477 T667 R671 Y672	R477-D669 IonicContact CZ-OD2 3.43Å; R477-D669 VanDerWaalsContact CZ-OD2 3.28Å; R477-D669 IonicContact NH1-OD2 3.21Å; R477-D669 PolarHBondContact NH1-OD2 3.13Å; R477-D669 IonicContact NH2-OD2 2.74Å; R477-D669 PolarHBondContact NH2-OD2 3.29Å; T667-D669 PolarHBondContact O-N 3.1Å; T667-D669 VanDerWaalsContact O-N 3.09Å; D669-R671 PolarHBondContact O-N 3.21Å; D669-R671 IonicContact OD1-NE 3.68Å; D669-R671 PolarHBondContact OD1-NE 3.35Å; D669-Y672 PolarHBondContact O-N 3.02Å
670	K	51.5	Low	77.7	Confident	152.667 Å²	152.667	54.6 Å²	54.6	66%	0.664	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-15.2	-171.1	-66.2	-177.9	177.6	179.4	0	115.1	A668 Y672	A668-K670 VanDerWaalsContact C-N 3.3Å; A668-K670 WeakPolarHBondContact O-CG 3.48Å; A668-K670 PolarHBondContact O-N 3.14Å; K670-Y672 VanDerWaalsContact C-N 3.34Å
671	R	55.4	Low	77.7	Confident	121.667 Å²	121.667	54.2 Å²	54.2	46%	0.459	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-24	-173.3	-64	-172.2	-115.6	-162.1	-4.9	113.9	S452 D669	S452-R671 PolarHBondContact OG-NH1 2.76Å; D669-R671 PolarHBondContact O-N 3.21Å; D669-R671 IonicContact OD1-NE 3.68Å; D669-R671 PolarHBondContact OD1-NE 3.35Å
672	Y	59.9	Low	77.7	Confident	41.6667 Å²	41.6667	54.8 Å²	54.8	16%	0.163	27%	0.271	C	S	.	.			trans	-137.5	84	-177.9	-86.4	-82.9	0	0	0	112.3	Y454 P475 L628 P629 L630 D669 K670	Y454-Y672 AromaticContact CD1-CE1 3.91Å; Y454-Y672 HydrophobicContact CD1-CE1 3.91Å; Y454-Y672 AromaticContact CD1-CZ 3.82Å; Y454-Y672 WeakPolarHBondContact CD1-OH 3.47Å; Y454-Y672 AromaticContact CE1-CE1 3.36Å; Y454-Y672 HydrophobicContact CE1-CE1 3.36Å; Y454-Y672 HydrophobicContact CE1-CE2 4.26Å; Y454-Y672 AromaticContact CE1-CZ 3.15Å; Y454-Y672 WeakPolarHBondContact CE1-OH 3.42Å; Y454-Y672 AromaticContact CZ-CZ 3.66Å; Y454-Y672 PolarHBondContact OH-OH 2.95Å; P475-Y672 WeakPolarHBondContact CA-OH 3.34Å; P475-Y672 HydrophobicContact CB-CD2 4.39Å; P475-Y672 HydrophobicContact CB-CE1 3.94Å; P475-Y672 HydrophobicContact CB-CE2 3.62Å; P475-Y672 WeakPolarHBondContact CB-OH 3.42Å; P475-Y672 HydrophobicContact CG-CD1 3.78Å; P475-Y672 HydrophobicContact CG-CD2 3.76Å; P475-Y672 HydrophobicContact CG-CE1 3.42Å; P475-Y672 VanDerWaalsContact CG-CE1 3.42Å; P475-Y672 HydrophobicContact CG-CE2 3.92Å; P475-Y672 HydrophobicContact CG-CG 3.9Å; L628-Y672 HydrophobicContact CD1-CD1 3.46Å; L628-Y672 VanDerWaalsContact CD1-CD1 3.46Å; L628-Y672 HydrophobicContact CD1-CE1 3.86Å; L628-Y672 HydrophobicContact CD1-CG 4.2Å; L628-Y672 HydrophobicContact CD2-CD1 3.89Å; L628-Y672 HydrophobicContact CD2-CE1 3.78Å; L628-Y672 HydrophobicContact CD2-CE2 4.43Å; L628-Y672 HydrophobicContact CD2-CG 4.24Å; L628-Y672 HydrophobicContact CG-CD1 3.9Å; L628-Y672 HydrophobicContact CG-CE1 3.78Å; P629-Y672 WeakPolarHBondContact O-CE1 3.34Å; L630-Y672 WeakPolarHBondContact CD2-OH 3.13Å; D669-Y672 PolarHBondContact O-N 3.02Å; K670-Y672 VanDerWaalsContact C-N 3.34Å
673	V	64.5	Low	78.2	Confident	51 Å²	51	59.4 Å²	59.4	31%	0.309	29%	0.287	S	S	.	.			trans	-103.1	129.1	175.9	-175.5	0	0	0	0	108.7	T666 R675 P706	T666-V673 HydrophobicContact CG2-CG1 4.43Å; V673-R675 WeakPolarHBondContact O-CG 3.23Å; V673-R675 PolarHBondContact O-N 3.35Å; V673-R675 VanDerWaalsContact O-N 3.1Å; V673-P706 HydrophobicContact CG1-CB 3.91Å; V673-P706 HydrophobicContact CG1-CG 3.71Å
674	V	74.5	Confident	78.9	Confident	12 Å²	12	55.5 Å²	55.5	7%	0.073	27%	0.267	C	S	.	.			trans	-59.7	110.6	167.1	176.1	0	0	0	0	107.5	P629 F632 F664 T666 D676 P677 P706	P629-V674 HydrophobicContact CG-CG2 4.16Å; F632-V674 HydrophobicContact CB-CG1 4.26Å; F664-V674 HydrophobicContact CE1-CB 4.33Å; F664-V674 HydrophobicContact CZ-CB 4.16Å; F664-V674 HydrophobicContact CZ-CG2 4.23Å; T666-V674 HydrophobicContact CG2-CB 4.16Å; T666-V674 HydrophobicContact CG2-CG2 4.2Å; V674-D676 VanDerWaalsContact C-N 3.31Å; V674-D676 PolarHBondContact O-N 3.02Å; V674-P677 HydrophobicContact CG1-CB 4.33Å; V674-P706 WeakPolarHBondContact O-CB 3.29Å; V674-P706 WeakPolarHBondContact O-CG 3.4Å
675	R	74.1	Confident	79.3	Confident	237.333 Å²	237.333	57.7 Å²	57.7	90%	0.896	28%	0.277	S	S	*	.	S	Bend	trans	-75.8	13.4	-169.9	-64.5	-172.2	179.8	-153.7	-0.8	112.6	V673	V673-R675 WeakPolarHBondContact O-CG 3.23Å; V673-R675 PolarHBondContact O-N 3.35Å; V673-R675 VanDerWaalsContact O-N 3.1Å
676	D	85	Confident	79.9	Confident	58.3333 Å²	58.3333	56.7 Å²	56.7	31%	0.312	27%	0.27	S	S	.	.			trans	174.5	66.7	179.7	-164.6	30.1	0	0	0	113	V674 R678 R709	V674-D676 VanDerWaalsContact C-N 3.31Å; V674-D676 PolarHBondContact O-N 3.02Å; D676-R678 WeakPolarHBondContact O-CG 3.41Å; D676-R678 PolarHBondContact O-N 3.38Å; D676-R678 IonicContact OD1-NE 3.63Å; D676-R678 IonicContact OD2-CZ 3.35Å; D676-R678 IonicContact OD2-NE 2.85Å; D676-R678 PolarHBondContact OD2-NE 2.92Å; D676-R678 IonicContact OD2-NH2 3.8Å; D676-R678 PolarHBondContact OD2-NH2 2.96Å; D676-R709 VanDerWaalsContact CG-NH1 3.33Å; D676-R709 VanDerWaalsContact OD1-CD 3.27Å; D676-R709 WeakPolarHBondContact OD1-CD 3.26Å; D676-R709 IonicContact OD1-CZ 3.4Å; D676-R709 VanDerWaalsContact OD1-CZ 3.31Å; D676-R709 IonicContact OD1-NE 3.32Å; D676-R709 PolarHBondContact OD1-NE 3.01Å; D676-R709 IonicContact OD1-NH1 2.98Å; D676-R709 PolarHBondContact OD1-NH1 2.92Å; D676-R709 IonicContact OD2-CZ 2.89Å; D676-R709 IonicContact OD2-NH1 3Å; D676-R709 PolarHBondContact OD2-NH1 3.39Å
677	P	92.2	Very high	80.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.275	C	S	.	.			trans	-63.2	134.2	172.5	24.3	-27.5	0	0	0	110.3	F632 F664 V674 P706 T708 R709	F632-P677 HydrophobicContact CB-CB 4.21Å; F632-P677 HydrophobicContact CD1-CB 3.73Å; F632-P677 HydrophobicContact CE1-CB 4.36Å; F632-P677 HydrophobicContact CG-CB 4.05Å; F632-P677 WeakPolarHBondContact O-CA 3.38Å; F664-P677 HydrophobicContact CD1-CB 4Å; F664-P677 HydrophobicContact CD1-CG 4.1Å; F664-P677 HydrophobicContact CE1-CB 3.91Å; F664-P677 HydrophobicContact CE1-CG 4.01Å; F664-P677 HydrophobicContact CG-CB 4.48Å; F664-P677 HydrophobicContact CZ-CB 4.4Å; V674-P677 HydrophobicContact CG1-CB 4.33Å; P677-P706 HydrophobicContact CG-CB 4.18Å; P677-P706 HydrophobicContact CG-CG 4.04Å; P677-T708 HydrophobicContact CB-CG2 4.22Å; P677-T708 HydrophobicContact CG-CG2 4.29Å; P677-T708 WeakPolarHBondContact CG-OG1 3.37Å; P677-T708 WeakPolarHBondContact O-CA 3.36Å; P677-R709 PolarHBondContact O-N 2.95Å
678	R	94.4	Very high	82	Confident	103 Å²	103	55.5 Å²	55.5	39%	0.389	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142.6	-174.6	32.9	-178	177.6	-179.5	-0.5	114.3	F632 E633 V634 D676 R709	F632-R678 PolarHBondContact O-N 3.22Å; E633-R678 CarbonylContact C-O 3.32Å; E633-R678 VanDerWaalsContact CA-O 3.26Å; E633-R678 WeakPolarHBondContact CA-O 3.39Å; E633-R678 HydrophobicContact CB-CG 3.93Å; E633-R678 HydrophobicContact CG-CG 3.88Å; E633-R678 IonicContact OE1-CZ 3.76Å; E633-R678 VanDerWaalsContact OE1-CZ 3.25Å; E633-R678 IonicContact OE1-NE 3.6Å; E633-R678 PolarHBondContact OE1-NE 3.08Å; E633-R678 IonicContact OE1-NH2 3.09Å; E633-R678 PolarHBondContact OE1-NH2 3.06Å; E633-R678 IonicContact OE2-CZ 3.64Å; E633-R678 IonicContact OE2-NE 3.1Å; E633-R678 PolarHBondContact OE2-NE 3.4Å; E633-R678 IonicContact OE2-NH2 2.64Å; E633-R678 PolarHBondContact OE2-NH2 3.16Å; V634-R678 PolarHBondContact N-O 3.06Å; D676-R678 WeakPolarHBondContact O-CG 3.41Å; D676-R678 PolarHBondContact O-N 3.38Å; D676-R678 IonicContact OD1-NE 3.63Å; D676-R678 IonicContact OD2-CZ 3.35Å; D676-R678 IonicContact OD2-NE 2.85Å; D676-R678 PolarHBondContact OD2-NE 2.92Å; D676-R678 IonicContact OD2-NH2 3.8Å; D676-R678 PolarHBondContact OD2-NH2 2.96Å; R678-R709 CarbonylContact C-O 3.44Å; R678-R709 WeakPolarHBondContact CA-O 3.37Å; R678-R709 HydrophobicContact CB-CB 4.24Å; R678-R709 HydrophobicContact CG-CB 4.37Å
679	V	96.5	Very high	84	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	121.8	171.3	177.9	0	0	0	0	107.6	F632 V634 I661 V681 F695 Y697 T708 R709 V710 E711	F632-V679 HydrophobicContact CE1-CG2 4.38Å; V634-V679 HydrophobicContact CB-CG1 4.35Å; V634-V679 HydrophobicContact CB-CG2 4.41Å; V634-V679 CarbonylContact O-C 3.48Å; V634-V679 VanDerWaalsContact O-CA 3.28Å; V634-V679 WeakPolarHBondContact O-CA 3.34Å; I661-V679 HydrophobicContact CD1-CB 4.45Å; I661-V679 HydrophobicContact CD1-CG1 3.36Å; I661-V679 HydrophobicContact CD1-CG2 4.24Å; I661-V679 HydrophobicContact CG1-CG1 4.23Å; I661-V679 HydrophobicContact CG2-CG2 4.13Å; V679-V681 HydrophobicContact CG1-CG2 4.49Å; V679-F695 HydrophobicContact CG1-CZ 4.38Å; V679-Y697 HydrophobicContact CG2-CD2 4.33Å; V679-Y697 HydrophobicContact CG2-CE2 4.02Å; V679-T708 HydrophobicContact CG2-CG2 4.47Å; V679-R709 PolarHBondContact N-O 2.94Å; V679-V710 HydrophobicContact CB-CB 4.45Å; V679-V710 HydrophobicContact CB-CG1 4.28Å; V679-V710 HydrophobicContact CB-CG2 4.17Å; V679-V710 HydrophobicContact CG1-CG1 4.34Å; V679-V710 HydrophobicContact CG2-CG2 4.44Å; V679-V710 CarbonylContact O-C 3.54Å; V679-V710 VanDerWaalsContact O-CA 3.32Å; V679-V710 WeakPolarHBondContact O-CA 3.24Å; V679-E711 PolarHBondContact O-N 3.14Å
680	V	97.2	Very high	85.5	Confident	30 Å²	30	55 Å²	55	18%	0.182	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	120.8	-178.1	-177.4	0	0	0	0	109.1	V634 V635 F636 A682 E711	V634-V680 PolarHBondContact O-N 3.17Å; V635-V680 CarbonylContact C-O 3.55Å; V635-V680 VanDerWaalsContact CA-O 3.32Å; V635-V680 WeakPolarHBondContact CA-O 3.44Å; V635-V680 HydrophobicContact CG1-CB 4.47Å; V635-V680 HydrophobicContact CG2-CB 4.36Å; V635-V680 HydrophobicContact CG2-CG2 4.45Å; F636-V680 PolarHBondContact N-O 3.18Å; V680-A682 HydrophobicContact CG1-CB 4.42Å; V680-E711 CarbonylContact C-O 3.5Å; V680-E711 WeakPolarHBondContact CA-O 3.33Å
681	V	97	Very high	87.2	Confident	0.333333 Å²	0.333333	50.1 Å²	50.1	0%	0.002	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	99.7	175.2	-178.4	0	0	0	0	108.3	F636 V679 V684 F686 F695 E711 V712 S713 S715	F636-V681 HydrophobicContact CB-CG1 4.4Å; F636-V681 HydrophobicContact CB-CG2 4.45Å; V679-V681 HydrophobicContact CG1-CG2 4.49Å; V681-V684 HydrophobicContact CG1-CB 4Å; V681-V684 HydrophobicContact CG1-CG2 3.72Å; V681-F686 HydrophobicContact CG1-CE2 4Å; V681-F686 HydrophobicContact CG1-CZ 3.95Å; V681-F695 HydrophobicContact CG2-CD2 4.2Å; V681-F695 HydrophobicContact CG2-CE2 3.65Å; V681-F695 HydrophobicContact CG2-CZ 4.37Å; V681-E711 PolarHBondContact N-O 2.98Å; V681-V712 HydrophobicContact CB-CG1 4.26Å; V681-V712 HydrophobicContact CB-CG2 4.08Å; V681-V712 HydrophobicContact CG1-CG1 4.42Å; V681-V712 HydrophobicContact CG2-CG2 4.44Å; V681-V712 CarbonylContact O-C 3.49Å; V681-V712 WeakPolarHBondContact O-CA 3.34Å; V681-S713 PolarHBondContact O-N 3.12Å; V681-S715 PolarHBondContact O-OG 3.24Å
682	A	95.5	Very high	88.9	Confident	12.3333 Å²	12.3333	45.5 Å²	45.5	10%	0.102	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.3	-173.4	0	0	0	0	0	111.4	F636 K637 G638 V680 V684 S713	F636-A682 PolarHBondContact O-N 3.27Å; K637-A682 CarbonylContact C-O 3.54Å; K637-A682 WeakPolarHBondContact CA-O 3.33Å; G638-A682 PolarHBondContact N-O 2.96Å; V680-A682 HydrophobicContact CG1-CB 4.42Å; A682-V684 VanDerWaalsContact C-N 3.29Å; A682-V684 PolarHBondContact O-N 3.01Å; A682-S713 CarbonylContact C-O 3.53Å; A682-S713 VanDerWaalsContact CA-O 3.28Å; A682-S713 WeakPolarHBondContact CA-O 3.33Å
683	Y	95.3	Very high	90.5	Very high	101.333 Å²	101.333	43.8 Å²	43.8	40%	0.397	20%	0.196	S	C	.	.	S	Bend	trans	56	37.6	175	-49.9	-75.9	0	0	0	114.6	G638 R639 P640 S713 S715	G638-Y683 CarbonylContact C-O 3.52Å; G638-Y683 VanDerWaalsContact CA-O 3.25Å; G638-Y683 WeakPolarHBondContact CA-O 3.27Å; R639-Y683 PolarHBondContact N-O 3.17Å; P640-Y683 HydrophobicContact CB-CD1 4.16Å; P640-Y683 HydrophobicContact CB-CD2 4.39Å; P640-Y683 HydrophobicContact CB-CE1 4.06Å; P640-Y683 HydrophobicContact CB-CE2 4.32Å; P640-Y683 HydrophobicContact CB-CG 4.31Å; P640-Y683 HydrophobicContact CG-CD1 4.36Å; P640-Y683 HydrophobicContact CG-CD2 3.88Å; P640-Y683 HydrophobicContact CG-CE1 4.4Å; P640-Y683 HydrophobicContact CG-CE2 3.94Å; P640-Y683 HydrophobicContact CG-CG 4.17Å; Y683-S713 PolarHBondContact N-O 3Å; Y683-S715 PolarHBondContact N-OG 3.1Å
684	V	96	Very high	92	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	140.7	177.9	-179.6	0	0	0	0	110.2	F636 T649 V651 V681 A682 F686 S715 V716	F636-V684 HydrophobicContact CB-CG2 3.72Å; T649-V684 HydrophobicContact CG2-CG1 4.28Å; T649-V684 HydrophobicContact CG2-CG2 4.3Å; V651-V684 HydrophobicContact CG2-CG1 4.19Å; V681-V684 HydrophobicContact CG1-CB 4Å; V681-V684 HydrophobicContact CG1-CG2 3.72Å; A682-V684 VanDerWaalsContact C-N 3.29Å; A682-V684 PolarHBondContact O-N 3.01Å; V684-F686 HydrophobicContact CB-CD2 4.38Å; V684-F686 HydrophobicContact CB-CE2 3.77Å; V684-F686 HydrophobicContact CB-CZ 4.24Å; V684-F686 HydrophobicContact CG1-CD2 4.06Å; V684-F686 HydrophobicContact CG1-CE1 4.33Å; V684-F686 HydrophobicContact CG1-CE2 3.62Å; V684-F686 HydrophobicContact CG1-CZ 3.77Å; V684-S715 PolarHBondContact N-OG 3.02Å; V684-S715 VanDerWaalsContact N-OG 3.13Å; V684-S715 CarbonylContact O-C 3.57Å; V684-S715 WeakPolarHBondContact O-CA 3.26Å; V684-S715 VanDerWaalsContact O-CB 3.27Å; V684-S715 WeakPolarHBondContact O-CB 3.43Å; V684-V716 PolarHBondContact O-N 3.06Å
685	E	95.3	Very high	93.1	Very high	49.6667 Å²	49.6667	40.9 Å²	40.9	23%	0.232	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	113	174.2	-64.5	-164.4	-156.3	0	0	111	T649 Y650 V651 V687 V716 R718	T649-E685 PolarHBondContact O-N 3.03Å; T649-E685 VanDerWaalsContact O-N 3.11Å; Y650-E685 WeakPolarHBondContact CA-O 3.39Å; Y650-E685 HydrophobicContact CD1-CB 3.7Å; Y650-E685 HydrophobicContact CD1-CG 4.41Å; Y650-E685 HydrophobicContact CE1-CB 3.97Å; Y650-E685 HydrophobicContact CE1-CG 4.19Å; Y650-E685 WeakPolarHBondContact CE1-OE2 3.36Å; V651-E685 PolarHBondContact N-O 3.04Å; E685-V687 HydrophobicContact CB-CG2 4.44Å; E685-V716 HydrophobicContact CG-CB 4.39Å; E685-R718 IonicContact OE2-NH1 2.66Å
686	F	96.5	Very high	94.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	108.6	173.3	-62.1	-91.2	0	0	0	109.5	V651 I659 V681 V684 A694 F695 V716 F717 R718	V651-F686 HydrophobicContact CB-CD1 3.98Å; V651-F686 HydrophobicContact CB-CE1 4.14Å; V651-F686 HydrophobicContact CG1-CD1 4.29Å; V651-F686 HydrophobicContact CG1-CE1 4.4Å; V651-F686 HydrophobicContact CG2-CE1 4.43Å; V651-F686 WeakPolarHBondContact O-CA 3.37Å; I659-F686 HydrophobicContact CB-CE1 4.38Å; I659-F686 HydrophobicContact CD1-CE1 3.68Å; I659-F686 HydrophobicContact CD1-CZ 3.69Å; I659-F686 HydrophobicContact CG1-CE1 3.85Å; I659-F686 HydrophobicContact CG1-CZ 4.34Å; V681-F686 HydrophobicContact CG1-CE2 4Å; V681-F686 HydrophobicContact CG1-CZ 3.95Å; V684-F686 HydrophobicContact CB-CD2 4.38Å; V684-F686 HydrophobicContact CB-CE2 3.77Å; V684-F686 HydrophobicContact CB-CZ 4.24Å; V684-F686 HydrophobicContact CG1-CD2 4.06Å; V684-F686 HydrophobicContact CG1-CE1 4.33Å; V684-F686 HydrophobicContact CG1-CE2 3.62Å; V684-F686 HydrophobicContact CG1-CZ 3.77Å; F686-A694 HydrophobicContact CB-CB 4.14Å; F686-A694 HydrophobicContact CD1-CB 4.14Å; F686-A694 WeakPolarHBondContact CD1-O 3.3Å; F686-A694 VanDerWaalsContact CE1-O 3.3Å; F686-A694 WeakPolarHBondContact CE1-O 3.35Å; F686-A694 HydrophobicContact CG-CB 4.37Å; F686-F695 HydrophobicContact CZ-CB 4.46Å; F686-V716 PolarHBondContact N-O 3.05Å; F686-F717 HydrophobicContact CB-CD1 3.61Å; F686-F717 HydrophobicContact CB-CE1 3.97Å; F686-F717 HydrophobicContact CB-CG 4.22Å; F686-F717 HydrophobicContact CD1-CE1 4.21Å; F686-F717 AromaticContact CD2-CD1 3.79Å; F686-F717 HydrophobicContact CD2-CD1 3.79Å; F686-F717 HydrophobicContact CD2-CD2 4.41Å; F686-F717 AromaticContact CD2-CE1 3.36Å; F686-F717 HydrophobicContact CD2-CE1 3.36Å; F686-F717 VanDerWaalsContact CD2-CE1 3.42Å; F686-F717 HydrophobicContact CD2-CE2 4.05Å; F686-F717 HydrophobicContact CD2-CG 4.29Å; F686-F717 AromaticContact CD2-CZ 3.51Å; F686-F717 HydrophobicContact CD2-CZ 3.51Å; F686-F717 VanDerWaalsContact CD2-CZ 3.49Å; F686-F717 AromaticContact CE2-CE1 3.8Å; F686-F717 HydrophobicContact CE2-CE1 3.8Å; F686-F717 HydrophobicContact CE2-CE2 4.32Å; F686-F717 AromaticContact CE2-CZ 3.61Å; F686-F717 HydrophobicContact CE2-CZ 3.61Å; F686-F717 AromaticContact CG-CD1 3.8Å; F686-F717 HydrophobicContact CG-CD1 3.8Å; F686-F717 AromaticContact CG-CE1 3.6Å; F686-F717 HydrophobicContact CG-CE1 3.6Å; F686-F717 HydrophobicContact CG-CZ 4.23Å; F686-F717 HydrophobicContact CZ-CE1 4.37Å; F686-F717 HydrophobicContact CZ-CZ 4.39Å; F686-F717 CarbonylContact O-C 3.57Å; F686-F717 WeakPolarHBondContact O-CA 3.3Å; F686-R718 PolarHBondContact O-N 3.11Å
687	V	95.2	Very high	94.7	Very high	33.6667 Å²	33.6667	27.5 Å²	27.5	20%	0.204	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.3	-173.7	-174.6	0	0	0	0	111	V651 N652 E653 E685 N689 R718 L719	V651-V687 PolarHBondContact O-N 3.15Å; N652-V687 CarbonylContact C-O 3.54Å; N652-V687 WeakPolarHBondContact CA-O 3.36Å; N652-V687 HydrophobicContact CB-CB 3.95Å; N652-V687 WeakPolarHBondContact CB-O 3.4Å; E653-V687 PolarHBondContact N-O 2.83Å; E685-V687 HydrophobicContact CB-CG2 4.44Å; V687-N689 PolarHBondContact O-N 3.12Å; V687-N689 VanDerWaalsContact O-N 3.14Å; V687-R718 CarbonylContact C-O 3.58Å; V687-R718 WeakPolarHBondContact CA-O 3.29Å; V687-L719 HydrophobicContact CG1-CD1 4.46Å
688	G	94.1	Very high	94.8	Very high	14.3333 Å²	14.3333	30.8 Å²	30.8	15%	0.148	14%	0.139	C	C	.	.	S	Bend	trans	65.5	19.9	169.7	0	0	0	0	0	115.2	E653 R690 R718 L719	E653-G688 WeakPolarHBondContact CA-O 3.42Å; G688-R690 WeakPolarHBondContact O-CG 3.05Å; G688-R718 PolarHBondContact N-O 3.25Å; G688-L719 WeakPolarHBondContact CA-O 3.4Å
689	N	94.4	Very high	94.8	Very high	0.666667 Å²	0.666667	25.9 Å²	25.9	0%	0.004	12%	0.121	C	C	.	.			trans	-68.3	136.5	173.4	-64.2	-62.9	0	0	0	109.3	V651 N654 V687 A694 S720 T721	V651-N689 PolarHBondContact O-ND2 2.97Å; V651-N689 PolarHBondContact O-OD1 2.86Å; N654-N689 PolarHBondContact N-OD1 3.16Å; N654-N689 PolarHBondContact ND2-OD1 2.93Å; N654-N689 VanDerWaalsContact ND2-OD1 3.14Å; V687-N689 PolarHBondContact O-N 3.12Å; V687-N689 VanDerWaalsContact O-N 3.14Å; N689-A694 HydrophobicContact CB-CB 4.3Å; N689-S720 WeakPolarHBondContact O-CA 3.14Å; N689-T721 PolarHBondContact O-N 3.31Å
690	R	92	Very high	94.6	Very high	134 Å²	134	26.1 Å²	26.1	51%	0.506	12%	0.122	S	C	.	.			trans	-109.7	153.5	-168.7	-57.5	-176.6	-147.6	-173.5	-0.7	112.3	E653 N654 S655 G657 G688 H692 T721	E653-R690 PolarHBondContact O-NH2 3.12Å; N654-R690 PolarHBondContact O-N 3.19Å; S655-R690 CarbonylContact C-O 3.48Å; G657-R690 PolarHBondContact N-O 2.95Å; G688-R690 WeakPolarHBondContact O-CG 3.05Å; R690-H692 VanDerWaalsContact C-N 3.3Å; R690-H692 PolarHBondContact O-N 3.06Å; R690-T721 VanDerWaalsContact CA-OG1 3.27Å; R690-T721 WeakPolarHBondContact CA-OG1 3.38Å
691	Y	86.6	Confident	94.4	Very high	51 Å²	51	29 Å²	29	20%	0.2	13%	0.133	C	C	.	.	S	Bend	trans	66.3	-71.8	168.7	-159.7	-106.7	0	0	0	114.4	W656 T721 G722 R1080 E1082 E1085 R1092	W656-Y691 HydrophobicContact CD2-CD1 4.36Å; W656-Y691 AromaticContact CE3-CD1 3.84Å; W656-Y691 HydrophobicContact CE3-CD1 3.84Å; W656-Y691 HydrophobicContact CE3-CE1 4.33Å; W656-Y691 AromaticContact CH2-CD1 3.77Å; W656-Y691 HydrophobicContact CH2-CD1 3.85Å; W656-Y691 AromaticContact CH2-CE1 3.51Å; W656-Y691 HydrophobicContact CH2-CE1 3.51Å; W656-Y691 HydrophobicContact CZ2-CD1 4.38Å; W656-Y691 HydrophobicContact CZ2-CE1 4.09Å; W656-Y691 AromaticContact CZ3-CD1 3.52Å; W656-Y691 HydrophobicContact CZ3-CD1 3.52Å; W656-Y691 VanDerWaalsContact CZ3-CD1 3.42Å; W656-Y691 AromaticContact CZ3-CE1 3.56Å; W656-Y691 HydrophobicContact CZ3-CE1 3.56Å; W656-Y691 VanDerWaalsContact CZ3-CE1 3.47Å; W656-Y691 HydrophobicContact CZ3-CG 4.41Å; Y691-T721 PolarHBondContact N-OG1 3.14Å; Y691-G722 VanDerWaalsContact O-CA 3.25Å; Y691-G722 WeakPolarHBondContact O-CA 3.28Å; Y691-R1080 PolarHBondContact OH-O 2.94Å; Y691-E1082 HydrophobicContact CE1-CG 3.74Å; Y691-E1082 HydrophobicContact CE2-CG 4.41Å; Y691-E1082 VanDerWaalsContact CZ-CG 3.47Å; Y691-E1082 WeakPolarHBondContact OH-CG 3.4Å; Y691-E1085 WeakPolarHBondContact CE2-OE1 3.37Å; Y691-R1092 HydrophobicContact CE1-CG 4.49Å; Y691-R1092 HydrophobicContact CE2-CB 4.18Å; Y691-R1092 HydrophobicContact CE2-CG 4.03Å; Y691-R1092 VanDerWaalsContact CZ-CD 3.5Å; Y691-R1092 WeakPolarHBondContact OH-CB 3.39Å; Y691-R1092 WeakPolarHBondContact OH-CD 3.07Å; Y691-R1092 WeakPolarHBondContact OH-CG 3.27Å; Y691-R1092 PolarHBondContact OH-NE 3.19Å
692	H	90.5	Very high	94	Very high	25.3333 Å²	25.3333	31.7 Å²	31.7	12%	0.117	15%	0.153	C	C	.	.	S	Bend	trans	-88.2	171.4	178.3	-87.7	-39.2	0	0	0	113.1	W656 G657 R690 E1082	W656-H692 AromaticContact CD1-CD2 3.42Å; W656-H692 VanDerWaalsContact CD1-CD2 3.45Å; W656-H692 AromaticContact CD1-CG 3.88Å; W656-H692 AromaticContact CD1-ND1 3.75Å; W656-H692 AromaticContact CD2-CD2 3.53Å; W656-H692 VanDerWaalsContact CD2-CD2 3.48Å; W656-H692 AromaticContact CD2-CE1 3.91Å; W656-H692 AromaticContact CD2-ND1 3.49Å; W656-H692 AromaticContact CE2-CD2 3.12Å; W656-H692 AromaticContact CE2-CE1 3.16Å; W656-H692 AromaticContact CE2-ND1 3.2Å; W656-H692 AromaticContact CE2-NE2 3.4Å; W656-H692 AromaticContact CG-CD2 3.71Å; W656-H692 AromaticContact CG-ND1 3.87Å; W656-H692 AromaticContact CH2-CE1 3.69Å; W656-H692 AromaticContact CH2-NE2 3.85Å; W656-H692 AromaticContact CZ2-CD2 3.52Å; W656-H692 AromaticContact CZ2-CE1 3.06Å; W656-H692 WeakPolarHBondContact CZ2-CE1 3.31Å; W656-H692 AromaticContact CZ2-ND1 3.56Å; W656-H692 AromaticContact CZ2-NE2 3.34Å; W656-H692 WeakPolarHBondContact CZ2-NE2 3.37Å; W656-H692 AromaticContact NE1-CD2 3.35Å; W656-H692 PolarHBondContact NE1-CD2 3.05Å; W656-H692 AromaticContact NE1-CE1 3.39Å; W656-H692 PolarHBondContact NE1-CE1 3.13Å; W656-H692 AromaticContact NE1-CG 3.83Å; W656-H692 AromaticContact NE1-ND1 3.33Å; W656-H692 PolarHBondContact NE1-ND1 3.32Å; W656-H692 AromaticContact NE1-NE2 3.38Å; W656-H692 PolarHBondContact NE1-NE2 2.9Å; W656-H692 WeakPolarHBondContact O-CB 3.33Å; G657-H692 WeakPolarHBondContact CA-O 3.36Å; R690-H692 VanDerWaalsContact C-N 3.3Å; R690-H692 PolarHBondContact O-N 3.06Å; H692-E1082 IonicContact CE1-OE1 3Å; H692-E1082 PolarHBondContact CE1-OE1 3.27Å; H692-E1082 IonicContact CE1-OE2 3.82Å; H692-E1082 IonicContact CG-OE1 2.78Å; H692-E1082 IonicContact ND1-OE1 2.71Å; H692-E1082 PolarHBondContact ND1-OE1 2.88Å; H692-E1082 IonicContact NE2-OE1 2.69Å; H692-E1082 PolarHBondContact NE2-OE1 3.1Å
693	P	94.2	Very high	93.5	Very high	6 Å²	6	35.8 Å²	35.8	4%	0.039	17%	0.173	C	C	.	.			trans	-60.3	144.2	-176.2	-22.9	31.6	0	0	0	114.5	G657 G658 F695 E696 I723 R726	G657-P693 CarbonylContact C-O 3.55Å; G657-P693 VanDerWaalsContact CA-O 3.28Å; G657-P693 WeakPolarHBondContact CA-O 3.3Å; G658-P693 PolarHBondContact N-O 3.12Å; P693-F695 VanDerWaalsContact C-N 3.31Å; P693-E696 HydrophobicContact CB-CB 4.1Å; P693-E696 HydrophobicContact CG-CB 4.32Å; P693-I723 CarbonylContact C-O 3.53Å; P693-I723 WeakPolarHBondContact CA-O 3.36Å; P693-I723 HydrophobicContact CB-CB 4.46Å; P693-I723 WeakPolarHBondContact CB-O 3.27Å; P693-I723 HydrophobicContact CG-CB 4.42Å; P693-R726 HydrophobicContact CB-CB 4.1Å; P693-R726 HydrophobicContact CG-CB 3.83Å; P693-R726 HydrophobicContact CG-CG 4.46Å
694	A	95.6	Very high	92.8	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.008	19%	0.191	C	C	.	.	S	Bend	trans	-67.7	-35.4	173.3	0	0	0	0	0	111.4	G658 I659 F686 N689 F717 I723 C724	G658-A694 CarbonylContact C-O 3.44Å; G658-A694 WeakPolarHBondContact CA-O 3.37Å; I659-A694 PolarHBondContact N-O 2.89Å; F686-A694 HydrophobicContact CB-CB 4.14Å; F686-A694 HydrophobicContact CD1-CB 4.14Å; F686-A694 WeakPolarHBondContact CD1-O 3.3Å; F686-A694 VanDerWaalsContact CE1-O 3.3Å; F686-A694 WeakPolarHBondContact CE1-O 3.35Å; F686-A694 HydrophobicContact CG-CB 4.37Å; N689-A694 HydrophobicContact CB-CB 4.3Å; A694-F717 HydrophobicContact CB-CD1 3.88Å; A694-F717 HydrophobicContact CB-CE1 4.04Å; A694-I723 PolarHBondContact N-O 2.94Å; A694-I723 VanDerWaalsContact N-O 3.07Å; A694-C724 WeakPolarHBondContact CB-O 3.23Å; A694-C724 PolarHBondContact N-O 3.12Å
695	F	96.9	Very high	92.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	129.1	167.7	178.6	-93.2	0	0	0	110.5	I659 I661 V679 V681 F686 P693 V710 V712 F717 C724 F725 R726	I659-F695 HydrophobicContact CB-CD2 4.06Å; I659-F695 HydrophobicContact CG2-CD2 4.07Å; I659-F695 HydrophobicContact CG2-CE2 4.18Å; I659-F695 CarbonylContact O-C 3.31Å; I659-F695 WeakPolarHBondContact O-CA 3.43Å; I661-F695 HydrophobicContact CD1-CE2 4.2Å; I661-F695 HydrophobicContact CG1-CE2 4.39Å; V679-F695 HydrophobicContact CG1-CZ 4.38Å; V681-F695 HydrophobicContact CG2-CD2 4.2Å; V681-F695 HydrophobicContact CG2-CE2 3.65Å; V681-F695 HydrophobicContact CG2-CZ 4.37Å; F686-F695 HydrophobicContact CZ-CB 4.46Å; P693-F695 VanDerWaalsContact C-N 3.31Å; F695-V710 HydrophobicContact CE1-CG1 4.46Å; F695-V710 HydrophobicContact CZ-CG1 4.26Å; F695-V712 HydrophobicContact CE1-CG2 4.17Å; F695-V712 HydrophobicContact CZ-CG2 4.2Å; F695-F717 HydrophobicContact CB-CE1 4.11Å; F695-F717 HydrophobicContact CB-CZ 4.32Å; F695-C724 PolarHBondContact N-O 3.06Å; F695-F725 HydrophobicContact CB-CD2 4.33Å; F695-F725 AromaticContact CD1-CD2 3.53Å; F695-F725 HydrophobicContact CD1-CD2 3.53Å; F695-F725 HydrophobicContact CD1-CE1 4.42Å; F695-F725 AromaticContact CD1-CE2 3.27Å; F695-F725 HydrophobicContact CD1-CE2 3.27Å; F695-F725 HydrophobicContact CD1-CG 4.25Å; F695-F725 AromaticContact CD1-CZ 3.79Å; F695-F725 HydrophobicContact CD1-CZ 3.79Å; F695-F725 HydrophobicContact CE1-CD2 4.25Å; F695-F725 AromaticContact CE1-CE2 3.53Å; F695-F725 HydrophobicContact CE1-CE2 3.53Å; F695-F725 VanDerWaalsContact CE1-CE2 3.47Å; F695-F725 AromaticContact CE1-CZ 3.71Å; F695-F725 HydrophobicContact CE1-CZ 3.71Å; F695-F725 HydrophobicContact CG-CD2 4.27Å; F695-F725 HydrophobicContact CG-CE2 4.26Å; F695-F725 WeakPolarHBondContact O-CA 3.39Å; F695-R726 PolarHBondContact O-N 2.88Å; F695-R726 VanDerWaalsContact O-N 3.11Å
696	E	96	Very high	92	Very high	13.6667 Å²	13.6667	40.5 Å²	40.5	6%	0.064	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.6	177.5	179.4	164.3	-151.2	0	0	111.7	I659 L660 I661 P693 H698 R726	I659-E696 PolarHBondContact O-N 3.16Å; L660-E696 WeakPolarHBondContact CA-O 3.46Å; L660-E696 HydrophobicContact CD1-CB 3.81Å; L660-E696 HydrophobicContact CD1-CG 3.61Å; I661-E696 PolarHBondContact N-O 3.01Å; P693-E696 HydrophobicContact CB-CB 4.1Å; P693-E696 HydrophobicContact CG-CB 4.32Å; E696-H698 IonicContact OE1-CE1 3Å; E696-H698 PolarHBondContact OE1-CE1 3.09Å; E696-H698 VanDerWaalsContact OE1-CE1 3.23Å; E696-H698 IonicContact OE1-ND1 2.65Å; E696-H698 IonicContact OE1-NE2 3.6Å; E696-H698 PolarHBondContact OE1-NE2 3.28Å; E696-R726 WeakPolarHBondContact CA-O 3.37Å; E696-R726 VanDerWaalsContact CD-NE 3.35Å; E696-R726 IonicContact OE1-CZ 3.29Å; E696-R726 IonicContact OE1-NE 3.41Å; E696-R726 PolarHBondContact OE1-NE 2.87Å; E696-R726 IonicContact OE1-NH2 3.04Å; E696-R726 PolarHBondContact OE1-NH2 3.1Å; E696-R726 IonicContact OE2-CZ 3.8Å; E696-R726 IonicContact OE2-NE 2.85Å; E696-R726 IonicContact OE2-NH2 3.37Å; E696-R726 PolarHBondContact OE2-NH2 2.89Å
697	Y	96.5	Very high	91.7	Very high	1.33333 Å²	1.33333	44.4 Å²	44.4	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.1	174.6	175.4	-90.3	0	0	0	110.8	I661 V679 T708 V710 R726 I727 I733	I661-Y697 HydrophobicContact CB-CD2 3.95Å; I661-Y697 HydrophobicContact CB-CE2 4.47Å; I661-Y697 HydrophobicContact CG1-CD2 4.45Å; I661-Y697 HydrophobicContact CG2-CD2 3.81Å; I661-Y697 HydrophobicContact CG2-CE2 4.02Å; I661-Y697 CarbonylContact O-C 3.57Å; I661-Y697 WeakPolarHBondContact O-CA 3.28Å; V679-Y697 HydrophobicContact CG2-CD2 4.33Å; V679-Y697 HydrophobicContact CG2-CE2 4.02Å; Y697-T708 HydrophobicContact CE2-CG2 4.32Å; Y697-T708 VanDerWaalsContact OH-CB 3.24Å; Y697-T708 WeakPolarHBondContact OH-CB 3.39Å; Y697-T708 VanDerWaalsContact OH-CG2 3.26Å; Y697-T708 WeakPolarHBondContact OH-CG2 3.37Å; Y697-T708 PolarHBondContact OH-OG1 2.88Å; Y697-V710 HydrophobicContact CD1-CG2 4.27Å; Y697-V710 HydrophobicContact CD2-CG2 4.08Å; Y697-V710 HydrophobicContact CE1-CG2 4.06Å; Y697-V710 HydrophobicContact CE2-CG2 3.87Å; Y697-V710 HydrophobicContact CG-CG2 4.29Å; Y697-R726 PolarHBondContact N-O 3.17Å; Y697-I727 HydrophobicContact CD1-CD1 4.25Å; Y697-I727 HydrophobicContact CD1-CG2 4.33Å; Y697-I733 HydrophobicContact CD1-CD1 3.78Å; Y697-I733 HydrophobicContact CE1-CD1 3.61Å; Y697-I733 HydrophobicContact CE1-CG1 4.31Å
698	H	95	Very high	91.7	Very high	68.3333 Å²	68.3333	43 Å²	43	32%	0.316	20%	0.203	S	C	.	.			trans	-97.3	115.9	172.6	-64.3	-66.2	0	0	0	110.5	L660 I661 N663 E696	L660-H698 WeakPolarHBondContact CD1-NE2 3.37Å; I661-H698 PolarHBondContact O-N 3.01Å; N663-H698 VanDerWaalsContact CA-O 3.3Å; N663-H698 WeakPolarHBondContact CA-O 3.37Å; N663-H698 HydrophobicContact CB-CB 4.2Å; N663-H698 WeakPolarHBondContact CB-O 3.41Å; N663-H698 PolarHBondContact N-O 2.99Å; E696-H698 IonicContact OE1-CE1 3Å; E696-H698 PolarHBondContact OE1-CE1 3.09Å; E696-H698 VanDerWaalsContact OE1-CE1 3.23Å; E696-H698 IonicContact OE1-ND1 2.65Å; E696-H698 IonicContact OE1-NE2 3.6Å; E696-H698 PolarHBondContact OE1-NE2 3.28Å
699	S	94.6	Very high	91.8	Very high	1.66667 Å²	1.66667	48.1 Å²	48.1	1%	0.012	22%	0.218	C	C	.	.			trans	-68.3	152.3	176.4	-66.5	0	0	0	0	112.9	Q701 P729 V731	S699-Q701 PolarHBondContact O-N 3.27Å; S699-P729 WeakPolarHBondContact CB-O 3.33Å; S699-P729 PolarHBondContact OG-O 3.17Å; S699-V731 WeakPolarHBondContact CB-O 3.36Å; S699-V731 PolarHBondContact OG-N 2.93Å; S699-V731 PolarHBondContact OG-O 3.07Å
700	C	91.8	Very high	91.9	Very high	3.33333 Å²	3.33333	48.2 Å²	48.2	2%	0.023	22%	0.218	C	C	.	.			trans	-75.5	126.5	167	-176	0	0	0	0	110.9	F664 C665 Q705 N732	F664-C700 VanDerWaalsContact O-CB 3.32Å; F664-C700 WeakPolarHBondContact O-CB 3.36Å; C665-C700 VanDerWaalsContact CA-SG 3.54Å; C665-C700 WeakPolarHBondContact CA-SG 3.28Å; C665-C700 HydrophobicContact CB-CB 4.2Å; C665-C700 WeakPolarHBondContact CB-SG 3.43Å; C665-C700 VanDerWaalsContact SG-CA 3.56Å; C665-C700 WeakPolarHBondContact SG-CB 3.23Å; C665-C700 CovalentContact SG-SG 2.04Å; C665-C700 PolarHBondContact SG-SG 2.93Å; C700-Q705 VanDerWaalsContact SG-CG 3.56Å; C700-N732 PolarHBondContact O-ND2 3.2Å
701	Q	92.5	Very high	92.1	Very high	90.3333 Å²	90.3333	45.6 Å²	45.6	42%	0.422	21%	0.212	S	C	.	.			trans	-100.5	8	-173.5	-57.2	177.8	6	0	0	113.3	S699 P729 V731 L760	S699-Q701 PolarHBondContact O-N 3.27Å; Q701-P729 HydrophobicContact CG-CG 4.3Å; Q701-V731 HydrophobicContact CG-CG2 4.32Å; Q701-L760 HydrophobicContact CB-CD1 4.14Å; Q701-L760 HydrophobicContact CB-CD2 4.19Å; Q701-L760 HydrophobicContact CG-CD1 3.95Å
702	S	88.8	Confident	92.6	Very high	58 Å²	58	43.2 Å²	43.2	41%	0.406	20%	0.202	S	C	.	.	S	Bend	trans	-88.3	151.2	179.2	-57.2	0	0	0	0	111.9	Q705 N732	S702-Q705 WeakPolarHBondContact O-CG 3.38Å; S702-N732 PolarHBondContact O-ND2 2.93Å
703	D	85	Confident	92.9	Very high	98.6667 Å²	98.6667	42.4 Å²	42.4	53%	0.528	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	156.9	172.5	-69.8	-48.2	0	0	0	112.3	Q705 N762 L763	D703-Q705 VanDerWaalsContact C-N 3.27Å; D703-Q705 PolarHBondContact O-N 3.06Å; D703-Q705 PolarHBondContact O-NE2 3.05Å; D703-N762 PolarHBondContact OD1-ND2 3.25Å; D703-N762 VanDerWaalsContact OD1-ND2 3.09Å; D703-L763 VanDerWaalsContact OD1-CD2 3.3Å; D703-L763 WeakPolarHBondContact OD1-CD2 3.35Å
704	R	82.3	Confident	92.9	Very high	203.667 Å²	203.667	42.9 Å²	42.9	77%	0.769	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	33.8	173.9	-56.5	178.1	178.6	168.8	1.2	114.2
705	Q	85.8	Confident	92.9	Very high	24 Å²	24	42.9 Å²	42.9	11%	0.112	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-93.3	151.8	177.8	-63.1	-65.4	-40.5	0	0	111.3	T666 C700 S702 D703	T666-Q705 PolarHBondContact O-NE2 3.18Å; T666-Q705 PolarHBondContact O-OE1 3.12Å; T666-Q705 PolarHBondContact OG1-OE1 2.96Å; C700-Q705 VanDerWaalsContact SG-CG 3.56Å; S702-Q705 WeakPolarHBondContact O-CG 3.38Å; D703-Q705 VanDerWaalsContact C-N 3.27Å; D703-Q705 PolarHBondContact O-N 3.06Å; D703-Q705 PolarHBondContact O-NE2 3.05Å
706	P	87.6	Confident	92.9	Very high	22.3333 Å²	22.3333	43.7 Å²	43.7	15%	0.145	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-66.4	143.2	171.6	29.2	-34.3	0	0	0	110.5	F664 T666 V673 V674 P677 T708	F664-P706 HydrophobicContact CE1-CG 3.79Å; T666-P706 HydrophobicContact CG2-CG 3.97Å; T666-P706 VanDerWaalsContact OG1-CD 3.24Å; T666-P706 WeakPolarHBondContact OG1-CD 3.41Å; V673-P706 HydrophobicContact CG1-CB 3.91Å; V673-P706 HydrophobicContact CG1-CG 3.71Å; V674-P706 WeakPolarHBondContact O-CB 3.29Å; V674-P706 WeakPolarHBondContact O-CG 3.4Å; P677-P706 HydrophobicContact CG-CB 4.18Å; P677-P706 HydrophobicContact CG-CG 4.04Å; P706-T708 PolarHBondContact O-N 2.93Å
707	I	91.1	Very high	92.9	Very high	81.6667 Å²	81.6667	43 Å²	43	42%	0.419	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-71.2	119.6	176.6	-61.3	175	0	0	0	109	N732 K734 P764	I707-N732 CarbonylContact C-O 3.55Å; I707-N732 WeakPolarHBondContact CA-O 3.43Å; I707-K734 HydrophobicContact CG2-CB 3.86Å; I707-P764 HydrophobicContact CD1-CB 4.45Å; I707-P764 HydrophobicContact CD1-CG 4.28Å; I707-P764 HydrophobicContact CG1-CG 4.32Å
708	T	94.3	Very high	92.8	Very high	2.66667 Å²	2.66667	47.4 Å²	47.4	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	128.4	176.1	-56.8	0	0	0	0	110.7	P677 V679 Y697 P706 V710 N732 I733 K734	P677-T708 HydrophobicContact CB-CG2 4.22Å; P677-T708 HydrophobicContact CG-CG2 4.29Å; P677-T708 WeakPolarHBondContact CG-OG1 3.37Å; P677-T708 WeakPolarHBondContact O-CA 3.36Å; V679-T708 HydrophobicContact CG2-CG2 4.47Å; Y697-T708 HydrophobicContact CE2-CG2 4.32Å; Y697-T708 VanDerWaalsContact OH-CB 3.24Å; Y697-T708 WeakPolarHBondContact OH-CB 3.39Å; Y697-T708 VanDerWaalsContact OH-CG2 3.26Å; Y697-T708 WeakPolarHBondContact OH-CG2 3.37Å; Y697-T708 PolarHBondContact OH-OG1 2.88Å; P706-T708 PolarHBondContact O-N 2.93Å; T708-V710 HydrophobicContact CG2-CG2 4.11Å; T708-N732 PolarHBondContact N-O 2.89Å; T708-I733 CarbonylContact O-C 3.52Å; T708-I733 WeakPolarHBondContact O-CA 3.3Å; T708-K734 PolarHBondContact O-N 3.03Å
709	R	95.9	Very high	92.8	Very high	122.333 Å²	122.333	48.1 Å²	48.1	46%	0.462	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	116.4	174.5	-68	-178.7	174.1	154.4	-7.4	109.7	D676 P677 R678 V679 K734	D676-R709 VanDerWaalsContact CG-NH1 3.33Å; D676-R709 VanDerWaalsContact OD1-CD 3.27Å; D676-R709 WeakPolarHBondContact OD1-CD 3.26Å; D676-R709 IonicContact OD1-CZ 3.4Å; D676-R709 VanDerWaalsContact OD1-CZ 3.31Å; D676-R709 IonicContact OD1-NE 3.32Å; D676-R709 PolarHBondContact OD1-NE 3.01Å; D676-R709 IonicContact OD1-NH1 2.98Å; D676-R709 PolarHBondContact OD1-NH1 2.92Å; D676-R709 IonicContact OD2-CZ 2.89Å; D676-R709 IonicContact OD2-NH1 3Å; D676-R709 PolarHBondContact OD2-NH1 3.39Å; P677-R709 PolarHBondContact O-N 2.95Å; R678-R709 CarbonylContact C-O 3.44Å; R678-R709 WeakPolarHBondContact CA-O 3.37Å; R678-R709 HydrophobicContact CB-CB 4.24Å; R678-R709 HydrophobicContact CG-CB 4.37Å; V679-R709 PolarHBondContact N-O 2.94Å; R709-K734 CarbonylContact C-O 3.47Å; R709-K734 WeakPolarHBondContact CA-O 3.35Å; R709-K734 HydrophobicContact CG-CB 4.41Å
710	V	96.8	Very high	92.6	Very high	2 Å²	2	48 Å²	48	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.7	176.6	-176.4	0	0	0	0	107.9	V679 F695 Y697 T708 V712 I733 K734 L735 D736	V679-V710 HydrophobicContact CB-CB 4.45Å; V679-V710 HydrophobicContact CB-CG1 4.28Å; V679-V710 HydrophobicContact CB-CG2 4.17Å; V679-V710 HydrophobicContact CG1-CG1 4.34Å; V679-V710 HydrophobicContact CG2-CG2 4.44Å; V679-V710 CarbonylContact O-C 3.54Å; V679-V710 VanDerWaalsContact O-CA 3.32Å; V679-V710 WeakPolarHBondContact O-CA 3.24Å; F695-V710 HydrophobicContact CE1-CG1 4.46Å; F695-V710 HydrophobicContact CZ-CG1 4.26Å; Y697-V710 HydrophobicContact CD1-CG2 4.27Å; Y697-V710 HydrophobicContact CD2-CG2 4.08Å; Y697-V710 HydrophobicContact CE1-CG2 4.06Å; Y697-V710 HydrophobicContact CE2-CG2 3.87Å; Y697-V710 HydrophobicContact CG-CG2 4.29Å; T708-V710 HydrophobicContact CG2-CG2 4.11Å; V710-V712 HydrophobicContact CG1-CG2 4.45Å; V710-I733 HydrophobicContact CB-CD1 4.21Å; V710-I733 HydrophobicContact CB-CG1 4.43Å; V710-I733 HydrophobicContact CG2-CD1 3.77Å; V710-I733 HydrophobicContact CG2-CG1 3.96Å; V710-K734 PolarHBondContact N-O 2.96Å; V710-L735 HydrophobicContact CB-CD1 3.85Å; V710-L735 HydrophobicContact CG1-CD1 3.73Å; V710-L735 CarbonylContact O-C 3.43Å; V710-L735 VanDerWaalsContact O-CA 3.3Å; V710-L735 WeakPolarHBondContact O-CA 3.41Å; V710-D736 PolarHBondContact O-N 2.96Å
711	E	97	Very high	92.5	Very high	80 Å²	80	50.8 Å²	50.8	37%	0.374	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.5	179.1	-173.3	-171.2	151.1	0	0	109.3	V679 V680 V681 S713 D736	V679-E711 PolarHBondContact O-N 3.14Å; V680-E711 CarbonylContact C-O 3.5Å; V680-E711 WeakPolarHBondContact CA-O 3.33Å; V681-E711 PolarHBondContact N-O 2.98Å; E711-S713 PolarHBondContact OE1-OG 2.99Å; E711-S713 VanDerWaalsContact OE1-OG 3.13Å; E711-D736 WeakPolarHBondContact CA-O 3.23Å
712	V	97.1	Very high	92.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	111.1	172.5	-175.9	0	0	0	0	108.6	V681 F695 V710 F725 D736 I737 N738	V681-V712 HydrophobicContact CB-CG1 4.26Å; V681-V712 HydrophobicContact CB-CG2 4.08Å; V681-V712 HydrophobicContact CG1-CG1 4.42Å; V681-V712 HydrophobicContact CG2-CG2 4.44Å; V681-V712 CarbonylContact O-C 3.49Å; V681-V712 WeakPolarHBondContact O-CA 3.34Å; F695-V712 HydrophobicContact CE1-CG2 4.17Å; F695-V712 HydrophobicContact CZ-CG2 4.2Å; V710-V712 HydrophobicContact CG1-CG2 4.45Å; V712-F725 HydrophobicContact CB-CE2 4.15Å; V712-F725 HydrophobicContact CG1-CE2 4.28Å; V712-F725 HydrophobicContact CG2-CE2 3.74Å; V712-F725 HydrophobicContact CG2-CZ 4.37Å; V712-D736 PolarHBondContact N-O 3.03Å; V712-I737 WeakPolarHBondContact O-CA 3.26Å; V712-N738 PolarHBondContact O-N 3.01Å
713	S	95.9	Very high	92.5	Very high	9 Å²	9	44.4 Å²	44.4	6%	0.063	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140	-169.4	54.9	0	0	0	0	112.6	V681 A682 Y683 E711 S715 N738	V681-S713 PolarHBondContact O-N 3.12Å; A682-S713 CarbonylContact C-O 3.53Å; A682-S713 VanDerWaalsContact CA-O 3.28Å; A682-S713 WeakPolarHBondContact CA-O 3.33Å; Y683-S713 PolarHBondContact N-O 3Å; E711-S713 PolarHBondContact OE1-OG 2.99Å; E711-S713 VanDerWaalsContact OE1-OG 3.13Å; S713-S715 PolarHBondContact O-N 3.22Å; S713-S715 PolarHBondContact O-OG 2.93Å; S713-N738 CarbonylContact C-O 3.58Å; S713-N738 VanDerWaalsContact CA-O 3.28Å; S713-N738 WeakPolarHBondContact CA-O 3.28Å; S713-N738 WeakPolarHBondContact CA-OD1 3.05Å; S713-N738 WeakPolarHBondContact CB-OD1 3.32Å
714	G	94.5	Very high	92.9	Very high	17.3333 Å²	17.3333	39.7 Å²	39.7	18%	0.179	19%	0.186	C	C	.	.	S	Bend	trans	60.4	11.9	171.7	0	0	0	0	0	116.1	N738 D739	G714-N738 PolarHBondContact N-O 2.89Å; G714-N738 VanDerWaalsContact N-O 3.16Å; G714-D739 WeakPolarHBondContact CA-O 3.41Å
715	S	96	Very high	93.6	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.			trans	-88	155.3	-172.7	-64.7	0	0	0	0	111.9	V681 Y683 V684 S713 C740 R741	V681-S715 PolarHBondContact O-OG 3.24Å; Y683-S715 PolarHBondContact N-OG 3.1Å; V684-S715 PolarHBondContact N-OG 3.02Å; V684-S715 VanDerWaalsContact N-OG 3.13Å; V684-S715 CarbonylContact O-C 3.57Å; V684-S715 WeakPolarHBondContact O-CA 3.26Å; V684-S715 VanDerWaalsContact O-CB 3.27Å; V684-S715 WeakPolarHBondContact O-CB 3.43Å; S713-S715 PolarHBondContact O-N 3.22Å; S713-S715 PolarHBondContact O-OG 2.93Å; S715-C740 CarbonylContact O-C 3.5Å; S715-C740 VanDerWaalsContact O-CA 3.28Å; S715-C740 WeakPolarHBondContact O-CA 3.32Å; S715-C740 WeakPolarHBondContact O-CB 3.33Å; S715-R741 PolarHBondContact O-N 3.03Å
716	V	95.5	Very high	94	Very high	17.3333 Å²	17.3333	30.1 Å²	30.1	11%	0.105	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	128	-173.9	-178.9	0	0	0	0	110.1	V684 E685 F686 R718 R741	V684-V716 PolarHBondContact O-N 3.06Å; E685-V716 HydrophobicContact CG-CB 4.39Å; F686-V716 PolarHBondContact N-O 3.05Å; V716-R718 HydrophobicContact CG1-CG 3.93Å; V716-R718 VanDerWaalsContact CG1-CZ 3.41Å; V716-R741 CarbonylContact C-O 3.58Å; V716-R741 WeakPolarHBondContact CA-O 3.39Å; V716-R741 HydrophobicContact CG1-CB 4.49Å; V716-R741 HydrophobicContact CG2-CB 4.42Å
717	F	96.6	Very high	94.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.3	178.7	-64	-99.2	0	0	0	109.8	F686 A694 F695 C724 F725 R741 F742 V743 N745	F686-F717 HydrophobicContact CB-CD1 3.61Å; F686-F717 HydrophobicContact CB-CE1 3.97Å; F686-F717 HydrophobicContact CB-CG 4.22Å; F686-F717 HydrophobicContact CD1-CE1 4.21Å; F686-F717 AromaticContact CD2-CD1 3.79Å; F686-F717 HydrophobicContact CD2-CD1 3.79Å; F686-F717 HydrophobicContact CD2-CD2 4.41Å; F686-F717 AromaticContact CD2-CE1 3.36Å; F686-F717 HydrophobicContact CD2-CE1 3.36Å; F686-F717 VanDerWaalsContact CD2-CE1 3.42Å; F686-F717 HydrophobicContact CD2-CE2 4.05Å; F686-F717 HydrophobicContact CD2-CG 4.29Å; F686-F717 AromaticContact CD2-CZ 3.51Å; F686-F717 HydrophobicContact CD2-CZ 3.51Å; F686-F717 VanDerWaalsContact CD2-CZ 3.49Å; F686-F717 AromaticContact CE2-CE1 3.8Å; F686-F717 HydrophobicContact CE2-CE1 3.8Å; F686-F717 HydrophobicContact CE2-CE2 4.32Å; F686-F717 AromaticContact CE2-CZ 3.61Å; F686-F717 HydrophobicContact CE2-CZ 3.61Å; F686-F717 AromaticContact CG-CD1 3.8Å; F686-F717 HydrophobicContact CG-CD1 3.8Å; F686-F717 AromaticContact CG-CE1 3.6Å; F686-F717 HydrophobicContact CG-CE1 3.6Å; F686-F717 HydrophobicContact CG-CZ 4.23Å; F686-F717 HydrophobicContact CZ-CE1 4.37Å; F686-F717 HydrophobicContact CZ-CZ 4.39Å; F686-F717 CarbonylContact O-C 3.57Å; F686-F717 WeakPolarHBondContact O-CA 3.3Å; A694-F717 HydrophobicContact CB-CD1 3.88Å; A694-F717 HydrophobicContact CB-CE1 4.04Å; F695-F717 HydrophobicContact CB-CE1 4.11Å; F695-F717 HydrophobicContact CB-CZ 4.32Å; F717-C724 HydrophobicContact CB-CB 4.1Å; F717-C724 HydrophobicContact CD1-CB 3.86Å; F717-C724 WeakPolarHBondContact CE1-O 3.46Å; F717-C724 HydrophobicContact CG-CB 4.13Å; F717-F725 HydrophobicContact CZ-CD2 4.47Å; F717-R741 PolarHBondContact N-O 3.23Å; F717-F742 HydrophobicContact CB-CD1 3.54Å; F717-F742 HydrophobicContact CB-CE1 4.05Å; F717-F742 HydrophobicContact CB-CG 4.41Å; F717-F742 HydrophobicContact CD1-CD1 4.49Å; F717-F742 HydrophobicContact CD1-CE1 4.27Å; F717-F742 AromaticContact CD2-CD1 3.55Å; F717-F742 HydrophobicContact CD2-CD1 3.55Å; F717-F742 AromaticContact CD2-CE1 3.22Å; F717-F742 HydrophobicContact CD2-CE1 3.22Å; F717-F742 HydrophobicContact CD2-CG 4.46Å; F717-F742 AromaticContact CD2-CZ 3.89Å; F717-F742 HydrophobicContact CD2-CZ 3.89Å; F717-F742 HydrophobicContact CE2-CD1 4.39Å; F717-F742 AromaticContact CE2-CE1 3.62Å; F717-F742 HydrophobicContact CE2-CE1 3.62Å; F717-F742 AromaticContact CE2-CZ 3.95Å; F717-F742 HydrophobicContact CE2-CZ 3.99Å; F717-F742 AromaticContact CG-CD1 3.64Å; F717-F742 HydrophobicContact CG-CD1 3.64Å; F717-F742 AromaticContact CG-CE1 3.6Å; F717-F742 HydrophobicContact CG-CE1 3.6Å; F717-F742 HydrophobicContact CZ-CE1 4.29Å; F717-F742 WeakPolarHBondContact O-CA 3.38Å; F717-V743 PolarHBondContact O-N 2.75Å; F717-N745 PolarHBondContact O-ND2 3.11Å; F717-N745 VanDerWaalsContact O-ND2 3.11Å
718	R	95.7	Very high	94.5	Very high	92.6667 Å²	92.6667	26.6 Å²	26.6	35%	0.35	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	149.9	-177.2	-66.8	-178.4	-177.1	134.3	-3.4	113.2	E685 F686 V687 G688 V716 S720 V743 N745	E685-R718 IonicContact OE2-NH1 2.66Å; F686-R718 PolarHBondContact O-N 3.11Å; V687-R718 CarbonylContact C-O 3.58Å; V687-R718 WeakPolarHBondContact CA-O 3.29Å; G688-R718 PolarHBondContact N-O 3.25Å; V716-R718 HydrophobicContact CG1-CG 3.93Å; V716-R718 VanDerWaalsContact CG1-CZ 3.41Å; R718-S720 PolarHBondContact O-N 3.05Å; R718-S720 PolarHBondContact O-OG 2.85Å; R718-V743 VanDerWaalsContact CA-O 3.29Å; R718-V743 WeakPolarHBondContact CA-O 3.35Å; R718-V743 HydrophobicContact CG-CB 4.37Å; R718-V743 WeakPolarHBondContact CG-O 3.47Å; R718-N745 VanDerWaalsContact C-OD1 3.26Å; R718-N745 WeakPolarHBondContact CA-OD1 3.24Å
719	L	94.4	Very high	94.6	Very high	83 Å²	83	26.5 Å²	26.5	44%	0.435	13%	0.128	S	C	.	.	S	Bend	trans	53.3	22.5	171.6	-56.7	174.7	0	0	0	113.9	V687 G688 E744 N745	V687-L719 HydrophobicContact CG1-CD1 4.46Å; G688-L719 WeakPolarHBondContact CA-O 3.4Å; L719-E744 WeakPolarHBondContact CA-O 3.37Å; L719-E744 HydrophobicContact CD2-CB 4.22Å; L719-E744 PolarHBondContact N-O 2.95Å; L719-N745 PolarHBondContact N-OD1 3.06Å
720	S	90.3	Very high	94.5	Very high	0.666667 Å²	0.666667	20.7 Å²	20.7	1%	0.005	11%	0.106	C	C	.	.			trans	-75.1	137.3	-179.5	-59.6	0	0	0	0	109.6	N689 R718 N745 H746	N689-S720 WeakPolarHBondContact O-CA 3.14Å; R718-S720 PolarHBondContact O-N 3.05Å; R718-S720 PolarHBondContact O-OG 2.85Å; S720-N745 WeakPolarHBondContact CB-OD1 3.35Å; S720-N745 PolarHBondContact N-OD1 3.12Å; S720-N745 PolarHBondContact OG-OD1 2.92Å; S720-H746 PolarHBondContact O-N 2.97Å; S720-H746 VanDerWaalsContact O-N 3.1Å
721	T	89.5	Confident	94.5	Very high	60.6667 Å²	60.6667	20.6 Å²	20.6	37%	0.372	11%	0.105	S	C	.	.	S	Bend	trans	-101.7	-5.1	174.6	69.3	0	0	0	0	113	N689 R690 Y691 R747	N689-T721 PolarHBondContact O-N 3.31Å; R690-T721 VanDerWaalsContact CA-OG1 3.27Å; R690-T721 WeakPolarHBondContact CA-OG1 3.38Å; Y691-T721 PolarHBondContact N-OG1 3.14Å; T721-R747 WeakPolarHBondContact O-CD 3.14Å; T721-R747 WeakPolarHBondContact O-CG 3.21Å; T721-R747 PolarHBondContact O-NE 2.94Å
722	G	87.9	Confident	94.3	Very high	1.66667 Å²	1.66667	17 Å²	17	2%	0.017	9%	0.089	C	C	.	.	S	Bend	trans	-103.1	179.6	163.1	0	0	0	0	0	111.2	Y691 C724 R747	Y691-G722 VanDerWaalsContact O-CA 3.25Å; Y691-G722 WeakPolarHBondContact O-CA 3.28Å; G722-C724 PolarHBondContact O-N 2.8Å; G722-R747 WeakPolarHBondContact O-CB 3.38Å
723	I	93	Very high	94.3	Very high	12.6667 Å²	12.6667	17.1 Å²	17.1	7%	0.065	9%	0.089	C	C	.	.			trans	-61	137.3	174.9	-61.1	171.5	0	0	0	109.5	P693 A694 F725 R726 P748 L751 L1084	P693-I723 CarbonylContact C-O 3.53Å; P693-I723 WeakPolarHBondContact CA-O 3.36Å; P693-I723 HydrophobicContact CB-CB 4.46Å; P693-I723 WeakPolarHBondContact CB-O 3.27Å; P693-I723 HydrophobicContact CG-CB 4.42Å; A694-I723 PolarHBondContact N-O 2.94Å; A694-I723 VanDerWaalsContact N-O 3.07Å; I723-F725 WeakPolarHBondContact CG2-O 3.46Å; I723-R726 HydrophobicContact CG2-CB 4.36Å; I723-P748 VanDerWaalsContact CA-O 3.28Å; I723-P748 WeakPolarHBondContact CA-O 3.29Å; I723-L751 HydrophobicContact CD1-CD2 3.83Å; I723-L751 HydrophobicContact CG2-CB 4.26Å; I723-L1084 HydrophobicContact CD1-CD1 4Å; I723-L1084 HydrophobicContact CG1-CD1 4.16Å
724	C	94.7	Very high	94.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	-70.2	-46.6	-179.2	-60.7	0	0	0	0	111.8	A694 F695 F717 G722 F742 N745 P748 V749	A694-C724 WeakPolarHBondContact CB-O 3.23Å; A694-C724 PolarHBondContact N-O 3.12Å; F695-C724 PolarHBondContact N-O 3.06Å; F717-C724 HydrophobicContact CB-CB 4.1Å; F717-C724 HydrophobicContact CD1-CB 3.86Å; F717-C724 WeakPolarHBondContact CE1-O 3.46Å; F717-C724 HydrophobicContact CG-CB 4.13Å; G722-C724 PolarHBondContact O-N 2.8Å; C724-F742 HydrophobicContact CB-CD1 3.81Å; C724-F742 HydrophobicContact CB-CE1 3.97Å; C724-N745 PolarHBondContact SG-OD1 3.03Å; C724-N745 VanDerWaalsContact SG-OD1 3.41Å; C724-P748 PolarHBondContact N-O 3.23Å; C724-P748 VanDerWaalsContact N-O 3.17Å; C724-V749 HydrophobicContact CB-CG1 4.48Å; C724-V749 VanDerWaalsContact CB-O 3.3Å; C724-V749 WeakPolarHBondContact CB-O 3.31Å; C724-V749 PolarHBondContact N-O 2.77Å
725	F	95.6	Very high	94.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	121.2	-174.7	-169.5	-74.4	0	0	0	111	F695 V712 F717 I723 I727 L735 I737 F742 V749 L750 L751 I752	F695-F725 HydrophobicContact CB-CD2 4.33Å; F695-F725 AromaticContact CD1-CD2 3.53Å; F695-F725 HydrophobicContact CD1-CD2 3.53Å; F695-F725 HydrophobicContact CD1-CE1 4.42Å; F695-F725 AromaticContact CD1-CE2 3.27Å; F695-F725 HydrophobicContact CD1-CE2 3.27Å; F695-F725 HydrophobicContact CD1-CG 4.25Å; F695-F725 AromaticContact CD1-CZ 3.79Å; F695-F725 HydrophobicContact CD1-CZ 3.79Å; F695-F725 HydrophobicContact CE1-CD2 4.25Å; F695-F725 AromaticContact CE1-CE2 3.53Å; F695-F725 HydrophobicContact CE1-CE2 3.53Å; F695-F725 VanDerWaalsContact CE1-CE2 3.47Å; F695-F725 AromaticContact CE1-CZ 3.71Å; F695-F725 HydrophobicContact CE1-CZ 3.71Å; F695-F725 HydrophobicContact CG-CD2 4.27Å; F695-F725 HydrophobicContact CG-CE2 4.26Å; F695-F725 WeakPolarHBondContact O-CA 3.39Å; V712-F725 HydrophobicContact CB-CE2 4.15Å; V712-F725 HydrophobicContact CG1-CE2 4.28Å; V712-F725 HydrophobicContact CG2-CE2 3.74Å; V712-F725 HydrophobicContact CG2-CZ 4.37Å; F717-F725 HydrophobicContact CZ-CD2 4.47Å; I723-F725 WeakPolarHBondContact CG2-O 3.46Å; F725-I727 HydrophobicContact CD1-CG1 4.44Å; F725-I727 HydrophobicContact CE1-CD1 3.55Å; F725-I727 VanDerWaalsContact CE1-CD1 3.5Å; F725-I727 HydrophobicContact CE1-CG1 3.66Å; F725-I727 HydrophobicContact CZ-CD1 3.77Å; F725-I727 HydrophobicContact CZ-CG1 4.25Å; F725-L735 HydrophobicContact CE1-CD2 4.34Å; F725-L735 HydrophobicContact CZ-CD1 4.05Å; F725-I737 HydrophobicContact CD1-CD1 4.01Å; F725-I737 HydrophobicContact CD2-CD1 4.37Å; F725-I737 HydrophobicContact CE1-CD1 3.5Å; F725-I737 VanDerWaalsContact CE1-CD1 3.5Å; F725-I737 HydrophobicContact CE1-CG1 4.47Å; F725-I737 HydrophobicContact CE2-CD1 3.96Å; F725-I737 HydrophobicContact CE2-CG1 4.32Å; F725-I737 HydrophobicContact CG-CD1 4.37Å; F725-I737 HydrophobicContact CZ-CD1 3.49Å; F725-I737 VanDerWaalsContact CZ-CD1 3.43Å; F725-I737 HydrophobicContact CZ-CG1 4.02Å; F725-F742 HydrophobicContact CB-CE1 4.44Å; F725-V749 PolarHBondContact N-O 2.97Å; F725-L750 HydrophobicContact CB-CD1 3.85Å; F725-L750 HydrophobicContact CD1-CD1 3.36Å; F725-L750 HydrophobicContact CE1-CD1 4.12Å; F725-L750 HydrophobicContact CG-CD1 3.79Å; F725-L751 PolarHBondContact O-N 2.98Å; F725-I752 HydrophobicContact CE1-CD1 4.35Å; F725-I752 HydrophobicContact CE1-CG1 4.43Å
726	R	95.4	Very high	94.6	Very high	26.6667 Å²	26.6667	23.7 Å²	23.7	10%	0.101	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	129.5	-180	-176.6	169.8	72.1	-174.4	-5.1	112.8	P693 F695 E696 Y697 I723 L751 E1083	P693-R726 HydrophobicContact CB-CB 4.1Å; P693-R726 HydrophobicContact CG-CB 3.83Å; P693-R726 HydrophobicContact CG-CG 4.46Å; F695-R726 PolarHBondContact O-N 2.88Å; F695-R726 VanDerWaalsContact O-N 3.11Å; E696-R726 WeakPolarHBondContact CA-O 3.37Å; E696-R726 VanDerWaalsContact CD-NE 3.35Å; E696-R726 IonicContact OE1-CZ 3.29Å; E696-R726 IonicContact OE1-NE 3.41Å; E696-R726 PolarHBondContact OE1-NE 2.87Å; E696-R726 IonicContact OE1-NH2 3.04Å; E696-R726 PolarHBondContact OE1-NH2 3.1Å; E696-R726 IonicContact OE2-CZ 3.8Å; E696-R726 IonicContact OE2-NE 2.85Å; E696-R726 IonicContact OE2-NH2 3.37Å; E696-R726 PolarHBondContact OE2-NH2 2.89Å; Y697-R726 PolarHBondContact N-O 3.17Å; I723-R726 HydrophobicContact CG2-CB 4.36Å; R726-L751 WeakPolarHBondContact CA-O 3.43Å; R726-L751 HydrophobicContact CG-CD2 4.24Å; R726-E1083 IonicContact NH1-OE2 2.97Å; R726-E1083 PolarHBondContact NH1-OE2 3.44Å
727	I	96.2	Very high	94.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	109.9	165.5	-58.8	-176.3	0	0	0	109.2	Y697 F725 A730 I733 L735 L751 I752 R753	Y697-I727 HydrophobicContact CD1-CD1 4.25Å; Y697-I727 HydrophobicContact CD1-CG2 4.33Å; F725-I727 HydrophobicContact CD1-CG1 4.44Å; F725-I727 HydrophobicContact CE1-CD1 3.55Å; F725-I727 VanDerWaalsContact CE1-CD1 3.5Å; F725-I727 HydrophobicContact CE1-CG1 3.66Å; F725-I727 HydrophobicContact CZ-CD1 3.77Å; F725-I727 HydrophobicContact CZ-CG1 4.25Å; I727-A730 HydrophobicContact CG2-CB 3.73Å; I727-I733 HydrophobicContact CD1-CD1 4.13Å; I727-I733 HydrophobicContact CG2-CD1 4.44Å; I727-L735 HydrophobicContact CD1-CD1 3.95Å; I727-L735 HydrophobicContact CD1-CD2 3.66Å; I727-L735 HydrophobicContact CD1-CG 4.43Å; I727-L751 PolarHBondContact N-O 2.87Å; I727-I752 HydrophobicContact CB-CG1 4.47Å; I727-I752 WeakPolarHBondContact O-CA 3.44Å; I727-R753 PolarHBondContact O-N 2.82Å
728	Q	93	Very high	94.6	Very high	29 Å²	29	23.8 Å²	23.8	14%	0.136	11%	0.114	C	C	.	.	S	Bend	trans	-146.5	109.2	-177.9	178.8	166.4	-20.7	0	0	109.3	R753 D756 E1083	Q728-R753 WeakPolarHBondContact CG-O 3.29Å; Q728-D756 PolarHBondContact NE2-OD2 3.16Å; Q728-E1083 PolarHBondContact NE2-OE1 3.11Å; Q728-E1083 PolarHBondContact NE2-OE2 3.13Å; Q728-E1083 PolarHBondContact OE1-OE2 2.89Å
729	P	95.1	Very high	94.6	Very high	2.33333 Å²	2.33333	22.7 Å²	22.7	2%	0.015	12%	0.115	C	C	.	.	S	Bend	cis	-82.3	156	-8.2	33.2	-32.6	0	0	0	113.1	S699 Q701 V731 N754 H757 L760	S699-P729 WeakPolarHBondContact CB-O 3.33Å; S699-P729 PolarHBondContact OG-O 3.17Å; Q701-P729 HydrophobicContact CG-CG 4.3Å; P729-V731 HydrophobicContact CB-CG1 4.4Å; P729-V731 HydrophobicContact CB-CG2 4.49Å; P729-V731 HydrophobicContact CG-CG2 4.24Å; P729-V731 PolarHBondContact O-N 2.9Å; P729-N754 WeakPolarHBondContact CA-OD1 3.39Å; P729-N754 HydrophobicContact CB-CB 4.45Å; P729-H757 HydrophobicContact CB-CB 4.46Å; P729-L760 HydrophobicContact CB-CD1 4.43Å; P729-L760 HydrophobicContact CG-CD1 3.8Å
730	A	95.4	Very high	94.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.094	C	C	.	.			trans	-92.1	93.2	168	0	0	0	0	0	110.5	I727 I733 I752 N754 A765 L787	I727-A730 HydrophobicContact CG2-CB 3.73Å; A730-I733 HydrophobicContact CB-CG2 4.03Å; A730-I752 HydrophobicContact CB-CG2 3.75Å; A730-N754 PolarHBondContact N-OD1 3.09Å; A730-N754 PolarHBondContact O-ND2 3.01Å; A730-A765 VanDerWaalsContact O-CB 3.25Å; A730-A765 WeakPolarHBondContact O-CB 3.42Å; A730-L787 HydrophobicContact CB-CD2 4.2Å
731	V	95.2	Very high	95	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.117	C	C	.	.			trans	-138.9	156.7	179.6	-67.7	0	0	0	0	110.9	S699 Q701 P729 I733 L760 L763	S699-V731 WeakPolarHBondContact CB-O 3.36Å; S699-V731 PolarHBondContact OG-N 2.93Å; S699-V731 PolarHBondContact OG-O 3.07Å; Q701-V731 HydrophobicContact CG-CG2 4.32Å; P729-V731 HydrophobicContact CB-CG1 4.4Å; P729-V731 HydrophobicContact CB-CG2 4.49Å; P729-V731 HydrophobicContact CG-CG2 4.24Å; P729-V731 PolarHBondContact O-N 2.9Å; V731-I733 WeakPolarHBondContact O-CB 3.34Å; V731-I733 PolarHBondContact O-N 2.92Å; V731-I733 VanDerWaalsContact O-N 3.14Å; V731-L760 HydrophobicContact CG1-CB 4.14Å; V731-L760 HydrophobicContact CG2-CD1 4.36Å; V731-L763 HydrophobicContact CB-CB 3.9Å; V731-L763 HydrophobicContact CB-CD1 4.04Å; V731-L763 HydrophobicContact CG1-CB 4.16Å; V731-L763 HydrophobicContact CG1-CD1 4.46Å; V731-L763 HydrophobicContact CG2-CD1 4.02Å
732	N	94.2	Very high	95.4	Very high	4.66667 Å²	4.66667	21.9 Å²	21.9	3%	0.025	10%	0.099	C	C	.	.	S	Bend	trans	48.8	37.8	-172.3	-69.2	-43.5	0	0	0	112.6	C700 S702 I707 T708 P764	C700-N732 PolarHBondContact O-ND2 3.2Å; S702-N732 PolarHBondContact O-ND2 2.93Å; I707-N732 CarbonylContact C-O 3.55Å; I707-N732 WeakPolarHBondContact CA-O 3.43Å; T708-N732 PolarHBondContact N-O 2.89Å; N732-P764 VanDerWaalsContact CA-O 3.3Å; N732-P764 WeakPolarHBondContact CA-O 3.28Å; N732-P764 PolarHBondContact N-O 2.92Å; N732-P764 WeakPolarHBondContact OD1-CD 3.43Å
733	I	95.8	Very high	95.7	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.1	-167.4	-167.6	178.5	0	0	0	111.8	Y697 T708 V710 I727 A730 V731 L735 P764 A765 T766	Y697-I733 HydrophobicContact CD1-CD1 3.78Å; Y697-I733 HydrophobicContact CE1-CD1 3.61Å; Y697-I733 HydrophobicContact CE1-CG1 4.31Å; T708-I733 CarbonylContact O-C 3.52Å; T708-I733 WeakPolarHBondContact O-CA 3.3Å; V710-I733 HydrophobicContact CB-CD1 4.21Å; V710-I733 HydrophobicContact CB-CG1 4.43Å; V710-I733 HydrophobicContact CG2-CD1 3.77Å; V710-I733 HydrophobicContact CG2-CG1 3.96Å; I727-I733 HydrophobicContact CD1-CD1 4.13Å; I727-I733 HydrophobicContact CG2-CD1 4.44Å; A730-I733 HydrophobicContact CB-CG2 4.03Å; V731-I733 WeakPolarHBondContact O-CB 3.34Å; V731-I733 PolarHBondContact O-N 2.92Å; V731-I733 VanDerWaalsContact O-N 3.14Å; I733-L735 HydrophobicContact CD1-CB 4.08Å; I733-L735 HydrophobicContact CG1-CB 4.27Å; I733-P764 PolarHBondContact N-O 3.05Å; I733-A765 HydrophobicContact CG2-CB 4.25Å; I733-A765 WeakPolarHBondContact O-CA 3.36Å; I733-T766 PolarHBondContact O-N 3.32Å
734	K	97	Very high	95.8	Very high	114 Å²	114	27.3 Å²	27.3	50%	0.496	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	104.1	162	-178.4	174.9	-178.3	177.6	0	108.1	I707 T708 R709 V710 T766	I707-K734 HydrophobicContact CG2-CB 3.86Å; T708-K734 PolarHBondContact O-N 3.03Å; R709-K734 CarbonylContact C-O 3.47Å; R709-K734 WeakPolarHBondContact CA-O 3.35Å; R709-K734 HydrophobicContact CG-CB 4.41Å; V710-K734 PolarHBondContact N-O 2.96Å; K734-T766 CarbonylContact C-O 3.57Å; K734-T766 WeakPolarHBondContact CA-O 3.21Å; K734-T766 WeakPolarHBondContact CG-OG1 3.4Å
735	L	97.7	Very high	95.9	Very high	2.33333 Å²	2.33333	27.3 Å²	27.3	1%	0.012	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.8	-174.7	176.1	63.5	0	0	0	110.8	V710 F725 I727 I733 I737 I752 T766 V767 S768	V710-L735 HydrophobicContact CB-CD1 3.85Å; V710-L735 HydrophobicContact CG1-CD1 3.73Å; V710-L735 CarbonylContact O-C 3.43Å; V710-L735 VanDerWaalsContact O-CA 3.3Å; V710-L735 WeakPolarHBondContact O-CA 3.41Å; F725-L735 HydrophobicContact CE1-CD2 4.34Å; F725-L735 HydrophobicContact CZ-CD1 4.05Å; I727-L735 HydrophobicContact CD1-CD1 3.95Å; I727-L735 HydrophobicContact CD1-CD2 3.66Å; I727-L735 HydrophobicContact CD1-CG 4.43Å; I733-L735 HydrophobicContact CD1-CB 4.08Å; I733-L735 HydrophobicContact CG1-CB 4.27Å; L735-I737 HydrophobicContact CD1-CD1 4.42Å; L735-I737 HydrophobicContact CD1-CG1 3.98Å; L735-I737 HydrophobicContact CD2-CD1 4.16Å; L735-I737 HydrophobicContact CD2-CG1 4.42Å; L735-I737 HydrophobicContact CG-CD1 4.37Å; L735-I737 HydrophobicContact CG-CG1 4.08Å; L735-I752 HydrophobicContact CD2-CD1 3.66Å; L735-I752 HydrophobicContact CD2-CG1 4.46Å; L735-T766 PolarHBondContact N-O 3.32Å; L735-V767 HydrophobicContact CB-CB 4.47Å; L735-V767 HydrophobicContact CB-CG1 4.31Å; L735-V767 HydrophobicContact CB-CG2 4.13Å; L735-V767 HydrophobicContact CD2-CG1 3.82Å; L735-V767 HydrophobicContact CD2-CG2 4.22Å; L735-V767 HydrophobicContact CG-CG1 4.23Å; L735-V767 CarbonylContact O-C 3.49Å; L735-V767 WeakPolarHBondContact O-CA 3.3Å; L735-S768 PolarHBondContact O-N 3.13Å
736	D	97.5	Very high	95.6	Very high	49.6667 Å²	49.6667	32.8 Å²	32.8	27%	0.266	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.8	169.6	-168.3	34.1	0	0	0	110.4	V710 E711 V712 N738 S768	V710-D736 PolarHBondContact O-N 2.96Å; E711-D736 WeakPolarHBondContact CA-O 3.23Å; V712-D736 PolarHBondContact N-O 3.03Å; D736-N738 PolarHBondContact OD2-ND2 3.05Å; D736-S768 WeakPolarHBondContact CA-O 3.43Å; D736-S768 WeakPolarHBondContact OD1-CB 3.23Å; D736-S768 PolarHBondContact OD1-OG 3.08Å; D736-S768 VanDerWaalsContact OD1-OG 3.11Å
737	I	97.5	Very high	95.3	Very high	0.666667 Å²	0.666667	34.6 Å²	34.6	0%	0.003	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	108.3	176	-54	177	0	0	0	107.4	V712 F725 L735 L750 I752 S768 I769 T770 N772	V712-I737 WeakPolarHBondContact O-CA 3.26Å; F725-I737 HydrophobicContact CD1-CD1 4.01Å; F725-I737 HydrophobicContact CD2-CD1 4.37Å; F725-I737 HydrophobicContact CE1-CD1 3.5Å; F725-I737 VanDerWaalsContact CE1-CD1 3.5Å; F725-I737 HydrophobicContact CE1-CG1 4.47Å; F725-I737 HydrophobicContact CE2-CD1 3.96Å; F725-I737 HydrophobicContact CE2-CG1 4.32Å; F725-I737 HydrophobicContact CG-CD1 4.37Å; F725-I737 HydrophobicContact CZ-CD1 3.49Å; F725-I737 VanDerWaalsContact CZ-CD1 3.43Å; F725-I737 HydrophobicContact CZ-CG1 4.02Å; L735-I737 HydrophobicContact CD1-CD1 4.42Å; L735-I737 HydrophobicContact CD1-CG1 3.98Å; L735-I737 HydrophobicContact CD2-CD1 4.16Å; L735-I737 HydrophobicContact CD2-CG1 4.42Å; L735-I737 HydrophobicContact CG-CD1 4.37Å; L735-I737 HydrophobicContact CG-CG1 4.08Å; I737-L750 HydrophobicContact CD1-CD1 3.85Å; I737-I752 HydrophobicContact CD1-CD1 4.05Å; I737-S768 PolarHBondContact N-O 2.99Å; I737-I769 HydrophobicContact CB-CG1 4.37Å; I737-I769 HydrophobicContact CB-CG2 4.48Å; I737-I769 HydrophobicContact CD1-CG1 4.31Å; I737-I769 WeakPolarHBondContact O-CA 3.17Å; I737-T770 PolarHBondContact O-N 2.93Å; I737-N772 PolarHBondContact O-ND2 3.2Å
738	N	96.4	Very high	95.2	Very high	17.3333 Å²	17.3333	34.6 Å²	34.6	9%	0.093	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147	-175	67.5	59.9	0	0	0	113.5	V712 S713 G714 D736 C740 T770	V712-N738 PolarHBondContact O-N 3.01Å; S713-N738 CarbonylContact C-O 3.58Å; S713-N738 VanDerWaalsContact CA-O 3.28Å; S713-N738 WeakPolarHBondContact CA-O 3.28Å; S713-N738 WeakPolarHBondContact CA-OD1 3.05Å; S713-N738 WeakPolarHBondContact CB-OD1 3.32Å; G714-N738 PolarHBondContact N-O 2.89Å; G714-N738 VanDerWaalsContact N-O 3.16Å; D736-N738 PolarHBondContact OD2-ND2 3.05Å; N738-C740 PolarHBondContact O-N 3.17Å; N738-C740 PolarHBondContact O-SG 3.06Å; N738-T770 VanDerWaalsContact CA-O 3.27Å; N738-T770 WeakPolarHBondContact CA-O 3.22Å
739	D	95.7	Very high	95.2	Very high	69.6667 Å²	69.6667	33.3 Å²	33.3	37%	0.373	15%	0.152	S	C	.	.	S	Bend	trans	55.3	24.7	169.8	-59.8	-71.5	0	0	0	114.1	G714 T770 R771	G714-D739 WeakPolarHBondContact CA-O 3.41Å; D739-T770 PolarHBondContact N-O 3Å; D739-R771 WeakPolarHBondContact CA-O 3.24Å; D739-R771 WeakPolarHBondContact OD1-CB 3.38Å; D739-R771 IonicContact OD1-CZ 3.5Å; D739-R771 IonicContact OD1-NE 3.14Å; D739-R771 PolarHBondContact OD1-NE 3.09Å; D739-R771 VanDerWaalsContact OD1-NE 3.1Å; D739-R771 IonicContact OD2-CZ 3.11Å; D739-R771 IonicContact OD2-NE 3.47Å; D739-R771 PolarHBondContact OD2-NE 2.9Å; D739-R771 VanDerWaalsContact OD2-NE 3.12Å; D739-R771 IonicContact OD2-NH2 3.58Å; D739-R771 PolarHBondContact OD2-NH2 2.77Å
740	C	96.5	Very high	95.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.151	C	C	.	.			trans	-88	150.8	179.1	-68	0	0	0	0	112	S715 N738 F742 N772 H773	S715-C740 CarbonylContact O-C 3.5Å; S715-C740 VanDerWaalsContact O-CA 3.28Å; S715-C740 WeakPolarHBondContact O-CA 3.32Å; S715-C740 WeakPolarHBondContact O-CB 3.33Å; N738-C740 PolarHBondContact O-N 3.17Å; N738-C740 PolarHBondContact O-SG 3.06Å; C740-F742 HydrophobicContact CB-CD2 4.38Å; C740-F742 HydrophobicContact CB-CE2 3.63Å; C740-F742 HydrophobicContact CB-CZ 3.99Å; C740-N772 VanDerWaalsContact CB-OD1 3.28Å; C740-N772 WeakPolarHBondContact CB-OD1 3.26Å; C740-N772 PolarHBondContact N-OD1 3.02Å; C740-N772 WeakPolarHBondContact O-CA 3.38Å; C740-H773 PolarHBondContact O-N 3.05Å
741	R	96	Very high	95.3	Very high	127 Å²	127	33.4 Å²	33.4	48%	0.479	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.4	178.4	-62.2	-178.9	149.1	139.7	-0.6	110.7	S715 V716 F717 V743 H773	S715-R741 PolarHBondContact O-N 3.03Å; V716-R741 CarbonylContact C-O 3.58Å; V716-R741 WeakPolarHBondContact CA-O 3.39Å; V716-R741 HydrophobicContact CG1-CB 4.49Å; V716-R741 HydrophobicContact CG2-CB 4.42Å; F717-R741 PolarHBondContact N-O 3.23Å; R741-V743 HydrophobicContact CB-CG2 4.49Å; R741-H773 CarbonylContact C-O 3.5Å; R741-H773 WeakPolarHBondContact CA-O 3.29Å; R741-H773 HydrophobicContact CG-CB 4.43Å
742	F	96.9	Very high	95.3	Very high	0.666667 Å²	0.666667	33.4 Å²	33.4	0%	0.003	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	105.1	176.6	-55.8	-90.3	0	0	0	109	F717 C724 F725 C740 V749 H773 M774 K775 N777	F717-F742 HydrophobicContact CB-CD1 3.54Å; F717-F742 HydrophobicContact CB-CE1 4.05Å; F717-F742 HydrophobicContact CB-CG 4.41Å; F717-F742 HydrophobicContact CD1-CD1 4.49Å; F717-F742 HydrophobicContact CD1-CE1 4.27Å; F717-F742 AromaticContact CD2-CD1 3.55Å; F717-F742 HydrophobicContact CD2-CD1 3.55Å; F717-F742 AromaticContact CD2-CE1 3.22Å; F717-F742 HydrophobicContact CD2-CE1 3.22Å; F717-F742 HydrophobicContact CD2-CG 4.46Å; F717-F742 AromaticContact CD2-CZ 3.89Å; F717-F742 HydrophobicContact CD2-CZ 3.89Å; F717-F742 HydrophobicContact CE2-CD1 4.39Å; F717-F742 AromaticContact CE2-CE1 3.62Å; F717-F742 HydrophobicContact CE2-CE1 3.62Å; F717-F742 AromaticContact CE2-CZ 3.95Å; F717-F742 HydrophobicContact CE2-CZ 3.99Å; F717-F742 AromaticContact CG-CD1 3.64Å; F717-F742 HydrophobicContact CG-CD1 3.64Å; F717-F742 AromaticContact CG-CE1 3.6Å; F717-F742 HydrophobicContact CG-CE1 3.6Å; F717-F742 HydrophobicContact CZ-CE1 4.29Å; F717-F742 WeakPolarHBondContact O-CA 3.38Å; C724-F742 HydrophobicContact CB-CD1 3.81Å; C724-F742 HydrophobicContact CB-CE1 3.97Å; F725-F742 HydrophobicContact CB-CE1 4.44Å; C740-F742 HydrophobicContact CB-CD2 4.38Å; C740-F742 HydrophobicContact CB-CE2 3.63Å; C740-F742 HydrophobicContact CB-CZ 3.99Å; F742-V749 HydrophobicContact CB-CB 4.39Å; F742-V749 HydrophobicContact CB-CG1 3.42Å; F742-V749 VanDerWaalsContact CB-CG1 3.43Å; F742-V749 HydrophobicContact CB-CG2 4.03Å; F742-V749 HydrophobicContact CD1-CB 4.5Å; F742-V749 HydrophobicContact CD1-CG1 3.27Å; F742-V749 HydrophobicContact CD2-CG1 3.76Å; F742-V749 HydrophobicContact CE1-CG1 3.85Å; F742-V749 HydrophobicContact CE2-CG1 4.29Å; F742-V749 HydrophobicContact CG-CB 4.48Å; F742-V749 HydrophobicContact CG-CG1 3.2Å; F742-V749 HydrophobicContact CZ-CG1 4.32Å; F742-H773 PolarHBondContact N-O 3.12Å; F742-M774 HydrophobicContact CB-CG 4.25Å; F742-M774 HydrophobicContact CD2-CE 4.28Å; F742-M774 HydrophobicContact CD2-CG 3.86Å; F742-M774 HydrophobicContact CE2-CE 4.24Å; F742-M774 HydrophobicContact CG-CG 4.42Å; F742-M774 WeakPolarHBondContact O-CA 3.39Å; F742-K775 PolarHBondContact O-N 2.97Å; F742-N777 PolarHBondContact O-ND2 2.75Å; F742-N777 PolarHBondContact O-OD1 3.1Å
743	V	95.7	Very high	95.3	Very high	27 Å²	27	34.6 Å²	34.6	16%	0.164	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	134.6	-169.9	-176.8	0	0	0	0	111.4	F717 R718 R741 N745 K775 Y776	F717-V743 PolarHBondContact O-N 2.75Å; R718-V743 VanDerWaalsContact CA-O 3.29Å; R718-V743 WeakPolarHBondContact CA-O 3.35Å; R718-V743 HydrophobicContact CG-CB 4.37Å; R718-V743 WeakPolarHBondContact CG-O 3.47Å; R741-V743 HydrophobicContact CB-CG2 4.49Å; V743-N745 VanDerWaalsContact C-N 3.31Å; V743-N745 PolarHBondContact N-ND2 3.08Å; V743-N745 PolarHBondContact O-N 3.07Å; V743-N745 PolarHBondContact O-ND2 2.89Å; V743-K775 VanDerWaalsContact CA-O 3.31Å; V743-K775 WeakPolarHBondContact CA-O 3.43Å; V743-Y776 HydrophobicContact CG1-CD2 4.35Å
744	E	95.4	Very high	95.2	Very high	101 Å²	101	34.5 Å²	34.5	47%	0.472	16%	0.156	S	C	.	.	S	Bend	trans	56.8	37.9	173.8	-68	170.1	-170.8	0	0	114.2	L719 K775 Y776 N777	L719-E744 WeakPolarHBondContact CA-O 3.37Å; L719-E744 HydrophobicContact CD2-CB 4.22Å; L719-E744 PolarHBondContact N-O 2.95Å; E744-K775 PolarHBondContact N-O 3.17Å; E744-Y776 WeakPolarHBondContact CA-O 3.38Å; E744-N777 PolarHBondContact N-OD1 3.11Å
745	N	94.9	Very high	94.7	Very high	0.333333 Å²	0.333333	32.8 Å²	32.8	0%	0.002	15%	0.147	C	C	.	.			trans	-90.3	144.4	174.5	-58.6	-73.9	0	0	0	111	F717 R718 L719 S720 C724 V743 N777 V778	F717-N745 PolarHBondContact O-ND2 3.11Å; F717-N745 VanDerWaalsContact O-ND2 3.11Å; R718-N745 VanDerWaalsContact C-OD1 3.26Å; R718-N745 WeakPolarHBondContact CA-OD1 3.24Å; L719-N745 PolarHBondContact N-OD1 3.06Å; S720-N745 WeakPolarHBondContact CB-OD1 3.35Å; S720-N745 PolarHBondContact N-OD1 3.12Å; S720-N745 PolarHBondContact OG-OD1 2.92Å; C724-N745 PolarHBondContact SG-OD1 3.03Å; C724-N745 VanDerWaalsContact SG-OD1 3.41Å; V743-N745 VanDerWaalsContact C-N 3.31Å; V743-N745 PolarHBondContact N-ND2 3.08Å; V743-N745 PolarHBondContact O-N 3.07Å; V743-N745 PolarHBondContact O-ND2 2.89Å; N745-N777 WeakPolarHBondContact CB-OD1 3.41Å; N745-N777 PolarHBondContact N-OD1 3.27Å; N745-N777 VanDerWaalsContact N-OD1 3.1Å; N745-N777 PolarHBondContact ND2-OD1 2.96Å; N745-N777 CarbonylContact O-C 3.46Å; N745-N777 WeakPolarHBondContact O-CA 3.4Å; N745-V778 PolarHBondContact O-N 3.29Å
746	H	90.6	Very high	94.2	Very high	115.333 Å²	115.333	36.5 Å²	36.5	53%	0.534	17%	0.167	S	C	.	.	S	Bend	trans	-98.3	9.8	-174.8	-67.3	79.5	0	0	0	113.4	S720 V778	S720-H746 PolarHBondContact O-N 2.97Å; S720-H746 VanDerWaalsContact O-N 3.1Å; H746-V778 CarbonylContact C-O 3.28Å
747	R	89.6	Confident	93.9	Very high	64.3333 Å²	64.3333	36.4 Å²	36.4	24%	0.243	16%	0.164	C	C	.	.	S	Bend	trans	-142.7	170.4	176.5	-79.1	-84.8	-164.4	-155.6	6.9	109.9	T721 G722 V778 L1084 E1085	T721-R747 WeakPolarHBondContact O-CD 3.14Å; T721-R747 WeakPolarHBondContact O-CG 3.21Å; T721-R747 PolarHBondContact O-NE 2.94Å; G722-R747 WeakPolarHBondContact O-CB 3.38Å; R747-V778 CarbonylContact C-O 3.54Å; R747-V778 WeakPolarHBondContact CA-O 3.4Å; R747-V778 PolarHBondContact N-O 3.07Å; R747-V778 VanDerWaalsContact N-O 3.11Å; R747-L1084 PolarHBondContact NH1-O 3.17Å; R747-L1084 VanDerWaalsContact NH1-O 3.08Å; R747-E1085 IonicContact CZ-OE1 3.2Å; R747-E1085 IonicContact NH2-OE1 3.44Å; R747-E1085 PolarHBondContact NH2-OE1 3.42Å
748	P	92.4	Very high	93.3	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	19%	0.191	C	C	.	.			trans	-52.7	144.7	177.9	-28	37.1	0	0	0	112.9	I723 C724 P780 F781 L1084	I723-P748 VanDerWaalsContact CA-O 3.28Å; I723-P748 WeakPolarHBondContact CA-O 3.29Å; C724-P748 PolarHBondContact N-O 3.23Å; C724-P748 VanDerWaalsContact N-O 3.17Å; P748-P780 HydrophobicContact CG-CG 3.97Å; P748-F781 WeakPolarHBondContact CA-O 3.46Å; P748-F781 HydrophobicContact CB-CD2 3.89Å; P748-F781 HydrophobicContact CB-CE2 3.57Å; P748-F781 HydrophobicContact CB-CZ 4.11Å; P748-F781 VanDerWaalsContact CB-O 3.32Å; P748-F781 WeakPolarHBondContact CB-O 3.38Å; P748-F781 HydrophobicContact CG-CD2 4.21Å; P748-F781 HydrophobicContact CG-CE1 4.27Å; P748-F781 HydrophobicContact CG-CE2 3.95Å; P748-F781 HydrophobicContact CG-CG 4.46Å; P748-F781 HydrophobicContact CG-CZ 4.05Å; P748-F781 WeakPolarHBondContact CG-O 3.29Å; P748-L1084 HydrophobicContact CB-CD1 4.49Å; P748-L1084 HydrophobicContact CG-CD1 3.93Å
749	V	94.6	Very high	92.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.215	C	C	.	.	S	Bend	trans	-86.3	-53.5	-172.7	167.1	0	0	0	0	110.7	C724 F725 F742 M774 N777 I782	C724-V749 HydrophobicContact CB-CG1 4.48Å; C724-V749 VanDerWaalsContact CB-O 3.3Å; C724-V749 WeakPolarHBondContact CB-O 3.31Å; C724-V749 PolarHBondContact N-O 2.77Å; F725-V749 PolarHBondContact N-O 2.97Å; F742-V749 HydrophobicContact CB-CB 4.39Å; F742-V749 HydrophobicContact CB-CG1 3.42Å; F742-V749 VanDerWaalsContact CB-CG1 3.43Å; F742-V749 HydrophobicContact CB-CG2 4.03Å; F742-V749 HydrophobicContact CD1-CB 4.5Å; F742-V749 HydrophobicContact CD1-CG1 3.27Å; F742-V749 HydrophobicContact CD2-CG1 3.76Å; F742-V749 HydrophobicContact CE1-CG1 3.85Å; F742-V749 HydrophobicContact CE2-CG1 4.29Å; F742-V749 HydrophobicContact CG-CB 4.48Å; F742-V749 HydrophobicContact CG-CG1 3.2Å; F742-V749 HydrophobicContact CZ-CG1 4.32Å; V749-M774 HydrophobicContact CG1-CE 4.48Å; V749-M774 HydrophobicContact CG1-CG 4.22Å; V749-M774 HydrophobicContact CG1-SD 4.21Å; V749-N777 HydrophobicContact CG2-CB 3.82Å; V749-N777 VanDerWaalsContact CG2-CG 3.47Å; V749-I782 HydrophobicContact CB-CG2 4.05Å; V749-I782 WeakPolarHBondContact CB-O 3.47Å; V749-I782 HydrophobicContact CG2-CG2 3.89Å; V749-I782 PolarHBondContact N-O 3.23Å
750	L	95.9	Very high	92.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	122	-171.2	-175.8	62.9	0	0	0	110.9	F725 I737 I752 I769 M774 I782 V783 S784 I785	F725-L750 HydrophobicContact CB-CD1 3.85Å; F725-L750 HydrophobicContact CD1-CD1 3.36Å; F725-L750 HydrophobicContact CE1-CD1 4.12Å; F725-L750 HydrophobicContact CG-CD1 3.79Å; I737-L750 HydrophobicContact CD1-CD1 3.85Å; L750-I752 HydrophobicContact CD1-CD1 3.95Å; L750-I752 HydrophobicContact CD1-CG1 4.09Å; L750-I752 HydrophobicContact CD2-CD1 4.34Å; L750-I752 HydrophobicContact CG-CD1 4.26Å; L750-I752 HydrophobicContact CG-CG1 4.45Å; L750-I769 HydrophobicContact CD2-CD1 3.82Å; L750-I769 HydrophobicContact CD2-CG1 4.38Å; L750-I769 HydrophobicContact CD2-CG2 4.33Å; L750-M774 HydrophobicContact CB-CE 4.47Å; L750-M774 HydrophobicContact CD2-CE 4.1Å; L750-I782 PolarHBondContact N-O 3.22Å; L750-I782 VanDerWaalsContact N-O 3.12Å; L750-V783 HydrophobicContact CB-CG1 4.27Å; L750-V783 HydrophobicContact CB-CG2 4.31Å; L750-V783 HydrophobicContact CD2-CG1 4.15Å; L750-V783 HydrophobicContact CG-CG1 4.42Å; L750-V783 CarbonylContact O-C 3.58Å; L750-V783 WeakPolarHBondContact O-CA 3.19Å; L750-S784 PolarHBondContact O-N 2.93Å; L750-I785 HydrophobicContact CD2-CG2 4.35Å
751	L	95.7	Very high	92.3	Very high	5.66667 Å²	5.66667	44.3 Å²	44.3	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	108.7	175.3	179	61.8	0	0	0	110.2	I723 F725 R726 I727 R753 F781 S784	I723-L751 HydrophobicContact CD1-CD2 3.83Å; I723-L751 HydrophobicContact CG2-CB 4.26Å; F725-L751 PolarHBondContact O-N 2.98Å; R726-L751 WeakPolarHBondContact CA-O 3.43Å; R726-L751 HydrophobicContact CG-CD2 4.24Å; I727-L751 PolarHBondContact N-O 2.87Å; L751-R753 HydrophobicContact CD1-CB 4.21Å; L751-F781 HydrophobicContact CD1-CE2 4.5Å; L751-F781 HydrophobicContact CD1-CZ 4.4Å; L751-S784 WeakPolarHBondContact CA-O 3.46Å
752	I	96.4	Very high	91.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	104.7	172.8	-55.8	169.8	0	0	0	108.2	F725 I727 A730 L735 I737 L750 V767 I769 S784 I785 G786 M796	F725-I752 HydrophobicContact CE1-CD1 4.35Å; F725-I752 HydrophobicContact CE1-CG1 4.43Å; I727-I752 HydrophobicContact CB-CG1 4.47Å; I727-I752 WeakPolarHBondContact O-CA 3.44Å; A730-I752 HydrophobicContact CB-CG2 3.75Å; L735-I752 HydrophobicContact CD2-CD1 3.66Å; L735-I752 HydrophobicContact CD2-CG1 4.46Å; I737-I752 HydrophobicContact CD1-CD1 4.05Å; L750-I752 HydrophobicContact CD1-CD1 3.95Å; L750-I752 HydrophobicContact CD1-CG1 4.09Å; L750-I752 HydrophobicContact CD2-CD1 4.34Å; L750-I752 HydrophobicContact CG-CD1 4.26Å; L750-I752 HydrophobicContact CG-CG1 4.45Å; I752-V767 HydrophobicContact CD1-CG1 4.16Å; I752-I769 HydrophobicContact CD1-CD1 4.08Å; I752-S784 PolarHBondContact N-O 3.06Å; I752-I785 HydrophobicContact CB-CG2 4.48Å; I752-I785 CarbonylContact O-C 3.56Å; I752-I785 VanDerWaalsContact O-CA 3.27Å; I752-I785 WeakPolarHBondContact O-CA 3.24Å; I752-G786 PolarHBondContact O-N 3.17Å; I752-M796 HydrophobicContact CB-CE 4.02Å; I752-M796 HydrophobicContact CD1-CE 4.46Å; I752-M796 HydrophobicContact CG2-CE 3.51Å; I752-M796 VanDerWaalsContact CG2-CE 3.49Å
753	R	92.8	Very high	91.8	Very high	29 Å²	29	42.9 Å²	42.9	11%	0.109	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.5	-169.7	-170.2	171.7	89.8	128.2	5.3	112	I727 Q728 L751 R755 D756 G786 T829 D852	I727-R753 PolarHBondContact O-N 2.82Å; Q728-R753 WeakPolarHBondContact CG-O 3.29Å; L751-R753 HydrophobicContact CD1-CB 4.21Å; R753-R755 HydrophobicContact CG-CB 4.06Å; R753-D756 IonicContact CZ-OD1 3.45Å; R753-D756 IonicContact CZ-OD2 3.3Å; R753-D756 VanDerWaalsContact CZ-OD2 3.31Å; R753-D756 IonicContact NE-OD1 2.89Å; R753-D756 IonicContact NE-OD2 3.12Å; R753-D756 PolarHBondContact NE-OD2 2.82Å; R753-D756 IonicContact NH1-OD1 3.11Å; R753-D756 PolarHBondContact NH1-OD1 3.44Å; R753-D756 VanDerWaalsContact NH1-OD1 3.1Å; R753-D756 IonicContact NH1-OD2 2.92Å; R753-D756 PolarHBondContact NH1-OD2 3Å; R753-D756 IonicContact NH2-OD1 2.74Å; R753-D756 PolarHBondContact NH2-OD1 3.38Å; R753-D756 IonicContact NH2-OD2 3.4Å; R753-D756 PolarHBondContact NH2-OD2 3.06Å; R753-G786 CarbonylContact C-O 3.47Å; R753-G786 VanDerWaalsContact CA-O 3.24Å; R753-G786 WeakPolarHBondContact CA-O 3.26Å; R753-T829 HydrophobicContact CG-CG2 4.31Å; R753-D852 IonicContact NH1-OD2 3.17Å; R753-D852 PolarHBondContact NH1-OD2 3.31Å
754	N	94.5	Very high	91.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.			trans	-108.1	-5.3	174	-63.7	2.1	0	0	0	114.3	P729 A730 D756 H757 G786 L787 N788 Q794	P729-N754 WeakPolarHBondContact CA-OD1 3.39Å; P729-N754 HydrophobicContact CB-CB 4.45Å; A730-N754 PolarHBondContact N-OD1 3.09Å; A730-N754 PolarHBondContact O-ND2 3.01Å; N754-D756 PolarHBondContact O-N 2.92Å; N754-D756 VanDerWaalsContact O-N 3.08Å; N754-H757 CarbonylContact O-C 3.28Å; N754-H757 WeakPolarHBondContact O-CA 3.45Å; N754-H757 PolarHBondContact O-N 2.94Å; N754-G786 PolarHBondContact N-O 3.02Å; N754-G786 VanDerWaalsContact N-O 3.11Å; N754-L787 WeakPolarHBondContact ND2-CD2 3.33Å; N754-N788 VanDerWaalsContact C-OD1 3.26Å; N754-N788 VanDerWaalsContact CB-OD1 3.28Å; N754-N788 WeakPolarHBondContact CB-OD1 3.42Å; N754-N788 PolarHBondContact ND2-OD1 3.03Å; N754-N788 PolarHBondContact O-ND2 3.2Å; N754-N788 PolarHBondContact O-OD1 2.95Å; N754-Q794 PolarHBondContact ND2-OE1 3.05Å; N754-Q794 VanDerWaalsContact ND2-OE1 3.12Å
755	R	85.8	Confident	91.8	Very high	77.6667 Å²	77.6667	38.9 Å²	38.9	29%	0.293	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-39.3	-172.7	179.7	177.8	174.3	177.5	4.9	114.3	R753 H757 D852	R753-R755 HydrophobicContact CG-CB 4.06Å; R755-H757 PolarHBondContact O-N 2.95Å; R755-D852 IonicContact CZ-OD1 2.91Å; R755-D852 IonicContact CZ-OD2 3.44Å; R755-D852 PolarHBondContact NH1-O 3.36Å; R755-D852 VanDerWaalsContact NH1-O 3.09Å; R755-D852 IonicContact NH1-OD1 3.24Å; R755-D852 PolarHBondContact NH1-OD1 2.79Å; R755-D852 IonicContact NH1-OD2 3.62Å; R755-D852 PolarHBondContact NH1-OD2 3.17Å
756	D	86.7	Confident	91.9	Very high	81 Å²	81	42.2 Å²	42.2	43%	0.433	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-1.7	-176	-53	-30.7	0	0	0	112.9	Q728 R753 N754 P758	Q728-D756 PolarHBondContact NE2-OD2 3.16Å; R753-D756 IonicContact CZ-OD1 3.45Å; R753-D756 IonicContact CZ-OD2 3.3Å; R753-D756 VanDerWaalsContact CZ-OD2 3.31Å; R753-D756 IonicContact NE-OD1 2.89Å; R753-D756 IonicContact NE-OD2 3.12Å; R753-D756 PolarHBondContact NE-OD2 2.82Å; R753-D756 IonicContact NH1-OD1 3.11Å; R753-D756 PolarHBondContact NH1-OD1 3.44Å; R753-D756 VanDerWaalsContact NH1-OD1 3.1Å; R753-D756 IonicContact NH1-OD2 2.92Å; R753-D756 PolarHBondContact NH1-OD2 3Å; R753-D756 IonicContact NH2-OD1 2.74Å; R753-D756 PolarHBondContact NH2-OD1 3.38Å; R753-D756 IonicContact NH2-OD2 3.4Å; R753-D756 PolarHBondContact NH2-OD2 3.06Å; N754-D756 PolarHBondContact O-N 2.92Å; N754-D756 VanDerWaalsContact O-N 3.08Å; D756-P758 VanDerWaalsContact C-CD 3.46Å
757	H	91	Very high	92.2	Very high	46.3333 Å²	46.3333	36.8 Å²	36.8	22%	0.215	19%	0.192	C	C	.	.			trans	-129.7	59.8	-179.5	-55.7	-75.4	0	0	0	112.3	P729 N754 R755 Q759 L760 N788	P729-H757 HydrophobicContact CB-CB 4.46Å; N754-H757 CarbonylContact O-C 3.28Å; N754-H757 WeakPolarHBondContact O-CA 3.45Å; N754-H757 PolarHBondContact O-N 2.94Å; R755-H757 PolarHBondContact O-N 2.95Å; H757-Q759 VanDerWaalsContact C-OE1 3.25Å; H757-Q759 VanDerWaalsContact CA-OE1 3.28Å; H757-Q759 PolarHBondContact O-N 2.83Å; H757-L760 HydrophobicContact CB-CB 4.46Å; H757-L760 HydrophobicContact CB-CD1 3.78Å; H757-L760 HydrophobicContact CB-CG 4.09Å; H757-L760 PolarHBondContact O-N 3.24Å; H757-L760 VanDerWaalsContact O-N 3.13Å; H757-N788 PolarHBondContact O-ND2 3.19Å
758	P	85.5	Confident	92.6	Very high	86.6667 Å²	86.6667	35.2 Å²	35.2	56%	0.563	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-59.5	-29.4	-178.2	25.9	-35.1	0	0	0	113.5	D756 L760 A761 N788	D756-P758 VanDerWaalsContact C-CD 3.46Å; P758-L760 PolarHBondContact O-N 3.14Å; P758-L760 VanDerWaalsContact O-N 3.11Å; P758-A761 WeakPolarHBondContact O-CB 3.34Å; P758-A761 PolarHBondContact O-N 3Å; P758-A761 VanDerWaalsContact O-N 3.15Å; P758-N788 WeakPolarHBondContact CA-ND2 3.43Å
759	Q	87.2	Confident	92.8	Very high	126 Å²	126	35.2 Å²	35.2	59%	0.589	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-63.4	-14.7	177.9	72	-81	16.8	0	0	114.2	H757	H757-Q759 VanDerWaalsContact C-OE1 3.25Å; H757-Q759 VanDerWaalsContact CA-OE1 3.28Å; H757-Q759 PolarHBondContact O-N 2.83Å
760	L	91.9	Very high	92.9	Very high	15.6667 Å²	15.6667	35.6 Å²	35.6	8%	0.082	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-97.1	11.4	-179.7	-54.8	-178.9	0	0	0	112.9	Q701 P729 V731 H757 P758 N762 L763 Q794	Q701-L760 HydrophobicContact CB-CD1 4.14Å; Q701-L760 HydrophobicContact CB-CD2 4.19Å; Q701-L760 HydrophobicContact CG-CD1 3.95Å; P729-L760 HydrophobicContact CB-CD1 4.43Å; P729-L760 HydrophobicContact CG-CD1 3.8Å; V731-L760 HydrophobicContact CG1-CB 4.14Å; V731-L760 HydrophobicContact CG2-CD1 4.36Å; H757-L760 HydrophobicContact CB-CB 4.46Å; H757-L760 HydrophobicContact CB-CD1 3.78Å; H757-L760 HydrophobicContact CB-CG 4.09Å; H757-L760 PolarHBondContact O-N 3.24Å; H757-L760 VanDerWaalsContact O-N 3.13Å; P758-L760 PolarHBondContact O-N 3.14Å; P758-L760 VanDerWaalsContact O-N 3.11Å; L760-N762 PolarHBondContact O-N 2.96Å; L760-N762 VanDerWaalsContact O-N 3.11Å; L760-L763 HydrophobicContact CB-CD1 4.25Å; L760-L763 HydrophobicContact CD2-CD1 4.01Å; L760-L763 PolarHBondContact O-N 3.03Å; L760-Q794 PolarHBondContact O-NE2 3.12Å; L760-Q794 VanDerWaalsContact O-NE2 3.1Å
761	A	89	Confident	92.8	Very high	25.6667 Å²	25.6667	39.8 Å²	39.8	21%	0.212	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.8	-178.3	0	0	0	0	0	113.9	P758 L763 N788 P790 S791	P758-A761 WeakPolarHBondContact O-CB 3.34Å; P758-A761 PolarHBondContact O-N 3Å; P758-A761 VanDerWaalsContact O-N 3.15Å; A761-L763 VanDerWaalsContact C-N 3.35Å; A761-N788 HydrophobicContact CB-CB 3.8Å; A761-N788 PolarHBondContact N-ND2 2.93Å; A761-P790 HydrophobicContact CB-CG 4.19Å; A761-S791 WeakPolarHBondContact O-CB 3.4Å; A761-S791 PolarHBondContact O-OG 2.61Å
762	N	88.3	Confident	92.9	Very high	94.6667 Å²	94.6667	39.6 Å²	39.6	51%	0.506	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.4	177.3	68.3	-40.6	0	0	0	113.8	D703 L760 V793	D703-N762 PolarHBondContact OD1-ND2 3.25Å; D703-N762 VanDerWaalsContact OD1-ND2 3.09Å; L760-N762 PolarHBondContact O-N 2.96Å; L760-N762 VanDerWaalsContact O-N 3.11Å; N762-V793 WeakPolarHBondContact O-CG2 3.06Å
763	L	93.4	Very high	92.9	Very high	4.33333 Å²	4.33333	42.5 Å²	42.5	2%	0.023	22%	0.221	C	C	.	.	S	Bend	trans	-84.6	136.2	-178.3	-60.8	-178.5	0	0	0	111.2	D703 V731 L760 A761 Q794	D703-L763 VanDerWaalsContact OD1-CD2 3.3Å; D703-L763 WeakPolarHBondContact OD1-CD2 3.35Å; V731-L763 HydrophobicContact CB-CB 3.9Å; V731-L763 HydrophobicContact CB-CD1 4.04Å; V731-L763 HydrophobicContact CG1-CB 4.16Å; V731-L763 HydrophobicContact CG1-CD1 4.46Å; V731-L763 HydrophobicContact CG2-CD1 4.02Å; L760-L763 HydrophobicContact CB-CD1 4.25Å; L760-L763 HydrophobicContact CD2-CD1 4.01Å; L760-L763 PolarHBondContact O-N 3.03Å; A761-L763 VanDerWaalsContact C-N 3.35Å; L763-Q794 VanDerWaalsContact O-CG 3.25Å; L763-Q794 WeakPolarHBondContact O-CG 3.28Å; L763-Q794 PolarHBondContact O-NE2 3.32Å
764	P	94.5	Very high	93.1	Very high	43.3333 Å²	43.3333	41.2 Å²	41.2	28%	0.281	22%	0.216	S	C	.	.			trans	-72.2	142	-175.1	29.3	-35.7	0	0	0	112.5	I707 N732 I733 V793	I707-P764 HydrophobicContact CD1-CB 4.45Å; I707-P764 HydrophobicContact CD1-CG 4.28Å; I707-P764 HydrophobicContact CG1-CG 4.32Å; N732-P764 VanDerWaalsContact CA-O 3.3Å; N732-P764 WeakPolarHBondContact CA-O 3.28Å; N732-P764 PolarHBondContact N-O 2.92Å; N732-P764 WeakPolarHBondContact OD1-CD 3.43Å; I733-P764 PolarHBondContact N-O 3.05Å; P764-V793 WeakPolarHBondContact CA-O 3.36Å; P764-V793 HydrophobicContact CB-CB 4.42Å
765	A	96.3	Very high	93.1	Very high	0.666667 Å²	0.666667	44 Å²	44	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	134.5	172.3	0	0	0	0	0	111	A730 I733 L787 V793 Q794 N795	A730-A765 VanDerWaalsContact O-CB 3.25Å; A730-A765 WeakPolarHBondContact O-CB 3.42Å; I733-A765 HydrophobicContact CG2-CB 4.25Å; I733-A765 WeakPolarHBondContact O-CA 3.36Å; A765-L787 HydrophobicContact CB-CD1 4.42Å; A765-L787 HydrophobicContact CB-CD2 4.49Å; A765-V793 PolarHBondContact N-O 3.09Å; A765-Q794 HydrophobicContact CB-CB 4.26Å; A765-Q794 HydrophobicContact CB-CG 3.83Å; A765-Q794 VanDerWaalsContact O-CA 3.31Å; A765-Q794 WeakPolarHBondContact O-CA 3.4Å; A765-N795 PolarHBondContact O-N 3.09Å
766	T	96.8	Very high	93.6	Very high	69 Å²	69	46.8 Å²	46.8	42%	0.423	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	118.1	172.7	-23.9	0	0	0	0	109.1	I733 K734 L735 N795	I733-T766 PolarHBondContact O-N 3.32Å; K734-T766 CarbonylContact C-O 3.57Å; K734-T766 WeakPolarHBondContact CA-O 3.21Å; K734-T766 WeakPolarHBondContact CG-OG1 3.4Å; L735-T766 PolarHBondContact N-O 3.32Å; T766-N795 WeakPolarHBondContact CA-O 3.44Å
767	V	97.5	Very high	94	Very high	1.33333 Å²	1.33333	42.9 Å²	42.9	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129	-177	179.7	0	0	0	0	110.3	L735 I752 I769 L787 N795 M796 H797	L735-V767 HydrophobicContact CB-CB 4.47Å; L735-V767 HydrophobicContact CB-CG1 4.31Å; L735-V767 HydrophobicContact CB-CG2 4.13Å; L735-V767 HydrophobicContact CD2-CG1 3.82Å; L735-V767 HydrophobicContact CD2-CG2 4.22Å; L735-V767 HydrophobicContact CG-CG1 4.23Å; L735-V767 CarbonylContact O-C 3.49Å; L735-V767 WeakPolarHBondContact O-CA 3.3Å; I752-V767 HydrophobicContact CD1-CG1 4.16Å; V767-I769 HydrophobicContact CG1-CD1 4.06Å; V767-I769 HydrophobicContact CG1-CG1 4.05Å; V767-L787 HydrophobicContact CG2-CD2 4.5Å; V767-N795 PolarHBondContact N-O 3.03Å; V767-M796 HydrophobicContact CB-CB 4.15Å; V767-M796 HydrophobicContact CB-CE 3.93Å; V767-M796 HydrophobicContact CB-CG 3.85Å; V767-M796 HydrophobicContact CG1-CE 3.92Å; V767-M796 HydrophobicContact CG1-CG 3.94Å; V767-M796 HydrophobicContact CG1-SD 4.33Å; V767-M796 HydrophobicContact CG2-CE 3.95Å; V767-M796 CarbonylContact O-C 3.59Å; V767-M796 WeakPolarHBondContact O-CA 3.4Å; V767-H797 PolarHBondContact O-N 3.24Å
768	S	97.3	Very high	94.2	Very high	31.3333 Å²	31.3333	42.9 Å²	42.9	22%	0.219	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	126.1	176	167.8	0	0	0	0	109.3	L735 D736 I737	L735-S768 PolarHBondContact O-N 3.13Å; D736-S768 WeakPolarHBondContact CA-O 3.43Å; D736-S768 WeakPolarHBondContact OD1-CB 3.23Å; D736-S768 PolarHBondContact OD1-OG 3.08Å; D736-S768 VanDerWaalsContact OD1-OG 3.11Å; I737-S768 PolarHBondContact N-O 2.99Å
769	I	97.6	Very high	94.5	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	111.9	178.1	-58.3	158.4	0	0	0	107	I737 L750 I752 V767 N772 I785 M796 H797 F798 H799 N802	I737-I769 HydrophobicContact CB-CG1 4.37Å; I737-I769 HydrophobicContact CB-CG2 4.48Å; I737-I769 HydrophobicContact CD1-CG1 4.31Å; I737-I769 WeakPolarHBondContact O-CA 3.17Å; L750-I769 HydrophobicContact CD2-CD1 3.82Å; L750-I769 HydrophobicContact CD2-CG1 4.38Å; L750-I769 HydrophobicContact CD2-CG2 4.33Å; I752-I769 HydrophobicContact CD1-CD1 4.08Å; V767-I769 HydrophobicContact CG1-CD1 4.06Å; V767-I769 HydrophobicContact CG1-CG1 4.05Å; I769-N772 VanDerWaalsContact CG2-ND2 3.28Å; I769-N772 WeakPolarHBondContact CG2-ND2 3.36Å; I769-I785 HydrophobicContact CD1-CG2 4.31Å; I769-M796 HydrophobicContact CD1-SD 4.36Å; I769-H797 PolarHBondContact N-O 3.22Å; I769-F798 HydrophobicContact CB-CD2 3.83Å; I769-F798 HydrophobicContact CB-CE2 4.36Å; I769-F798 HydrophobicContact CD1-CD2 3.81Å; I769-F798 HydrophobicContact CD1-CE2 4.46Å; I769-F798 HydrophobicContact CG1-CD2 4.45Å; I769-F798 HydrophobicContact CG2-CD2 3.66Å; I769-F798 HydrophobicContact CG2-CE2 3.67Å; I769-H799 PolarHBondContact O-N 2.84Å; I769-H799 VanDerWaalsContact O-N 3.09Å; I769-H799 VanDerWaalsContact O-O 3.11Å; I769-N802 PolarHBondContact O-ND2 2.8Å
770	T	96	Very high	94.7	Very high	9.33333 Å²	9.33333	33.4 Å²	33.4	6%	0.057	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147.1	-171.9	69	0	0	0	0	113.3	I737 N738 D739 N772 H799 V800 N802	I737-T770 PolarHBondContact O-N 2.93Å; N738-T770 VanDerWaalsContact CA-O 3.27Å; N738-T770 WeakPolarHBondContact CA-O 3.22Å; D739-T770 PolarHBondContact N-O 3Å; T770-N772 PolarHBondContact N-ND2 3.19Å; T770-N772 PolarHBondContact O-N 2.91Å; T770-N772 VanDerWaalsContact O-N 3.1Å; T770-N772 PolarHBondContact O-ND2 3.2Å; T770-H799 VanDerWaalsContact CA-O 3.29Å; T770-H799 WeakPolarHBondContact CA-O 3.41Å; T770-H799 WeakPolarHBondContact CB-O 3.24Å; T770-H799 VanDerWaalsContact CG2-CE1 3.43Å; T770-H799 WeakPolarHBondContact CG2-CE1 3.36Å; T770-H799 WeakPolarHBondContact CG2-O 3.27Å; T770-V800 HydrophobicContact CG2-CB 4.42Å; T770-N802 VanDerWaalsContact C-OD1 3.32Å; T770-N802 WeakPolarHBondContact CA-OD1 3.3Å
771	R	95.3	Very high	94.8	Very high	89 Å²	89	33.3 Å²	33.3	34%	0.336	17%	0.171	S	C	.	.	S	Bend	trans	53	31.1	174.1	-59.7	-176.9	-60	-73.3	-5.5	115.5	D739 V800 Q801 N802	D739-R771 WeakPolarHBondContact CA-O 3.24Å; D739-R771 WeakPolarHBondContact OD1-CB 3.38Å; D739-R771 IonicContact OD1-CZ 3.5Å; D739-R771 IonicContact OD1-NE 3.14Å; D739-R771 PolarHBondContact OD1-NE 3.09Å; D739-R771 VanDerWaalsContact OD1-NE 3.1Å; D739-R771 IonicContact OD2-CZ 3.11Å; D739-R771 IonicContact OD2-NE 3.47Å; D739-R771 PolarHBondContact OD2-NE 2.9Å; D739-R771 VanDerWaalsContact OD2-NE 3.12Å; D739-R771 IonicContact OD2-NH2 3.58Å; D739-R771 PolarHBondContact OD2-NH2 2.77Å; R771-V800 HydrophobicContact CG-CG1 4.44Å; R771-V800 PolarHBondContact N-O 3.37Å; R771-Q801 WeakPolarHBondContact CA-O 3.38Å; R771-Q801 HydrophobicContact CG-CB 4.37Å; R771-N802 PolarHBondContact N-OD1 2.99Å
772	N	96.9	Very high	95.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.			trans	-91.2	144	178.5	-60.9	-72.9	0	0	0	111.9	I737 C740 I769 T770 M774 N802 E803	I737-N772 PolarHBondContact O-ND2 3.2Å; C740-N772 VanDerWaalsContact CB-OD1 3.28Å; C740-N772 WeakPolarHBondContact CB-OD1 3.26Å; C740-N772 PolarHBondContact N-OD1 3.02Å; C740-N772 WeakPolarHBondContact O-CA 3.38Å; I769-N772 VanDerWaalsContact CG2-ND2 3.28Å; I769-N772 WeakPolarHBondContact CG2-ND2 3.36Å; T770-N772 PolarHBondContact N-ND2 3.19Å; T770-N772 PolarHBondContact O-N 2.91Å; T770-N772 VanDerWaalsContact O-N 3.1Å; T770-N772 PolarHBondContact O-ND2 3.2Å; N772-M774 HydrophobicContact CB-CE 4.09Å; N772-N802 WeakPolarHBondContact CB-OD1 3.46Å; N772-N802 PolarHBondContact N-OD1 3.29Å; N772-N802 VanDerWaalsContact N-OD1 3.11Å; N772-N802 PolarHBondContact ND2-OD1 3.03Å; N772-N802 CarbonylContact O-C 3.34Å; N772-N802 WeakPolarHBondContact O-CA 3.2Å; N772-E803 PolarHBondContact O-N 3.26Å
773	H	96	Very high	95.5	Very high	61.6667 Å²	61.6667	27.5 Å²	27.5	29%	0.285	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.5	175.8	-61.6	-84.8	0	0	0	110.8	C740 R741 F742 E803	C740-H773 PolarHBondContact O-N 3.05Å; R741-H773 CarbonylContact C-O 3.5Å; R741-H773 WeakPolarHBondContact CA-O 3.29Å; R741-H773 HydrophobicContact CG-CB 4.43Å; F742-H773 PolarHBondContact N-O 3.12Å; H773-E803 IonicContact CE1-OE1 3.11Å; H773-E803 IonicContact CE1-OE2 3.19Å; H773-E803 PolarHBondContact CE1-OE2 3.35Å; H773-E803 IonicContact CG-OE2 3.74Å; H773-E803 VanDerWaalsContact ND1-CD 3.26Å; H773-E803 IonicContact ND1-OE1 2.92Å; H773-E803 IonicContact ND1-OE2 3.56Å; H773-E803 PolarHBondContact ND1-OE2 3.02Å
774	M	96.4	Very high	95.7	Very high	0.666667 Å²	0.666667	27.5 Å²	27.5	0%	0.003	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	98.6	180	-56.3	175.3	-172.2	0	0	109.3	F742 V749 L750 N772 I782 V783 F798 E803 V804 K805 N807	F742-M774 HydrophobicContact CB-CG 4.25Å; F742-M774 HydrophobicContact CD2-CE 4.28Å; F742-M774 HydrophobicContact CD2-CG 3.86Å; F742-M774 HydrophobicContact CE2-CE 4.24Å; F742-M774 HydrophobicContact CG-CG 4.42Å; F742-M774 WeakPolarHBondContact O-CA 3.39Å; V749-M774 HydrophobicContact CG1-CE 4.48Å; V749-M774 HydrophobicContact CG1-CG 4.22Å; V749-M774 HydrophobicContact CG1-SD 4.21Å; L750-M774 HydrophobicContact CB-CE 4.47Å; L750-M774 HydrophobicContact CD2-CE 4.1Å; N772-M774 HydrophobicContact CB-CE 4.09Å; M774-I782 HydrophobicContact CB-CG2 4.47Å; M774-V783 HydrophobicContact CE-CG2 4.11Å; M774-V783 HydrophobicContact SD-CG2 3.32Å; M774-V783 WeakPolarHBondContact SD-CG2 3.29Å; M774-F798 HydrophobicContact CE-CE2 4.37Å; M774-E803 WeakPolarHBondContact CA-O 3.4Å; M774-E803 PolarHBondContact N-O 3.11Å; M774-V804 HydrophobicContact CB-CG2 4.45Å; M774-V804 HydrophobicContact SD-CG2 3.99Å; M774-K805 PolarHBondContact O-N 3.25Å; M774-K805 VanDerWaalsContact O-N 3.09Å; M774-N807 PolarHBondContact O-ND2 2.95Å; M774-N807 PolarHBondContact O-OD1 2.94Å
775	K	95.4	Very high	95.8	Very high	60 Å²	60	25.5 Å²	25.5	26%	0.261	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145.7	-172.2	-60.8	-178.2	-178.4	173.1	0	114.2	F742 V743 E744 N777 E803 K805	F742-K775 PolarHBondContact O-N 2.97Å; V743-K775 VanDerWaalsContact CA-O 3.31Å; V743-K775 WeakPolarHBondContact CA-O 3.43Å; E744-K775 PolarHBondContact N-O 3.17Å; K775-N777 PolarHBondContact N-ND2 3.2Å; K775-N777 VanDerWaalsContact N-ND2 3.11Å; K775-N777 PolarHBondContact O-N 2.73Å; K775-N777 VanDerWaalsContact O-N 3.12Å; K775-N777 PolarHBondContact O-ND2 3.25Å; K775-N777 VanDerWaalsContact O-ND2 3.1Å; K775-E803 WeakPolarHBondContact CE-OE2 3.35Å; K775-E803 IonicContact NZ-OE2 3.2Å; K775-E803 PolarHBondContact NZ-OE2 3.2Å; K775-K805 VanDerWaalsContact CA-O 3.28Å; K775-K805 WeakPolarHBondContact CA-O 3.35Å
776	Y	96	Very high	95.7	Very high	135.667 Å²	135.667	25.4 Å²	25.4	53%	0.532	12%	0.124	S	C	.	.	S	Bend	trans	56.2	26.4	175.2	-47.3	-63	0	0	0	114.2	V743 E744 E806 N807	V743-Y776 HydrophobicContact CG1-CD2 4.35Å; E744-Y776 WeakPolarHBondContact CA-O 3.38Å; Y776-E806 VanDerWaalsContact CA-O 3.26Å; Y776-E806 WeakPolarHBondContact CA-O 3.38Å; Y776-E806 HydrophobicContact CD1-CB 3.67Å; Y776-E806 HydrophobicContact CD1-CG 4.48Å; Y776-E806 HydrophobicContact CE1-CB 3.5Å; Y776-E806 VanDerWaalsContact CE1-CB 3.46Å; Y776-E806 HydrophobicContact CE1-CG 3.93Å; Y776-E806 HydrophobicContact CG-CB 4.48Å; Y776-E806 PolarHBondContact N-O 3.19Å; Y776-N807 PolarHBondContact N-OD1 3.17Å
777	N	96	Very high	95.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.104	C	C	.	.			trans	-89.5	153.7	176.8	-52.4	-76.2	0	0	0	110.3	F742 E744 N745 V749 K775 I782 N807 R808	F742-N777 PolarHBondContact O-ND2 2.75Å; F742-N777 PolarHBondContact O-OD1 3.1Å; E744-N777 PolarHBondContact N-OD1 3.11Å; N745-N777 WeakPolarHBondContact CB-OD1 3.41Å; N745-N777 PolarHBondContact N-OD1 3.27Å; N745-N777 VanDerWaalsContact N-OD1 3.1Å; N745-N777 PolarHBondContact ND2-OD1 2.96Å; N745-N777 CarbonylContact O-C 3.46Å; N745-N777 WeakPolarHBondContact O-CA 3.4Å; V749-N777 HydrophobicContact CG2-CB 3.82Å; V749-N777 VanDerWaalsContact CG2-CG 3.47Å; K775-N777 PolarHBondContact N-ND2 3.2Å; K775-N777 VanDerWaalsContact N-ND2 3.11Å; K775-N777 PolarHBondContact O-N 2.73Å; K775-N777 VanDerWaalsContact O-N 3.12Å; K775-N777 PolarHBondContact O-ND2 3.25Å; K775-N777 VanDerWaalsContact O-ND2 3.1Å; N777-I782 HydrophobicContact CB-CD1 4.18Å; N777-I782 HydrophobicContact CB-CG2 4.49Å; N777-N807 VanDerWaalsContact CB-OD1 3.31Å; N777-N807 WeakPolarHBondContact CB-OD1 3.26Å; N777-N807 PolarHBondContact N-OD1 3.15Å; N777-N807 PolarHBondContact ND2-OD1 3.1Å; N777-N807 CarbonylContact O-C 3.58Å; N777-N807 WeakPolarHBondContact O-CA 3.24Å; N777-N807 WeakPolarHBondContact O-CB 3.33Å; N777-R808 PolarHBondContact O-N 2.95Å
778	V	94.4	Very high	95.4	Very high	45.6667 Å²	45.6667	22.4 Å²	22.4	28%	0.277	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.2	-178.8	-172.6	0	0	0	0	109.6	N745 H746 R747 R808 V810	N745-V778 PolarHBondContact O-N 3.29Å; H746-V778 CarbonylContact C-O 3.28Å; R747-V778 CarbonylContact C-O 3.54Å; R747-V778 WeakPolarHBondContact CA-O 3.4Å; R747-V778 PolarHBondContact N-O 3.07Å; R747-V778 VanDerWaalsContact N-O 3.11Å; V778-R808 WeakPolarHBondContact CA-O 3.31Å; V778-R808 HydrophobicContact CG1-CB 4.47Å; V778-R808 HydrophobicContact CG2-CB 4.25Å; V778-V810 HydrophobicContact CG1-CG2 3.89Å
779	G	92	Very high	94.6	Very high	4.66667 Å²	4.66667	23.2 Å²	23.2	5%	0.048	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.4	174.8	175.9	0	0	0	0	0	113.5	F781 R808 V809 V810	G779-F781 PolarHBondContact O-N 2.88Å; G779-R808 PolarHBondContact N-O 3Å; G779-V809 CarbonylContact O-C 3.41Å; G779-V809 VanDerWaalsContact O-CA 3.28Å; G779-V809 WeakPolarHBondContact O-CA 3.3Å; G779-V810 PolarHBondContact O-N 2.8Å
780	P	91.6	Very high	93.2	Very high	8.33333 Å²	8.33333	26.1 Å²	26.1	5%	0.054	12%	0.124	C	C	.	.	S	Bend	trans	-64.2	-21.9	172.6	29.2	-37.7	0	0	0	113.3	P748 V809 V810 H823 L1084 Y1086	P748-P780 HydrophobicContact CG-CG 3.97Å; P780-V809 WeakPolarHBondContact O-CG1 3.42Å; P780-V810 WeakPolarHBondContact CA-O 3.32Å; P780-H823 WeakPolarHBondContact O-CA 3.38Å; P780-H823 PolarHBondContact O-ND1 3Å; P780-L1084 HydrophobicContact CG-CB 4.48Å; P780-Y1086 HydrophobicContact CB-CE1 3.96Å; P780-Y1086 HydrophobicContact CB-CE2 3.62Å; P780-Y1086 WeakPolarHBondContact CB-OH 3.25Å; P780-Y1086 HydrophobicContact CG-CE1 3.93Å; P780-Y1086 HydrophobicContact CG-CE2 3.74Å
781	F	94.6	Very high	92.7	Very high	13 Å²	13	26.1 Å²	26.1	6%	0.057	12%	0.124	C	C	.	.			trans	-159	166.4	167.3	56.9	-94.8	0	0	0	108.1	P748 L751 G779 A824 I827 L1084	P748-F781 WeakPolarHBondContact CA-O 3.46Å; P748-F781 HydrophobicContact CB-CD2 3.89Å; P748-F781 HydrophobicContact CB-CE2 3.57Å; P748-F781 HydrophobicContact CB-CZ 4.11Å; P748-F781 VanDerWaalsContact CB-O 3.32Å; P748-F781 WeakPolarHBondContact CB-O 3.38Å; P748-F781 HydrophobicContact CG-CD2 4.21Å; P748-F781 HydrophobicContact CG-CE1 4.27Å; P748-F781 HydrophobicContact CG-CE2 3.95Å; P748-F781 HydrophobicContact CG-CG 4.46Å; P748-F781 HydrophobicContact CG-CZ 4.05Å; P748-F781 WeakPolarHBondContact CG-O 3.29Å; L751-F781 HydrophobicContact CD1-CE2 4.5Å; L751-F781 HydrophobicContact CD1-CZ 4.4Å; G779-F781 PolarHBondContact O-N 2.88Å; F781-A824 WeakPolarHBondContact CA-O 3.38Å; F781-A824 WeakPolarHBondContact CB-O 3.33Å; F781-I827 HydrophobicContact CB-CD1 3.54Å; F781-I827 HydrophobicContact CB-CG1 4.06Å; F781-I827 HydrophobicContact CD1-CD1 3.72Å; F781-I827 HydrophobicContact CD2-CD1 4.43Å; F781-I827 HydrophobicContact CE1-CD1 4.43Å; F781-I827 HydrophobicContact CG-CD1 3.67Å; F781-I827 HydrophobicContact CG-CG1 4.48Å; F781-L1084 HydrophobicContact CE1-CD1 3.8Å; F781-L1084 HydrophobicContact CE1-CD2 3.72Å; F781-L1084 HydrophobicContact CE1-CG 4.36Å; F781-L1084 HydrophobicContact CE2-CD1 4.29Å; F781-L1084 HydrophobicContact CZ-CD1 3.51Å; F781-L1084 HydrophobicContact CZ-CD2 4.14Å; F781-L1084 HydrophobicContact CZ-CG 4.3Å
782	I	95.7	Very high	91.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-101.3	-46	178.6	-49.8	-56.5	0	0	0	110.5	V749 L750 M774 N777 V804 N807 V809 A825	V749-I782 HydrophobicContact CB-CG2 4.05Å; V749-I782 WeakPolarHBondContact CB-O 3.47Å; V749-I782 HydrophobicContact CG2-CG2 3.89Å; V749-I782 PolarHBondContact N-O 3.23Å; L750-I782 PolarHBondContact N-O 3.22Å; L750-I782 VanDerWaalsContact N-O 3.12Å; M774-I782 HydrophobicContact CB-CG2 4.47Å; N777-I782 HydrophobicContact CB-CD1 4.18Å; N777-I782 HydrophobicContact CB-CG2 4.49Å; I782-V804 HydrophobicContact CB-CG1 4.47Å; I782-V804 HydrophobicContact CG2-CG1 4.4Å; I782-N807 HydrophobicContact CD1-CB 3.7Å; I782-N807 HydrophobicContact CG1-CB 3.58Å; I782-V809 HydrophobicContact CG1-CG2 4.36Å; I782-A825 WeakPolarHBondContact CA-O 3.43Å; I782-A825 VanDerWaalsContact CB-O 3.29Å; I782-A825 WeakPolarHBondContact CB-O 3.26Å; I782-A825 HydrophobicContact CG1-CB 4.46Å; I782-A825 PolarHBondContact N-O 3.31Å; I782-A825 VanDerWaalsContact N-O 3.15Å
783	V	96.5	Very high	91.6	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	130.1	179	-179.3	0	0	0	0	109.2	L750 M774 I785 F798 V804 A825 V826 I827	L750-V783 HydrophobicContact CB-CG1 4.27Å; L750-V783 HydrophobicContact CB-CG2 4.31Å; L750-V783 HydrophobicContact CD2-CG1 4.15Å; L750-V783 HydrophobicContact CG-CG1 4.42Å; L750-V783 CarbonylContact O-C 3.58Å; L750-V783 WeakPolarHBondContact O-CA 3.19Å; M774-V783 HydrophobicContact CE-CG2 4.11Å; M774-V783 HydrophobicContact SD-CG2 3.32Å; M774-V783 WeakPolarHBondContact SD-CG2 3.29Å; V783-I785 HydrophobicContact CG1-CB 4.49Å; V783-I785 HydrophobicContact CG1-CD1 4.39Å; V783-I785 HydrophobicContact CG1-CG1 4.27Å; V783-I785 HydrophobicContact CG1-CG2 3.69Å; V783-F798 HydrophobicContact CG1-CE2 4.25Å; V783-V804 HydrophobicContact CG2-CG2 4.43Å; V783-A825 PolarHBondContact N-O 2.9Å; V783-V826 HydrophobicContact CB-CG1 4.34Å; V783-V826 HydrophobicContact CB-CG2 4.17Å; V783-V826 HydrophobicContact CG1-CG1 4.34Å; V783-V826 CarbonylContact O-C 3.5Å; V783-V826 WeakPolarHBondContact O-CA 3.29Å; V783-I827 PolarHBondContact O-N 3.41Å
784	S	96.1	Very high	91.6	Very high	4.66667 Å²	4.66667	29.3 Å²	29.3	3%	0.033	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.8	168.6	179.9	0	0	0	0	109	L750 L751 I752 I827	L750-S784 PolarHBondContact O-N 2.93Å; L751-S784 WeakPolarHBondContact CA-O 3.46Å; I752-S784 PolarHBondContact N-O 3.06Å; S784-I827 WeakPolarHBondContact CA-O 3.29Å
785	I	96.3	Very high	91.5	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.6	-171.8	52.9	172.9	0	0	0	112.1	L750 I752 I769 V783 M796 F798 V826 I827 I828 T829 V833 I835	L750-I785 HydrophobicContact CD2-CG2 4.35Å; I752-I785 HydrophobicContact CB-CG2 4.48Å; I752-I785 CarbonylContact O-C 3.56Å; I752-I785 VanDerWaalsContact O-CA 3.27Å; I752-I785 WeakPolarHBondContact O-CA 3.24Å; I769-I785 HydrophobicContact CD1-CG2 4.31Å; V783-I785 HydrophobicContact CG1-CB 4.49Å; V783-I785 HydrophobicContact CG1-CD1 4.39Å; V783-I785 HydrophobicContact CG1-CG1 4.27Å; V783-I785 HydrophobicContact CG1-CG2 3.69Å; I785-M796 HydrophobicContact CB-SD 3.62Å; I785-M796 HydrophobicContact CD1-SD 4.33Å; I785-M796 HydrophobicContact CG1-SD 4.43Å; I785-M796 HydrophobicContact CG2-SD 3.96Å; I785-F798 HydrophobicContact CD1-CB 3.84Å; I785-F798 HydrophobicContact CD1-CD2 3.92Å; I785-F798 HydrophobicContact CD1-CG 3.98Å; I785-V826 HydrophobicContact CD1-CG1 4.47Å; I785-V826 HydrophobicContact CG1-CG1 4.49Å; I785-I827 PolarHBondContact N-O 2.92Å; I785-I828 WeakPolarHBondContact O-CA 3.37Å; I785-T829 PolarHBondContact O-N 3.2Å; I785-T829 PolarHBondContact O-OG1 3.09Å; I785-V833 HydrophobicContact CD1-CG1 3.74Å; I785-V833 HydrophobicContact CG1-CG1 4.29Å; I785-I835 HydrophobicContact CD1-CD1 4.31Å
786	G	94.9	Very high	91.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.2	161.9	164.1	0	0	0	0	0	114	I752 R753 N754 T829 S830	I752-G786 PolarHBondContact O-N 3.17Å; R753-G786 CarbonylContact C-O 3.47Å; R753-G786 VanDerWaalsContact CA-O 3.24Å; R753-G786 WeakPolarHBondContact CA-O 3.26Å; N754-G786 PolarHBondContact N-O 3.02Å; N754-G786 VanDerWaalsContact N-O 3.11Å; G786-T829 WeakPolarHBondContact CA-OG1 3.41Å; G786-T829 PolarHBondContact N-OG1 2.95Å; G786-S830 VanDerWaalsContact CA-OG 3.31Å; G786-S830 WeakPolarHBondContact CA-OG 3.4Å
787	L	95	Very high	91.6	Very high	2 Å²	2	26.4 Å²	26.4	1%	0.01	14%	0.14	C	C	.	.			trans	-114.1	-163.8	-174.9	-59.1	177.6	0	0	0	109	A730 N754 A765 V767 Q794 M796 S830 N832	A730-L787 HydrophobicContact CB-CD2 4.2Å; N754-L787 WeakPolarHBondContact ND2-CD2 3.33Å; A765-L787 HydrophobicContact CB-CD1 4.42Å; A765-L787 HydrophobicContact CB-CD2 4.49Å; V767-L787 HydrophobicContact CG2-CD2 4.5Å; L787-Q794 HydrophobicContact CB-CB 4.11Å; L787-Q794 HydrophobicContact CD1-CB 3.85Å; L787-M796 HydrophobicContact CD1-CB 3.89Å; L787-M796 HydrophobicContact CD1-CE 4.43Å; L787-M796 HydrophobicContact CD2-CE 3.76Å; L787-M796 HydrophobicContact CG-CB 4.33Å; L787-M796 HydrophobicContact CG-CE 3.93Å; L787-S830 PolarHBondContact N-OG 3.26Å; L787-S830 WeakPolarHBondContact O-CB 3.35Å; L787-N832 WeakPolarHBondContact CB-ND2 3.06Å
788	N	92.7	Very high	91.6	Very high	4.66667 Å²	4.66667	26.4 Å²	26.4	3%	0.025	14%	0.14	C	C	.	.			trans	-80.5	140	178.5	-69.1	73.6	0	0	0	111.8	N754 H757 P758 A761 S791 Q794 N832	N754-N788 VanDerWaalsContact C-OD1 3.26Å; N754-N788 VanDerWaalsContact CB-OD1 3.28Å; N754-N788 WeakPolarHBondContact CB-OD1 3.42Å; N754-N788 PolarHBondContact ND2-OD1 3.03Å; N754-N788 PolarHBondContact O-ND2 3.2Å; N754-N788 PolarHBondContact O-OD1 2.95Å; H757-N788 PolarHBondContact O-ND2 3.19Å; P758-N788 WeakPolarHBondContact CA-ND2 3.43Å; A761-N788 HydrophobicContact CB-CB 3.8Å; A761-N788 PolarHBondContact N-ND2 2.93Å; N788-S791 WeakPolarHBondContact O-CB 3.33Å; N788-S791 PolarHBondContact O-N 3.05Å; N788-S791 VanDerWaalsContact O-N 3.09Å; N788-Q794 VanDerWaalsContact N-OE1 3.13Å; N788-Q794 PolarHBondContact OD1-NE2 3.03Å; N788-Q794 VanDerWaalsContact OD1-NE2 3.13Å; N788-Q794 PolarHBondContact OD1-OE1 2.93Å; N788-Q794 VanDerWaalsContact OD1-OE1 3.09Å; N788-N832 PolarHBondContact O-ND2 2.87Å; N788-N832 VanDerWaalsContact O-ND2 3.12Å
789	E	81.5	Confident	91.5	Very high	47.3333 Å²	47.3333	27 Å²	27	22%	0.221	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	98.7	-176.3	-146.9	36	-168.8	0	0	113.8	S830 S831 N832 L853 L858	E789-S830 VanDerWaalsContact CD-CA 3.5Å; E789-S830 VanDerWaalsContact OE1-CA 3.29Å; E789-S830 WeakPolarHBondContact OE1-CA 3.46Å; E789-S830 WeakPolarHBondContact OE1-CB 3.25Å; E789-S830 WeakPolarHBondContact OE2-CA 3.49Å; E789-S830 WeakPolarHBondContact OE2-CB 3.47Å; E789-S831 VanDerWaalsContact CD-OG 3.25Å; E789-S831 WeakPolarHBondContact OE1-CB 3.42Å; E789-S831 PolarHBondContact OE1-N 2.87Å; E789-S831 PolarHBondContact OE1-OG 2.97Å; E789-S831 VanDerWaalsContact OE1-OG 3.11Å; E789-S831 WeakPolarHBondContact OE2-CA 3.37Å; E789-S831 VanDerWaalsContact OE2-CB 3.27Å; E789-S831 WeakPolarHBondContact OE2-CB 3.25Å; E789-S831 PolarHBondContact OE2-N 3.06Å; E789-S831 VanDerWaalsContact OE2-N 3.15Å; E789-S831 PolarHBondContact OE2-OG 2.92Å; E789-S831 VanDerWaalsContact OE2-OG 3.1Å; E789-N832 PolarHBondContact OE1-N 2.81Å; E789-L853 HydrophobicContact CB-CD1 4.41Å; E789-L853 HydrophobicContact CG-CD1 3.93Å; E789-L853 HydrophobicContact CG-CD2 4.47Å; E789-L858 HydrophobicContact CG-CD1 3.83Å; E789-L858 WeakPolarHBondContact OE1-CD1 3.5Å; E789-L858 VanDerWaalsContact OE2-CD1 3.23Å; E789-L858 WeakPolarHBondContact OE2-CD1 3.31Å
790	P	68.2	Low	91.4	Very high	61 Å²	61	29 Å²	29	40%	0.396	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	cis	-100.3	90.5	-0.3	33.9	-28.8	0	0	0	111.7	A761 F792 L1373	A761-P790 HydrophobicContact CB-CG 4.19Å; P790-F792 PolarHBondContact O-N 2.96Å; P790-L1373 HydrophobicContact CG-CD1 4.27Å
791	S	84.1	Confident	91.4	Very high	10.3333 Å²	10.3333	32 Å²	32	7%	0.072	16%	0.164	C	C	.	.			trans	-103.9	123.8	177.6	179	0	0	0	0	112	A761 N788 V793 Q794 N832	A761-S791 WeakPolarHBondContact O-CB 3.4Å; A761-S791 PolarHBondContact O-OG 2.61Å; N788-S791 WeakPolarHBondContact O-CB 3.33Å; N788-S791 PolarHBondContact O-N 3.05Å; N788-S791 VanDerWaalsContact O-N 3.09Å; S791-V793 VanDerWaalsContact C-N 3.27Å; S791-V793 PolarHBondContact O-N 3Å; S791-V793 WeakPolarHBondContact OG-CG2 3.25Å; S791-V793 PolarHBondContact OG-N 2.99Å; S791-Q794 WeakPolarHBondContact OG-CB 3.35Å; S791-Q794 VanDerWaalsContact OG-CG 3.24Å; S791-Q794 WeakPolarHBondContact OG-CG 3.35Å; S791-Q794 PolarHBondContact OG-N 3.21Å; S791-N832 PolarHBondContact N-ND2 3.36Å; S791-N832 PolarHBondContact O-ND2 2.72Å
792	F	80.4	Confident	91.4	Very high	143 Å²	143	31.4 Å²	31.4	63%	0.627	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.4	176.9	-57.5	-75.3	0	0	0	114	P790 L1292 L1373	P790-F792 PolarHBondContact O-N 2.96Å; F792-L1292 HydrophobicContact CE1-CD1 4.29Å; F792-L1292 HydrophobicContact CE2-CD1 4.39Å; F792-L1292 HydrophobicContact CZ-CD1 4.13Å; F792-L1373 HydrophobicContact CE2-CD2 4Å; F792-L1373 HydrophobicContact CZ-CD2 4.05Å
793	V	90.3	Very high	91.4	Very high	72.6667 Å²	72.6667	32 Å²	32	44%	0.44	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	2.6	-177.8	-64.9	0	0	0	0	112.8	N762 P764 A765 S791	N762-V793 WeakPolarHBondContact O-CG2 3.06Å; P764-V793 WeakPolarHBondContact CA-O 3.36Å; P764-V793 HydrophobicContact CB-CB 4.42Å; A765-V793 PolarHBondContact N-O 3.09Å; S791-V793 VanDerWaalsContact C-N 3.27Å; S791-V793 PolarHBondContact O-N 3Å; S791-V793 WeakPolarHBondContact OG-CG2 3.25Å; S791-V793 PolarHBondContact OG-N 2.99Å
794	Q	94.5	Very high	91.3	Very high	1 Å²	1	32 Å²	32	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.4	-179.9	-67.7	-175.6	12.3	0	0	109.9	N754 L760 L763 A765 L787 N788 S791 N832	N754-Q794 PolarHBondContact ND2-OE1 3.05Å; N754-Q794 VanDerWaalsContact ND2-OE1 3.12Å; L760-Q794 PolarHBondContact O-NE2 3.12Å; L760-Q794 VanDerWaalsContact O-NE2 3.1Å; L763-Q794 VanDerWaalsContact O-CG 3.25Å; L763-Q794 WeakPolarHBondContact O-CG 3.28Å; L763-Q794 PolarHBondContact O-NE2 3.32Å; A765-Q794 HydrophobicContact CB-CB 4.26Å; A765-Q794 HydrophobicContact CB-CG 3.83Å; A765-Q794 VanDerWaalsContact O-CA 3.31Å; A765-Q794 WeakPolarHBondContact O-CA 3.4Å; L787-Q794 HydrophobicContact CB-CB 4.11Å; L787-Q794 HydrophobicContact CD1-CB 3.85Å; N788-Q794 VanDerWaalsContact N-OE1 3.13Å; N788-Q794 PolarHBondContact OD1-NE2 3.03Å; N788-Q794 VanDerWaalsContact OD1-NE2 3.13Å; N788-Q794 PolarHBondContact OD1-OE1 2.93Å; N788-Q794 VanDerWaalsContact OD1-OE1 3.09Å; S791-Q794 WeakPolarHBondContact OG-CB 3.35Å; S791-Q794 VanDerWaalsContact OG-CG 3.24Å; S791-Q794 WeakPolarHBondContact OG-CG 3.35Å; S791-Q794 PolarHBondContact OG-N 3.21Å; Q794-N832 PolarHBondContact O-ND2 3.17Å; Q794-N832 VanDerWaalsContact O-ND2 3.1Å
795	N	95	Very high	91.2	Very high	68.6667 Å²	68.6667	33.9 Å²	33.9	37%	0.367	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	138.8	180	-99.3	-33.3	0	0	0	111.3	A765 T766 V767 H797 N832	A765-N795 PolarHBondContact O-N 3.09Å; T766-N795 WeakPolarHBondContact CA-O 3.44Å; V767-N795 PolarHBondContact N-O 3.03Å; N795-H797 PolarHBondContact ND2-NE2 3.26Å; N795-H797 PolarHBondContact OD1-NE2 2.88Å; N795-N832 PolarHBondContact OD1-O 2.92Å
796	M	96.6	Very high	91.1	Very high	0.333333 Å²	0.333333	37 Å²	37	0%	0.002	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.5	178	-179.1	175.6	-61.8	0	0	111.6	I752 V767 I769 I785 L787 N832 V833 I834	I752-M796 HydrophobicContact CB-CE 4.02Å; I752-M796 HydrophobicContact CD1-CE 4.46Å; I752-M796 HydrophobicContact CG2-CE 3.51Å; I752-M796 VanDerWaalsContact CG2-CE 3.49Å; V767-M796 HydrophobicContact CB-CB 4.15Å; V767-M796 HydrophobicContact CB-CE 3.93Å; V767-M796 HydrophobicContact CB-CG 3.85Å; V767-M796 HydrophobicContact CG1-CE 3.92Å; V767-M796 HydrophobicContact CG1-CG 3.94Å; V767-M796 HydrophobicContact CG1-SD 4.33Å; V767-M796 HydrophobicContact CG2-CE 3.95Å; V767-M796 CarbonylContact O-C 3.59Å; V767-M796 WeakPolarHBondContact O-CA 3.4Å; I769-M796 HydrophobicContact CD1-SD 4.36Å; I785-M796 HydrophobicContact CB-SD 3.62Å; I785-M796 HydrophobicContact CD1-SD 4.33Å; I785-M796 HydrophobicContact CG1-SD 4.43Å; I785-M796 HydrophobicContact CG2-SD 3.96Å; L787-M796 HydrophobicContact CD1-CB 3.89Å; L787-M796 HydrophobicContact CD1-CE 4.43Å; L787-M796 HydrophobicContact CD2-CE 3.76Å; L787-M796 HydrophobicContact CG-CB 4.33Å; L787-M796 HydrophobicContact CG-CE 3.93Å; M796-N832 PolarHBondContact N-O 2.9Å; M796-N832 VanDerWaalsContact N-O 3.1Å; M796-V833 HydrophobicContact CB-CG2 4.08Å; M796-V833 HydrophobicContact CG-CG1 4.37Å; M796-V833 HydrophobicContact CG-CG2 4.41Å; M796-V833 CarbonylContact O-C 3.52Å; M796-V833 WeakPolarHBondContact O-CA 3.31Å; M796-V833 HydrophobicContact SD-CG1 4.34Å; M796-V833 HydrophobicContact SD-CG2 4.08Å; M796-I834 PolarHBondContact O-N 2.97Å
797	H	96.4	Very high	91.2	Very high	67.3333 Å²	67.3333	37 Å²	37	31%	0.312	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	107.9	175.9	-62.3	-87.5	0	0	0	110.5	V767 I769 N795 H799	V767-H797 PolarHBondContact O-N 3.24Å; I769-H797 PolarHBondContact N-O 3.22Å; N795-H797 PolarHBondContact ND2-NE2 3.26Å; N795-H797 PolarHBondContact OD1-NE2 2.88Å; H797-H799 WeakPolarHBondContact CB-CD2 3.05Å; H797-H799 VanDerWaalsContact CB-ND1 3.35Å; H797-H799 WeakPolarHBondContact CB-ND1 3.39Å; H797-H799 PolarHBondContact O-N 3.12Å; H797-H799 PolarHBondContact O-ND1 3.04Å
798	F	96.4	Very high	91.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	91.3	168.7	-170.4	-87.4	0	0	0	107.5	I769 M774 V783 I785 N802 V804 I834 I835 R836 N838 F840	I769-F798 HydrophobicContact CB-CD2 3.83Å; I769-F798 HydrophobicContact CB-CE2 4.36Å; I769-F798 HydrophobicContact CD1-CD2 3.81Å; I769-F798 HydrophobicContact CD1-CE2 4.46Å; I769-F798 HydrophobicContact CG1-CD2 4.45Å; I769-F798 HydrophobicContact CG2-CD2 3.66Å; I769-F798 HydrophobicContact CG2-CE2 3.67Å; M774-F798 HydrophobicContact CE-CE2 4.37Å; V783-F798 HydrophobicContact CG1-CE2 4.25Å; I785-F798 HydrophobicContact CD1-CB 3.84Å; I785-F798 HydrophobicContact CD1-CD2 3.92Å; I785-F798 HydrophobicContact CD1-CG 3.98Å; F798-N802 HydrophobicContact CD1-CB 4.4Å; F798-N802 HydrophobicContact CE1-CB 3.64Å; F798-N802 HydrophobicContact CE2-CB 4.44Å; F798-N802 HydrophobicContact CZ-CB 3.64Å; F798-V804 HydrophobicContact CZ-CG2 4.2Å; F798-I834 PolarHBondContact N-O 2.96Å; F798-I835 HydrophobicContact CB-CG1 4.34Å; F798-I835 HydrophobicContact CD1-CG2 4.11Å; F798-I835 VanDerWaalsContact O-CA 3.31Å; F798-I835 WeakPolarHBondContact O-CA 3.36Å; F798-R836 PolarHBondContact O-N 3.24Å; F798-N838 HydrophobicContact CD1-CB 4.47Å; F798-N838 HydrophobicContact CE1-CB 4.23Å; F798-N838 PolarHBondContact O-ND2 3.06Å; F798-F840 HydrophobicContact CE1-CE1 4.39Å; F798-F840 HydrophobicContact CE1-CZ 4.27Å
799	H	93.1	Very high	91.2	Very high	57 Å²	57	44.8 Å²	44.8	26%	0.264	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	165	-165.8	72.8	-40.1	0	0	0	114	I769 T770 H797 N802 R836	I769-H799 PolarHBondContact O-N 2.84Å; I769-H799 VanDerWaalsContact O-N 3.09Å; I769-H799 VanDerWaalsContact O-O 3.11Å; T770-H799 VanDerWaalsContact CA-O 3.29Å; T770-H799 WeakPolarHBondContact CA-O 3.41Å; T770-H799 WeakPolarHBondContact CB-O 3.24Å; T770-H799 VanDerWaalsContact CG2-CE1 3.43Å; T770-H799 WeakPolarHBondContact CG2-CE1 3.36Å; T770-H799 WeakPolarHBondContact CG2-O 3.27Å; H797-H799 WeakPolarHBondContact CB-CD2 3.05Å; H797-H799 VanDerWaalsContact CB-ND1 3.35Å; H797-H799 WeakPolarHBondContact CB-ND1 3.39Å; H797-H799 PolarHBondContact O-N 3.12Å; H797-H799 PolarHBondContact O-ND1 3.04Å; H799-N802 PolarHBondContact N-ND2 3.32Å; H799-N802 PolarHBondContact O-ND2 3.2Å; H799-N802 VanDerWaalsContact O-ND2 3.12Å; H799-R836 WeakPolarHBondContact CA-O 3.39Å; H799-R836 VanDerWaalsContact CB-O 3.31Å; H799-R836 WeakPolarHBondContact CB-O 3.32Å
800	V	90	Very high	91.7	Very high	47 Å²	47	44.8 Å²	44.8	29%	0.285	22%	0.221	S	C	.	.	S	Bend	trans	63.1	89.7	173.2	-179.5	0	0	0	0	112.1	T770 R771 N802 R836	T770-V800 HydrophobicContact CG2-CB 4.42Å; R771-V800 HydrophobicContact CG-CG1 4.44Å; R771-V800 PolarHBondContact N-O 3.37Å; V800-N802 VanDerWaalsContact C-N 3.33Å; V800-N802 PolarHBondContact O-N 2.96Å; V800-R836 PolarHBondContact N-O 3.11Å
801	Q	90.7	Very high	92.7	Very high	71.25 Å²	71.25	44.5 Å²	44.5	33%	0.333	22%	0.216	S	C	.	.	S	Bend	trans	59.1	30.9	166.7	-60.1	178.3	-42.3	0	0	115.2	R771 E803 R837	R771-Q801 WeakPolarHBondContact CA-O 3.38Å; R771-Q801 HydrophobicContact CG-CB 4.37Å; Q801-E803 PolarHBondContact O-N 3Å; Q801-R837 PolarHBondContact N-O 3.12Å
802	N	94.8	Very high	92.7	Very high	0.25 Å²	0.25	45.5 Å²	45.5	0%	0.001	22%	0.222	C	C	.	.			trans	-72.6	128.3	162.4	-57.7	-70.5	0	0	0	109.1	I769 T770 R771 N772 F798 H799 V800 N838 C839	I769-N802 PolarHBondContact O-ND2 2.8Å; T770-N802 VanDerWaalsContact C-OD1 3.32Å; T770-N802 WeakPolarHBondContact CA-OD1 3.3Å; R771-N802 PolarHBondContact N-OD1 2.99Å; N772-N802 WeakPolarHBondContact CB-OD1 3.46Å; N772-N802 PolarHBondContact N-OD1 3.29Å; N772-N802 VanDerWaalsContact N-OD1 3.11Å; N772-N802 PolarHBondContact ND2-OD1 3.03Å; N772-N802 CarbonylContact O-C 3.34Å; N772-N802 WeakPolarHBondContact O-CA 3.2Å; F798-N802 HydrophobicContact CD1-CB 4.4Å; F798-N802 HydrophobicContact CE1-CB 3.64Å; F798-N802 HydrophobicContact CE2-CB 4.44Å; F798-N802 HydrophobicContact CZ-CB 3.64Å; H799-N802 PolarHBondContact N-ND2 3.32Å; H799-N802 PolarHBondContact O-ND2 3.2Å; H799-N802 VanDerWaalsContact O-ND2 3.12Å; V800-N802 VanDerWaalsContact C-N 3.33Å; V800-N802 PolarHBondContact O-N 2.96Å; N802-N838 HydrophobicContact CB-CB 4.47Å; N802-N838 VanDerWaalsContact CB-OD1 3.31Å; N802-N838 WeakPolarHBondContact CB-OD1 3.34Å; N802-N838 PolarHBondContact N-OD1 2.88Å; N802-N838 PolarHBondContact ND2-OD1 2.98Å; N802-C839 PolarHBondContact O-N 2.99Å
803	E	95	Very high	93.1	Very high	14.5 Å²	14.5	39.5 Å²	39.5	7%	0.068	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	113.6	177.1	-62.8	-170.5	150.3	0	0	110.2	N772 H773 M774 K775 Q801 K805 N901	N772-E803 PolarHBondContact O-N 3.26Å; H773-E803 IonicContact CE1-OE1 3.11Å; H773-E803 IonicContact CE1-OE2 3.19Å; H773-E803 PolarHBondContact CE1-OE2 3.35Å; H773-E803 IonicContact CG-OE2 3.74Å; H773-E803 VanDerWaalsContact ND1-CD 3.26Å; H773-E803 IonicContact ND1-OE1 2.92Å; H773-E803 IonicContact ND1-OE2 3.56Å; H773-E803 PolarHBondContact ND1-OE2 3.02Å; M774-E803 WeakPolarHBondContact CA-O 3.4Å; M774-E803 PolarHBondContact N-O 3.11Å; K775-E803 WeakPolarHBondContact CE-OE2 3.35Å; K775-E803 IonicContact NZ-OE2 3.2Å; K775-E803 PolarHBondContact NZ-OE2 3.2Å; Q801-E803 PolarHBondContact O-N 3Å; E803-K805 HydrophobicContact CB-CG 4.48Å; E803-K805 IonicContact OE1-NZ 3.35Å; E803-K805 PolarHBondContact OE1-NZ 2.83Å; E803-N901 PolarHBondContact OE1-ND2 3.11Å; E803-N901 PolarHBondContact OE1-OD1 2.84Å
804	V	95.7	Very high	92.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	92.1	170.5	-173.6	0	0	0	0	107.1	M774 I782 V783 F798 A825 V826 C839 F840 Y841 N842	M774-V804 HydrophobicContact CB-CG2 4.45Å; M774-V804 HydrophobicContact SD-CG2 3.99Å; I782-V804 HydrophobicContact CB-CG1 4.47Å; I782-V804 HydrophobicContact CG2-CG1 4.4Å; V783-V804 HydrophobicContact CG2-CG2 4.43Å; F798-V804 HydrophobicContact CZ-CG2 4.2Å; V804-A825 HydrophobicContact CG1-CB 4.11Å; V804-V826 HydrophobicContact CG1-CG2 4.37Å; V804-V826 HydrophobicContact CG2-CG2 4.33Å; V804-C839 PolarHBondContact N-O 3.35Å; V804-F840 HydrophobicContact CB-CD1 3.93Å; V804-F840 HydrophobicContact CB-CE1 4.18Å; V804-F840 HydrophobicContact CG2-CD1 4.29Å; V804-F840 HydrophobicContact CG2-CE1 4.02Å; V804-F840 WeakPolarHBondContact O-CA 3.34Å; V804-Y841 PolarHBondContact O-N 3.01Å; V804-Y841 VanDerWaalsContact O-N 3.09Å; V804-N842 PolarHBondContact O-ND2 3.27Å; V804-N842 PolarHBondContact O-OD1 2.82Å
805	K	93.7	Very high	92.3	Very high	43.25 Å²	43.25	41.7 Å²	41.7	19%	0.188	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	151.9	-171.1	-61.6	-175.8	176.8	170.4	0	113	M774 K775 E803 N807 Y841 N842 C900	M774-K805 PolarHBondContact O-N 3.25Å; M774-K805 VanDerWaalsContact O-N 3.09Å; K775-K805 VanDerWaalsContact CA-O 3.28Å; K775-K805 WeakPolarHBondContact CA-O 3.35Å; E803-K805 HydrophobicContact CB-CG 4.48Å; E803-K805 IonicContact OE1-NZ 3.35Å; E803-K805 PolarHBondContact OE1-NZ 2.83Å; K805-N807 PolarHBondContact N-ND2 2.91Å; K805-N807 VanDerWaalsContact N-ND2 3.2Å; K805-N807 PolarHBondContact O-N 3.15Å; K805-N807 VanDerWaalsContact O-N 3.11Å; K805-N807 PolarHBondContact O-ND2 3.13Å; K805-Y841 CarbonylContact C-O 3.49Å; K805-Y841 VanDerWaalsContact CA-O 3.24Å; K805-Y841 WeakPolarHBondContact CA-O 3.24Å; K805-N842 VanDerWaalsContact C-OD1 3.27Å; K805-N842 WeakPolarHBondContact CA-OD1 3.41Å; K805-C900 PolarHBondContact NZ-SG 2.89Å
806	E	94.4	Very high	92	Very high	65.25 Å²	65.25	38.6 Å²	38.6	31%	0.305	19%	0.193	S	C	.	.	S	Bend	trans	54.4	29	174.7	-56.1	-61.6	165.3	0	0	113.7	Y776 Y841 N842	Y776-E806 VanDerWaalsContact CA-O 3.26Å; Y776-E806 WeakPolarHBondContact CA-O 3.38Å; Y776-E806 HydrophobicContact CD1-CB 3.67Å; Y776-E806 HydrophobicContact CD1-CG 4.48Å; Y776-E806 HydrophobicContact CE1-CB 3.5Å; Y776-E806 VanDerWaalsContact CE1-CB 3.46Å; Y776-E806 HydrophobicContact CE1-CG 3.93Å; Y776-E806 HydrophobicContact CG-CB 4.48Å; Y776-E806 PolarHBondContact N-O 3.19Å; E806-Y841 PolarHBondContact N-O 2.85Å; E806-Y841 WeakPolarHBondContact OE1-CE1 3.25Å; E806-N842 PolarHBondContact N-OD1 3.05Å
807	N	95.8	Very high	91.7	Very high	0.75 Å²	0.75	40.3 Å²	40.3	0%	0.004	20%	0.201	C	C	.	.			trans	-92.3	152.1	175	-55.5	-77.5	0	0	0	110.4	M774 Y776 N777 I782 K805 N842	M774-N807 PolarHBondContact O-ND2 2.95Å; M774-N807 PolarHBondContact O-OD1 2.94Å; Y776-N807 PolarHBondContact N-OD1 3.17Å; N777-N807 VanDerWaalsContact CB-OD1 3.31Å; N777-N807 WeakPolarHBondContact CB-OD1 3.26Å; N777-N807 PolarHBondContact N-OD1 3.15Å; N777-N807 PolarHBondContact ND2-OD1 3.1Å; N777-N807 CarbonylContact O-C 3.58Å; N777-N807 WeakPolarHBondContact O-CA 3.24Å; N777-N807 WeakPolarHBondContact O-CB 3.33Å; I782-N807 HydrophobicContact CD1-CB 3.7Å; I782-N807 HydrophobicContact CG1-CB 3.58Å; K805-N807 PolarHBondContact N-ND2 2.91Å; K805-N807 VanDerWaalsContact N-ND2 3.2Å; K805-N807 PolarHBondContact O-N 3.15Å; K805-N807 VanDerWaalsContact O-N 3.11Å; K805-N807 PolarHBondContact O-ND2 3.13Å; N807-N842 VanDerWaalsContact CB-OD1 3.32Å; N807-N842 WeakPolarHBondContact CB-OD1 3.35Å; N807-N842 PolarHBondContact N-OD1 3.05Å; N807-N842 PolarHBondContact ND2-OD1 3.04Å
808	R	95.1	Very high	91.1	Very high	152.25 Å²	152.25	37.8 Å²	37.8	58%	0.575	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.6	177.4	-177.4	179.4	178.4	-177.8	-0.6	109.9	N777 V778 G779 V810 H844	N777-R808 PolarHBondContact O-N 2.95Å; V778-R808 WeakPolarHBondContact CA-O 3.31Å; V778-R808 HydrophobicContact CG1-CB 4.47Å; V778-R808 HydrophobicContact CG2-CB 4.25Å; G779-R808 PolarHBondContact N-O 3Å; R808-V810 HydrophobicContact CG-CG2 4.48Å; R808-H844 HydrophobicContact CB-CB 4.37Å; R808-H844 HydrophobicContact CG-CB 4.21Å
809	V	93.9	Very high	90.8	Very high	17.5 Å²	17.5	38.1 Å²	38.1	11%	0.106	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130.6	175.5	178.1	0	0	0	0	109.1	G779 P780 I782 H823 A825 A845	G779-V809 CarbonylContact O-C 3.41Å; G779-V809 VanDerWaalsContact O-CA 3.28Å; G779-V809 WeakPolarHBondContact O-CA 3.3Å; P780-V809 WeakPolarHBondContact O-CG1 3.42Å; I782-V809 HydrophobicContact CG1-CG2 4.36Å; V809-H823 HydrophobicContact CG1-CB 3.88Å; V809-A825 HydrophobicContact CG2-CB 4.45Å; V809-A845 HydrophobicContact CB-CB 3.91Å; V809-A845 HydrophobicContact CG2-CB 3.58Å
810	V	90.7	Very high	90.3	Very high	48.25 Å²	48.25	35.6 Å²	35.6	29%	0.292	18%	0.184	S	C	.	.			trans	-109.3	121.8	-179	-179.7	0	0	0	0	109.2	V778 G779 P780 R808 P812	V778-V810 HydrophobicContact CG1-CG2 3.89Å; G779-V810 PolarHBondContact O-N 2.8Å; P780-V810 WeakPolarHBondContact CA-O 3.32Å; R808-V810 HydrophobicContact CG-CG2 4.48Å; V810-P812 VanDerWaalsContact O-CD 3.28Å; V810-P812 WeakPolarHBondContact O-CD 3.3Å
811	N	89.5	Confident	90	Very high	54.25 Å²	54.25	35.8 Å²	35.8	29%	0.29	18%	0.184	S	C	.	.			trans	-86.2	108.9	167.9	-177.2	-5.4	0	0	0	109.1	Y813 H823	N811-Y813 VanDerWaalsContact C-N 3.27Å; N811-Y813 PolarHBondContact O-N 3.1Å; N811-Y813 VanDerWaalsContact OD1-C 3.28Å; N811-Y813 PolarHBondContact OD1-N 3.17Å; N811-Y813 PolarHBondContact OD1-O 3Å; N811-H823 HydrophobicContact CB-CB 4.44Å; N811-H823 VanDerWaalsContact CG-CD2 3.46Å; N811-H823 PolarHBondContact OD1-CD2 3.06Å; N811-H823 VanDerWaalsContact OD1-CD2 3.3Å; N811-H823 PolarHBondContact OD1-NE2 3.29Å
812	P	85.6	Confident	89.9	Confident	30 Å²	30	32.9 Å²	32.9	20%	0.195	17%	0.171	C	C	.	.	S	Bend	trans	-68.4	-20.7	178.2	29.9	-36.6	0	0	0	113.8	V810 P814 H823 Y1086	V810-P812 VanDerWaalsContact O-CD 3.28Å; V810-P812 WeakPolarHBondContact O-CD 3.3Å; P812-P814 VanDerWaalsContact C-CD 3.46Å; P812-P814 WeakPolarHBondContact O-CD 3.31Å; P812-H823 VanDerWaalsContact CD-CE1 3.4Å; P812-H823 WeakPolarHBondContact CD-CE1 3.32Å; P812-H823 VanDerWaalsContact CD-NE2 3.34Å; P812-H823 WeakPolarHBondContact CD-NE2 3.38Å; P812-Y1086 HydrophobicContact CB-CD1 3.86Å; P812-Y1086 HydrophobicContact CB-CD2 3.39Å; P812-Y1086 HydrophobicContact CB-CE1 4Å; P812-Y1086 HydrophobicContact CB-CE2 3.62Å; P812-Y1086 HydrophobicContact CB-CG 3.39Å; P812-Y1086 HydrophobicContact CG-CD1 3.91Å; P812-Y1086 HydrophobicContact CG-CD2 4.01Å; P812-Y1086 HydrophobicContact CG-CE1 4.28Å; P812-Y1086 HydrophobicContact CG-CE2 4.21Å; P812-Y1086 HydrophobicContact CG-CG 3.83Å
813	Y	87.2	Confident	89.7	Confident	17.25 Å²	17.25	33.9 Å²	33.9	7%	0.068	18%	0.175	C	C	.	.			trans	-125.3	67.4	-177.2	-50.9	-59.1	0	0	0	110.7	N811 L815 L816 H1049 Q1050 Y1086 F1152 R1153	N811-Y813 VanDerWaalsContact C-N 3.27Å; N811-Y813 PolarHBondContact O-N 3.1Å; N811-Y813 VanDerWaalsContact OD1-C 3.28Å; N811-Y813 PolarHBondContact OD1-N 3.17Å; N811-Y813 PolarHBondContact OD1-O 3Å; Y813-L815 PolarHBondContact O-N 2.99Å; Y813-L815 VanDerWaalsContact O-N 3.11Å; Y813-L816 PolarHBondContact O-N 3.07Å; Y813-L816 VanDerWaalsContact O-O 3.12Å; Y813-H1049 HydrophobicContact CD1-CB 3.81Å; Y813-H1049 WeakPolarHBondContact CD1-O 3.3Å; Y813-H1049 HydrophobicContact CD2-CB 4.46Å; Y813-H1049 HydrophobicContact CE1-CB 3.48Å; Y813-H1049 HydrophobicContact CE2-CB 4.18Å; Y813-H1049 HydrophobicContact CG-CB 4.29Å; Y813-Q1050 HydrophobicContact CE1-CG 4.03Å; Y813-Y1086 AromaticContact CE2-CD1 3.72Å; Y813-Y1086 HydrophobicContact CE2-CD1 3.72Å; Y813-Y1086 HydrophobicContact CE2-CE1 4.38Å; Y813-Y1086 HydrophobicContact CE2-CG 4.41Å; Y813-Y1086 AromaticContact CZ-CD1 3.88Å; Y813-Y1086 WeakPolarHBondContact OH-CA 3.41Å; Y813-Y1086 VanDerWaalsContact OH-CB 3.24Å; Y813-Y1086 WeakPolarHBondContact OH-CB 3.34Å; Y813-Y1086 PolarHBondContact OH-O 3.32Å; Y813-F1152 AromaticContact CD2-CE2 3.81Å; Y813-F1152 HydrophobicContact CD2-CE2 3.81Å; Y813-F1152 AromaticContact CD2-CZ 3.83Å; Y813-F1152 HydrophobicContact CD2-CZ 3.94Å; Y813-F1152 HydrophobicContact CE2-CE2 4.29Å; Y813-F1152 HydrophobicContact CG-CE2 4.35Å; Y813-F1152 HydrophobicContact CG-CZ 4.32Å; Y813-R1153 PolarHBondContact OH-NH1 2.87Å
814	P	84.6	Confident	89.7	Confident	86.25 Å²	86.25	33.2 Å²	33.2	56%	0.56	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19	-175.1	26.7	-35.5	0	0	0	113.8	P812	P812-P814 VanDerWaalsContact C-CD 3.46Å; P812-P814 WeakPolarHBondContact O-CD 3.31Å
815	L	84.6	Confident	89.7	Confident	34 Å²	34	33.2 Å²	33.2	18%	0.178	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-5.8	178.6	-58.5	174.8	0	0	0	113.5	Y813 N967 Q999	Y813-L815 PolarHBondContact O-N 2.99Å; Y813-L815 VanDerWaalsContact O-N 3.11Å; L815-N967 PolarHBondContact O-ND2 3.03Å; L815-N967 VanDerWaalsContact O-ND2 3.1Å; L815-N967 PolarHBondContact O-OD1 3.13Å; L815-Q999 HydrophobicContact CD1-CB 4.1Å; L815-Q999 HydrophobicContact CD1-CG 4.21Å; L815-Q999 HydrophobicContact CD2-CB 4.39Å; L815-Q999 HydrophobicContact CD2-CG 4.32Å
816	L	88.5	Confident	89.8	Confident	3.5 Å²	3.5	31.1 Å²	31.1	2%	0.018	16%	0.163	C	C	.	.	S	Bend	trans	-123.6	113.9	-175.5	-63.6	175.4	0	0	0	110.4	Y813 G818 N967 H1049 M1053 I1054 P1117 F1152	Y813-L816 PolarHBondContact O-N 3.07Å; Y813-L816 VanDerWaalsContact O-O 3.12Å; L816-G818 PolarHBondContact O-N 2.87Å; L816-N967 WeakPolarHBondContact CA-OD1 3.32Å; L816-H1049 HydrophobicContact CD1-CB 4.04Å; L816-M1053 WeakPolarHBondContact CD1-O 3.47Å; L816-I1054 HydrophobicContact CD2-CG1 4.23Å; L816-I1054 HydrophobicContact CD2-CG2 4.2Å; L816-P1117 HydrophobicContact CD2-CB 3.79Å; L816-P1117 HydrophobicContact CD2-CG 3.7Å; L816-F1152 HydrophobicContact CB-CD1 3.86Å; L816-F1152 HydrophobicContact CB-CD2 4.39Å; L816-F1152 HydrophobicContact CB-CE1 3.61Å; L816-F1152 HydrophobicContact CB-CE2 4.15Å; L816-F1152 HydrophobicContact CB-CG 4.3Å; L816-F1152 HydrophobicContact CB-CZ 3.85Å; L816-F1152 HydrophobicContact CD1-CB 4.45Å; L816-F1152 HydrophobicContact CD1-CD1 4.46Å; L816-F1152 HydrophobicContact CD1-CD2 4.02Å; L816-F1152 HydrophobicContact CD1-CE2 3.9Å; L816-F1152 HydrophobicContact CD1-CG 4.28Å; L816-F1152 HydrophobicContact CD1-CZ 4.33Å; L816-F1152 VanDerWaalsContact O-CE1 3.31Å; L816-F1152 WeakPolarHBondContact O-CE1 3.31Å
817	N	88.9	Confident	89.8	Confident	35.5 Å²	35.5	28.2 Å²	28.2	19%	0.19	15%	0.149	C	C	.	.			trans	-77.7	117.8	173.4	-70	-29.8	0	0	0	110.1	Q966 N967 S968 I969 F1152	N817-Q966 WeakPolarHBondContact ND2-CB 3.19Å; N817-Q966 PolarHBondContact ND2-OE1 3.15Å; N817-Q966 VanDerWaalsContact ND2-OE1 3.13Å; N817-N967 VanDerWaalsContact CB-O 3.27Å; N817-N967 WeakPolarHBondContact CB-O 3.36Å; N817-N967 PolarHBondContact N-ND2 3.12Å; N817-N967 VanDerWaalsContact N-ND2 3.16Å; N817-N967 PolarHBondContact N-OD1 2.83Å; N817-N967 PolarHBondContact ND2-O 3.1Å; N817-N967 VanDerWaalsContact ND2-O 3.1Å; N817-S968 WeakPolarHBondContact O-CB 3.33Å; N817-S968 PolarHBondContact O-OG 3.09Å; N817-I969 HydrophobicContact CB-CD1 4.26Å; N817-F1152 WeakPolarHBondContact O-CD1 3.42Å
818	G	85.8	Confident	89.8	Confident	15.75 Å²	15.75	28.1 Å²	28.1	16%	0.162	15%	0.149	C	C	.	.			trans	-84.8	151.4	173.6	0	0	0	0	0	111.4	L816 R885 F1152	L816-G818 PolarHBondContact O-N 2.87Å; G818-R885 PolarHBondContact O-NE 2.86Å; G818-R885 VanDerWaalsContact O-NE 3.15Å; G818-R885 PolarHBondContact O-NH2 3.07Å; G818-F1152 VanDerWaalsContact CA-CE1 3.47Å
819	R	88.3	Confident	89.7	Confident	6 Å²	6	21.2 Å²	21.2	2%	0.023	12%	0.124	C	C	.	.	S	Bend	trans	-99.1	-41	164.9	-115.9	-179.9	-173.6	-1.2	-3.1	110.7	R885 Y886 S887 D946 S968 L1149 L1150 D1151	R819-R885 HydrophobicContact CG-CB 4.29Å; R819-R885 HydrophobicContact CG-CG 4.21Å; R819-Y886 VanDerWaalsContact NH2-CD2 3.34Å; R819-Y886 VanDerWaalsContact NH2-CE2 3.3Å; R819-S887 WeakPolarHBondContact CD-OG 3.3Å; R819-S887 VanDerWaalsContact CZ-OG 3.29Å; R819-S887 PolarHBondContact NE-OG 2.94Å; R819-S887 PolarHBondContact NH1-OG 3.17Å; R819-S887 PolarHBondContact NH2-OG 2.84Å; R819-D946 IonicContact CZ-OD1 3.24Å; R819-D946 IonicContact CZ-OD2 3.48Å; R819-D946 VanDerWaalsContact CZ-OD2 3.29Å; R819-D946 VanDerWaalsContact NH1-CG 3.35Å; R819-D946 IonicContact NH1-OD1 3.04Å; R819-D946 PolarHBondContact NH1-OD1 2.97Å; R819-D946 IonicContact NH1-OD2 3.25Å; R819-D946 PolarHBondContact NH1-OD2 2.94Å; R819-D946 VanDerWaalsContact NH2-CG 3.29Å; R819-D946 IonicContact NH2-OD1 3.44Å; R819-D946 PolarHBondContact NH2-OD1 3.15Å; R819-D946 IonicContact NH2-OD2 3.44Å; R819-D946 PolarHBondContact NH2-OD2 2.99Å; R819-D946 VanDerWaalsContact NH2-OD2 3.07Å; R819-S968 WeakPolarHBondContact CD-O 3.27Å; R819-S968 VanDerWaalsContact CG-O 3.25Å; R819-S968 WeakPolarHBondContact CG-O 3.45Å; R819-S968 PolarHBondContact NE-O 2.97Å; R819-S968 PolarHBondContact NH1-O 2.85Å; R819-S968 PolarHBondContact NH2-O 3.1Å; R819-L1149 HydrophobicContact CG-CD1 4.25Å; R819-L1150 WeakPolarHBondContact CD-O 3.34Å; R819-L1150 PolarHBondContact NE-O 3.15Å; R819-L1150 VanDerWaalsContact NE-O 3.14Å; R819-D1151 HydrophobicContact CB-CB 4.03Å; R819-D1151 HydrophobicContact CG-CB 4.34Å; R819-D1151 PolarHBondContact N-OD1 2.85Å; R819-D1151 PolarHBondContact N-OD2 3.07Å
820	T	83.2	Confident	89.6	Confident	4.25 Å²	4.25	20.4 Å²	20.4	3%	0.026	12%	0.119	C	C	.	.	S	Bend	trans	-100.4	160.9	173.7	60	0	0	0	0	111.7	D852 N854 D1151 R1153 L1154	T820-D852 VanDerWaalsContact CA-OD1 3.27Å; T820-D852 WeakPolarHBondContact CA-OD1 3.08Å; T820-D852 VanDerWaalsContact CB-OD1 3.27Å; T820-D852 WeakPolarHBondContact CB-OD1 3.15Å; T820-N854 VanDerWaalsContact CG2-ND2 3.27Å; T820-N854 WeakPolarHBondContact CG2-ND2 3.27Å; T820-D1151 VanDerWaalsContact CB-OD2 3.28Å; T820-D1151 WeakPolarHBondContact CB-OD2 3.39Å; T820-D1151 WeakPolarHBondContact CG2-OD2 3.28Å; T820-D1151 PolarHBondContact N-OD2 3.26Å; T820-D1151 PolarHBondContact OG1-OD2 2.91Å; T820-R1153 VanDerWaalsContact O-CD 3.29Å; T820-R1153 WeakPolarHBondContact O-CD 3.38Å; T820-R1153 PolarHBondContact O-NE 2.63Å; T820-L1154 HydrophobicContact CG2-CD1 4.05Å; T820-L1154 WeakPolarHBondContact OG1-CD1 3.22Å
821	L	82.9	Confident	89.7	Confident	52 Å²	52	19.7 Å²	19.7	27%	0.272	12%	0.116	S	C	.	.	S	Bend	trans	49.7	58.5	-179.2	-60.3	166.6	0	0	0	113.6	D852 R1153	L821-D852 WeakPolarHBondContact CD2-OD2 3.27Å; L821-D852 PolarHBondContact N-OD1 3.12Å; L821-R1153 VanDerWaalsContact CB-NH1 3.31Å; L821-R1153 HydrophobicContact CD1-CB 4.27Å; L821-R1153 PolarHBondContact O-NH1 3.34Å; L821-R1153 PolarHBondContact O-NH2 3.07Å
822	P	88.9	Confident	89.8	Confident	9.5 Å²	9.5	18.1 Å²	18.1	6%	0.062	11%	0.108	C	C	.	.			trans	-63.9	161.9	-179.8	28.6	-35.7	0	0	0	112.6	A824 I827 A850 F880	P822-A824 PolarHBondContact O-N 3.49Å; P822-I827 HydrophobicContact CG-CG1 4.46Å; P822-I827 HydrophobicContact CG-CG2 4.31Å; P822-I827 WeakPolarHBondContact O-CD1 3.22Å; P822-A850 HydrophobicContact CB-CB 3.85Å; P822-A850 HydrophobicContact CG-CB 3.37Å; P822-A850 VanDerWaalsContact CG-CB 3.49Å; P822-F880 HydrophobicContact CB-CD1 3.62Å; P822-F880 HydrophobicContact CB-CE1 3.72Å; P822-F880 HydrophobicContact CB-CG 4.18Å; P822-F880 HydrophobicContact CB-CZ 4.38Å; P822-F880 HydrophobicContact CG-CD1 3.91Å; P822-F880 HydrophobicContact CG-CE1 4.16Å; P822-F880 HydrophobicContact CG-CG 4.35Å
823	H	91.5	Very high	90.2	Very high	21.25 Å²	21.25	16.7 Å²	16.7	10%	0.098	10%	0.098	C	C	.	.			trans	-97.4	101	176.3	-64.1	-59.9	0	0	0	110.7	P780 V809 N811 P812 F847 R1153	P780-H823 WeakPolarHBondContact O-CA 3.38Å; P780-H823 PolarHBondContact O-ND1 3Å; V809-H823 HydrophobicContact CG1-CB 3.88Å; N811-H823 HydrophobicContact CB-CB 4.44Å; N811-H823 VanDerWaalsContact CG-CD2 3.46Å; N811-H823 PolarHBondContact OD1-CD2 3.06Å; N811-H823 VanDerWaalsContact OD1-CD2 3.3Å; N811-H823 PolarHBondContact OD1-NE2 3.29Å; P812-H823 VanDerWaalsContact CD-CE1 3.4Å; P812-H823 WeakPolarHBondContact CD-CE1 3.32Å; P812-H823 VanDerWaalsContact CD-NE2 3.34Å; P812-H823 WeakPolarHBondContact CD-NE2 3.38Å; H823-F847 WeakPolarHBondContact O-CD2 3.49Å; H823-R1153 PolarHBondContact CE1-NH2 2.98Å; H823-R1153 VanDerWaalsContact CE1-NH2 3.31Å; H823-R1153 PolarHBondContact NE2-NH2 2.98Å
824	A	94.3	Very high	90.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	164.2	-177.4	0	0	0	0	0	112.1	F781 P822 V826 I827 F847 A850	F781-A824 WeakPolarHBondContact CA-O 3.38Å; F781-A824 WeakPolarHBondContact CB-O 3.33Å; P822-A824 PolarHBondContact O-N 3.49Å; A824-V826 VanDerWaalsContact C-N 3.32Å; A824-V826 PolarHBondContact O-N 3.17Å; A824-I827 HydrophobicContact CB-CG1 4.35Å; A824-F847 VanDerWaalsContact CA-O 3.31Å; A824-F847 WeakPolarHBondContact CA-O 3.43Å; A824-F847 HydrophobicContact CB-CB 3.78Å; A824-A850 HydrophobicContact CB-CB 3.45Å; A824-A850 VanDerWaalsContact CB-CB 3.45Å
825	A	95.4	Very high	91	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	-44	174	0	0	0	0	0	110.6	I782 V783 V804 V809 N842 F847 E848	I782-A825 WeakPolarHBondContact CA-O 3.43Å; I782-A825 VanDerWaalsContact CB-O 3.29Å; I782-A825 WeakPolarHBondContact CB-O 3.26Å; I782-A825 HydrophobicContact CG1-CB 4.46Å; I782-A825 PolarHBondContact N-O 3.31Å; I782-A825 VanDerWaalsContact N-O 3.15Å; V783-A825 PolarHBondContact N-O 2.9Å; V804-A825 HydrophobicContact CG1-CB 4.11Å; V809-A825 HydrophobicContact CG2-CB 4.45Å; A825-N842 HydrophobicContact CB-CB 4.37Å; A825-N842 WeakPolarHBondContact CB-ND2 3.45Å; A825-F847 PolarHBondContact N-O 3.04Å; A825-E848 WeakPolarHBondContact CB-O 3.24Å; A825-E848 PolarHBondContact N-O 2.98Å
826	V	95.9	Very high	91.4	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.5	174.1	-175.6	0	0	0	0	111.2	V783 I785 V804 A824 I828 I835 F840 E848 I849 A850	V783-V826 HydrophobicContact CB-CG1 4.34Å; V783-V826 HydrophobicContact CB-CG2 4.17Å; V783-V826 HydrophobicContact CG1-CG1 4.34Å; V783-V826 CarbonylContact O-C 3.5Å; V783-V826 WeakPolarHBondContact O-CA 3.29Å; I785-V826 HydrophobicContact CD1-CG1 4.47Å; I785-V826 HydrophobicContact CG1-CG1 4.49Å; V804-V826 HydrophobicContact CG1-CG2 4.37Å; V804-V826 HydrophobicContact CG2-CG2 4.33Å; A824-V826 VanDerWaalsContact C-N 3.32Å; A824-V826 PolarHBondContact O-N 3.17Å; V826-I828 HydrophobicContact CG1-CG1 4.4Å; V826-I835 HydrophobicContact CG1-CD1 4.4Å; V826-F840 HydrophobicContact CG2-CD1 4.13Å; V826-F840 HydrophobicContact CG2-CE1 3.56Å; V826-F840 HydrophobicContact CG2-CZ 4.39Å; V826-E848 PolarHBondContact N-O 3.08Å; V826-I849 HydrophobicContact CB-CG1 4.35Å; V826-I849 CarbonylContact O-C 3.49Å; V826-I849 WeakPolarHBondContact O-CA 3.27Å; V826-A850 PolarHBondContact O-N 2.98Å
827	I	95.6	Very high	91.6	Very high	3.25 Å²	3.25	22.1 Å²	22.1	2%	0.017	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.2	173.1	-56	171.6	0	0	0	109.4	F781 V783 S784 I785 P822 A824 T829 A850 D852	F781-I827 HydrophobicContact CB-CD1 3.54Å; F781-I827 HydrophobicContact CB-CG1 4.06Å; F781-I827 HydrophobicContact CD1-CD1 3.72Å; F781-I827 HydrophobicContact CD2-CD1 4.43Å; F781-I827 HydrophobicContact CE1-CD1 4.43Å; F781-I827 HydrophobicContact CG-CD1 3.67Å; F781-I827 HydrophobicContact CG-CG1 4.48Å; V783-I827 PolarHBondContact O-N 3.41Å; S784-I827 WeakPolarHBondContact CA-O 3.29Å; I785-I827 PolarHBondContact N-O 2.92Å; P822-I827 HydrophobicContact CG-CG1 4.46Å; P822-I827 HydrophobicContact CG-CG2 4.31Å; P822-I827 WeakPolarHBondContact O-CD1 3.22Å; A824-I827 HydrophobicContact CB-CG1 4.35Å; I827-T829 HydrophobicContact CG2-CG2 4.37Å; I827-A850 CarbonylContact C-O 3.54Å; I827-A850 VanDerWaalsContact CA-O 3.32Å; I827-A850 WeakPolarHBondContact CA-O 3.33Å; I827-D852 HydrophobicContact CG2-CB 3.9Å
828	I	95.3	Very high	91.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.1	179.8	-47.1	167.7	0	0	0	109	I785 V826 S830 V833 I835 I849 A850 T851 D852 I860	I785-I828 WeakPolarHBondContact O-CA 3.37Å; V826-I828 HydrophobicContact CG1-CG1 4.4Å; I828-S830 VanDerWaalsContact CG2-O 3.3Å; I828-S830 WeakPolarHBondContact CG2-O 3.39Å; I828-V833 HydrophobicContact CG2-CB 3.97Å; I828-V833 HydrophobicContact CG2-CG1 4.27Å; I828-V833 HydrophobicContact CG2-CG2 4.28Å; I828-I835 HydrophobicContact CD1-CD1 3.22Å; I828-I835 HydrophobicContact CD1-CG1 4.3Å; I828-I835 HydrophobicContact CG1-CD1 3.66Å; I828-I849 HydrophobicContact CD1-CD1 3.77Å; I828-I849 HydrophobicContact CD1-CG1 3.92Å; I828-I849 HydrophobicContact CD1-CG2 3.59Å; I828-I849 HydrophobicContact CG1-CG1 4.44Å; I828-I849 HydrophobicContact CG1-CG2 4.26Å; I828-A850 PolarHBondContact N-O 2.91Å; I828-T851 VanDerWaalsContact O-CA 3.32Å; I828-T851 WeakPolarHBondContact O-CA 3.38Å; I828-T851 PolarHBondContact O-OG1 2.98Å; I828-D852 PolarHBondContact O-N 2.85Å; I828-I860 HydrophobicContact CB-CD1 4.12Å; I828-I860 HydrophobicContact CD1-CG2 3.66Å; I828-I860 HydrophobicContact CG2-CD1 3.91Å; I828-I860 HydrophobicContact CG2-CG1 4.39Å; I828-I860 HydrophobicContact CG2-CG2 3.99Å
829	T	92.2	Very high	92.2	Very high	7.25 Å²	7.25	19.8 Å²	19.8	4%	0.044	9%	0.092	C	C	.	.			trans	-107.8	-4.2	-174.8	61	0	0	0	0	114	R753 I785 G786 I827 D852	R753-T829 HydrophobicContact CG-CG2 4.31Å; I785-T829 PolarHBondContact O-N 3.2Å; I785-T829 PolarHBondContact O-OG1 3.09Å; G786-T829 WeakPolarHBondContact CA-OG1 3.41Å; G786-T829 PolarHBondContact N-OG1 2.95Å; I827-T829 HydrophobicContact CG2-CG2 4.37Å; T829-D852 HydrophobicContact CG2-CB 4.15Å
830	S	93.4	Very high	92.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.091	C	C	.	.			trans	-151.4	151.8	-177.9	65.3	0	0	0	0	112.4	G786 L787 E789 I828 N832 V833	G786-S830 VanDerWaalsContact CA-OG 3.31Å; G786-S830 WeakPolarHBondContact CA-OG 3.4Å; L787-S830 PolarHBondContact N-OG 3.26Å; L787-S830 WeakPolarHBondContact O-CB 3.35Å; E789-S830 VanDerWaalsContact CD-CA 3.5Å; E789-S830 VanDerWaalsContact OE1-CA 3.29Å; E789-S830 WeakPolarHBondContact OE1-CA 3.46Å; E789-S830 WeakPolarHBondContact OE1-CB 3.25Å; E789-S830 WeakPolarHBondContact OE2-CA 3.49Å; E789-S830 WeakPolarHBondContact OE2-CB 3.47Å; I828-S830 VanDerWaalsContact CG2-O 3.3Å; I828-S830 WeakPolarHBondContact CG2-O 3.39Å; S830-N832 VanDerWaalsContact C-N 3.25Å; S830-N832 WeakPolarHBondContact CB-OD1 3.35Å; S830-N832 PolarHBondContact O-N 2.85Å; S830-N832 PolarHBondContact OG-OD1 3.06Å; S830-V833 PolarHBondContact O-N 2.84Å; S830-V833 VanDerWaalsContact OG-CG2 3.27Å; S830-V833 WeakPolarHBondContact OG-CG2 3.36Å
831	S	91.4	Very high	93	Very high	33.75 Å²	33.75	24 Å²	24	24%	0.236	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-20.8	178.4	75.1	0	0	0	0	113.6	E789 V833	E789-S831 VanDerWaalsContact CD-OG 3.25Å; E789-S831 WeakPolarHBondContact OE1-CB 3.42Å; E789-S831 PolarHBondContact OE1-N 2.87Å; E789-S831 PolarHBondContact OE1-OG 2.97Å; E789-S831 VanDerWaalsContact OE1-OG 3.11Å; E789-S831 WeakPolarHBondContact OE2-CA 3.37Å; E789-S831 VanDerWaalsContact OE2-CB 3.27Å; E789-S831 WeakPolarHBondContact OE2-CB 3.25Å; E789-S831 PolarHBondContact OE2-N 3.06Å; E789-S831 VanDerWaalsContact OE2-N 3.15Å; E789-S831 PolarHBondContact OE2-OG 2.92Å; E789-S831 VanDerWaalsContact OE2-OG 3.1Å; S831-V833 PolarHBondContact O-N 3.2Å; S831-V833 VanDerWaalsContact O-N 3.11Å
832	N	91.8	Very high	93.5	Very high	20.25 Å²	20.25	21.5 Å²	21.5	11%	0.108	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	6.9	172	44.5	3.2	0	0	0	114.8	L787 N788 E789 S791 Q794 N795 M796 S830	L787-N832 WeakPolarHBondContact CB-ND2 3.06Å; N788-N832 PolarHBondContact O-ND2 2.87Å; N788-N832 VanDerWaalsContact O-ND2 3.12Å; E789-N832 PolarHBondContact OE1-N 2.81Å; S791-N832 PolarHBondContact N-ND2 3.36Å; S791-N832 PolarHBondContact O-ND2 2.72Å; Q794-N832 PolarHBondContact O-ND2 3.17Å; Q794-N832 VanDerWaalsContact O-ND2 3.1Å; N795-N832 PolarHBondContact OD1-O 2.92Å; M796-N832 PolarHBondContact N-O 2.9Å; M796-N832 VanDerWaalsContact N-O 3.1Å; S830-N832 VanDerWaalsContact C-N 3.25Å; S830-N832 WeakPolarHBondContact CB-OD1 3.35Å; S830-N832 PolarHBondContact O-N 2.85Å; S830-N832 PolarHBondContact OG-OD1 3.06Å
833	V	94.4	Very high	93.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.6	172.4	179.9	0	0	0	0	109.1	I785 M796 I828 S830 S831 I835	I785-V833 HydrophobicContact CD1-CG1 3.74Å; I785-V833 HydrophobicContact CG1-CG1 4.29Å; M796-V833 HydrophobicContact CB-CG2 4.08Å; M796-V833 HydrophobicContact CG-CG1 4.37Å; M796-V833 HydrophobicContact CG-CG2 4.41Å; M796-V833 CarbonylContact O-C 3.52Å; M796-V833 WeakPolarHBondContact O-CA 3.31Å; M796-V833 HydrophobicContact SD-CG1 4.34Å; M796-V833 HydrophobicContact SD-CG2 4.08Å; I828-V833 HydrophobicContact CG2-CB 3.97Å; I828-V833 HydrophobicContact CG2-CG1 4.27Å; I828-V833 HydrophobicContact CG2-CG2 4.28Å; S830-V833 PolarHBondContact O-N 2.84Å; S830-V833 VanDerWaalsContact OG-CG2 3.27Å; S830-V833 WeakPolarHBondContact OG-CG2 3.36Å; S831-V833 PolarHBondContact O-N 3.2Å; S831-V833 VanDerWaalsContact O-N 3.11Å; V833-I835 HydrophobicContact CG1-CD1 4.29Å; V833-I835 HydrophobicContact CG1-CG1 3.85Å
834	I	94.8	Very high	93.4	Very high	46.75 Å²	46.75	30.5 Å²	30.5	24%	0.24	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	120.8	174.6	-62.9	171.7	0	0	0	108.9	M796 F798 R836	M796-I834 PolarHBondContact O-N 2.97Å; F798-I834 PolarHBondContact N-O 2.96Å; I834-R836 HydrophobicContact CG2-CG 3.82Å
835	I	94.9	Very high	93.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	107.7	179.8	-52.8	-168.4	0	0	0	108.9	I785 F798 V826 I828 V833 N838 F840 I849 D861 A862 N865	I785-I835 HydrophobicContact CD1-CD1 4.31Å; F798-I835 HydrophobicContact CB-CG1 4.34Å; F798-I835 HydrophobicContact CD1-CG2 4.11Å; F798-I835 VanDerWaalsContact O-CA 3.31Å; F798-I835 WeakPolarHBondContact O-CA 3.36Å; V826-I835 HydrophobicContact CG1-CD1 4.4Å; I828-I835 HydrophobicContact CD1-CD1 3.22Å; I828-I835 HydrophobicContact CD1-CG1 4.3Å; I828-I835 HydrophobicContact CG1-CD1 3.66Å; V833-I835 HydrophobicContact CG1-CD1 4.29Å; V833-I835 HydrophobicContact CG1-CG1 3.85Å; I835-N838 VanDerWaalsContact CG2-ND2 3.33Å; I835-N838 WeakPolarHBondContact CG2-ND2 3.34Å; I835-F840 HydrophobicContact CG2-CE2 4.3Å; I835-F840 HydrophobicContact CG2-CZ 4.05Å; I835-I849 HydrophobicContact CD1-CD1 4.25Å; I835-D861 PolarHBondContact N-O 3.05Å; I835-A862 HydrophobicContact CB-CB 4.39Å; I835-A862 CarbonylContact O-C 3.45Å; I835-A862 VanDerWaalsContact O-CA 3.27Å; I835-A862 WeakPolarHBondContact O-CA 3.32Å; I835-N865 WeakPolarHBondContact CG2-ND2 3.33Å; I835-N865 PolarHBondContact O-ND2 2.94Å
836	R	92.9	Very high	93.1	Very high	77.75 Å²	77.75	36.6 Å²	36.6	29%	0.293	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144.5	-179.8	-62.7	-171.2	-174.4	156.8	3.6	113.5	F798 H799 V800 I834 N838 D861 R863 N865	F798-R836 PolarHBondContact O-N 3.24Å; H799-R836 WeakPolarHBondContact CA-O 3.39Å; H799-R836 VanDerWaalsContact CB-O 3.31Å; H799-R836 WeakPolarHBondContact CB-O 3.32Å; V800-R836 PolarHBondContact N-O 3.11Å; I834-R836 HydrophobicContact CG2-CG 3.82Å; R836-N838 VanDerWaalsContact C-N 3.3Å; R836-N838 PolarHBondContact N-ND2 2.96Å; R836-N838 PolarHBondContact O-N 2.99Å; R836-N838 PolarHBondContact O-ND2 3.09Å; R836-N838 VanDerWaalsContact O-ND2 3.14Å; R836-D861 IonicContact CZ-OD2 3.09Å; R836-D861 IonicContact NE-OD1 3.52Å; R836-D861 IonicContact NE-OD2 3.23Å; R836-D861 PolarHBondContact NE-OD2 2.83Å; R836-D861 IonicContact NH2-OD1 2.93Å; R836-D861 IonicContact NH2-OD2 3.32Å; R836-D861 PolarHBondContact NH2-OD2 3.07Å; R836-R863 WeakPolarHBondContact CA-O 3.37Å; R836-R863 WeakPolarHBondContact CG-O 3.29Å; R836-R863 VanDerWaalsContact NH2-NH2 3.17Å; R836-N865 VanDerWaalsContact C-OD1 3.22Å; R836-N865 WeakPolarHBondContact CA-OD1 3.32Å
837	R	91.7	Very high	93	Very high	130.5 Å²	130.5	37.3 Å²	37.3	49%	0.492	17%	0.17	S	C	.	.	S	Bend	trans	59.5	37.6	174.2	-53.4	179.5	-176.9	-177.9	-1.6	113.8	Q801 E864 N865	Q801-R837 PolarHBondContact N-O 3.12Å; R837-E864 WeakPolarHBondContact CA-O 3.35Å; R837-E864 HydrophobicContact CG-CB 4.11Å; R837-E864 IonicContact CZ-OE2 3.29Å; R837-E864 PolarHBondContact N-O 3.09Å; R837-E864 IonicContact NE-OE2 3.01Å; R837-E864 PolarHBondContact NE-OE2 3.11Å; R837-E864 IonicContact NH2-OE2 2.87Å; R837-E864 PolarHBondContact NH2-OE2 3Å; R837-N865 PolarHBondContact N-OD1 3.05Å; R837-N865 VanDerWaalsContact N-OD1 3.09Å
838	N	93.6	Very high	92.9	Very high	1.5 Å²	1.5	37.4 Å²	37.4	1%	0.008	17%	0.171	C	C	.	.			trans	-105.3	170	173	-52.1	-73.4	0	0	0	111.2	F798 N802 I835 R836 F840 N865 N866	F798-N838 HydrophobicContact CD1-CB 4.47Å; F798-N838 HydrophobicContact CE1-CB 4.23Å; F798-N838 PolarHBondContact O-ND2 3.06Å; N802-N838 HydrophobicContact CB-CB 4.47Å; N802-N838 VanDerWaalsContact CB-OD1 3.31Å; N802-N838 WeakPolarHBondContact CB-OD1 3.34Å; N802-N838 PolarHBondContact N-OD1 2.88Å; N802-N838 PolarHBondContact ND2-OD1 2.98Å; I835-N838 VanDerWaalsContact CG2-ND2 3.33Å; I835-N838 WeakPolarHBondContact CG2-ND2 3.34Å; R836-N838 VanDerWaalsContact C-N 3.3Å; R836-N838 PolarHBondContact N-ND2 2.96Å; R836-N838 PolarHBondContact O-N 2.99Å; R836-N838 PolarHBondContact O-ND2 3.09Å; R836-N838 VanDerWaalsContact O-ND2 3.14Å; N838-F840 HydrophobicContact CB-CE1 4.46Å; N838-F840 HydrophobicContact CB-CE2 3.9Å; N838-F840 HydrophobicContact CB-CZ 3.77Å; N838-N865 WeakPolarHBondContact CB-OD1 3.39Å; N838-N865 PolarHBondContact N-OD1 2.9Å; N838-N865 PolarHBondContact ND2-OD1 3Å; N838-N866 PolarHBondContact O-N 3.22Å
839	C	93.7	Very high	92.9	Very high	2.5 Å²	2.5	37.4 Å²	37.4	2%	0.017	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.1	179.2	-58.8	0	0	0	0	112.3	N802 V804 C900 N901	N802-C839 PolarHBondContact O-N 2.99Å; V804-C839 PolarHBondContact N-O 3.35Å; C839-C900 HydrophobicContact CB-CB 3.89Å; C839-C900 WeakPolarHBondContact CB-SG 3.33Å; C839-C900 WeakPolarHBondContact SG-CA 3.23Å; C839-C900 WeakPolarHBondContact SG-CB 3.42Å; C839-C900 CovalentContact SG-SG 2.01Å; C839-C900 PolarHBondContact SG-SG 3.17Å; C839-N901 PolarHBondContact SG-N 2.84Å; C839-N901 VanDerWaalsContact SG-N 3.42Å; C839-N901 PolarHBondContact SG-OD1 3.41Å; C839-N901 VanDerWaalsContact SG-OD1 3.33Å
840	F	94.4	Very high	93.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.2	178.3	-55.3	-68.6	0	0	0	109.7	F798 V804 V826 I835 N838 E848 I849 N865 N866 Y867 G868	F798-F840 HydrophobicContact CE1-CE1 4.39Å; F798-F840 HydrophobicContact CE1-CZ 4.27Å; V804-F840 HydrophobicContact CB-CD1 3.93Å; V804-F840 HydrophobicContact CB-CE1 4.18Å; V804-F840 HydrophobicContact CG2-CD1 4.29Å; V804-F840 HydrophobicContact CG2-CE1 4.02Å; V804-F840 WeakPolarHBondContact O-CA 3.34Å; V826-F840 HydrophobicContact CG2-CD1 4.13Å; V826-F840 HydrophobicContact CG2-CE1 3.56Å; V826-F840 HydrophobicContact CG2-CZ 4.39Å; I835-F840 HydrophobicContact CG2-CE2 4.3Å; I835-F840 HydrophobicContact CG2-CZ 4.05Å; N838-F840 HydrophobicContact CB-CE1 4.46Å; N838-F840 HydrophobicContact CB-CE2 3.9Å; N838-F840 HydrophobicContact CB-CZ 3.77Å; F840-E848 HydrophobicContact CB-CB 4.43Å; F840-I849 HydrophobicContact CD2-CD1 4.05Å; F840-I849 HydrophobicContact CD2-CG1 4.42Å; F840-I849 HydrophobicContact CE2-CD1 3.67Å; F840-I849 HydrophobicContact CE2-CG1 4.41Å; F840-I849 HydrophobicContact CZ-CD1 3.99Å; F840-I849 HydrophobicContact CZ-CG1 4.48Å; F840-N865 HydrophobicContact CD2-CB 4.22Å; F840-N865 HydrophobicContact CE2-CB 3.9Å; F840-N866 PolarHBondContact N-O 3.03Å; F840-Y867 HydrophobicContact CB-CD1 4.37Å; F840-Y867 AromaticContact CD2-CD1 3.88Å; F840-Y867 HydrophobicContact CD2-CD1 4Å; F840-Y867 AromaticContact CD2-CE1 3.88Å; F840-Y867 HydrophobicContact CD2-CE1 3.88Å; F840-Y867 HydrophobicContact CE2-CE1 4.36Å; F840-Y867 HydrophobicContact CG-CD1 4.46Å; F840-Y867 CarbonylContact O-C 3.51Å; F840-Y867 WeakPolarHBondContact O-CA 3.39Å; F840-G868 WeakPolarHBondContact O-CA 3.36Å; F840-G868 PolarHBondContact O-N 3.05Å; F840-G868 VanDerWaalsContact O-N 3.14Å
841	Y	93.3	Very high	93.2	Very high	97 Å²	97	37.1 Å²	37.1	38%	0.38	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	90.3	171.3	-175.4	-114.1	0	0	0	110.4	V804 K805 E806 I843	V804-Y841 PolarHBondContact O-N 3.01Å; V804-Y841 VanDerWaalsContact O-N 3.09Å; K805-Y841 CarbonylContact C-O 3.49Å; K805-Y841 VanDerWaalsContact CA-O 3.24Å; K805-Y841 WeakPolarHBondContact CA-O 3.24Å; E806-Y841 PolarHBondContact N-O 2.85Å; E806-Y841 WeakPolarHBondContact OE1-CE1 3.25Å; Y841-I843 HydrophobicContact CE1-CD1 3.81Å; Y841-I843 HydrophobicContact CE1-CG1 3.88Å; Y841-I843 HydrophobicContact CE2-CG1 4.19Å; Y841-I843 WeakPolarHBondContact OH-CD1 3.28Å
842	N	93.9	Very high	93.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.158	C	C	.	.			trans	-126	88.4	-176.4	-58.2	-77.3	0	0	0	109.6	V804 K805 E806 N807 A825 H844 A845 E848 K878	V804-N842 PolarHBondContact O-ND2 3.27Å; V804-N842 PolarHBondContact O-OD1 2.82Å; K805-N842 VanDerWaalsContact C-OD1 3.27Å; K805-N842 WeakPolarHBondContact CA-OD1 3.41Å; E806-N842 PolarHBondContact N-OD1 3.05Å; N807-N842 VanDerWaalsContact CB-OD1 3.32Å; N807-N842 WeakPolarHBondContact CB-OD1 3.35Å; N807-N842 PolarHBondContact N-OD1 3.05Å; N807-N842 PolarHBondContact ND2-OD1 3.04Å; A825-N842 HydrophobicContact CB-CB 4.37Å; A825-N842 WeakPolarHBondContact CB-ND2 3.45Å; N842-H844 VanDerWaalsContact C-N 3.28Å; N842-H844 PolarHBondContact O-N 2.86Å; N842-A845 HydrophobicContact CB-CB 3.74Å; N842-A845 PolarHBondContact O-N 3.02Å; N842-E848 WeakPolarHBondContact CA-OE1 3.3Å; N842-E848 PolarHBondContact N-OE1 3.01Å; N842-E848 PolarHBondContact N-OE2 3.06Å; N842-E848 PolarHBondContact ND2-OE2 2.93Å; N842-K878 PolarHBondContact O-NZ 3.13Å
843	I	89.3	Confident	93.1	Very high	92.75 Å²	92.75	35.1 Å²	35.1	48%	0.476	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-40.4	-175	-59.3	170.4	0	0	0	111.7	Y841 A845 K878	Y841-I843 HydrophobicContact CE1-CD1 3.81Å; Y841-I843 HydrophobicContact CE1-CG1 3.88Å; Y841-I843 HydrophobicContact CE2-CG1 4.19Å; Y841-I843 WeakPolarHBondContact OH-CD1 3.28Å; I843-A845 VanDerWaalsContact C-N 3.31Å; I843-A845 PolarHBondContact O-N 3.06Å; I843-K878 PolarHBondContact O-NZ 2.98Å
844	H	90.1	Very high	92.8	Very high	128.25 Å²	128.25	37.1 Å²	37.1	59%	0.594	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	1.6	-178.2	-59.2	-56.5	0	0	0	114.4	R808 N842	R808-H844 HydrophobicContact CB-CB 4.37Å; R808-H844 HydrophobicContact CG-CB 4.21Å; N842-H844 VanDerWaalsContact C-N 3.28Å; N842-H844 PolarHBondContact O-N 2.86Å
845	A	91.8	Very high	92.5	Very high	3 Å²	3	37.2 Å²	37.2	3%	0.025	17%	0.166	C	C	.	.			trans	-95.5	131.5	172	0	0	0	0	0	109.8	V809 N842 I843 F847 K878	V809-A845 HydrophobicContact CB-CB 3.91Å; V809-A845 HydrophobicContact CG2-CB 3.58Å; N842-A845 HydrophobicContact CB-CB 3.74Å; N842-A845 PolarHBondContact O-N 3.02Å; I843-A845 VanDerWaalsContact C-N 3.31Å; I843-A845 PolarHBondContact O-N 3.06Å; A845-F847 VanDerWaalsContact C-N 3.31Å; A845-K878 WeakPolarHBondContact O-CE 3.36Å; A845-K878 PolarHBondContact O-NZ 2.86Å; A845-K878 VanDerWaalsContact O-NZ 3.09Å
846	E	90.9	Very high	92.1	Very high	123.5 Å²	123.5	37.4 Å²	37.4	58%	0.577	17%	0.166	S	C	*	.	S	Bend	trans	-61	-43.7	173.1	-170.9	179.8	171	0	0	110.7	K878	E846-K878 WeakPolarHBondContact O-CE 3.36Å
847	F	94.2	Very high	91.6	Very high	16.25 Å²	16.25	34.8 Å²	34.8	7%	0.071	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.6	178.4	-53.6	-66.2	0	0	0	111.8	H823 A824 A825 A845 K878 F880	H823-F847 WeakPolarHBondContact O-CD2 3.49Å; A824-F847 VanDerWaalsContact CA-O 3.31Å; A824-F847 WeakPolarHBondContact CA-O 3.43Å; A824-F847 HydrophobicContact CB-CB 3.78Å; A825-F847 PolarHBondContact N-O 3.04Å; A845-F847 VanDerWaalsContact C-N 3.31Å; F847-K878 CarbonylContact C-O 3.57Å; F847-K878 VanDerWaalsContact CA-O 3.24Å; F847-K878 WeakPolarHBondContact CA-O 3.27Å; F847-F880 HydrophobicContact CB-CB 4.33Å; F847-F880 HydrophobicContact CD1-CB 3.9Å; F847-F880 HydrophobicContact CD1-CD2 4.41Å; F847-F880 HydrophobicContact CD2-CB 4.23Å; F847-F880 HydrophobicContact CD2-CD2 4.22Å; F847-F880 HydrophobicContact CD2-CG 4.46Å; F847-F880 HydrophobicContact CE1-CB 4.3Å; F847-F880 AromaticContact CE1-CD2 3.97Å; F847-F880 HydrophobicContact CE1-CD2 4.02Å; F847-F880 AromaticContact CE2-CD2 3.8Å; F847-F880 HydrophobicContact CE2-CD2 3.8Å; F847-F880 HydrophobicContact CE2-CE2 4.43Å; F847-F880 HydrophobicContact CE2-CG 4.45Å; F847-F880 HydrophobicContact CG-CB 3.87Å; F847-F880 AromaticContact CZ-CD2 3.7Å; F847-F880 HydrophobicContact CZ-CD2 3.7Å; F847-F880 HydrophobicContact CZ-CE2 4.4Å
848	E	94	Very high	91.4	Very high	4.75 Å²	4.75	30.9 Å²	30.9	2%	0.022	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-50.3	173.4	-67	-65.7	163.6	0	0	110.5	A825 V826 F840 N842 K878	A825-E848 WeakPolarHBondContact CB-O 3.24Å; A825-E848 PolarHBondContact N-O 2.98Å; V826-E848 PolarHBondContact N-O 3.08Å; F840-E848 HydrophobicContact CB-CB 4.43Å; N842-E848 WeakPolarHBondContact CA-OE1 3.3Å; N842-E848 PolarHBondContact N-OE1 3.01Å; N842-E848 PolarHBondContact N-OE2 3.06Å; N842-E848 PolarHBondContact ND2-OE2 2.93Å; E848-K878 HydrophobicContact CG-CB 4.07Å; E848-K878 HydrophobicContact CG-CD 4.15Å; E848-K878 PolarHBondContact N-O 3.2Å; E848-K878 IonicContact OE1-NZ 2.84Å; E848-K878 PolarHBondContact OE1-NZ 3.14Å
849	I	95.1	Very high	91.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.1	179.7	-74.8	-174.9	0	0	0	108.9	V826 I828 I835 F840 A862 Y867 I879 F880 I891	V826-I849 HydrophobicContact CB-CG1 4.35Å; V826-I849 CarbonylContact O-C 3.49Å; V826-I849 WeakPolarHBondContact O-CA 3.27Å; I828-I849 HydrophobicContact CD1-CD1 3.77Å; I828-I849 HydrophobicContact CD1-CG1 3.92Å; I828-I849 HydrophobicContact CD1-CG2 3.59Å; I828-I849 HydrophobicContact CG1-CG1 4.44Å; I828-I849 HydrophobicContact CG1-CG2 4.26Å; I835-I849 HydrophobicContact CD1-CD1 4.25Å; F840-I849 HydrophobicContact CD2-CD1 4.05Å; F840-I849 HydrophobicContact CD2-CG1 4.42Å; F840-I849 HydrophobicContact CE2-CD1 3.67Å; F840-I849 HydrophobicContact CE2-CG1 4.41Å; F840-I849 HydrophobicContact CZ-CD1 3.99Å; F840-I849 HydrophobicContact CZ-CG1 4.48Å; I849-A862 HydrophobicContact CD1-CB 4.11Å; I849-Y867 HydrophobicContact CB-CE1 4.5Å; I849-Y867 HydrophobicContact CD1-CE1 3.78Å; I849-Y867 HydrophobicContact CG1-CE1 4.11Å; I849-Y867 HydrophobicContact CG2-CE1 4.03Å; I849-I879 HydrophobicContact CG2-CB 4.26Å; I849-I879 HydrophobicContact CG2-CG1 3.86Å; I849-I879 HydrophobicContact CG2-CG2 3.96Å; I849-I879 WeakPolarHBondContact O-CA 3.27Å; I849-F880 PolarHBondContact O-N 3.24Å; I849-I891 HydrophobicContact CD1-CG2 4.49Å; I849-I891 HydrophobicContact CG1-CD1 4.4Å; I849-I891 HydrophobicContact CG2-CD1 3.98Å
850	A	95.5	Very high	91.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152	174	0	0	0	0	0	111.5	P822 A824 V826 I827 I828 F880	P822-A850 HydrophobicContact CB-CB 3.85Å; P822-A850 HydrophobicContact CG-CB 3.37Å; P822-A850 VanDerWaalsContact CG-CB 3.49Å; A824-A850 HydrophobicContact CB-CB 3.45Å; A824-A850 VanDerWaalsContact CB-CB 3.45Å; V826-A850 PolarHBondContact O-N 2.98Å; I827-A850 CarbonylContact C-O 3.54Å; I827-A850 VanDerWaalsContact CA-O 3.32Å; I827-A850 WeakPolarHBondContact CA-O 3.33Å; I828-A850 PolarHBondContact N-O 2.91Å; A850-F880 CarbonylContact C-O 3.49Å; A850-F880 VanDerWaalsContact CA-O 3.27Å; A850-F880 WeakPolarHBondContact CA-O 3.34Å; A850-F880 HydrophobicContact CB-CB 3.68Å; A850-F880 HydrophobicContact CB-CD1 4.23Å; A850-F880 HydrophobicContact CB-CG 4.35Å
851	T	94.9	Very high	91.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142.4	168.4	178.2	0	0	0	0	110.8	I828 L853 I860 F880 D881 L888 A889 I891	I828-T851 VanDerWaalsContact O-CA 3.32Å; I828-T851 WeakPolarHBondContact O-CA 3.38Å; I828-T851 PolarHBondContact O-OG1 2.98Å; T851-L853 WeakPolarHBondContact OG1-CB 3.3Å; T851-L853 PolarHBondContact OG1-N 3.19Å; T851-I860 HydrophobicContact CG2-CD1 4.44Å; T851-I860 VanDerWaalsContact OG1-CD1 3.32Å; T851-I860 WeakPolarHBondContact OG1-CD1 3.37Å; T851-F880 WeakPolarHBondContact CG2-O 3.45Å; T851-F880 PolarHBondContact N-O 2.97Å; T851-D881 HydrophobicContact CG2-CB 4.17Å; T851-L888 HydrophobicContact CG2-CB 4.02Å; T851-L888 HydrophobicContact CG2-CD1 4.36Å; T851-A889 WeakPolarHBondContact CG2-O 3.34Å; T851-I891 HydrophobicContact CG2-CD1 4.04Å; T851-I891 HydrophobicContact CG2-CG1 4.12Å
852	D	91.5	Very high	91.2	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.158	C	C	.	.			trans	-113.1	11	170.4	-177.3	34	0	0	0	110.6	R753 R755 T820 L821 I827 I828 T829 N854	R753-D852 IonicContact NH1-OD2 3.17Å; R753-D852 PolarHBondContact NH1-OD2 3.31Å; R755-D852 IonicContact CZ-OD1 2.91Å; R755-D852 IonicContact CZ-OD2 3.44Å; R755-D852 PolarHBondContact NH1-O 3.36Å; R755-D852 VanDerWaalsContact NH1-O 3.09Å; R755-D852 IonicContact NH1-OD1 3.24Å; R755-D852 PolarHBondContact NH1-OD1 2.79Å; R755-D852 IonicContact NH1-OD2 3.62Å; R755-D852 PolarHBondContact NH1-OD2 3.17Å; T820-D852 VanDerWaalsContact CA-OD1 3.27Å; T820-D852 WeakPolarHBondContact CA-OD1 3.08Å; T820-D852 VanDerWaalsContact CB-OD1 3.27Å; T820-D852 WeakPolarHBondContact CB-OD1 3.15Å; L821-D852 WeakPolarHBondContact CD2-OD2 3.27Å; L821-D852 PolarHBondContact N-OD1 3.12Å; I827-D852 HydrophobicContact CG2-CB 3.9Å; I828-D852 PolarHBondContact O-N 2.85Å; T829-D852 HydrophobicContact CG2-CB 4.15Å; D852-N854 PolarHBondContact O-N 3.11Å; D852-N854 VanDerWaalsContact O-N 3.17Å
853	L	91.1	Very high	91.2	Very high	11.75 Å²	11.75	34.8 Å²	34.8	6%	0.062	17%	0.174	C	C	.	.			trans	-80.3	101.6	176.5	179.3	58	0	0	0	109.4	E789 T851 E855 L858 I860 L888 A889	E789-L853 HydrophobicContact CB-CD1 4.41Å; E789-L853 HydrophobicContact CG-CD1 3.93Å; E789-L853 HydrophobicContact CG-CD2 4.47Å; T851-L853 WeakPolarHBondContact OG1-CB 3.3Å; T851-L853 PolarHBondContact OG1-N 3.19Å; L853-E855 HydrophobicContact CD1-CB 4.1Å; L853-E855 HydrophobicContact CD1-CG 4.05Å; L853-E855 HydrophobicContact CG-CB 4.08Å; L853-E855 HydrophobicContact CG-CG 4.44Å; L853-E855 PolarHBondContact O-N 3.05Å; L853-L858 HydrophobicContact CD1-CD1 4.48Å; L853-L858 HydrophobicContact CD2-CB 4.11Å; L853-L858 HydrophobicContact CD2-CD1 4.03Å; L853-I860 HydrophobicContact CB-CD1 4.37Å; L853-I860 HydrophobicContact CD2-CD1 4.38Å; L853-I860 HydrophobicContact CD2-CG1 4.39Å; L853-L888 WeakPolarHBondContact O-CA 3.33Å; L853-A889 HydrophobicContact CB-CB 4.08Å; L853-A889 HydrophobicContact CD2-CB 3.85Å; L853-A889 HydrophobicContact CG-CB 4.01Å; L853-A889 PolarHBondContact O-N 2.95Å
854	N	88	Confident	91.3	Very high	42 Å²	42	32.3 Å²	32.3	23%	0.225	16%	0.16	C	C	.	.			trans	-78.9	51.2	178.9	-148	35.3	0	0	0	112.4	T820 D852 S887 L888 K1240	T820-N854 VanDerWaalsContact CG2-ND2 3.27Å; T820-N854 WeakPolarHBondContact CG2-ND2 3.27Å; D852-N854 PolarHBondContact O-N 3.11Å; D852-N854 VanDerWaalsContact O-N 3.17Å; N854-S887 CarbonylContact C-O 3.42Å; N854-S887 VanDerWaalsContact OD1-CB 3.28Å; N854-S887 WeakPolarHBondContact OD1-CB 3.44Å; N854-S887 PolarHBondContact OD1-O 3.11Å; N854-S887 PolarHBondContact OD1-OG 3.1Å; N854-S887 VanDerWaalsContact OD1-OG 3.08Å; N854-L888 WeakPolarHBondContact OD1-CD2 3.46Å; N854-K1240 WeakPolarHBondContact ND2-CE 3Å
855	E	86.8	Confident	91.4	Very high	49.25 Å²	49.25	26.2 Å²	26.2	23%	0.23	13%	0.132	C	C	.	.			trans	-135.8	93.6	177.9	-71.4	-86.4	169.4	0	0	108.9	L853 A857 L858 S887 A889 R1243	L853-E855 HydrophobicContact CD1-CB 4.1Å; L853-E855 HydrophobicContact CD1-CG 4.05Å; L853-E855 HydrophobicContact CG-CB 4.08Å; L853-E855 HydrophobicContact CG-CG 4.44Å; L853-E855 PolarHBondContact O-N 3.05Å; E855-A857 PolarHBondContact O-N 2.95Å; E855-A857 VanDerWaalsContact O-N 3.15Å; E855-L858 HydrophobicContact CB-CB 4.37Å; E855-L858 HydrophobicContact CB-CD1 3.78Å; E855-L858 HydrophobicContact CB-CG 4.04Å; E855-L858 HydrophobicContact CG-CD1 4.23Å; E855-L858 PolarHBondContact O-N 2.99Å; E855-L858 VanDerWaalsContact O-N 3.13Å; E855-S887 PolarHBondContact N-O 3.19Å; E855-A889 VanDerWaalsContact O-CA 3.29Å; E855-A889 WeakPolarHBondContact O-CA 3.28Å; E855-A889 WeakPolarHBondContact O-CB 3.33Å; E855-A889 PolarHBondContact O-N 3.49Å; E855-R1243 VanDerWaalsContact CD-NH2 3.3Å; E855-R1243 IonicContact OE1-CZ 3.41Å; E855-R1243 IonicContact OE1-NE 3.48Å; E855-R1243 PolarHBondContact OE1-NE 2.85Å; E855-R1243 IonicContact OE1-NH1 2.78Å; E855-R1243 IonicContact OE1-NH2 3.02Å; E855-R1243 PolarHBondContact OE1-NH2 3.13Å; E855-R1243 IonicContact OE2-CZ 3.2Å; E855-R1243 VanDerWaalsContact OE2-CZ 3.28Å; E855-R1243 IonicContact OE2-NE 3.08Å; E855-R1243 PolarHBondContact OE2-NE 3.39Å; E855-R1243 IonicContact OE2-NH2 3.29Å; E855-R1243 PolarHBondContact OE2-NH2 3.13Å
856	H	86.5	Confident	91.5	Very high	2.75 Å²	2.75	26.6 Å²	26.6	1%	0.013	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-17.1	-172.4	63.7	-8.1	0	0	0	115.2	Q882 Y886 S887 L888 D1244 S1247 W1248	H856-Q882 PolarHBondContact O-NE2 3.08Å; H856-Q882 VanDerWaalsContact O-NE2 3.1Å; H856-Y886 WeakPolarHBondContact CB-O 3.3Å; H856-S887 PolarHBondContact N-O 2.96Å; H856-L888 WeakPolarHBondContact CA-O 3.38Å; H856-D1244 IonicContact CD2-OD1 3.93Å; H856-D1244 PolarHBondContact CD2-OD1 3.23Å; H856-D1244 PolarHBondContact CE1-O 3.24Å; H856-D1244 VanDerWaalsContact CE1-O 3.24Å; H856-D1244 IonicContact CE1-OD1 2.71Å; H856-D1244 PolarHBondContact CE1-OD1 3.3Å; H856-D1244 IonicContact ND1-OD1 3.14Å; H856-D1244 PolarHBondContact ND1-OD1 3.08Å; H856-D1244 VanDerWaalsContact ND1-OD1 3.09Å; H856-D1244 PolarHBondContact NE2-O 2.87Å; H856-D1244 IonicContact NE2-OD1 2.74Å; H856-D1244 PolarHBondContact NE2-OD1 2.92Å; H856-S1247 PolarHBondContact CE1-OG 2.9Å; H856-S1247 PolarHBondContact NE2-OG 3.22Å; H856-S1247 VanDerWaalsContact NE2-OG 3.15Å; H856-W1248 HydrophobicContact CB-CH2 4.01Å; H856-W1248 HydrophobicContact CB-CZ2 4.17Å; H856-W1248 HydrophobicContact CB-CZ3 4.38Å; H856-W1248 AromaticContact CD2-CD2 3.27Å; H856-W1248 AromaticContact CD2-CE2 3.49Å; H856-W1248 AromaticContact CD2-CE3 3.33Å; H856-W1248 AromaticContact CD2-CG 3.96Å; H856-W1248 AromaticContact CD2-CH2 3.45Å; H856-W1248 WeakPolarHBondContact CD2-CH2 3.24Å; H856-W1248 AromaticContact CD2-CZ2 3.47Å; H856-W1248 VanDerWaalsContact CD2-CZ2 3.49Å; H856-W1248 WeakPolarHBondContact CD2-CZ2 3.31Å; H856-W1248 AromaticContact CD2-CZ3 3.45Å; H856-W1248 VanDerWaalsContact CD2-CZ3 3.45Å; H856-W1248 WeakPolarHBondContact CD2-CZ3 3.38Å; H856-W1248 AromaticContact CD2-NE1 3.78Å; H856-W1248 AromaticContact CE1-CD1 3.84Å; H856-W1248 AromaticContact CE1-CD2 3.51Å; H856-W1248 AromaticContact CE1-CE2 3.52Å; H856-W1248 VanDerWaalsContact CE1-CE2 3.47Å; H856-W1248 AromaticContact CE1-CE3 3.47Å; H856-W1248 VanDerWaalsContact CE1-CE3 3.47Å; H856-W1248 AromaticContact CE1-CG 3.61Å; H856-W1248 AromaticContact CE1-CH2 3.97Å; H856-W1248 AromaticContact CE1-CZ2 3.82Å; H856-W1248 AromaticContact CE1-CZ3 3.86Å; H856-W1248 AromaticContact CE1-NE1 3.56Å; H856-W1248 PolarHBondContact CE1-NE1 2.92Å; H856-W1248 AromaticContact CG-CE2 3.82Å; H856-W1248 AromaticContact CG-CH2 3.71Å; H856-W1248 AromaticContact CG-CZ2 3.62Å; H856-W1248 AromaticContact CG-CZ3 3.89Å; H856-W1248 AromaticContact ND1-CD2 3.62Å; H856-W1248 AromaticContact ND1-CE2 3.8Å; H856-W1248 AromaticContact ND1-CE3 3.39Å; H856-W1248 AromaticContact ND1-CH2 3.6Å; H856-W1248 AromaticContact ND1-CZ2 3.79Å; H856-W1248 AromaticContact ND1-CZ3 3.39Å; H856-W1248 WeakPolarHBondContact ND1-CZ3 3.33Å; H856-W1248 AromaticContact ND1-NE1 3.99Å; H856-W1248 AromaticContact NE2-CD1 3.44Å; H856-W1248 AromaticContact NE2-CD2 3.33Å; H856-W1248 AromaticContact NE2-CE2 3.24Å; H856-W1248 AromaticContact NE2-CE3 3.65Å; H856-W1248 AromaticContact NE2-CG 3.32Å; H856-W1248 VanDerWaalsContact NE2-CG 3.32Å; H856-W1248 AromaticContact NE2-CZ2 3.72Å; H856-W1248 PolarHBondContact NE2-N 3.13Å; H856-W1248 AromaticContact NE2-NE1 3.4Å; H856-W1248 PolarHBondContact NE2-NE1 2.82Å
857	A	83.4	Confident	91.5	Very high	23.75 Å²	23.75	21.1 Å²	21.1	20%	0.196	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-16.1	177.5	0	0	0	0	0	113.2	E855 S1247	E855-A857 PolarHBondContact O-N 2.95Å; E855-A857 VanDerWaalsContact O-N 3.15Å; A857-S1247 WeakPolarHBondContact CB-O 3.28Å
858	L	86.9	Confident	91.2	Very high	49.25 Å²	49.25	21.8 Å²	21.8	26%	0.258	12%	0.12	S	C	.	.			trans	-89.4	153.7	-179.6	-63	179.2	0	0	0	111.2	E789 L853 E855 A889 K890	E789-L858 HydrophobicContact CG-CD1 3.83Å; E789-L858 WeakPolarHBondContact OE1-CD1 3.5Å; E789-L858 VanDerWaalsContact OE2-CD1 3.23Å; E789-L858 WeakPolarHBondContact OE2-CD1 3.31Å; L853-L858 HydrophobicContact CD1-CD1 4.48Å; L853-L858 HydrophobicContact CD2-CB 4.11Å; L853-L858 HydrophobicContact CD2-CD1 4.03Å; E855-L858 HydrophobicContact CB-CB 4.37Å; E855-L858 HydrophobicContact CB-CD1 3.78Å; E855-L858 HydrophobicContact CB-CG 4.04Å; E855-L858 HydrophobicContact CG-CD1 4.23Å; E855-L858 PolarHBondContact O-N 2.99Å; E855-L858 VanDerWaalsContact O-N 3.13Å; L858-A889 HydrophobicContact CB-CB 4.39Å; L858-A889 WeakPolarHBondContact O-CA 3.33Å; L858-A889 VanDerWaalsContact O-CB 3.32Å; L858-A889 WeakPolarHBondContact O-CB 3.29Å; L858-K890 PolarHBondContact O-N 3.04Å; L858-K890 VanDerWaalsContact O-N 3.07Å
859	V	90	Very high	90.8	Very high	71 Å²	71	23.2 Å²	23.2	43%	0.43	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130.8	179.7	-175.5	0	0	0	0	109	K890 N892	V859-K890 CarbonylContact C-O 3.56Å; V859-K890 WeakPolarHBondContact CA-O 3.3Å; V859-K890 HydrophobicContact CG2-CB 4.4Å; V859-N892 HydrophobicContact CG1-CB 3.74Å
860	I	93.3	Very high	90.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.7	175	-65.6	164	0	0	0	108.8	I828 T851 L853 A862 A889 K890 I891 N892	I828-I860 HydrophobicContact CB-CD1 4.12Å; I828-I860 HydrophobicContact CD1-CG2 3.66Å; I828-I860 HydrophobicContact CG2-CD1 3.91Å; I828-I860 HydrophobicContact CG2-CG1 4.39Å; I828-I860 HydrophobicContact CG2-CG2 3.99Å; T851-I860 HydrophobicContact CG2-CD1 4.44Å; T851-I860 VanDerWaalsContact OG1-CD1 3.32Å; T851-I860 WeakPolarHBondContact OG1-CD1 3.37Å; L853-I860 HydrophobicContact CB-CD1 4.37Å; L853-I860 HydrophobicContact CD2-CD1 4.38Å; L853-I860 HydrophobicContact CD2-CG1 4.39Å; I860-A862 PolarHBondContact O-N 3.01Å; I860-A889 HydrophobicContact CD1-CB 4.23Å; I860-A889 HydrophobicContact CG1-CB 4.46Å; I860-K890 PolarHBondContact N-O 2.82Å; I860-I891 HydrophobicContact CB-CG1 4.44Å; I860-I891 HydrophobicContact CD1-CG1 4.44Å; I860-N892 PolarHBondContact O-N 3.07Å
861	D	93.7	Very high	89.9	Confident	26.5 Å²	26.5	29.8 Å²	29.8	14%	0.142	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	103.4	179.2	-168.6	-17.6	0	0	0	111.2	I835 R836 R863	I835-D861 PolarHBondContact N-O 3.05Å; R836-D861 IonicContact CZ-OD2 3.09Å; R836-D861 IonicContact NE-OD1 3.52Å; R836-D861 IonicContact NE-OD2 3.23Å; R836-D861 PolarHBondContact NE-OD2 2.83Å; R836-D861 IonicContact NH2-OD1 2.93Å; R836-D861 IonicContact NH2-OD2 3.32Å; R836-D861 PolarHBondContact NH2-OD2 3.07Å; D861-R863 WeakPolarHBondContact OD1-CB 3.32Å; D861-R863 VanDerWaalsContact OD1-CG 3.31Å; D861-R863 WeakPolarHBondContact OD1-CG 3.4Å; D861-R863 IonicContact OD1-CZ 3.11Å; D861-R863 PolarHBondContact OD1-N 3.2Å; D861-R863 IonicContact OD1-NE 3.41Å; D861-R863 PolarHBondContact OD1-NE 2.99Å; D861-R863 IonicContact OD1-NH2 3.55Å; D861-R863 IonicContact OD2-CZ 3.5Å; D861-R863 IonicContact OD2-NE 3.18Å; D861-R863 PolarHBondContact OD2-NE 2.82Å; D861-R863 IonicContact OD2-NH2 3.21Å; D861-R863 PolarHBondContact OD2-NH2 2.86Å
862	A	95	Very high	89.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.18	C	C	.	.			trans	-120.4	33.2	176.5	0	0	0	0	0	112.1	I835 I849 I860 N865 Y867 I891 N892 V893	I835-A862 HydrophobicContact CB-CB 4.39Å; I835-A862 CarbonylContact O-C 3.45Å; I835-A862 VanDerWaalsContact O-CA 3.27Å; I835-A862 WeakPolarHBondContact O-CA 3.32Å; I849-A862 HydrophobicContact CD1-CB 4.11Å; I860-A862 PolarHBondContact O-N 3.01Å; A862-N865 PolarHBondContact O-ND2 3.02Å; A862-Y867 PolarHBondContact O-OH 2.87Å; A862-Y867 VanDerWaalsContact O-OH 3.05Å; A862-I891 HydrophobicContact CB-CG2 3.58Å; A862-N892 CarbonylContact C-O 3.55Å; A862-N892 VanDerWaalsContact CA-O 3.27Å; A862-N892 WeakPolarHBondContact CA-O 3.39Å; A862-N892 PolarHBondContact N-O 3.05Å; A862-V893 HydrophobicContact CB-CG1 4.3Å
863	R	92.9	Very high	89.4	Confident	84.75 Å²	84.75	33.9 Å²	33.9	32%	0.32	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	163	-179.3	-62.2	179.9	-71.5	177.8	-6.7	112.4	R836 D861 N865 N892 D894	R836-R863 WeakPolarHBondContact CA-O 3.37Å; R836-R863 WeakPolarHBondContact CG-O 3.29Å; R836-R863 VanDerWaalsContact NH2-NH2 3.17Å; D861-R863 WeakPolarHBondContact OD1-CB 3.32Å; D861-R863 VanDerWaalsContact OD1-CG 3.31Å; D861-R863 WeakPolarHBondContact OD1-CG 3.4Å; D861-R863 IonicContact OD1-CZ 3.11Å; D861-R863 PolarHBondContact OD1-N 3.2Å; D861-R863 IonicContact OD1-NE 3.41Å; D861-R863 PolarHBondContact OD1-NE 2.99Å; D861-R863 IonicContact OD1-NH2 3.55Å; D861-R863 IonicContact OD2-CZ 3.5Å; D861-R863 IonicContact OD2-NE 3.18Å; D861-R863 PolarHBondContact OD2-NE 2.82Å; D861-R863 IonicContact OD2-NH2 3.21Å; D861-R863 PolarHBondContact OD2-NH2 2.86Å; R863-N865 PolarHBondContact O-N 3.33Å; R863-N865 VanDerWaalsContact O-N 3.13Å; R863-N865 PolarHBondContact O-ND2 2.95Å; R863-N892 PolarHBondContact N-O 3Å; R863-D894 WeakPolarHBondContact CD-O 3.28Å; R863-D894 VanDerWaalsContact CG-O 3.24Å; R863-D894 WeakPolarHBondContact CG-O 3.39Å
864	E	92.1	Very high	89.3	Confident	40.5 Å²	40.5	37 Å²	37	19%	0.189	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	21.2	175.8	-53.6	178.9	-168.3	0	0	114.6	R837 P895 I907	R837-E864 WeakPolarHBondContact CA-O 3.35Å; R837-E864 HydrophobicContact CG-CB 4.11Å; R837-E864 IonicContact CZ-OE2 3.29Å; R837-E864 PolarHBondContact N-O 3.09Å; R837-E864 IonicContact NE-OE2 3.01Å; R837-E864 PolarHBondContact NE-OE2 3.11Å; R837-E864 IonicContact NH2-OE2 2.87Å; R837-E864 PolarHBondContact NH2-OE2 3Å; E864-P895 PolarHBondContact N-O 3.09Å; E864-I907 HydrophobicContact CB-CD1 3.97Å; E864-I907 HydrophobicContact CG-CD1 4.13Å
865	N	93	Very high	89.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.211	C	C	.	.			trans	-94.5	153.3	175.1	-63.1	-60.7	0	0	0	111.7	I835 R836 R837 N838 F840 A862 R863 Y867 A897	I835-N865 WeakPolarHBondContact CG2-ND2 3.33Å; I835-N865 PolarHBondContact O-ND2 2.94Å; R836-N865 VanDerWaalsContact C-OD1 3.22Å; R836-N865 WeakPolarHBondContact CA-OD1 3.32Å; R837-N865 PolarHBondContact N-OD1 3.05Å; R837-N865 VanDerWaalsContact N-OD1 3.09Å; N838-N865 WeakPolarHBondContact CB-OD1 3.39Å; N838-N865 PolarHBondContact N-OD1 2.9Å; N838-N865 PolarHBondContact ND2-OD1 3Å; F840-N865 HydrophobicContact CD2-CB 4.22Å; F840-N865 HydrophobicContact CE2-CB 3.9Å; A862-N865 PolarHBondContact O-ND2 3.02Å; R863-N865 PolarHBondContact O-N 3.33Å; R863-N865 VanDerWaalsContact O-N 3.13Å; R863-N865 PolarHBondContact O-ND2 2.95Å; N865-Y867 HydrophobicContact CB-CE2 3.92Å; N865-A897 PolarHBondContact O-N 3Å
866	N	92.8	Very high	89.7	Confident	11.75 Å²	11.75	33.4 Å²	33.4	6%	0.063	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-97	127.1	170.5	179	-98.6	0	0	0	109.9	N838 F840 G868 A897 A898 C900	N838-N866 PolarHBondContact O-N 3.22Å; F840-N866 PolarHBondContact N-O 3.03Å; N866-G868 PolarHBondContact OD1-N 2.87Å; N866-G868 VanDerWaalsContact OD1-N 3.15Å; N866-A897 WeakPolarHBondContact CA-O 3.41Å; N866-A897 HydrophobicContact CB-CB 4.25Å; N866-A897 WeakPolarHBondContact CB-O 3.29Å; N866-A897 PolarHBondContact ND2-O 3.03Å; N866-A898 VanDerWaalsContact ND2-C 3.34Å; N866-A898 PolarHBondContact ND2-O 3.06Å; N866-A898 VanDerWaalsContact ND2-O 3.15Å; N866-C900 HydrophobicContact CB-CB 4.1Å
867	Y	91.6	Very high	89.9	Confident	7 Å²	7	36.1 Å²	36.1	3%	0.027	21%	0.213	C	C	.	.			trans	-106.9	28.4	-179.2	-62.3	-82	0	0	0	112.6	F840 I849 A862 N865 S869 F875 V893	F840-Y867 HydrophobicContact CB-CD1 4.37Å; F840-Y867 AromaticContact CD2-CD1 3.88Å; F840-Y867 HydrophobicContact CD2-CD1 4Å; F840-Y867 AromaticContact CD2-CE1 3.88Å; F840-Y867 HydrophobicContact CD2-CE1 3.88Å; F840-Y867 HydrophobicContact CE2-CE1 4.36Å; F840-Y867 HydrophobicContact CG-CD1 4.46Å; F840-Y867 CarbonylContact O-C 3.51Å; F840-Y867 WeakPolarHBondContact O-CA 3.39Å; I849-Y867 HydrophobicContact CB-CE1 4.5Å; I849-Y867 HydrophobicContact CD1-CE1 3.78Å; I849-Y867 HydrophobicContact CG1-CE1 4.11Å; I849-Y867 HydrophobicContact CG2-CE1 4.03Å; A862-Y867 PolarHBondContact O-OH 2.87Å; A862-Y867 VanDerWaalsContact O-OH 3.05Å; N865-Y867 HydrophobicContact CB-CE2 3.92Å; Y867-S869 PolarHBondContact O-N 2.93Å; Y867-S869 VanDerWaalsContact O-N 3.13Å; Y867-F875 VanDerWaalsContact CB-CG 3.48Å; Y867-F875 HydrophobicContact CD1-CD2 4.26Å; Y867-F875 AromaticContact CD2-CD2 3.84Å; Y867-F875 HydrophobicContact CD2-CD2 3.84Å; Y867-F875 AromaticContact CD2-CE2 3.62Å; Y867-F875 HydrophobicContact CD2-CE2 3.62Å; Y867-F875 HydrophobicContact CD2-CG 4.45Å; Y867-F875 HydrophobicContact CD2-CZ 4.12Å; Y867-F875 HydrophobicContact CE2-CE2 4.23Å; Y867-F875 AromaticContact CG-CD2 3.66Å; Y867-F875 HydrophobicContact CG-CD2 3.66Å; Y867-F875 AromaticContact CG-CE2 3.92Å; Y867-F875 HydrophobicContact CG-CE2 3.96Å; Y867-F875 HydrophobicContact CG-CG 4.17Å; Y867-V893 HydrophobicContact CE2-CB 4.03Å; Y867-V893 HydrophobicContact CE2-CG1 4.11Å; Y867-V893 VanDerWaalsContact OH-CG1 3.29Å; Y867-V893 WeakPolarHBondContact OH-CG1 3.39Å
868	G	87.2	Confident	90.4	Very high	32.5 Å²	32.5	37.1 Å²	37.1	34%	0.335	21%	0.213	S	C	.	.	S	Bend	trans	78.8	-9.6	175.6	0	0	0	0	0	116	F840 N866	F840-G868 WeakPolarHBondContact O-CA 3.36Å; F840-G868 PolarHBondContact O-N 3.05Å; F840-G868 VanDerWaalsContact O-N 3.14Å; N866-G868 PolarHBondContact OD1-N 2.87Å; N866-G868 VanDerWaalsContact OD1-N 3.15Å
869	S	86	Confident	90.8	Very high	32.5 Å²	32.5	34.8 Å²	34.8	23%	0.227	20%	0.201	C	C	.	.			trans	-143.2	149.8	176.9	178.3	0	0	0	0	111.1	Y867 V871 T874	Y867-S869 PolarHBondContact O-N 2.93Å; Y867-S869 VanDerWaalsContact O-N 3.13Å; S869-V871 VanDerWaalsContact C-N 3.31Å; S869-V871 PolarHBondContact OG-N 3.04Å; S869-V871 VanDerWaalsContact OG-N 3.08Å; S869-T874 WeakPolarHBondContact CB-OG1 3.31Å; S869-T874 PolarHBondContact OG-OG1 3.1Å
870	S	83.5	Confident	91	Very high	71.75 Å²	71.75	31.8 Å²	31.8	50%	0.502	18%	0.182	S	C	.	.	S	Bend	trans	-82.8	-9.5	171.5	55.9	0	0	0	0	113	Y896	S870-Y896 PolarHBondContact O-OH 2.97Å
871	V	87.7	Confident	91.1	Very high	68.75 Å²	68.75	32 Å²	32	42%	0.417	18%	0.183	S	C	.	.			trans	-100.7	117.4	-175.1	-175.3	0	0	0	0	110.2	S869 S873 T874 F875	S869-V871 VanDerWaalsContact C-N 3.31Å; S869-V871 PolarHBondContact OG-N 3.04Å; S869-V871 VanDerWaalsContact OG-N 3.08Å; V871-S873 VanDerWaalsContact C-N 3.31Å; V871-S873 VanDerWaalsContact CG1-OG 3.31Å; V871-S873 WeakPolarHBondContact CG1-OG 3.43Å; V871-S873 PolarHBondContact O-N 3.25Å; V871-T874 HydrophobicContact CB-CG2 4.22Å; V871-T874 HydrophobicContact CG1-CG2 4.33Å; V871-T874 PolarHBondContact O-N 3.01Å; V871-T874 VanDerWaalsContact O-N 3.1Å; V871-T874 PolarHBondContact O-OG1 2.97Å; V871-F875 WeakPolarHBondContact O-CD1 3.4Å
872	P	89.3	Confident	91.1	Very high	21.75 Å²	21.75	31.4 Å²	31.4	14%	0.141	18%	0.18	C	C	.	.	H	α-helix	trans	-55.8	-37	-176.7	-30.1	37.2	0	0	0	115.5	T874 F875 M876 Y896 L910 F913	P872-T874 PolarHBondContact O-N 2.92Å; P872-T874 VanDerWaalsContact O-N 3.11Å; P872-F875 HydrophobicContact CB-CE1 4.43Å; P872-F875 PolarHBondContact O-N 2.92Å; P872-M876 HydrophobicContact CB-CE 4.45Å; P872-M876 VanDerWaalsContact O-CB 3.26Å; P872-M876 WeakPolarHBondContact O-CB 3.35Å; P872-M876 PolarHBondContact O-N 3.02Å; P872-Y896 WeakPolarHBondContact CD-OH 2.93Å; P872-Y896 HydrophobicContact CG-CE1 4.36Å; P872-Y896 WeakPolarHBondContact CG-OH 3.34Å; P872-L910 HydrophobicContact CB-CD1 3.97Å; P872-L910 HydrophobicContact CB-CD2 3.78Å; P872-L910 HydrophobicContact CG-CD1 4.04Å; P872-L910 HydrophobicContact CG-CD2 3.64Å; P872-F913 HydrophobicContact CB-CB 4.08Å; P872-F913 HydrophobicContact CB-CD1 3.62Å; P872-F913 HydrophobicContact CB-CD2 3.82Å; P872-F913 HydrophobicContact CB-CE1 3.98Å; P872-F913 HydrophobicContact CB-CE2 4.16Å; P872-F913 HydrophobicContact CB-CG 3.53Å; P872-F913 VanDerWaalsContact CB-CG 3.5Å; P872-F913 HydrophobicContact CB-CZ 4.23Å; P872-F913 HydrophobicContact CG-CB 4.37Å; P872-F913 HydrophobicContact CG-CG 4.32Å
873	S	87.4	Confident	91	Very high	64.25 Å²	64.25	31.7 Å²	31.7	45%	0.449	18%	0.181	S	C	.	.	H	α-helix	trans	-61.7	-23.6	-178.4	58.2	0	0	0	0	113.9	V871	V871-S873 VanDerWaalsContact C-N 3.31Å; V871-S873 VanDerWaalsContact CG1-OG 3.31Å; V871-S873 WeakPolarHBondContact CG1-OG 3.43Å; V871-S873 PolarHBondContact O-N 3.25Å
874	T	87.8	Confident	91	Very high	77 Å²	77	28.8 Å²	28.8	47%	0.472	17%	0.171	S	C	.	.	H	α-helix	trans	-83.3	-28.3	-177.6	61.2	0	0	0	0	113.5	S869 V871 P872	S869-T874 WeakPolarHBondContact CB-OG1 3.31Å; S869-T874 PolarHBondContact OG-OG1 3.1Å; V871-T874 HydrophobicContact CB-CG2 4.22Å; V871-T874 HydrophobicContact CG1-CG2 4.33Å; V871-T874 PolarHBondContact O-N 3.01Å; V871-T874 VanDerWaalsContact O-N 3.1Å; V871-T874 PolarHBondContact O-OG1 2.97Å; P872-T874 PolarHBondContact O-N 2.92Å; P872-T874 VanDerWaalsContact O-N 3.11Å
875	F	90.8	Very high	91.1	Very high	4.25 Å²	4.25	27.3 Å²	27.3	2%	0.019	16%	0.163	C	C	.	.	H	α-helix	trans	-114.6	-25.4	-174.5	76.3	-99.4	0	0	0	114.1	Y867 V871 P872 Y877 K878 I879 V893 Y896 L910	Y867-F875 VanDerWaalsContact CB-CG 3.48Å; Y867-F875 HydrophobicContact CD1-CD2 4.26Å; Y867-F875 AromaticContact CD2-CD2 3.84Å; Y867-F875 HydrophobicContact CD2-CD2 3.84Å; Y867-F875 AromaticContact CD2-CE2 3.62Å; Y867-F875 HydrophobicContact CD2-CE2 3.62Å; Y867-F875 HydrophobicContact CD2-CG 4.45Å; Y867-F875 HydrophobicContact CD2-CZ 4.12Å; Y867-F875 HydrophobicContact CE2-CE2 4.23Å; Y867-F875 AromaticContact CG-CD2 3.66Å; Y867-F875 HydrophobicContact CG-CD2 3.66Å; Y867-F875 AromaticContact CG-CE2 3.92Å; Y867-F875 HydrophobicContact CG-CE2 3.96Å; Y867-F875 HydrophobicContact CG-CG 4.17Å; V871-F875 WeakPolarHBondContact O-CD1 3.4Å; P872-F875 HydrophobicContact CB-CE1 4.43Å; P872-F875 PolarHBondContact O-N 2.92Å; F875-Y877 VanDerWaalsContact C-N 3.25Å; F875-Y877 PolarHBondContact O-N 3.04Å; F875-K878 WeakPolarHBondContact O-CA 3.32Å; F875-K878 WeakPolarHBondContact O-CB 3.25Å; F875-K878 PolarHBondContact O-N 2.97Å; F875-I879 HydrophobicContact CD2-CD1 4.24Å; F875-I879 HydrophobicContact CE2-CD1 4.34Å; F875-V893 HydrophobicContact CE2-CG2 4.44Å; F875-Y896 HydrophobicContact CE1-CD2 4.14Å; F875-Y896 AromaticContact CE1-CE2 3.9Å; F875-Y896 HydrophobicContact CE1-CE2 4.04Å; F875-Y896 HydrophobicContact CZ-CD1 4.33Å; F875-Y896 AromaticContact CZ-CD2 3.97Å; F875-Y896 HydrophobicContact CZ-CD2 4.12Å; F875-Y896 HydrophobicContact CZ-CE1 4.46Å; F875-Y896 HydrophobicContact CZ-CE2 4.29Å; F875-Y896 HydrophobicContact CZ-CG 4.12Å; F875-L910 HydrophobicContact CZ-CD1 4.42Å
876	M	92.5	Very high	91.1	Very high	11.5 Å²	11.5	28.1 Å²	28.1	6%	0.057	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-64.3	-29.4	-173.4	-162.5	66.1	64.9	0	0	113.2	P872 K878 I879 V893 L910 F913 R915	P872-M876 HydrophobicContact CB-CE 4.45Å; P872-M876 VanDerWaalsContact O-CB 3.26Å; P872-M876 WeakPolarHBondContact O-CB 3.35Å; P872-M876 PolarHBondContact O-N 3.02Å; M876-K878 VanDerWaalsContact C-N 3.28Å; M876-K878 PolarHBondContact O-N 2.87Å; M876-I879 PolarHBondContact O-N 3.26Å; M876-I879 HydrophobicContact SD-CD1 3.72Å; M876-V893 HydrophobicContact CE-CG2 3.72Å; M876-V893 HydrophobicContact SD-CG2 3.96Å; M876-L910 HydrophobicContact CE-CD1 3.34Å; M876-L910 VanDerWaalsContact CE-CD1 3.48Å; M876-L910 HydrophobicContact CE-CD2 3.83Å; M876-L910 HydrophobicContact CE-CG 4.22Å; M876-F913 HydrophobicContact CB-CD1 4.44Å; M876-F913 HydrophobicContact CB-CE1 3.65Å; M876-F913 HydrophobicContact CB-CZ 4.21Å; M876-F913 HydrophobicContact CE-CD1 4.39Å; M876-F913 HydrophobicContact CE-CE1 4.37Å; M876-F913 HydrophobicContact CG-CD1 4.37Å; M876-F913 HydrophobicContact CG-CE1 3.79Å; M876-R915 HydrophobicContact CB-CG 4.18Å; M876-R915 HydrophobicContact CG-CG 3.45Å; M876-R915 VanDerWaalsContact CG-CG 3.45Å; M876-R915 WeakPolarHBondContact O-CD 3.49Å
877	Y	91.9	Very high	90.9	Very high	60 Å²	60	28.1 Å²	28.1	24%	0.235	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-77	-11.5	174.6	-69.7	-77.6	0	0	0	113.6	F875 I879 F883 F913 R915 R916	F875-Y877 VanDerWaalsContact C-N 3.25Å; F875-Y877 PolarHBondContact O-N 3.04Å; Y877-I879 VanDerWaalsContact C-N 3.3Å; Y877-F883 HydrophobicContact CE1-CE1 4.4Å; Y877-F883 HydrophobicContact CE1-CZ 4.49Å; Y877-F913 HydrophobicContact CE2-CZ 4.37Å; Y877-R915 HydrophobicContact CE1-CB 4.32Å; Y877-R915 HydrophobicContact CE1-CG 4.33Å; Y877-R916 PolarHBondContact OH-N 3.19Å; Y877-R916 VanDerWaalsContact OH-N 3.15Å; Y877-R916 PolarHBondContact OH-O 2.77Å
878	K	93.2	Very high	91	Very high	43.75 Å²	43.75	27.7 Å²	27.7	19%	0.19	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-89.6	11.1	171.9	-58.7	-168.1	90.3	-170.6	0	112.9	N842 I843 A845 E846 F847 E848 F875 M876	N842-K878 PolarHBondContact O-NZ 3.13Å; I843-K878 PolarHBondContact O-NZ 2.98Å; A845-K878 WeakPolarHBondContact O-CE 3.36Å; A845-K878 PolarHBondContact O-NZ 2.86Å; A845-K878 VanDerWaalsContact O-NZ 3.09Å; E846-K878 WeakPolarHBondContact O-CE 3.36Å; F847-K878 CarbonylContact C-O 3.57Å; F847-K878 VanDerWaalsContact CA-O 3.24Å; F847-K878 WeakPolarHBondContact CA-O 3.27Å; E848-K878 HydrophobicContact CG-CB 4.07Å; E848-K878 HydrophobicContact CG-CD 4.15Å; E848-K878 PolarHBondContact N-O 3.2Å; E848-K878 IonicContact OE1-NZ 2.84Å; E848-K878 PolarHBondContact OE1-NZ 3.14Å; F875-K878 WeakPolarHBondContact O-CA 3.32Å; F875-K878 WeakPolarHBondContact O-CB 3.25Å; F875-K878 PolarHBondContact O-N 2.97Å; M876-K878 VanDerWaalsContact C-N 3.28Å; M876-K878 PolarHBondContact O-N 2.87Å
879	I	94.8	Very high	91.2	Very high	1.5 Å²	1.5	26.2 Å²	26.2	1%	0.008	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.6	174.3	-60.7	173.9	0	0	0	108.3	I849 F875 M876 Y877 D881 I891 V893 R915	I849-I879 HydrophobicContact CG2-CB 4.26Å; I849-I879 HydrophobicContact CG2-CG1 3.86Å; I849-I879 HydrophobicContact CG2-CG2 3.96Å; I849-I879 WeakPolarHBondContact O-CA 3.27Å; F875-I879 HydrophobicContact CD2-CD1 4.24Å; F875-I879 HydrophobicContact CE2-CD1 4.34Å; M876-I879 PolarHBondContact O-N 3.26Å; M876-I879 HydrophobicContact SD-CD1 3.72Å; Y877-I879 VanDerWaalsContact C-N 3.3Å; I879-D881 HydrophobicContact CG2-CB 4.17Å; I879-I891 HydrophobicContact CG2-CB 4.22Å; I879-I891 HydrophobicContact CG2-CD1 4.02Å; I879-I891 HydrophobicContact CG2-CG2 4.46Å; I879-V893 HydrophobicContact CD1-CB 4.48Å; I879-V893 HydrophobicContact CD1-CG1 3.71Å; I879-V893 HydrophobicContact CD1-CG2 4.27Å; I879-R915 PolarHBondContact O-NH1 3.39Å
880	F	95	Very high	91.5	Very high	8.75 Å²	8.75	28.1 Å²	28.1	4%	0.038	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	98.3	177.7	-170.1	-88	0	0	0	110.4	P822 F847 I849 A850 T851 K884 R885 L888	P822-F880 HydrophobicContact CB-CD1 3.62Å; P822-F880 HydrophobicContact CB-CE1 3.72Å; P822-F880 HydrophobicContact CB-CG 4.18Å; P822-F880 HydrophobicContact CB-CZ 4.38Å; P822-F880 HydrophobicContact CG-CD1 3.91Å; P822-F880 HydrophobicContact CG-CE1 4.16Å; P822-F880 HydrophobicContact CG-CG 4.35Å; F847-F880 HydrophobicContact CB-CB 4.33Å; F847-F880 HydrophobicContact CD1-CB 3.9Å; F847-F880 HydrophobicContact CD1-CD2 4.41Å; F847-F880 HydrophobicContact CD2-CB 4.23Å; F847-F880 HydrophobicContact CD2-CD2 4.22Å; F847-F880 HydrophobicContact CD2-CG 4.46Å; F847-F880 HydrophobicContact CE1-CB 4.3Å; F847-F880 AromaticContact CE1-CD2 3.97Å; F847-F880 HydrophobicContact CE1-CD2 4.02Å; F847-F880 AromaticContact CE2-CD2 3.8Å; F847-F880 HydrophobicContact CE2-CD2 3.8Å; F847-F880 HydrophobicContact CE2-CE2 4.43Å; F847-F880 HydrophobicContact CE2-CG 4.45Å; F847-F880 HydrophobicContact CG-CB 3.87Å; F847-F880 AromaticContact CZ-CD2 3.7Å; F847-F880 HydrophobicContact CZ-CD2 3.7Å; F847-F880 HydrophobicContact CZ-CE2 4.4Å; I849-F880 PolarHBondContact O-N 3.24Å; A850-F880 CarbonylContact C-O 3.49Å; A850-F880 VanDerWaalsContact CA-O 3.27Å; A850-F880 WeakPolarHBondContact CA-O 3.34Å; A850-F880 HydrophobicContact CB-CB 3.68Å; A850-F880 HydrophobicContact CB-CD1 4.23Å; A850-F880 HydrophobicContact CB-CG 4.35Å; T851-F880 WeakPolarHBondContact CG2-O 3.45Å; T851-F880 PolarHBondContact N-O 2.97Å; F880-K884 HydrophobicContact CD2-CB 3.81Å; F880-K884 HydrophobicContact CD2-CD 4.47Å; F880-K884 HydrophobicContact CD2-CG 3.97Å; F880-K884 HydrophobicContact CE2-CB 3.92Å; F880-K884 HydrophobicContact CE2-CG 4.39Å; F880-K884 HydrophobicContact CG-CB 4.36Å; F880-K884 HydrophobicContact CG-CG 4.47Å; F880-K884 HydrophobicContact CZ-CB 4.42Å; F880-R885 HydrophobicContact CE1-CG 4.1Å; F880-R885 HydrophobicContact CE2-CG 4.36Å; F880-R885 HydrophobicContact CZ-CG 3.62Å; F880-L888 HydrophobicContact CD1-CD1 3.86Å; F880-L888 HydrophobicContact CE1-CD1 3.47Å; F880-L888 VanDerWaalsContact CE1-CD1 3.46Å; F880-L888 HydrophobicContact CZ-CD1 4.43Å
881	D	95.1	Very high	92	Very high	2.25 Å²	2.25	25.1 Å²	25.1	1%	0.012	13%	0.132	C	C	.	.	S	Bend	trans	-143.1	-159.6	-174.9	71.1	-18.1	0	0	0	111.2	T851 I879 F883 K884 R885 I891 R915	T851-D881 HydrophobicContact CG2-CB 4.17Å; I879-D881 HydrophobicContact CG2-CB 4.17Å; D881-F883 PolarHBondContact O-N 3.14Å; D881-F883 VanDerWaalsContact O-N 3.1Å; D881-F883 WeakPolarHBondContact OD1-CB 3.35Å; D881-F883 PolarHBondContact OD1-N 2.68Å; D881-K884 PolarHBondContact O-N 3.12Å; D881-R885 PolarHBondContact O-N 3.2Å; D881-R885 VanDerWaalsContact O-N 3.09Å; D881-I891 HydrophobicContact CB-CB 4.17Å; D881-I891 HydrophobicContact CB-CD1 3.98Å; D881-I891 HydrophobicContact CB-CG1 3.8Å; D881-R915 VanDerWaalsContact CG-NH2 3.28Å; D881-R915 IonicContact OD1-CZ 3.05Å; D881-R915 VanDerWaalsContact OD1-CZ 3.27Å; D881-R915 IonicContact OD1-NH1 3.22Å; D881-R915 PolarHBondContact OD1-NH1 3.08Å; D881-R915 IonicContact OD1-NH2 2.87Å; D881-R915 PolarHBondContact OD1-NH2 2.98Å; D881-R915 IonicContact OD2-CZ 3.35Å; D881-R915 IonicContact OD2-NH1 3.4Å; D881-R915 IonicContact OD2-NH2 3.27Å; D881-R915 PolarHBondContact OD2-NH2 2.86Å
882	Q	92.6	Very high	92.2	Very high	15.75 Å²	15.75	24.2 Å²	24.2	7%	0.074	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-33	178	-165.2	171.7	38.4	0	0	115.1	H856 K884 R885 Y886 L888 A889 K890 R1251	H856-Q882 PolarHBondContact O-NE2 3.08Å; H856-Q882 VanDerWaalsContact O-NE2 3.1Å; Q882-K884 VanDerWaalsContact C-N 3.29Å; Q882-K884 PolarHBondContact O-N 2.96Å; Q882-R885 CarbonylContact C-O 3.58Å; Q882-R885 VanDerWaalsContact CA-O 3.25Å; Q882-R885 WeakPolarHBondContact CA-O 3.42Å; Q882-R885 CarbonylContact O-C 3.5Å; Q882-R885 PolarHBondContact O-N 3.13Å; Q882-R885 VanDerWaalsContact O-O 3.14Å; Q882-Y886 WeakPolarHBondContact O-CA 3.47Å; Q882-Y886 PolarHBondContact O-N 3.03Å; Q882-L888 VanDerWaalsContact CB-O 3.29Å; Q882-L888 WeakPolarHBondContact CB-O 3.37Å; Q882-L888 WeakPolarHBondContact CG-O 3.34Å; Q882-A889 PolarHBondContact N-O 3.34Å; Q882-A889 VanDerWaalsContact N-O 3.17Å; Q882-K890 HydrophobicContact CB-CB 4.47Å; Q882-R1251 VanDerWaalsContact OE1-NH1 3.13Å
883	F	93.3	Very high	92.4	Very high	5.5 Å²	5.5	23.5 Å²	23.5	2%	0.024	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-30.9	178.2	178.9	-89.8	0	0	0	112.2	Y877 D881 R915 G928 T929	Y877-F883 HydrophobicContact CE1-CE1 4.4Å; Y877-F883 HydrophobicContact CE1-CZ 4.49Å; D881-F883 PolarHBondContact O-N 3.14Å; D881-F883 VanDerWaalsContact O-N 3.1Å; D881-F883 WeakPolarHBondContact OD1-CB 3.35Å; D881-F883 PolarHBondContact OD1-N 2.68Å; F883-R915 HydrophobicContact CD1-CB 4.25Å; F883-R915 HydrophobicContact CD2-CB 3.81Å; F883-R915 HydrophobicContact CE1-CB 3.88Å; F883-R915 HydrophobicContact CE1-CG 4.47Å; F883-R915 HydrophobicContact CE2-CB 3.38Å; F883-R915 VanDerWaalsContact CE2-CB 3.42Å; F883-R915 HydrophobicContact CE2-CG 4.49Å; F883-R915 WeakPolarHBondContact CE2-O 3.34Å; F883-R915 HydrophobicContact CG-CB 4.23Å; F883-R915 HydrophobicContact CZ-CB 3.43Å; F883-R915 VanDerWaalsContact CZ-CB 3.45Å; F883-R915 HydrophobicContact CZ-CG 4.48Å; F883-G928 VanDerWaalsContact O-CA 3.29Å; F883-G928 WeakPolarHBondContact O-CA 3.31Å; F883-T929 VanDerWaalsContact CE2-N 3.31Å
884	K	94	Very high	92.5	Very high	24 Å²	24	23.5 Å²	23.5	10%	0.104	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-37	176.7	-69.5	-72.4	-173.7	175.4	0	111.4	F880 D881 Q882 D945 D946	F880-K884 HydrophobicContact CD2-CB 3.81Å; F880-K884 HydrophobicContact CD2-CD 4.47Å; F880-K884 HydrophobicContact CD2-CG 3.97Å; F880-K884 HydrophobicContact CE2-CB 3.92Å; F880-K884 HydrophobicContact CE2-CG 4.39Å; F880-K884 HydrophobicContact CG-CB 4.36Å; F880-K884 HydrophobicContact CG-CG 4.47Å; F880-K884 HydrophobicContact CZ-CB 4.42Å; D881-K884 PolarHBondContact O-N 3.12Å; Q882-K884 VanDerWaalsContact C-N 3.29Å; Q882-K884 PolarHBondContact O-N 2.96Å; K884-D945 HydrophobicContact CD-CB 4.25Å; K884-D945 WeakPolarHBondContact CD-OD1 3.34Å; K884-D945 WeakPolarHBondContact CD-OD2 3.39Å; K884-D945 VanDerWaalsContact NZ-CG 3.33Å; K884-D945 IonicContact NZ-OD1 3.04Å; K884-D945 PolarHBondContact NZ-OD1 2.85Å; K884-D945 VanDerWaalsContact NZ-OD1 3.11Å; K884-D945 IonicContact NZ-OD2 3.23Å; K884-D945 PolarHBondContact NZ-OD2 3.02Å; K884-D946 PolarHBondContact O-N 3.32Å; K884-D946 VanDerWaalsContact O-N 3.09Å
885	R	94	Very high	92.8	Very high	8.75 Å²	8.75	21.2 Å²	21.2	3%	0.033	10%	0.102	C	C	.	.			trans	-139.2	114.4	178.8	-60.1	-65.7	-179.3	-93.5	-0.9	110.5	G818 R819 F880 D881 Q882 S887 L888 D945 D946 I969	G818-R885 PolarHBondContact O-NE 2.86Å; G818-R885 VanDerWaalsContact O-NE 3.15Å; G818-R885 PolarHBondContact O-NH2 3.07Å; R819-R885 HydrophobicContact CG-CB 4.29Å; R819-R885 HydrophobicContact CG-CG 4.21Å; F880-R885 HydrophobicContact CE1-CG 4.1Å; F880-R885 HydrophobicContact CE2-CG 4.36Å; F880-R885 HydrophobicContact CZ-CG 3.62Å; D881-R885 PolarHBondContact O-N 3.2Å; D881-R885 VanDerWaalsContact O-N 3.09Å; Q882-R885 CarbonylContact C-O 3.58Å; Q882-R885 VanDerWaalsContact CA-O 3.25Å; Q882-R885 WeakPolarHBondContact CA-O 3.42Å; Q882-R885 CarbonylContact O-C 3.5Å; Q882-R885 PolarHBondContact O-N 3.13Å; Q882-R885 VanDerWaalsContact O-O 3.14Å; R885-S887 PolarHBondContact O-N 3.06Å; R885-L888 HydrophobicContact CB-CD1 3.71Å; R885-L888 HydrophobicContact CB-CG 3.83Å; R885-L888 HydrophobicContact CG-CD1 4.07Å; R885-L888 PolarHBondContact O-N 3.25Å; R885-L888 VanDerWaalsContact O-N 3.07Å; R885-D945 IonicContact NH1-OD1 2.99Å; R885-D945 PolarHBondContact NH1-OD1 2.99Å; R885-D946 VanDerWaalsContact CA-OD2 3.25Å; R885-D946 WeakPolarHBondContact CA-OD2 3.35Å; R885-I969 VanDerWaalsContact NH1-CD1 3.3Å; R885-I969 VanDerWaalsContact NH2-CD1 3.29Å
886	Y	91.9	Very high	92.8	Very high	16.25 Å²	16.25	21.4 Å²	21.4	6%	0.064	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.4	-171	66.2	-107.3	0	0	0	114.4	R819 H856 Q882 D946 L972	R819-Y886 VanDerWaalsContact NH2-CD2 3.34Å; R819-Y886 VanDerWaalsContact NH2-CE2 3.3Å; H856-Y886 WeakPolarHBondContact CB-O 3.3Å; Q882-Y886 WeakPolarHBondContact O-CA 3.47Å; Q882-Y886 PolarHBondContact O-N 3.03Å; Y886-D946 HydrophobicContact CD1-CB 3.82Å; Y886-D946 WeakPolarHBondContact CD1-OD2 3.41Å; Y886-D946 HydrophobicContact CE1-CB 4.49Å; Y886-D946 WeakPolarHBondContact CE1-OD2 3.31Å; Y886-D946 PolarHBondContact N-OD2 3.13Å; Y886-D946 VanDerWaalsContact N-OD2 3.09Å; Y886-L972 HydrophobicContact CD1-CB 3.67Å; Y886-L972 HydrophobicContact CD2-CB 4.15Å; Y886-L972 HydrophobicContact CD2-CD1 4.38Å; Y886-L972 HydrophobicContact CD2-CD2 3.84Å; Y886-L972 HydrophobicContact CD2-CG 4.29Å; Y886-L972 HydrophobicContact CE1-CB 4.13Å; Y886-L972 HydrophobicContact CE2-CB 4.43Å; Y886-L972 HydrophobicContact CE2-CD1 4.46Å; Y886-L972 HydrophobicContact CE2-CD2 4.5Å; Y886-L972 HydrophobicContact CG-CB 3.72Å; Y886-L972 HydrophobicContact CG-CD2 3.85Å; Y886-L972 HydrophobicContact CG-CG 4.32Å
887	S	90.2	Very high	92.7	Very high	11.5 Å²	11.5	21 Å²	21	8%	0.08	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-12.8	-178.7	64.8	0	0	0	0	113.9	R819 N854 E855 H856 R885	R819-S887 WeakPolarHBondContact CD-OG 3.3Å; R819-S887 VanDerWaalsContact CZ-OG 3.29Å; R819-S887 PolarHBondContact NE-OG 2.94Å; R819-S887 PolarHBondContact NH1-OG 3.17Å; R819-S887 PolarHBondContact NH2-OG 2.84Å; N854-S887 CarbonylContact C-O 3.42Å; N854-S887 VanDerWaalsContact OD1-CB 3.28Å; N854-S887 WeakPolarHBondContact OD1-CB 3.44Å; N854-S887 PolarHBondContact OD1-O 3.11Å; N854-S887 PolarHBondContact OD1-OG 3.1Å; N854-S887 VanDerWaalsContact OD1-OG 3.08Å; E855-S887 PolarHBondContact N-O 3.19Å; H856-S887 PolarHBondContact N-O 2.96Å; R885-S887 PolarHBondContact O-N 3.06Å
888	L	92.8	Very high	92.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-85.6	156.8	-179.6	-63.3	179.3	0	0	0	111.8	T851 L853 N854 H856 F880 Q882 R885	T851-L888 HydrophobicContact CG2-CB 4.02Å; T851-L888 HydrophobicContact CG2-CD1 4.36Å; L853-L888 WeakPolarHBondContact O-CA 3.33Å; N854-L888 WeakPolarHBondContact OD1-CD2 3.46Å; H856-L888 WeakPolarHBondContact CA-O 3.38Å; F880-L888 HydrophobicContact CD1-CD1 3.86Å; F880-L888 HydrophobicContact CE1-CD1 3.47Å; F880-L888 VanDerWaalsContact CE1-CD1 3.46Å; F880-L888 HydrophobicContact CZ-CD1 4.43Å; Q882-L888 VanDerWaalsContact CB-O 3.29Å; Q882-L888 WeakPolarHBondContact CB-O 3.37Å; Q882-L888 WeakPolarHBondContact CG-O 3.34Å; R885-L888 HydrophobicContact CB-CD1 3.71Å; R885-L888 HydrophobicContact CB-CG 3.83Å; R885-L888 HydrophobicContact CG-CD1 4.07Å; R885-L888 PolarHBondContact O-N 3.25Å; R885-L888 VanDerWaalsContact O-N 3.07Å
889	A	91.7	Very high	92	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.	P	Polyproline II helix	trans	-60.5	152.5	171	0	0	0	0	0	112.3	T851 L853 E855 L858 I860 Q882	T851-A889 WeakPolarHBondContact CG2-O 3.34Å; L853-A889 HydrophobicContact CB-CB 4.08Å; L853-A889 HydrophobicContact CD2-CB 3.85Å; L853-A889 HydrophobicContact CG-CB 4.01Å; L853-A889 PolarHBondContact O-N 2.95Å; E855-A889 VanDerWaalsContact O-CA 3.29Å; E855-A889 WeakPolarHBondContact O-CA 3.28Å; E855-A889 WeakPolarHBondContact O-CB 3.33Å; E855-A889 PolarHBondContact O-N 3.49Å; L858-A889 HydrophobicContact CB-CB 4.39Å; L858-A889 WeakPolarHBondContact O-CA 3.33Å; L858-A889 VanDerWaalsContact O-CB 3.32Å; L858-A889 WeakPolarHBondContact O-CB 3.29Å; I860-A889 HydrophobicContact CD1-CB 4.23Å; I860-A889 HydrophobicContact CG1-CB 4.46Å; Q882-A889 PolarHBondContact N-O 3.34Å; Q882-A889 VanDerWaalsContact N-O 3.17Å
890	K	91.3	Very high	91.6	Very high	73.25 Å²	73.25	22.5 Å²	22.5	32%	0.318	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	139.5	172.9	-176.1	179.7	178.8	-175.8	0	109.7	L858 V859 I860 Q882 D1253	L858-K890 PolarHBondContact O-N 3.04Å; L858-K890 VanDerWaalsContact O-N 3.07Å; V859-K890 CarbonylContact C-O 3.56Å; V859-K890 WeakPolarHBondContact CA-O 3.3Å; V859-K890 HydrophobicContact CG2-CB 4.4Å; I860-K890 PolarHBondContact N-O 2.82Å; Q882-K890 HydrophobicContact CB-CB 4.47Å; K890-D1253 IonicContact NZ-OD1 3.18Å; K890-D1253 IonicContact NZ-OD2 3.34Å; K890-D1253 PolarHBondContact NZ-OD2 2.9Å
891	I	94.2	Very high	91	Very high	7.75 Å²	7.75	25.1 Å²	25.1	4%	0.04	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.1	171.6	-60.9	178.2	0	0	0	108.1	I849 T851 I860 A862 I879 D881 V893	I849-I891 HydrophobicContact CD1-CG2 4.49Å; I849-I891 HydrophobicContact CG1-CD1 4.4Å; I849-I891 HydrophobicContact CG2-CD1 3.98Å; T851-I891 HydrophobicContact CG2-CD1 4.04Å; T851-I891 HydrophobicContact CG2-CG1 4.12Å; I860-I891 HydrophobicContact CB-CG1 4.44Å; I860-I891 HydrophobicContact CD1-CG1 4.44Å; A862-I891 HydrophobicContact CB-CG2 3.58Å; I879-I891 HydrophobicContact CG2-CB 4.22Å; I879-I891 HydrophobicContact CG2-CD1 4.02Å; I879-I891 HydrophobicContact CG2-CG2 4.46Å; D881-I891 HydrophobicContact CB-CB 4.17Å; D881-I891 HydrophobicContact CB-CD1 3.98Å; D881-I891 HydrophobicContact CB-CG1 3.8Å; I891-V893 HydrophobicContact CG2-CG1 3.92Å; I891-V893 PolarHBondContact O-N 3.01Å
892	N	92.8	Very high	90	Very high	50.75 Å²	50.75	27.6 Å²	27.6	27%	0.271	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	112.9	176.9	-173.6	8.8	0	0	0	110.5	V859 I860 A862 R863 D894	V859-N892 HydrophobicContact CG1-CB 3.74Å; I860-N892 PolarHBondContact O-N 3.07Å; A862-N892 CarbonylContact C-O 3.55Å; A862-N892 VanDerWaalsContact CA-O 3.27Å; A862-N892 WeakPolarHBondContact CA-O 3.39Å; A862-N892 PolarHBondContact N-O 3.05Å; R863-N892 PolarHBondContact N-O 3Å; N892-D894 PolarHBondContact OD1-N 3.03Å; N892-D894 VanDerWaalsContact OD1-N 3.08Å; N892-D894 PolarHBondContact OD1-O 3.14Å
893	V	92.2	Very high	89	Confident	7.25 Å²	7.25	35.4 Å²	35.4	4%	0.044	19%	0.192	C	C	.	.			trans	-108.1	1.1	178.5	-57.6	0	0	0	0	113.5	A862 Y867 F875 M876 I879 I891 P895 Y896 L910	A862-V893 HydrophobicContact CB-CG1 4.3Å; Y867-V893 HydrophobicContact CE2-CB 4.03Å; Y867-V893 HydrophobicContact CE2-CG1 4.11Å; Y867-V893 VanDerWaalsContact OH-CG1 3.29Å; Y867-V893 WeakPolarHBondContact OH-CG1 3.39Å; F875-V893 HydrophobicContact CE2-CG2 4.44Å; M876-V893 HydrophobicContact CE-CG2 3.72Å; M876-V893 HydrophobicContact SD-CG2 3.96Å; I879-V893 HydrophobicContact CD1-CB 4.48Å; I879-V893 HydrophobicContact CD1-CG1 3.71Å; I879-V893 HydrophobicContact CD1-CG2 4.27Å; I891-V893 HydrophobicContact CG2-CG1 3.92Å; I891-V893 PolarHBondContact O-N 3.01Å; V893-P895 CarbonylContact O-C 3.51Å; V893-P895 VanDerWaalsContact O-O 3.05Å; V893-Y896 WeakPolarHBondContact O-CB 3.23Å; V893-Y896 PolarHBondContact O-N 3.04Å; V893-L910 HydrophobicContact CG2-CD1 4.06Å
894	D	90.6	Very high	88.2	Confident	63.25 Å²	63.25	42 Å²	42	34%	0.338	23%	0.227	S	C	.	.			trans	-98.5	121.1	-176.3	-171.1	30.3	0	0	0	111.5	R863 N892 D909 L910	R863-D894 WeakPolarHBondContact CD-O 3.28Å; R863-D894 VanDerWaalsContact CG-O 3.24Å; R863-D894 WeakPolarHBondContact CG-O 3.39Å; N892-D894 PolarHBondContact OD1-N 3.03Å; N892-D894 VanDerWaalsContact OD1-N 3.08Å; N892-D894 PolarHBondContact OD1-O 3.14Å; D894-D909 WeakPolarHBondContact OD1-CA 3.42Å; D894-L910 HydrophobicContact CB-CB 4.14Å; D894-L910 HydrophobicContact CB-CD1 3.91Å; D894-L910 HydrophobicContact CB-CG 4.24Å; D894-L910 WeakPolarHBondContact OD1-CB 3.36Å; D894-L910 PolarHBondContact OD1-N 3.1Å
895	P	92.8	Very high	87.3	Confident	29.5 Å²	29.5	42.1 Å²	42.1	19%	0.192	23%	0.23	C	C	.	.	S	Bend	cis	-85.8	163.7	1.5	37.4	-38	0	0	0	113.1	E864 V893 I907 T908	E864-P895 PolarHBondContact N-O 3.09Å; V893-P895 CarbonylContact O-C 3.51Å; V893-P895 VanDerWaalsContact O-O 3.05Å; P895-I907 HydrophobicContact CB-CG2 3.36Å; P895-I907 VanDerWaalsContact CB-CG2 3.4Å; P895-I907 HydrophobicContact CG-CG2 3.34Å; P895-T908 WeakPolarHBondContact CA-O 2.98Å; P895-T908 WeakPolarHBondContact CB-O 3.25Å
896	Y	91.5	Very high	86.7	Confident	8 Å²	8	49.3 Å²	49.3	3%	0.031	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	160.4	-179	66.3	-79.9	0	0	0	112.3	S870 P872 F875 V893 T908 L910	S870-Y896 PolarHBondContact O-OH 2.97Å; P872-Y896 WeakPolarHBondContact CD-OH 2.93Å; P872-Y896 HydrophobicContact CG-CE1 4.36Å; P872-Y896 WeakPolarHBondContact CG-OH 3.34Å; F875-Y896 HydrophobicContact CE1-CD2 4.14Å; F875-Y896 AromaticContact CE1-CE2 3.9Å; F875-Y896 HydrophobicContact CE1-CE2 4.04Å; F875-Y896 HydrophobicContact CZ-CD1 4.33Å; F875-Y896 AromaticContact CZ-CD2 3.97Å; F875-Y896 HydrophobicContact CZ-CD2 4.12Å; F875-Y896 HydrophobicContact CZ-CE1 4.46Å; F875-Y896 HydrophobicContact CZ-CE2 4.29Å; F875-Y896 HydrophobicContact CZ-CG 4.12Å; V893-Y896 WeakPolarHBondContact O-CB 3.23Å; V893-Y896 PolarHBondContact O-N 3.04Å; Y896-T908 VanDerWaalsContact CD1-O 3.24Å; Y896-T908 WeakPolarHBondContact CD1-O 3.34Å; Y896-T908 HydrophobicContact CE1-CG2 4.17Å; Y896-T908 WeakPolarHBondContact CE1-O 3.35Å; Y896-T908 HydrophobicContact CE2-CG2 4.43Å; Y896-T908 PolarHBondContact N-O 3Å; Y896-T908 PolarHBondContact O-N 2.89Å; Y896-L910 HydrophobicContact CD1-CD1 4.15Å; Y896-L910 HydrophobicContact CD1-CD2 3.91Å; Y896-L910 HydrophobicContact CD1-CG 4.06Å; Y896-L910 HydrophobicContact CE1-CD1 4.17Å; Y896-L910 HydrophobicContact CE1-CD2 3.52Å; Y896-L910 HydrophobicContact CE1-CG 4.01Å
897	A	90.2	Very high	86.4	Confident	3.5 Å²	3.5	52 Å²	52	3%	0.029	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.9	179.7	0	0	0	0	0	111.3	N865 N866 V899 P905 I907	N865-A897 PolarHBondContact O-N 3Å; N866-A897 WeakPolarHBondContact CA-O 3.41Å; N866-A897 HydrophobicContact CB-CB 4.25Å; N866-A897 WeakPolarHBondContact CB-O 3.29Å; N866-A897 PolarHBondContact ND2-O 3.03Å; A897-V899 VanDerWaalsContact C-N 3.33Å; A897-V899 PolarHBondContact O-N 3.05Å; A897-P905 HydrophobicContact CB-CB 3.96Å; A897-P905 HydrophobicContact CB-CG 4.41Å; A897-I907 HydrophobicContact CB-CD1 4.3Å
898	A	85.4	Confident	86.2	Confident	24 Å²	24	53.4 Å²	53.4	20%	0.198	29%	0.285	C	S	.	.	S	Bend	trans	-70.2	-29.2	179.5	0	0	0	0	0	113.4	N866 K906	N866-A898 VanDerWaalsContact ND2-C 3.34Å; N866-A898 PolarHBondContact ND2-O 3.06Å; N866-A898 VanDerWaalsContact ND2-O 3.15Å; A898-K906 PolarHBondContact N-O 3.04Å; A898-K906 VanDerWaalsContact N-O 3.16Å
899	V	85.3	Confident	85.9	Confident	87 Å²	87	56.8 Å²	56.8	53%	0.527	30%	0.303	S	S	.	.	S	Bend	trans	-127.7	132.7	-177.2	-176	0	0	0	0	109.9	A897	A897-V899 VanDerWaalsContact C-N 3.33Å; A897-V899 PolarHBondContact O-N 3.05Å
900	C	86.6	Confident	85.5	Confident	26 Å²	26	58.4 Å²	58.4	18%	0.176	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	148.3	175.1	170.6	0	0	0	0	112	K805 C839 N866 S902	K805-C900 PolarHBondContact NZ-SG 2.89Å; C839-C900 HydrophobicContact CB-CB 3.89Å; C839-C900 WeakPolarHBondContact CB-SG 3.33Å; C839-C900 WeakPolarHBondContact SG-CA 3.23Å; C839-C900 WeakPolarHBondContact SG-CB 3.42Å; C839-C900 CovalentContact SG-SG 2.01Å; C839-C900 PolarHBondContact SG-SG 3.17Å; N866-C900 HydrophobicContact CB-CB 4.1Å; C900-S902 PolarHBondContact O-N 3.07Å; C900-S902 VanDerWaalsContact O-N 3.09Å
901	N	81.3	Confident	84.9	Confident	63.5 Å²	63.5	64.1 Å²	64.1	34%	0.34	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	11.1	171.3	-62.8	-22.7	0	0	0	117.6	E803 C839	E803-N901 PolarHBondContact OE1-ND2 3.11Å; E803-N901 PolarHBondContact OE1-OD1 2.84Å; C839-N901 PolarHBondContact SG-N 2.84Å; C839-N901 VanDerWaalsContact SG-N 3.42Å; C839-N901 PolarHBondContact SG-OD1 3.41Å; C839-N901 VanDerWaalsContact SG-OD1 3.33Å
902	S	76.1	Confident	84.2	Confident	54 Å²	54	71.8 Å²	71.8	38%	0.378	37%	0.372	S	S	.	.			trans	-69.2	139.4	167.6	-178.5	0	0	0	0	110	C900 N904 P905	C900-S902 PolarHBondContact O-N 3.07Å; C900-S902 VanDerWaalsContact O-N 3.09Å; S902-N904 PolarHBondContact O-N 3.27Å; S902-N904 VanDerWaalsContact OG-C 3.23Å; S902-N904 PolarHBondContact OG-N 2.9Å; S902-N904 PolarHBondContact OG-O 3.07Å; S902-P905 WeakPolarHBondContact O-CD 3.41Å
903	Q	71.2	Confident	83.9	Confident	179.25 Å²	179.25	72 Å²	72	84%	0.838	37%	0.371	S	S	*	.	S	Bend	trans	-60.1	-36.3	172.5	-73.8	-175.8	-13.9	0	0	111.5
904	N	76.1	Confident	83.6	Confident	143.75 Å²	143.75	76.1 Å²	76.1	77%	0.769	39%	0.386	S	S	*	.	S	Bend	trans	-122.4	85.6	171	-73.2	-26.4	0	0	0	108.2	S902 K906	S902-N904 PolarHBondContact O-N 3.27Å; S902-N904 VanDerWaalsContact OG-C 3.23Å; S902-N904 PolarHBondContact OG-N 2.9Å; S902-N904 PolarHBondContact OG-O 3.07Å; N904-K906 PolarHBondContact O-N 3.2Å
905	P	75.4	Confident	83.6	Confident	26.5 Å²	26.5	74.3 Å²	74.3	17%	0.172	38%	0.375	C	S	.	.			trans	-65.7	138.8	179	27.1	-31.1	0	0	0	110	A897 S902 I907	A897-P905 HydrophobicContact CB-CB 3.96Å; A897-P905 HydrophobicContact CB-CG 4.41Å; S902-P905 WeakPolarHBondContact O-CD 3.41Å; P905-I907 HydrophobicContact CG-CD1 4.13Å; P905-I907 PolarHBondContact O-N 2.99Å
906	K	80	Confident	83.5	Confident	160.25 Å²	160.25	79.9 Å²	79.9	70%	0.697	39%	0.392	S	S	*	.			trans	-67.8	105.3	171	-174.1	177.9	179.3	-179.1	0	108.5	A898 N904 T908	A898-K906 PolarHBondContact N-O 3.04Å; A898-K906 VanDerWaalsContact N-O 3.16Å; N904-K906 PolarHBondContact O-N 3.2Å; K906-T908 PolarHBondContact O-OG1 3.14Å
907	I	86.1	Confident	83.5	Confident	72.75 Å²	72.75	80.4 Å²	80.4	37%	0.373	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	131.5	175.9	-60.3	-117.9	0	0	0	108.5	E864 P895 A897 P905	E864-I907 HydrophobicContact CB-CD1 3.97Å; E864-I907 HydrophobicContact CG-CD1 4.13Å; P895-I907 HydrophobicContact CB-CG2 3.36Å; P895-I907 VanDerWaalsContact CB-CG2 3.4Å; P895-I907 HydrophobicContact CG-CG2 3.34Å; A897-I907 HydrophobicContact CB-CD1 4.3Å; P905-I907 HydrophobicContact CG-CD1 4.13Å; P905-I907 PolarHBondContact O-N 2.99Å
908	T	85.9	Confident	83.6	Confident	41 Å²	41	84 Å²	84	25%	0.252	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.4	-177.6	-53.1	0	0	0	0	108.7	P895 Y896 K906	P895-T908 WeakPolarHBondContact CA-O 2.98Å; P895-T908 WeakPolarHBondContact CB-O 3.25Å; Y896-T908 VanDerWaalsContact CD1-O 3.24Å; Y896-T908 WeakPolarHBondContact CD1-O 3.34Å; Y896-T908 HydrophobicContact CE1-CG2 4.17Å; Y896-T908 WeakPolarHBondContact CE1-O 3.35Å; Y896-T908 HydrophobicContact CE2-CG2 4.43Å; Y896-T908 PolarHBondContact N-O 3Å; Y896-T908 PolarHBondContact O-N 2.89Å; K906-T908 PolarHBondContact O-OG1 3.14Å
909	D	86	Confident	83.7	Confident	71.25 Å²	71.25	86.5 Å²	86.5	38%	0.381	41%	0.414	S	S	.	.			trans	-79.8	149.3	177.2	-51.8	-31	0	0	0	110.6	D894 R911	D894-D909 WeakPolarHBondContact OD1-CA 3.42Å; D909-R911 HydrophobicContact CB-CG 3.91Å; D909-R911 PolarHBondContact O-N 2.96Å; D909-R911 IonicContact OD2-CZ 3.4Å; D909-R911 IonicContact OD2-NE 3.14Å; D909-R911 PolarHBondContact OD2-NE 3.16Å; D909-R911 VanDerWaalsContact OD2-NE 3.07Å; D909-R911 IonicContact OD2-NH2 3.36Å; D909-R911 PolarHBondContact OD2-NH2 2.86Å
910	L	84.4	Confident	83.6	Confident	33.5 Å²	33.5	86.7 Å²	86.7	18%	0.175	43%	0.425	C	S	.	.			trans	-76.1	52.5	173.6	-136.7	116.8	0	0	0	112.3	P872 F875 M876 V893 D894 Y896 N912 F913	P872-L910 HydrophobicContact CB-CD1 3.97Å; P872-L910 HydrophobicContact CB-CD2 3.78Å; P872-L910 HydrophobicContact CG-CD1 4.04Å; P872-L910 HydrophobicContact CG-CD2 3.64Å; F875-L910 HydrophobicContact CZ-CD1 4.42Å; M876-L910 HydrophobicContact CE-CD1 3.34Å; M876-L910 VanDerWaalsContact CE-CD1 3.48Å; M876-L910 HydrophobicContact CE-CD2 3.83Å; M876-L910 HydrophobicContact CE-CG 4.22Å; V893-L910 HydrophobicContact CG2-CD1 4.06Å; D894-L910 HydrophobicContact CB-CB 4.14Å; D894-L910 HydrophobicContact CB-CD1 3.91Å; D894-L910 HydrophobicContact CB-CG 4.24Å; D894-L910 WeakPolarHBondContact OD1-CB 3.36Å; D894-L910 PolarHBondContact OD1-N 3.1Å; Y896-L910 HydrophobicContact CD1-CD1 4.15Å; Y896-L910 HydrophobicContact CD1-CD2 3.91Å; Y896-L910 HydrophobicContact CD1-CG 4.06Å; Y896-L910 HydrophobicContact CE1-CD1 4.17Å; Y896-L910 HydrophobicContact CE1-CD2 3.52Å; Y896-L910 HydrophobicContact CE1-CG 4.01Å; L910-N912 PolarHBondContact O-N 3.09Å; L910-F913 HydrophobicContact CD1-CB 4.33Å; L910-F913 HydrophobicContact CD1-CD1 4.28Å; L910-F913 HydrophobicContact CD2-CB 3.93Å; L910-F913 HydrophobicContact CD2-CD1 4.02Å; L910-F913 HydrophobicContact CD2-CG 4.32Å; L910-F913 VanDerWaalsContact CD2-O 3.26Å; L910-F913 WeakPolarHBondContact CD2-O 3.45Å; L910-F913 HydrophobicContact CG-CB 4.27Å; L910-F913 HydrophobicContact CG-CD1 4.38Å; L910-F913 PolarHBondContact O-N 3.34Å; L910-F913 VanDerWaalsContact O-N 3.12Å
911	R	79	Confident	83.7	Confident	194.25 Å²	194.25	93.2 Å²	93.2	73%	0.733	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	126.5	-176.7	-65.1	-175	-171.7	-163.3	0.6	111.5	D909 F913	D909-R911 HydrophobicContact CB-CG 3.91Å; D909-R911 PolarHBondContact O-N 2.96Å; D909-R911 IonicContact OD2-CZ 3.4Å; D909-R911 IonicContact OD2-NE 3.14Å; D909-R911 PolarHBondContact OD2-NE 3.16Å; D909-R911 VanDerWaalsContact OD2-NE 3.07Å; D909-R911 IonicContact OD2-NH2 3.36Å; D909-R911 PolarHBondContact OD2-NH2 2.86Å; R911-F913 PolarHBondContact O-N 3.04Å; R911-F913 VanDerWaalsContact O-N 3.15Å
912	N	78.7	Confident	84.1	Confident	168.5 Å²	168.5	97.8 Å²	97.8	90%	0.901	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	17.3	173.1	-54.2	-24.1	0	0	0	115.8	L910	L910-N912 PolarHBondContact O-N 3.09Å
913	F	86.5	Confident	84.7	Confident	55 Å²	55	97.8 Å²	97.8	24%	0.241	47%	0.465	C	S	.	.			trans	-108.4	128.6	175.2	-175.3	-89.3	0	0	0	111	P872 M876 Y877 L910 R911 R915	P872-F913 HydrophobicContact CB-CB 4.08Å; P872-F913 HydrophobicContact CB-CD1 3.62Å; P872-F913 HydrophobicContact CB-CD2 3.82Å; P872-F913 HydrophobicContact CB-CE1 3.98Å; P872-F913 HydrophobicContact CB-CE2 4.16Å; P872-F913 HydrophobicContact CB-CG 3.53Å; P872-F913 VanDerWaalsContact CB-CG 3.5Å; P872-F913 HydrophobicContact CB-CZ 4.23Å; P872-F913 HydrophobicContact CG-CB 4.37Å; P872-F913 HydrophobicContact CG-CG 4.32Å; M876-F913 HydrophobicContact CB-CD1 4.44Å; M876-F913 HydrophobicContact CB-CE1 3.65Å; M876-F913 HydrophobicContact CB-CZ 4.21Å; M876-F913 HydrophobicContact CE-CD1 4.39Å; M876-F913 HydrophobicContact CE-CE1 4.37Å; M876-F913 HydrophobicContact CG-CD1 4.37Å; M876-F913 HydrophobicContact CG-CE1 3.79Å; Y877-F913 HydrophobicContact CE2-CZ 4.37Å; L910-F913 HydrophobicContact CD1-CB 4.33Å; L910-F913 HydrophobicContact CD1-CD1 4.28Å; L910-F913 HydrophobicContact CD2-CB 3.93Å; L910-F913 HydrophobicContact CD2-CD1 4.02Å; L910-F913 HydrophobicContact CD2-CG 4.32Å; L910-F913 VanDerWaalsContact CD2-O 3.26Å; L910-F913 WeakPolarHBondContact CD2-O 3.45Å; L910-F913 HydrophobicContact CG-CB 4.27Å; L910-F913 HydrophobicContact CG-CD1 4.38Å; L910-F913 PolarHBondContact O-N 3.34Å; L910-F913 VanDerWaalsContact O-N 3.12Å; R911-F913 PolarHBondContact O-N 3.04Å; R911-F913 VanDerWaalsContact O-N 3.15Å; F913-R915 HydrophobicContact CE1-CG 4.36Å
914	Y	85.4	Confident	85.7	Confident	93 Å²	93	93.8 Å²	93.8	37%	0.365	45%	0.449	S	S	.	.			trans	-135.7	149.7	167.8	62	-83.6	0	0	0	108.9	R916 Y931 E932	Y914-R916 HydrophobicContact CD2-CG 4.3Å; Y914-R916 HydrophobicContact CE2-CG 3.86Å; Y914-R916 PolarHBondContact O-N 3.07Å; Y914-Y931 AromaticContact CD2-CD2 3.86Å; Y914-Y931 HydrophobicContact CD2-CD2 3.92Å; Y914-Y931 HydrophobicContact CD2-CE2 4.35Å; Y914-Y931 HydrophobicContact CE2-CD2 4.45Å; Y914-E932 WeakPolarHBondContact CE2-OE1 3.24Å; Y914-E932 PolarHBondContact OH-OE1 2.97Å
915	R	90.9	Very high	86.6	Confident	26.25 Å²	26.25	89.7 Å²	89.7	10%	0.099	43%	0.426	C	S	.	.			trans	-70.1	124.1	173.8	-71.9	178.4	-82.6	-168.8	2.4	108.6	M876 Y877 I879 D881 F883 F913	M876-R915 HydrophobicContact CB-CG 4.18Å; M876-R915 HydrophobicContact CG-CG 3.45Å; M876-R915 VanDerWaalsContact CG-CG 3.45Å; M876-R915 WeakPolarHBondContact O-CD 3.49Å; Y877-R915 HydrophobicContact CE1-CB 4.32Å; Y877-R915 HydrophobicContact CE1-CG 4.33Å; I879-R915 PolarHBondContact O-NH1 3.39Å; D881-R915 VanDerWaalsContact CG-NH2 3.28Å; D881-R915 IonicContact OD1-CZ 3.05Å; D881-R915 VanDerWaalsContact OD1-CZ 3.27Å; D881-R915 IonicContact OD1-NH1 3.22Å; D881-R915 PolarHBondContact OD1-NH1 3.08Å; D881-R915 IonicContact OD1-NH2 2.87Å; D881-R915 PolarHBondContact OD1-NH2 2.98Å; D881-R915 IonicContact OD2-CZ 3.35Å; D881-R915 IonicContact OD2-NH1 3.4Å; D881-R915 IonicContact OD2-NH2 3.27Å; D881-R915 PolarHBondContact OD2-NH2 2.86Å; F883-R915 HydrophobicContact CD1-CB 4.25Å; F883-R915 HydrophobicContact CD2-CB 3.81Å; F883-R915 HydrophobicContact CE1-CB 3.88Å; F883-R915 HydrophobicContact CE1-CG 4.47Å; F883-R915 HydrophobicContact CE2-CB 3.38Å; F883-R915 VanDerWaalsContact CE2-CB 3.42Å; F883-R915 HydrophobicContact CE2-CG 4.49Å; F883-R915 WeakPolarHBondContact CE2-O 3.34Å; F883-R915 HydrophobicContact CG-CB 4.23Å; F883-R915 HydrophobicContact CZ-CB 3.43Å; F883-R915 VanDerWaalsContact CZ-CB 3.45Å; F883-R915 HydrophobicContact CZ-CG 4.48Å; F913-R915 HydrophobicContact CE1-CG 4.36Å
916	R	90.7	Very high	87.5	Confident	146.75 Å²	146.75	88.5 Å²	88.5	55%	0.554	42%	0.418	S	S	*	.			trans	-85.7	136	176.4	-64.8	-179	178.5	172.7	-0.5	109.7	Y877 Y914 R918	Y877-R916 PolarHBondContact OH-N 3.19Å; Y877-R916 VanDerWaalsContact OH-N 3.15Å; Y877-R916 PolarHBondContact OH-O 2.77Å; Y914-R916 HydrophobicContact CD2-CG 4.3Å; Y914-R916 HydrophobicContact CE2-CG 3.86Å; Y914-R916 PolarHBondContact O-N 3.07Å; R916-R918 VanDerWaalsContact C-N 3.28Å; R916-R918 PolarHBondContact O-N 3.04Å
917	F	92.4	Very high	88.2	Confident	19.25 Å²	19.25	81.1 Å²	81.1	8%	0.084	39%	0.388	C	S	.	.	S	Bend	trans	-73	-21.8	177	85.7	-82	0	0	0	113.3	I926 G927 V930 T934 L936 L947	F917-I926 HydrophobicContact CD2-CB 4.12Å; F917-I926 HydrophobicContact CD2-CG2 4.38Å; F917-I926 HydrophobicContact CE2-CB 4.34Å; F917-I926 HydrophobicContact CE2-CG2 4.21Å; F917-I926 CarbonylContact O-C 3.41Å; F917-I926 VanDerWaalsContact O-CA 3.29Å; F917-I926 WeakPolarHBondContact O-CA 3.26Å; F917-G927 WeakPolarHBondContact CA-O 3.27Å; F917-G927 WeakPolarHBondContact CB-O 3.36Å; F917-G927 PolarHBondContact O-N 3.1Å; F917-V930 HydrophobicContact CB-CG2 4.49Å; F917-V930 HydrophobicContact CD1-CB 4.39Å; F917-V930 HydrophobicContact CD1-CG1 4.47Å; F917-V930 HydrophobicContact CD1-CG2 3.92Å; F917-V930 HydrophobicContact CD2-CG2 4.01Å; F917-V930 HydrophobicContact CE1-CB 4.46Å; F917-V930 HydrophobicContact CE1-CG1 4.28Å; F917-V930 HydrophobicContact CE1-CG2 4.07Å; F917-V930 HydrophobicContact CE2-CG2 4.17Å; F917-V930 HydrophobicContact CG-CG2 3.88Å; F917-V930 HydrophobicContact CZ-CG2 4.19Å; F917-T934 HydrophobicContact CE1-CG2 3.98Å; F917-T934 HydrophobicContact CZ-CG2 3.69Å; F917-L936 HydrophobicContact CZ-CD2 4.41Å; F917-L947 HydrophobicContact CD2-CD1 4Å; F917-L947 HydrophobicContact CE2-CD1 4.47Å
918	R	91.8	Very high	88.5	Confident	77.25 Å²	77.25	77.6 Å²	77.6	29%	0.292	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-126.3	119.7	178.6	-173.5	175.1	162.8	-166.4	-2	109.3	R916 P923 I926	R916-R918 VanDerWaalsContact C-N 3.28Å; R916-R918 PolarHBondContact O-N 3.04Å; R918-P923 WeakPolarHBondContact CD-O 3.37Å; R918-P923 PolarHBondContact NE-O 2.89Å; R918-P923 PolarHBondContact NH2-O 2.98Å; R918-I926 HydrophobicContact CB-CG2 4.16Å; R918-I926 HydrophobicContact CG-CG2 4.02Å
919	Q	87.4	Confident	88.9	Confident	76.5 Å²	76.5	76 Å²	76	36%	0.357	36%	0.36	S	S	.	.			trans	-90.2	144	179.2	-67.6	-177.1	-9.2	0	0	110.8	E921 R922 P923	Q919-E921 VanDerWaalsContact C-N 3.3Å; Q919-E921 WeakPolarHBondContact CB-OE2 3.3Å; Q919-E921 PolarHBondContact O-N 2.99Å; Q919-R922 CarbonylContact O-C 3.39Å; Q919-R922 VanDerWaalsContact O-C 3.3Å; Q919-R922 PolarHBondContact O-N 2.86Å; Q919-P923 WeakPolarHBondContact O-CA 3.34Å
920	A	84.6	Confident	89.2	Confident	91.75 Å²	91.75	72.6 Å²	72.6	76%	0.758	34%	0.342	S	S	*	.	S	Bend	trans	-68.3	-31.6	-178.9	0	0	0	0	0	112.3	R922	A920-R922 VanDerWaalsContact C-N 3.33Å
921	E	87.4	Confident	89.4	Confident	162.5 Å²	162.5	76.8 Å²	76.8	76%	0.759	36%	0.356	S	S	*	.	S	Bend	trans	-71.5	-29.6	-179.6	-59.7	124.2	-168	0	0	112.5	Q919	Q919-E921 VanDerWaalsContact C-N 3.3Å; Q919-E921 WeakPolarHBondContact CB-OE2 3.3Å; Q919-E921 PolarHBondContact O-N 2.99Å
922	R	89.2	Confident	89.9	Confident	161 Å²	161	72.6 Å²	72.6	61%	0.608	35%	0.345	S	S	*	.	S	Bend	trans	-137	70.3	-177.5	-62.5	-172	-176.6	178.3	-1.7	110.1	Q919 A920 N924 I925	Q919-R922 CarbonylContact O-C 3.39Å; Q919-R922 VanDerWaalsContact O-C 3.3Å; Q919-R922 PolarHBondContact O-N 2.86Å; A920-R922 VanDerWaalsContact C-N 3.33Å; R922-N924 PolarHBondContact O-N 3.07Å; R922-N924 VanDerWaalsContact O-N 3.1Å; R922-I925 HydrophobicContact CB-CB 4.28Å; R922-I925 HydrophobicContact CB-CD1 4.26Å; R922-I925 HydrophobicContact CB-CG1 4.29Å; R922-I925 PolarHBondContact O-N 3.16Å
923	P	88.9	Confident	90.5	Very high	54.5 Å²	54.5	69.5 Å²	69.5	35%	0.354	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.4	-170.1	27.2	-35.9	0	0	0	114.2	R918 Q919 I925 Y941	R918-P923 WeakPolarHBondContact CD-O 3.37Å; R918-P923 PolarHBondContact NE-O 2.89Å; R918-P923 PolarHBondContact NH2-O 2.98Å; Q919-P923 WeakPolarHBondContact O-CA 3.34Å; P923-I925 VanDerWaalsContact C-N 3.34Å; P923-Y941 WeakPolarHBondContact O-CE1 3.37Å
924	N	92.9	Very high	90.8	Very high	94.75 Å²	94.75	67.9 Å²	67.9	51%	0.507	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.7	177.9	-60.7	-8.3	0	0	0	112.7	R922 Y941 L942	R922-N924 PolarHBondContact O-N 3.07Å; R922-N924 VanDerWaalsContact O-N 3.1Å; N924-Y941 CarbonylContact O-C 3.49Å; N924-Y941 VanDerWaalsContact O-CA 3.28Å; N924-Y941 WeakPolarHBondContact O-CA 3.32Å; N924-L942 PolarHBondContact O-N 3.12Å
925	I	94.2	Very high	91.1	Very high	56.25 Å²	56.25	68.8 Å²	68.8	29%	0.288	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.5	174.3	-56.3	-176	0	0	0	107.6	R922 P923 L942 V944	R922-I925 HydrophobicContact CB-CB 4.28Å; R922-I925 HydrophobicContact CB-CD1 4.26Å; R922-I925 HydrophobicContact CB-CG1 4.29Å; R922-I925 PolarHBondContact O-N 3.16Å; P923-I925 VanDerWaalsContact C-N 3.34Å; I925-L942 WeakPolarHBondContact CA-O 3.37Å; I925-V944 HydrophobicContact CG2-CB 4.42Å; I925-V944 HydrophobicContact CG2-CG1 3.73Å; I925-V944 HydrophobicContact CG2-CG2 3.73Å
926	I	95.1	Very high	91.2	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	158.6	-177.2	64.3	174.4	0	0	0	111	F917 R918 L936 Y941 L942 V943 V944 L947 L963	F917-I926 HydrophobicContact CD2-CB 4.12Å; F917-I926 HydrophobicContact CD2-CG2 4.38Å; F917-I926 HydrophobicContact CE2-CB 4.34Å; F917-I926 HydrophobicContact CE2-CG2 4.21Å; F917-I926 CarbonylContact O-C 3.41Å; F917-I926 VanDerWaalsContact O-CA 3.29Å; F917-I926 WeakPolarHBondContact O-CA 3.26Å; R918-I926 HydrophobicContact CB-CG2 4.16Å; R918-I926 HydrophobicContact CG-CG2 4.02Å; I926-L936 HydrophobicContact CD1-CD1 4.2Å; I926-Y941 HydrophobicContact CD1-CD1 4.46Å; I926-Y941 HydrophobicContact CD1-CG 4.35Å; I926-Y941 HydrophobicContact CG2-CD1 4.08Å; I926-L942 PolarHBondContact N-O 3.19Å; I926-V943 HydrophobicContact CD1-CG2 4.06Å; I926-V943 HydrophobicContact CG1-CB 4.47Å; I926-V943 HydrophobicContact CG1-CG2 3.89Å; I926-V943 VanDerWaalsContact O-CA 3.3Å; I926-V943 WeakPolarHBondContact O-CA 3.31Å; I926-V944 PolarHBondContact O-N 3.14Å; I926-V944 VanDerWaalsContact O-N 3.08Å; I926-L947 HydrophobicContact CD1-CD2 4.43Å; I926-L963 HydrophobicContact CD1-CD2 4.09Å
927	G	93.8	Very high	91.2	Very high	4.75 Å²	4.75	63.4 Å²	63.4	5%	0.049	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.1	148.1	174.8	0	0	0	0	0	112	F917 D945	F917-G927 WeakPolarHBondContact CA-O 3.27Å; F917-G927 WeakPolarHBondContact CB-O 3.36Å; F917-G927 PolarHBondContact O-N 3.1Å; G927-D945 WeakPolarHBondContact CA-O 3.43Å
928	G	94	Very high	91.2	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	99.2	-158.8	-175.7	0	0	0	0	0	113.9	F883 D946 H948	F883-G928 VanDerWaalsContact O-CA 3.29Å; F883-G928 WeakPolarHBondContact O-CA 3.31Å; G928-D946 CarbonylContact C-O 3.31Å; G928-D946 WeakPolarHBondContact CA-O 3.27Å; G928-D946 PolarHBondContact N-O 3.07Å; G928-H948 PolarHBondContact O-N 3.04Å
929	T	92.9	Very high	91.2	Very high	7.5 Å²	7.5	66.9 Å²	66.9	5%	0.046	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.4	-168.8	-48.9	0	0	0	0	113.1	F883 Y931 H948	F883-T929 VanDerWaalsContact CE2-N 3.31Å; T929-Y931 HydrophobicContact CG2-CD1 3.89Å; T929-Y931 HydrophobicContact CG2-CD2 4.34Å; T929-Y931 HydrophobicContact CG2-CE1 3.53Å; T929-Y931 VanDerWaalsContact CG2-CE1 3.49Å; T929-Y931 HydrophobicContact CG2-CE2 4.11Å; T929-Y931 HydrophobicContact CG2-CG 4.32Å; T929-H948 CarbonylContact C-O 3.52Å; T929-H948 VanDerWaalsContact CA-O 3.29Å; T929-H948 WeakPolarHBondContact CA-O 3.23Å; T929-H948 HydrophobicContact CG2-CB 4.38Å; T929-H948 PolarHBondContact OG1-ND1 2.89Å
930	V	93	Very high	91.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	105.3	169.7	-175.5	0	0	0	0	107.9	F917 E932 L947 H948 S950 S953	F917-V930 HydrophobicContact CB-CG2 4.49Å; F917-V930 HydrophobicContact CD1-CB 4.39Å; F917-V930 HydrophobicContact CD1-CG1 4.47Å; F917-V930 HydrophobicContact CD1-CG2 3.92Å; F917-V930 HydrophobicContact CD2-CG2 4.01Å; F917-V930 HydrophobicContact CE1-CB 4.46Å; F917-V930 HydrophobicContact CE1-CG1 4.28Å; F917-V930 HydrophobicContact CE1-CG2 4.07Å; F917-V930 HydrophobicContact CE2-CG2 4.17Å; F917-V930 HydrophobicContact CG-CG2 3.88Å; F917-V930 HydrophobicContact CZ-CG2 4.19Å; V930-E932 VanDerWaalsContact CG1-O 3.25Å; V930-E932 WeakPolarHBondContact CG1-O 3.32Å; V930-L947 HydrophobicContact CG2-CD1 3.97Å; V930-H948 PolarHBondContact N-O 3.08Å; V930-S950 VanDerWaalsContact O-CB 3.31Å; V930-S950 WeakPolarHBondContact O-CB 3.27Å; V930-S950 PolarHBondContact O-N 3.22Å; V930-S950 VanDerWaalsContact O-N 3.14Å; V930-S950 PolarHBondContact O-OG 2.88Å; V930-S953 WeakPolarHBondContact O-CB 3.4Å; V930-S953 PolarHBondContact O-OG 3.24Å; V930-S953 VanDerWaalsContact O-OG 3.1Å
931	Y	88.7	Confident	92.1	Very high	120.75 Å²	120.75	62.8 Å²	62.8	47%	0.474	31%	0.309	S	S	.	.			trans	-91.2	-21.1	-180	-65	-71	0	0	0	113.6	Y914 T929 S950	Y914-Y931 AromaticContact CD2-CD2 3.86Å; Y914-Y931 HydrophobicContact CD2-CD2 3.92Å; Y914-Y931 HydrophobicContact CD2-CE2 4.35Å; Y914-Y931 HydrophobicContact CE2-CD2 4.45Å; T929-Y931 HydrophobicContact CG2-CD1 3.89Å; T929-Y931 HydrophobicContact CG2-CD2 4.34Å; T929-Y931 HydrophobicContact CG2-CE1 3.53Å; T929-Y931 VanDerWaalsContact CG2-CE1 3.49Å; T929-Y931 HydrophobicContact CG2-CE2 4.11Å; T929-Y931 HydrophobicContact CG2-CG 4.32Å; Y931-S950 WeakPolarHBondContact CA-OG 3.31Å
932	E	89.4	Confident	92.6	Very high	107.25 Å²	107.25	57.8 Å²	57.8	50%	0.501	29%	0.287	S	S	.	.	S	Bend	trans	-127.9	153.2	-172.9	60.1	-171.5	156.8	0	0	110.7	Y914 V930 T934	Y914-E932 WeakPolarHBondContact CE2-OE1 3.24Å; Y914-E932 PolarHBondContact OH-OE1 2.97Å; V930-E932 VanDerWaalsContact CG1-O 3.25Å; V930-E932 WeakPolarHBondContact CG1-O 3.32Å; E932-T934 PolarHBondContact O-N 3.03Å; E932-T934 VanDerWaalsContact O-N 3.13Å; E932-T934 PolarHBondContact O-OG1 3.2Å
933	N	91.9	Very high	92.9	Very high	103.5 Å²	103.5	50.1 Å²	50.1	55%	0.553	26%	0.258	S	S	*	.			trans	-58.6	120	177.4	-67.2	-4.5	0	0	0	109.5	S953 I954	N933-S953 WeakPolarHBondContact OD1-CA 3.35Å; N933-I954 CarbonylContact C-O 3.45Å; N933-I954 VanDerWaalsContact CA-O 3.29Å; N933-I954 WeakPolarHBondContact CA-O 3.26Å; N933-I954 HydrophobicContact CB-CB 4.42Å; N933-I954 PolarHBondContact OD1-N 3.21Å
934	T	92.3	Very high	93.1	Very high	20 Å²	20	49.2 Å²	49.2	12%	0.123	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.6	-172.6	-54	0	0	0	0	111	F917 E932 L936 I954 T956	F917-T934 HydrophobicContact CE1-CG2 3.98Å; F917-T934 HydrophobicContact CZ-CG2 3.69Å; E932-T934 PolarHBondContact O-N 3.03Å; E932-T934 VanDerWaalsContact O-N 3.13Å; E932-T934 PolarHBondContact O-OG1 3.2Å; T934-L936 HydrophobicContact CG2-CD2 4.39Å; T934-I954 PolarHBondContact N-O 3.07Å; T934-T956 PolarHBondContact O-N 3.03Å
935	D	92	Very high	93.2	Very high	113.25 Å²	113.25	45.6 Å²	45.6	61%	0.606	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.9	172.5	-60.2	-31.9	0	0	0	110.1	P937 T956	D935-P937 WeakPolarHBondContact O-CD 3.31Å; D935-T956 WeakPolarHBondContact OD1-CB 3.39Å; D935-T956 WeakPolarHBondContact OD1-CG2 3.43Å; D935-T956 PolarHBondContact OD1-OG1 3.08Å
936	L	92.4	Very high	93.3	Very high	1.25 Å²	1.25	43 Å²	43	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.8	171.5	-67.6	-176.9	0	0	0	109.9	F917 I926 T934 Y941 L955 T956 L957 Q958	F917-L936 HydrophobicContact CZ-CD2 4.41Å; I926-L936 HydrophobicContact CD1-CD1 4.2Å; T934-L936 HydrophobicContact CG2-CD2 4.39Å; L936-Y941 HydrophobicContact CB-CE2 4.37Å; L936-Y941 HydrophobicContact CD2-CE1 4.28Å; L936-L955 HydrophobicContact CD1-CD1 3.97Å; L936-L955 HydrophobicContact CG-CD1 3.98Å; L936-T956 PolarHBondContact N-O 3.15Å; L936-L957 HydrophobicContact CB-CD2 3.9Å; L936-L957 HydrophobicContact CD1-CD2 3.71Å; L936-L957 HydrophobicContact CG-CD2 4.19Å; L936-Q958 PolarHBondContact O-N 3.04Å
937	P	91.1	Very high	93.3	Very high	58 Å²	58	42.9 Å²	42.9	38%	0.377	22%	0.218	S	C	.	.			trans	-65.5	162.4	173.8	28.6	-34.1	0	0	0	110.7	D935 G939 Y941 T961	D935-P937 WeakPolarHBondContact O-CD 3.31Å; P937-G939 PolarHBondContact O-N 2.95Å; P937-G939 VanDerWaalsContact O-N 3.13Å; P937-Y941 VanDerWaalsContact CD-OH 3.26Å; P937-Y941 WeakPolarHBondContact CD-OH 3.44Å; P937-Y941 WeakPolarHBondContact CG-OH 3.37Å; P937-Y941 WeakPolarHBondContact O-CE2 3.27Å; P937-Y941 PolarHBondContact O-OH 2.81Å; P937-Y941 VanDerWaalsContact O-OH 3.09Å; P937-T961 PolarHBondContact O-OG1 3.03Å
938	R	91.3	Very high	93.4	Very high	145.5 Å²	145.5	43 Å²	43	55%	0.549	22%	0.217	S	C	.	.	S	Bend	trans	-53.1	121.7	175.3	-179.4	-177.9	177.2	156.1	8.8	110	Q958 T961 E987	R938-Q958 HydrophobicContact CB-CB 4.27Å; R938-T961 WeakPolarHBondContact CA-OG1 3.32Å; R938-E987 IonicContact CZ-OE1 2.86Å; R938-E987 IonicContact CZ-OE2 3.28Å; R938-E987 IonicContact NE-OE2 2.87Å; R938-E987 IonicContact NH1-OE1 3.16Å; R938-E987 PolarHBondContact NH1-OE1 3.11Å; R938-E987 IonicContact NH1-OE2 3.2Å; R938-E987 PolarHBondContact NH1-OE2 3.03Å; R938-E987 IonicContact NH2-OE1 3.16Å; R938-E987 PolarHBondContact NH2-OE1 2.88Å; R938-E987 IonicContact NH2-OE2 3.17Å; R938-E987 PolarHBondContact NH2-OE2 3.33Å
939	G	92.4	Very high	93.3	Very high	24 Å²	24	43 Å²	43	25%	0.247	22%	0.217	C	C	.	.			trans	-174.2	172.4	-179.7	0	0	0	0	0	113	P937 T961 V962	P937-G939 PolarHBondContact O-N 2.95Å; P937-G939 VanDerWaalsContact O-N 3.13Å; G939-T961 WeakPolarHBondContact O-CA 3.4Å; G939-V962 PolarHBondContact O-N 3.1Å
940	D	95.3	Very high	93.2	Very high	76.75 Å²	76.75	43.3 Å²	43.3	41%	0.41	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114	171.4	-147.3	-10.5	0	0	0	108.3	V962 R964	D940-V962 WeakPolarHBondContact CA-O 3.39Å; D940-V962 HydrophobicContact CB-CB 4.45Å; D940-V962 WeakPolarHBondContact OD1-CB 3.4Å; D940-V962 WeakPolarHBondContact OD1-CG2 3.48Å; D940-R964 VanDerWaalsContact CG-NE 3.32Å; D940-R964 VanDerWaalsContact OD1-CD 3.26Å; D940-R964 WeakPolarHBondContact OD1-CD 3.33Å; D940-R964 WeakPolarHBondContact OD1-CG 3.13Å; D940-R964 IonicContact OD1-NE 2.88Å; D940-R964 PolarHBondContact OD1-NE 2.84Å; D940-R964 IonicContact OD2-CZ 3.03Å; D940-R964 IonicContact OD2-NE 3.33Å; D940-R964 PolarHBondContact OD2-NE 3.03Å; D940-R964 IonicContact OD2-NH2 3.41Å; D940-R964 PolarHBondContact OD2-NH2 3.23Å
941	Y	96.7	Very high	92.7	Very high	5.75 Å²	5.75	45.1 Å²	45.1	2%	0.023	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.3	-175.1	-62.8	-89.2	0	0	0	110.9	P923 N924 I926 L936 P937 T961 V962 L963 R964	P923-Y941 WeakPolarHBondContact O-CE1 3.37Å; N924-Y941 CarbonylContact O-C 3.49Å; N924-Y941 VanDerWaalsContact O-CA 3.28Å; N924-Y941 WeakPolarHBondContact O-CA 3.32Å; I926-Y941 HydrophobicContact CD1-CD1 4.46Å; I926-Y941 HydrophobicContact CD1-CG 4.35Å; I926-Y941 HydrophobicContact CG2-CD1 4.08Å; L936-Y941 HydrophobicContact CB-CE2 4.37Å; L936-Y941 HydrophobicContact CD2-CE1 4.28Å; P937-Y941 VanDerWaalsContact CD-OH 3.26Å; P937-Y941 WeakPolarHBondContact CD-OH 3.44Å; P937-Y941 WeakPolarHBondContact CG-OH 3.37Å; P937-Y941 WeakPolarHBondContact O-CE2 3.27Å; P937-Y941 PolarHBondContact O-OH 2.81Å; P937-Y941 VanDerWaalsContact O-OH 3.09Å; Y941-T961 HydrophobicContact CD2-CG2 3.84Å; Y941-T961 HydrophobicContact CE2-CG2 3.84Å; Y941-V962 PolarHBondContact N-O 3.11Å; Y941-L963 HydrophobicContact CD2-CD2 3.88Å; Y941-L963 HydrophobicContact CG-CD2 4.11Å; Y941-R964 PolarHBondContact O-N 3.11Å
942	L	96.1	Very high	92.3	Very high	56.75 Å²	56.75	42.3 Å²	42.3	30%	0.297	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.9	172.3	-179.2	68.4	0	0	0	109.6	N924 I925 I926 V944 R964 Q966 A994	N924-L942 PolarHBondContact O-N 3.12Å; I925-L942 WeakPolarHBondContact CA-O 3.37Å; I926-L942 PolarHBondContact N-O 3.19Å; L942-V944 HydrophobicContact CD2-CG1 3.95Å; L942-V944 HydrophobicContact CG-CG1 3.93Å; L942-R964 HydrophobicContact CD1-CB 4.49Å; L942-Q966 HydrophobicContact CD1-CG 4.17Å; L942-A994 HydrophobicContact CD1-CB 3.64Å
943	V	96.3	Very high	92.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	110.1	178	-166.5	0	0	0	0	109.5	I926 D945 L947 L963 R964 F965 Q966 I969	I926-V943 HydrophobicContact CD1-CG2 4.06Å; I926-V943 HydrophobicContact CG1-CB 4.47Å; I926-V943 HydrophobicContact CG1-CG2 3.89Å; I926-V943 VanDerWaalsContact O-CA 3.3Å; I926-V943 WeakPolarHBondContact O-CA 3.31Å; V943-D945 VanDerWaalsContact CG1-O 3.23Å; V943-D945 WeakPolarHBondContact CG1-O 3.41Å; V943-L947 HydrophobicContact CG1-CB 4.26Å; V943-L963 HydrophobicContact CG2-CB 4.14Å; V943-R964 PolarHBondContact N-O 3.24Å; V943-F965 HydrophobicContact CB-CD1 3.63Å; V943-F965 HydrophobicContact CB-CE1 3.92Å; V943-F965 HydrophobicContact CB-CG 4.1Å; V943-F965 HydrophobicContact CG1-CD1 3.67Å; V943-F965 HydrophobicContact CG1-CE1 3.67Å; V943-F965 HydrophobicContact CG2-CD1 3.98Å; V943-F965 HydrophobicContact CG2-CD2 4.38Å; V943-F965 HydrophobicContact CG2-CE1 3.89Å; V943-F965 HydrophobicContact CG2-CE2 4.36Å; V943-F965 HydrophobicContact CG2-CG 4.27Å; V943-F965 HydrophobicContact CG2-CZ 4.08Å; V943-Q966 PolarHBondContact O-N 3.12Å; V943-I969 HydrophobicContact CG1-CG2 4.08Å
944	V	93.8	Very high	92.1	Very high	34.5 Å²	34.5	34.6 Å²	34.6	21%	0.209	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-23.2	-173.9	-62.7	0	0	0	0	113.7	I925 I926 L942 Q966 I969	I925-V944 HydrophobicContact CG2-CB 4.42Å; I925-V944 HydrophobicContact CG2-CG1 3.73Å; I925-V944 HydrophobicContact CG2-CG2 3.73Å; I926-V944 PolarHBondContact O-N 3.14Å; I926-V944 VanDerWaalsContact O-N 3.08Å; L942-V944 HydrophobicContact CD2-CG1 3.95Å; L942-V944 HydrophobicContact CG-CG1 3.93Å; V944-Q966 HydrophobicContact CG1-CG 4.45Å; V944-I969 WeakPolarHBondContact O-CD1 3.26Å
945	D	94.6	Very high	92.2	Very high	19.25 Å²	19.25	33.6 Å²	33.6	10%	0.103	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	159.2	175.9	-62.1	-53.6	0	0	0	109.3	K884 R885 G927 V943 L947 I969	K884-D945 HydrophobicContact CD-CB 4.25Å; K884-D945 WeakPolarHBondContact CD-OD1 3.34Å; K884-D945 WeakPolarHBondContact CD-OD2 3.39Å; K884-D945 VanDerWaalsContact NZ-CG 3.33Å; K884-D945 IonicContact NZ-OD1 3.04Å; K884-D945 PolarHBondContact NZ-OD1 2.85Å; K884-D945 VanDerWaalsContact NZ-OD1 3.11Å; K884-D945 IonicContact NZ-OD2 3.23Å; K884-D945 PolarHBondContact NZ-OD2 3.02Å; R885-D945 IonicContact NH1-OD1 2.99Å; R885-D945 PolarHBondContact NH1-OD1 2.99Å; G927-D945 WeakPolarHBondContact CA-O 3.43Å; V943-D945 VanDerWaalsContact CG1-O 3.23Å; V943-D945 WeakPolarHBondContact CG1-O 3.41Å; D945-L947 PolarHBondContact O-N 3.06Å; D945-I969 VanDerWaalsContact C-CG2 3.41Å; D945-I969 VanDerWaalsContact O-CG2 3.3Å; D945-I969 WeakPolarHBondContact O-CG2 3.36Å
946	D	96.2	Very high	92.2	Very high	1.25 Å²	1.25	29 Å²	29	1%	0.007	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	128.2	-178.4	-83.5	0.6	0	0	0	111.1	R819 K884 R885 Y886 G928 H948 I969 G970	R819-D946 IonicContact CZ-OD1 3.24Å; R819-D946 IonicContact CZ-OD2 3.48Å; R819-D946 VanDerWaalsContact CZ-OD2 3.29Å; R819-D946 VanDerWaalsContact NH1-CG 3.35Å; R819-D946 IonicContact NH1-OD1 3.04Å; R819-D946 PolarHBondContact NH1-OD1 2.97Å; R819-D946 IonicContact NH1-OD2 3.25Å; R819-D946 PolarHBondContact NH1-OD2 2.94Å; R819-D946 VanDerWaalsContact NH2-CG 3.29Å; R819-D946 IonicContact NH2-OD1 3.44Å; R819-D946 PolarHBondContact NH2-OD1 3.15Å; R819-D946 IonicContact NH2-OD2 3.44Å; R819-D946 PolarHBondContact NH2-OD2 2.99Å; R819-D946 VanDerWaalsContact NH2-OD2 3.07Å; K884-D946 PolarHBondContact O-N 3.32Å; K884-D946 VanDerWaalsContact O-N 3.09Å; R885-D946 VanDerWaalsContact CA-OD2 3.25Å; R885-D946 WeakPolarHBondContact CA-OD2 3.35Å; Y886-D946 HydrophobicContact CD1-CB 3.82Å; Y886-D946 WeakPolarHBondContact CD1-OD2 3.41Å; Y886-D946 HydrophobicContact CE1-CB 4.49Å; Y886-D946 WeakPolarHBondContact CE1-OD2 3.31Å; Y886-D946 PolarHBondContact N-OD2 3.13Å; Y886-D946 VanDerWaalsContact N-OD2 3.09Å; G928-D946 CarbonylContact C-O 3.31Å; G928-D946 WeakPolarHBondContact CA-O 3.27Å; G928-D946 PolarHBondContact N-O 3.07Å; D946-H948 PolarHBondContact O-N 3.05Å; D946-I969 WeakPolarHBondContact OD1-CA 3.33Å; D946-G970 CarbonylContact C-O 3.51Å; D946-G970 VanDerWaalsContact CA-O 3.3Å; D946-G970 WeakPolarHBondContact CA-O 3.3Å; D946-G970 PolarHBondContact OD1-N 2.78Å
947	L	96.3	Very high	92.2	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	110.6	179.8	-173.6	64.6	0	0	0	109.5	F917 I926 V930 V943 D945 L955 L963 F965 G970 M971 L972	F917-L947 HydrophobicContact CD2-CD1 4Å; F917-L947 HydrophobicContact CE2-CD1 4.47Å; I926-L947 HydrophobicContact CD1-CD2 4.43Å; V930-L947 HydrophobicContact CG2-CD1 3.97Å; V943-L947 HydrophobicContact CG1-CB 4.26Å; D945-L947 PolarHBondContact O-N 3.06Å; L947-L955 HydrophobicContact CD2-CD2 3.92Å; L947-L955 HydrophobicContact CG-CD2 4.48Å; L947-L963 HydrophobicContact CD2-CD1 4.32Å; L947-F965 HydrophobicContact CB-CE1 4.47Å; L947-G970 PolarHBondContact N-O 2.81Å; L947-M971 HydrophobicContact CB-CB 4.42Å; L947-M971 HydrophobicContact CB-CG 4.18Å; L947-M971 HydrophobicContact CD2-CE 3.9Å; L947-M971 HydrophobicContact CD2-CG 4.37Å; L947-M971 HydrophobicContact CD2-SD 4.17Å; L947-M971 HydrophobicContact CG-CE 4.46Å; L947-M971 HydrophobicContact CG-CG 4.42Å; L947-M971 CarbonylContact O-C 3.56Å; L947-M971 VanDerWaalsContact O-CA 3.24Å; L947-M971 WeakPolarHBondContact O-CA 3.34Å; L947-M971 WeakPolarHBondContact O-CG 3.38Å; L947-L972 PolarHBondContact O-N 3.2Å
948	H	94.1	Very high	92.3	Very high	6.75 Å²	6.75	30.2 Å²	30.2	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.1	-177.3	174.9	-156	0	0	0	110.8	G928 T929 V930 D946 S950 L972 Q974	G928-H948 PolarHBondContact O-N 3.04Å; T929-H948 CarbonylContact C-O 3.52Å; T929-H948 VanDerWaalsContact CA-O 3.29Å; T929-H948 WeakPolarHBondContact CA-O 3.23Å; T929-H948 HydrophobicContact CG2-CB 4.38Å; T929-H948 PolarHBondContact OG1-ND1 2.89Å; V930-H948 PolarHBondContact N-O 3.08Å; D946-H948 PolarHBondContact O-N 3.05Å; H948-S950 PolarHBondContact O-N 3.02Å; H948-L972 CarbonylContact C-O 3.52Å; H948-L972 WeakPolarHBondContact CA-O 3.35Å; H948-L972 HydrophobicContact CB-CB 4.49Å; H948-Q974 PolarHBondContact CE1-OE1 3.01Å; H948-Q974 PolarHBondContact NE2-OE1 3.09Å
949	V	93.5	Very high	92.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	107.5	171.4	-172.4	0	0	0	0	108	S953 L955 M971 L972 Q974 G975	V949-S953 WeakPolarHBondContact CG1-O 3.33Å; V949-S953 WeakPolarHBondContact CG1-OG 3.41Å; V949-L955 HydrophobicContact CG1-CB 4.32Å; V949-L955 HydrophobicContact CG2-CB 3.92Å; V949-L955 HydrophobicContact CG2-CD2 3.97Å; V949-M971 HydrophobicContact CG2-CE 3.94Å; V949-L972 PolarHBondContact N-O 3.06Å; V949-Q974 CarbonylContact O-C 3.57Å; V949-Q974 WeakPolarHBondContact O-CA 3.4Å; V949-Q974 VanDerWaalsContact O-CB 3.3Å; V949-Q974 WeakPolarHBondContact O-CB 3.4Å; V949-Q974 PolarHBondContact O-N 3Å; V949-G975 PolarHBondContact O-N 2.97Å; V949-G975 VanDerWaalsContact O-N 3.08Å
950	S	89.1	Confident	92.3	Very high	15.5 Å²	15.5	23.3 Å²	23.3	11%	0.108	15%	0.145	C	C	.	.			trans	-68	155.8	-176.3	85.1	0	0	0	0	112.2	V930 Y931 H948 G952 S953 G975	V930-S950 VanDerWaalsContact O-CB 3.31Å; V930-S950 WeakPolarHBondContact O-CB 3.27Å; V930-S950 PolarHBondContact O-N 3.22Å; V930-S950 VanDerWaalsContact O-N 3.14Å; V930-S950 PolarHBondContact O-OG 2.88Å; Y931-S950 WeakPolarHBondContact CA-OG 3.31Å; H948-S950 PolarHBondContact O-N 3.02Å; S950-G952 PolarHBondContact O-N 2.99Å; S950-S953 PolarHBondContact N-OG 3.03Å; S950-S953 VanDerWaalsContact N-OG 3.13Å; S950-S953 WeakPolarHBondContact O-CB 3.1Å; S950-S953 PolarHBondContact O-N 3.26Å; S950-S953 VanDerWaalsContact O-N 3.12Å; S950-S953 PolarHBondContact O-OG 3.29Å; S950-S953 PolarHBondContact OG-OG 3.02Å; S950-S953 VanDerWaalsContact OG-OG 3.06Å; S950-G975 VanDerWaalsContact O-CA 3.24Å; S950-G975 WeakPolarHBondContact O-CA 3.3Å; S950-G975 PolarHBondContact O-N 2.97Å; S950-G975 VanDerWaalsContact O-N 3.13Å
951	P	83.5	Confident	92.3	Very high	36.75 Å²	36.75	19.6 Å²	19.6	24%	0.239	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	135.1	174.4	-24.2	33.2	0	0	0	112	S953 Q974 L1127 V1255	P951-S953 VanDerWaalsContact C-N 3.28Å; P951-S953 PolarHBondContact O-N 3.12Å; P951-Q974 WeakPolarHBondContact CA-O 3.42Å; P951-Q974 HydrophobicContact CG-CB 3.91Å; P951-L1127 HydrophobicContact CG-CD1 4.2Å; P951-V1255 HydrophobicContact CB-CG1 3.57Å; P951-V1255 HydrophobicContact CG-CG1 3.61Å
952	G	79.7	Confident	92.3	Very high	62.75 Å²	62.75	20.5 Å²	20.5	65%	0.647	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	-9.4	-178.9	0	0	0	0	0	116	S950	S950-G952 PolarHBondContact O-N 2.99Å
953	S	87.5	Confident	92.3	Very high	1.25 Å²	1.25	17.8 Å²	17.8	1%	0.009	12%	0.117	C	C	.	.			trans	-91.3	146.4	173.8	71.1	0	0	0	0	111.9	V930 N933 V949 S950 P951 G975 E976	V930-S953 WeakPolarHBondContact O-CB 3.4Å; V930-S953 PolarHBondContact O-OG 3.24Å; V930-S953 VanDerWaalsContact O-OG 3.1Å; N933-S953 WeakPolarHBondContact OD1-CA 3.35Å; V949-S953 WeakPolarHBondContact CG1-O 3.33Å; V949-S953 WeakPolarHBondContact CG1-OG 3.41Å; S950-S953 PolarHBondContact N-OG 3.03Å; S950-S953 VanDerWaalsContact N-OG 3.13Å; S950-S953 WeakPolarHBondContact O-CB 3.1Å; S950-S953 PolarHBondContact O-N 3.26Å; S950-S953 VanDerWaalsContact O-N 3.12Å; S950-S953 PolarHBondContact O-OG 3.29Å; S950-S953 PolarHBondContact OG-OG 3.02Å; S950-S953 VanDerWaalsContact OG-OG 3.06Å; P951-S953 VanDerWaalsContact C-N 3.28Å; P951-S953 PolarHBondContact O-N 3.12Å; S953-G975 CarbonylContact O-C 3.57Å; S953-G975 VanDerWaalsContact O-CA 3.27Å; S953-G975 WeakPolarHBondContact O-CA 3.45Å; S953-E976 PolarHBondContact O-N 2.94Å
954	I	90.7	Very high	92.4	Very high	46.75 Å²	46.75	21.6 Å²	21.6	24%	0.24	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.5	178.9	-52.8	180	0	0	0	108.8	N933 T934 E976 V978	N933-I954 CarbonylContact C-O 3.45Å; N933-I954 VanDerWaalsContact CA-O 3.29Å; N933-I954 WeakPolarHBondContact CA-O 3.26Å; N933-I954 HydrophobicContact CB-CB 4.42Å; N933-I954 PolarHBondContact OD1-N 3.21Å; T934-I954 PolarHBondContact N-O 3.07Å; I954-E976 WeakPolarHBondContact CA-O 3.39Å; I954-E976 HydrophobicContact CB-CB 4.44Å; I954-E976 HydrophobicContact CG1-CB 4.1Å; I954-E976 HydrophobicContact CG1-CG 4.46Å; I954-E976 HydrophobicContact CG2-CB 4.21Å; I954-V978 HydrophobicContact CG2-CB 4.29Å; I954-V978 HydrophobicContact CG2-CG2 3.79Å
955	L	93.2	Very high	92.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	111.4	169.1	-179.5	62.3	0	0	0	109	L936 L947 V949 L957 M971 E976 L977 V978	L936-L955 HydrophobicContact CD1-CD1 3.97Å; L936-L955 HydrophobicContact CG-CD1 3.98Å; L947-L955 HydrophobicContact CD2-CD2 3.92Å; L947-L955 HydrophobicContact CG-CD2 4.48Å; V949-L955 HydrophobicContact CG1-CB 4.32Å; V949-L955 HydrophobicContact CG2-CB 3.92Å; V949-L955 HydrophobicContact CG2-CD2 3.97Å; L955-L957 HydrophobicContact CD1-CD2 4.45Å; L955-L957 HydrophobicContact CD2-CD2 4.47Å; L955-L957 HydrophobicContact CG-CD2 4.2Å; L955-M971 HydrophobicContact CD2-CE 3.86Å; L955-E976 PolarHBondContact N-O 3.06Å; L955-L977 HydrophobicContact CB-CD1 4.06Å; L955-L977 HydrophobicContact CD2-CD1 3.89Å; L955-L977 HydrophobicContact CG-CD1 4.01Å; L955-L977 WeakPolarHBondContact O-CA 3.25Å; L955-V978 PolarHBondContact O-N 3.42Å
956	T	92.4	Very high	92.5	Very high	17.25 Å²	17.25	21.9 Å²	21.9	11%	0.106	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.5	-178.6	-39.7	0	0	0	0	110.5	T934 D935 L936 V978 T980	T934-T956 PolarHBondContact O-N 3.03Å; D935-T956 WeakPolarHBondContact OD1-CB 3.39Å; D935-T956 WeakPolarHBondContact OD1-CG2 3.43Å; D935-T956 PolarHBondContact OD1-OG1 3.08Å; L936-T956 PolarHBondContact N-O 3.15Å; T956-V978 CarbonylContact C-O 3.44Å; T956-V978 VanDerWaalsContact CA-O 3.31Å; T956-V978 WeakPolarHBondContact CA-O 3.33Å; T956-V978 HydrophobicContact CG2-CB 4.16Å; T956-V978 HydrophobicContact CG2-CG1 4.16Å; T956-T980 HydrophobicContact CG2-CG2 3.25Å
957	L	93.3	Very high	92.3	Very high	0.25 Å²	0.25	22.7 Å²	22.7	0%	0.001	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.4	-179.8	-57.7	-176.9	0	0	0	111.1	L936 L955 L963 L977 V978 R979 T980 I989 F991	L936-L957 HydrophobicContact CB-CD2 3.9Å; L936-L957 HydrophobicContact CD1-CD2 3.71Å; L936-L957 HydrophobicContact CG-CD2 4.19Å; L955-L957 HydrophobicContact CD1-CD2 4.45Å; L955-L957 HydrophobicContact CD2-CD2 4.47Å; L955-L957 HydrophobicContact CG-CD2 4.2Å; L957-L963 HydrophobicContact CD1-CD1 4.45Å; L957-L977 HydrophobicContact CD1-CD1 3.96Å; L957-L977 HydrophobicContact CG-CD1 4.16Å; L957-V978 PolarHBondContact N-O 2.99Å; L957-R979 WeakPolarHBondContact O-CA 3.25Å; L957-T980 PolarHBondContact O-N 2.92Å; L957-T980 PolarHBondContact O-OG1 3.05Å; L957-I989 HydrophobicContact CB-CD1 3.66Å; L957-I989 HydrophobicContact CB-CG1 4.4Å; L957-I989 HydrophobicContact CD1-CD1 4.22Å; L957-I989 HydrophobicContact CD1-CG2 3.91Å; L957-F991 HydrophobicContact CD1-CE1 3.85Å; L957-F991 HydrophobicContact CD1-CZ 3.81Å
958	Q	92	Very high	92.1	Very high	82.5 Å²	82.5	22.7 Å²	22.7	39%	0.386	13%	0.134	S	C	.	.			trans	-77	148.1	171.5	-72	-171.7	-15.2	0	0	112.5	L936 R938 G960 T961 T980	L936-Q958 PolarHBondContact O-N 3.04Å; R938-Q958 HydrophobicContact CB-CB 4.27Å; Q958-G960 PolarHBondContact O-N 3.27Å; Q958-T961 VanDerWaalsContact O-CB 3.25Å; Q958-T961 WeakPolarHBondContact O-CB 3.4Å; Q958-T961 PolarHBondContact O-N 3.01Å; Q958-T961 VanDerWaalsContact O-N 3.15Å; Q958-T961 PolarHBondContact O-OG1 3.22Å; Q958-T980 WeakPolarHBondContact CA-OG1 3.35Å; Q958-T980 HydrophobicContact CG-CG2 4.32Å; Q958-T980 WeakPolarHBondContact CG-OG1 3.47Å
959	P	92.4	Very high	92.1	Very high	8.5 Å²	8.5	22.4 Å²	22.4	6%	0.055	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	137.9	170.8	-27.6	35.6	0	0	0	112.1	T961 T980 E987	P959-T961 VanDerWaalsContact C-N 3.31Å; P959-T980 WeakPolarHBondContact CD-O 3.26Å; P959-T980 VanDerWaalsContact CD-OG1 3.23Å; P959-T980 WeakPolarHBondContact CD-OG1 3.38Å; P959-T980 VanDerWaalsContact CG-O 3.29Å; P959-T980 WeakPolarHBondContact CG-O 3.36Å; P959-E987 HydrophobicContact CB-CB 4.45Å
960	G	91.5	Very high	92.2	Very high	16.5 Å²	16.5	22.4 Å²	22.4	17%	0.17	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	5.9	-176.4	0	0	0	0	0	115.2	Q958 P988	Q958-G960 PolarHBondContact O-N 3.27Å; G960-P988 PolarHBondContact N-O 3Å
961	T	95.1	Very high	92.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.127	C	C	.	.			trans	-69.9	137	171.6	-60.6	0	0	0	0	110.9	P937 R938 G939 Y941 Q958 P959 L963 I989 L990	P937-T961 PolarHBondContact O-OG1 3.03Å; R938-T961 WeakPolarHBondContact CA-OG1 3.32Å; G939-T961 WeakPolarHBondContact O-CA 3.4Å; Y941-T961 HydrophobicContact CD2-CG2 3.84Å; Y941-T961 HydrophobicContact CE2-CG2 3.84Å; Q958-T961 VanDerWaalsContact O-CB 3.25Å; Q958-T961 WeakPolarHBondContact O-CB 3.4Å; Q958-T961 PolarHBondContact O-N 3.01Å; Q958-T961 VanDerWaalsContact O-N 3.15Å; Q958-T961 PolarHBondContact O-OG1 3.22Å; P959-T961 VanDerWaalsContact C-N 3.31Å; T961-L963 HydrophobicContact CG2-CD2 4.1Å; T961-I989 WeakPolarHBondContact O-CA 3.21Å; T961-L990 PolarHBondContact O-N 2.81Å
962	V	96.9	Very high	93.1	Very high	24.5 Å²	24.5	19.9 Å²	19.9	15%	0.148	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.3	177.4	-174.9	0	0	0	0	109.3	G939 D940 Y941 R964 L990 T992	G939-V962 PolarHBondContact O-N 3.1Å; D940-V962 WeakPolarHBondContact CA-O 3.39Å; D940-V962 HydrophobicContact CB-CB 4.45Å; D940-V962 WeakPolarHBondContact OD1-CB 3.4Å; D940-V962 WeakPolarHBondContact OD1-CG2 3.48Å; Y941-V962 PolarHBondContact N-O 3.11Å; V962-R964 HydrophobicContact CG1-CG 4.06Å; V962-L990 CarbonylContact C-O 3.5Å; V962-L990 VanDerWaalsContact CA-O 3.31Å; V962-L990 WeakPolarHBondContact CA-O 3.31Å; V962-L990 HydrophobicContact CG1-CB 4.33Å; V962-L990 HydrophobicContact CG1-CD2 4.07Å; V962-L990 HydrophobicContact CG1-CG 4.26Å; V962-L990 HydrophobicContact CG2-CB 4.28Å; V962-L990 HydrophobicContact CG2-CD2 4.45Å; V962-T992 HydrophobicContact CG1-CG2 4.33Å
963	L	97.2	Very high	93.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.8	170.1	-55	-170.7	0	0	0	109.2	I926 Y941 V943 L947 L957 T961 F965 L990 F991 T992	I926-L963 HydrophobicContact CD1-CD2 4.09Å; Y941-L963 HydrophobicContact CD2-CD2 3.88Å; Y941-L963 HydrophobicContact CG-CD2 4.11Å; V943-L963 HydrophobicContact CG2-CB 4.14Å; L947-L963 HydrophobicContact CD2-CD1 4.32Å; L957-L963 HydrophobicContact CD1-CD1 4.45Å; T961-L963 HydrophobicContact CG2-CD2 4.1Å; L963-F965 HydrophobicContact CB-CD2 4.36Å; L963-F965 HydrophobicContact CB-CE2 3.67Å; L963-F965 HydrophobicContact CB-CZ 4.22Å; L963-F965 HydrophobicContact CD1-CE2 4.41Å; L963-F965 HydrophobicContact CD1-CZ 4.23Å; L963-L990 PolarHBondContact N-O 2.94Å; L963-F991 HydrophobicContact CB-CD1 3.71Å; L963-F991 HydrophobicContact CB-CE1 4.08Å; L963-F991 HydrophobicContact CD1-CD1 3.82Å; L963-F991 HydrophobicContact CD1-CE1 3.32Å; L963-F991 HydrophobicContact CD1-CZ 3.9Å; L963-F991 HydrophobicContact CG-CD1 3.77Å; L963-F991 HydrophobicContact CG-CE1 3.6Å; L963-F991 WeakPolarHBondContact O-CA 3.3Å; L963-T992 PolarHBondContact O-N 3.1Å
964	R	97	Very high	93.8	Very high	78.75 Å²	78.75	16.9 Å²	16.9	30%	0.297	9%	0.085	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	104.7	178.3	-66.6	-173.9	-175.3	-79.8	-2	109.9	D940 Y941 L942 V943 V962 T992 A994	D940-R964 VanDerWaalsContact CG-NE 3.32Å; D940-R964 VanDerWaalsContact OD1-CD 3.26Å; D940-R964 WeakPolarHBondContact OD1-CD 3.33Å; D940-R964 WeakPolarHBondContact OD1-CG 3.13Å; D940-R964 IonicContact OD1-NE 2.88Å; D940-R964 PolarHBondContact OD1-NE 2.84Å; D940-R964 IonicContact OD2-CZ 3.03Å; D940-R964 IonicContact OD2-NE 3.33Å; D940-R964 PolarHBondContact OD2-NE 3.03Å; D940-R964 IonicContact OD2-NH2 3.41Å; D940-R964 PolarHBondContact OD2-NH2 3.23Å; Y941-R964 PolarHBondContact O-N 3.11Å; L942-R964 HydrophobicContact CD1-CB 4.49Å; V943-R964 PolarHBondContact N-O 3.24Å; V962-R964 HydrophobicContact CG1-CG 4.06Å; R964-T992 CarbonylContact C-O 3.49Å; R964-T992 VanDerWaalsContact CA-O 3.31Å; R964-T992 WeakPolarHBondContact CA-O 3.36Å; R964-T992 HydrophobicContact CG-CG2 4.1Å; R964-A994 HydrophobicContact CB-CB 4.1Å
965	F	96.6	Very high	93.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	131.8	-179.4	-66.8	-96.3	0	0	0	111	V943 L947 L963 I969 M971 F991 T992 A994 W1119	V943-F965 HydrophobicContact CB-CD1 3.63Å; V943-F965 HydrophobicContact CB-CE1 3.92Å; V943-F965 HydrophobicContact CB-CG 4.1Å; V943-F965 HydrophobicContact CG1-CD1 3.67Å; V943-F965 HydrophobicContact CG1-CE1 3.67Å; V943-F965 HydrophobicContact CG2-CD1 3.98Å; V943-F965 HydrophobicContact CG2-CD2 4.38Å; V943-F965 HydrophobicContact CG2-CE1 3.89Å; V943-F965 HydrophobicContact CG2-CE2 4.36Å; V943-F965 HydrophobicContact CG2-CG 4.27Å; V943-F965 HydrophobicContact CG2-CZ 4.08Å; L947-F965 HydrophobicContact CB-CE1 4.47Å; L963-F965 HydrophobicContact CB-CD2 4.36Å; L963-F965 HydrophobicContact CB-CE2 3.67Å; L963-F965 HydrophobicContact CB-CZ 4.22Å; L963-F965 HydrophobicContact CD1-CE2 4.41Å; L963-F965 HydrophobicContact CD1-CZ 4.23Å; F965-I969 HydrophobicContact CD1-CG2 4.1Å; F965-M971 HydrophobicContact CE1-CB 4.12Å; F965-M971 HydrophobicContact CZ-CB 4.17Å; F965-F991 HydrophobicContact CE2-CB 4.06Å; F965-F991 HydrophobicContact CE2-CD1 4.4Å; F965-F991 HydrophobicContact CE2-CD2 4.49Å; F965-F991 HydrophobicContact CE2-CG 4.11Å; F965-T992 PolarHBondContact N-O 3.12Å; F965-A994 WeakPolarHBondContact O-CB 3.34Å; F965-A994 PolarHBondContact O-N 3.04Å; F965-W1119 HydrophobicContact CB-CB 3.58Å; F965-W1119 HydrophobicContact CB-CD2 3.76Å; F965-W1119 HydrophobicContact CB-CE3 3.77Å; F965-W1119 HydrophobicContact CB-CG 3.7Å; F965-W1119 AromaticContact CD1-CE3 3.91Å; F965-W1119 HydrophobicContact CD1-CE3 3.91Å; F965-W1119 HydrophobicContact CD1-CZ3 4.21Å; F965-W1119 AromaticContact CD2-CD2 3.98Å; F965-W1119 HydrophobicContact CD2-CD2 4Å; F965-W1119 AromaticContact CD2-CE3 3.67Å; F965-W1119 HydrophobicContact CD2-CE3 3.67Å; F965-W1119 HydrophobicContact CD2-CH2 4.08Å; F965-W1119 HydrophobicContact CD2-CZ2 4.37Å; F965-W1119 AromaticContact CD2-CZ3 3.71Å; F965-W1119 HydrophobicContact CD2-CZ3 3.71Å; F965-W1119 HydrophobicContact CE1-CE3 4.42Å; F965-W1119 HydrophobicContact CE1-CZ3 4.28Å; F965-W1119 HydrophobicContact CE2-CE3 4.22Å; F965-W1119 HydrophobicContact CE2-CH2 4.07Å; F965-W1119 AromaticContact CE2-CZ3 3.79Å; F965-W1119 HydrophobicContact CE2-CZ3 3.79Å; F965-W1119 AromaticContact CG-CD2 3.93Å; F965-W1119 HydrophobicContact CG-CD2 3.93Å; F965-W1119 AromaticContact CG-CE3 3.5Å; F965-W1119 HydrophobicContact CG-CE3 3.5Å; F965-W1119 VanDerWaalsContact CG-CE3 3.46Å; F965-W1119 HydrophobicContact CG-CG 4.4Å; F965-W1119 AromaticContact CG-CZ3 3.94Å; F965-W1119 HydrophobicContact CG-CZ3 3.94Å; F965-W1119 HydrophobicContact CZ-CZ3 4.09Å
966	Q	94.2	Very high	93.4	Very high	59.75 Å²	59.75	17.4 Å²	17.4	28%	0.279	9%	0.087	S	C	.	.	P	Polyproline II helix	trans	-63.7	163.1	165.8	-68.8	-171	-19.7	0	0	110.9	N817 L942 V943 V944 S968 I969 A994 W1119	N817-Q966 WeakPolarHBondContact ND2-CB 3.19Å; N817-Q966 PolarHBondContact ND2-OE1 3.15Å; N817-Q966 VanDerWaalsContact ND2-OE1 3.13Å; L942-Q966 HydrophobicContact CD1-CG 4.17Å; V943-Q966 PolarHBondContact O-N 3.12Å; V944-Q966 HydrophobicContact CG1-CG 4.45Å; Q966-S968 PolarHBondContact O-N 3.3Å; Q966-I969 HydrophobicContact CB-CG1 3.83Å; Q966-I969 WeakPolarHBondContact O-CB 3.27Å; Q966-I969 WeakPolarHBondContact O-CG1 3.27Å; Q966-I969 PolarHBondContact O-N 3.17Å; Q966-A994 HydrophobicContact CG-CB 4.37Å; Q966-W1119 WeakPolarHBondContact O-CB 3.15Å
967	N	91.6	Very high	93.3	Very high	18.25 Å²	18.25	16.7 Å²	16.7	10%	0.098	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	146.8	179.1	64.2	-54.7	0	0	0	111.5	L815 L816 N817 I969 P1117 M1118	L815-N967 PolarHBondContact O-ND2 3.03Å; L815-N967 VanDerWaalsContact O-ND2 3.1Å; L815-N967 PolarHBondContact O-OD1 3.13Å; L816-N967 WeakPolarHBondContact CA-OD1 3.32Å; N817-N967 VanDerWaalsContact CB-O 3.27Å; N817-N967 WeakPolarHBondContact CB-O 3.36Å; N817-N967 PolarHBondContact N-ND2 3.12Å; N817-N967 VanDerWaalsContact N-ND2 3.16Å; N817-N967 PolarHBondContact N-OD1 2.83Å; N817-N967 PolarHBondContact ND2-O 3.1Å; N817-N967 VanDerWaalsContact ND2-O 3.1Å; N967-I969 WeakPolarHBondContact O-CG1 3.34Å; N967-I969 PolarHBondContact O-N 3.28Å; N967-I969 VanDerWaalsContact O-N 3.1Å; N967-P1117 HydrophobicContact CB-CB 3.83Å; N967-P1117 HydrophobicContact CB-CG 4.13Å; N967-M1118 CarbonylContact C-O 3.55Å; N967-M1118 VanDerWaalsContact CA-O 3.3Å; N967-M1118 WeakPolarHBondContact CA-O 3.23Å
968	S	91.7	Very high	93.2	Very high	0.25 Å²	0.25	18.8 Å²	18.8	0%	0.002	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	3.4	-176.7	-45.9	0	0	0	0	116.4	N817 R819 Q966 M1118 L1149	N817-S968 WeakPolarHBondContact O-CB 3.33Å; N817-S968 PolarHBondContact O-OG 3.09Å; R819-S968 WeakPolarHBondContact CD-O 3.27Å; R819-S968 VanDerWaalsContact CG-O 3.25Å; R819-S968 WeakPolarHBondContact CG-O 3.45Å; R819-S968 PolarHBondContact NE-O 2.97Å; R819-S968 PolarHBondContact NH1-O 2.85Å; R819-S968 PolarHBondContact NH2-O 3.1Å; Q966-S968 PolarHBondContact O-N 3.3Å; S968-M1118 PolarHBondContact N-O 2.95Å; S968-L1149 WeakPolarHBondContact CA-O 3.5Å
969	I	95.1	Very high	93	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.079	C	C	.	.			trans	-89.6	139.6	176	-53.6	-53.1	0	0	0	109.8	N817 R885 V943 V944 D945 D946 F965 Q966 N967 W1119 A1120	N817-I969 HydrophobicContact CB-CD1 4.26Å; R885-I969 VanDerWaalsContact NH1-CD1 3.3Å; R885-I969 VanDerWaalsContact NH2-CD1 3.29Å; V943-I969 HydrophobicContact CG1-CG2 4.08Å; V944-I969 WeakPolarHBondContact O-CD1 3.26Å; D945-I969 VanDerWaalsContact C-CG2 3.41Å; D945-I969 VanDerWaalsContact O-CG2 3.3Å; D945-I969 WeakPolarHBondContact O-CG2 3.36Å; D946-I969 WeakPolarHBondContact OD1-CA 3.33Å; F965-I969 HydrophobicContact CD1-CG2 4.1Å; Q966-I969 HydrophobicContact CB-CG1 3.83Å; Q966-I969 WeakPolarHBondContact O-CB 3.27Å; Q966-I969 WeakPolarHBondContact O-CG1 3.27Å; Q966-I969 PolarHBondContact O-N 3.17Å; N967-I969 WeakPolarHBondContact O-CG1 3.34Å; N967-I969 PolarHBondContact O-N 3.28Å; N967-I969 VanDerWaalsContact O-N 3.1Å; I969-W1119 WeakPolarHBondContact O-CB 3.28Å; I969-A1120 PolarHBondContact O-N 3.06Å
970	G	95	Very high	92.6	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	-178.7	180	0	0	0	0	0	113.7	D946 L947 G1121	D946-G970 CarbonylContact C-O 3.51Å; D946-G970 VanDerWaalsContact CA-O 3.3Å; D946-G970 WeakPolarHBondContact CA-O 3.3Å; D946-G970 PolarHBondContact OD1-N 2.78Å; L947-G970 PolarHBondContact N-O 2.81Å; G970-G1121 WeakPolarHBondContact CA-O 3.34Å
971	M	96.5	Very high	91.6	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.4	173.3	-177.5	176.9	-171.5	0	0	110.2	L947 V949 L955 F965 V973 L977 F991 G1121 V1122 R1123	L947-M971 HydrophobicContact CB-CB 4.42Å; L947-M971 HydrophobicContact CB-CG 4.18Å; L947-M971 HydrophobicContact CD2-CE 3.9Å; L947-M971 HydrophobicContact CD2-CG 4.37Å; L947-M971 HydrophobicContact CD2-SD 4.17Å; L947-M971 HydrophobicContact CG-CE 4.46Å; L947-M971 HydrophobicContact CG-CG 4.42Å; L947-M971 CarbonylContact O-C 3.56Å; L947-M971 VanDerWaalsContact O-CA 3.24Å; L947-M971 WeakPolarHBondContact O-CA 3.34Å; L947-M971 WeakPolarHBondContact O-CG 3.38Å; V949-M971 HydrophobicContact CG2-CE 3.94Å; L955-M971 HydrophobicContact CD2-CE 3.86Å; F965-M971 HydrophobicContact CE1-CB 4.12Å; F965-M971 HydrophobicContact CZ-CB 4.17Å; M971-V973 HydrophobicContact CE-CG2 3.96Å; M971-V973 HydrophobicContact CG-CG2 4.26Å; M971-V973 HydrophobicContact SD-CG2 4.44Å; M971-L977 HydrophobicContact CE-CD1 3.62Å; M971-L977 HydrophobicContact CE-CD2 3.8Å; M971-L977 HydrophobicContact CE-CG 4.26Å; M971-L977 HydrophobicContact SD-CD2 4.37Å; M971-F991 HydrophobicContact SD-CE2 4.03Å; M971-F991 HydrophobicContact SD-CZ 4.29Å; M971-G1121 PolarHBondContact N-O 3.1Å; M971-V1122 HydrophobicContact CB-CB 4.5Å; M971-V1122 HydrophobicContact CB-CG1 4.31Å; M971-V1122 HydrophobicContact CB-CG2 4.29Å; M971-V1122 HydrophobicContact CG-CG1 4.36Å; M971-V1122 CarbonylContact O-C 3.56Å; M971-V1122 WeakPolarHBondContact O-CA 3.36Å; M971-V1122 HydrophobicContact SD-CG1 4.32Å; M971-R1123 PolarHBondContact O-N 3.01Å
972	L	95	Very high	90.6	Very high	0.25 Å²	0.25	29.5 Å²	29.5	0%	0.001	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.5	172.9	179.1	68.3	0	0	0	109.5	Y886 L947 H948 V949 Q974 R1123 W1248	Y886-L972 HydrophobicContact CD1-CB 3.67Å; Y886-L972 HydrophobicContact CD2-CB 4.15Å; Y886-L972 HydrophobicContact CD2-CD1 4.38Å; Y886-L972 HydrophobicContact CD2-CD2 3.84Å; Y886-L972 HydrophobicContact CD2-CG 4.29Å; Y886-L972 HydrophobicContact CE1-CB 4.13Å; Y886-L972 HydrophobicContact CE2-CB 4.43Å; Y886-L972 HydrophobicContact CE2-CD1 4.46Å; Y886-L972 HydrophobicContact CE2-CD2 4.5Å; Y886-L972 HydrophobicContact CG-CB 3.72Å; Y886-L972 HydrophobicContact CG-CD2 3.85Å; Y886-L972 HydrophobicContact CG-CG 4.32Å; L947-L972 PolarHBondContact O-N 3.2Å; H948-L972 CarbonylContact C-O 3.52Å; H948-L972 WeakPolarHBondContact CA-O 3.35Å; H948-L972 HydrophobicContact CB-CB 4.49Å; V949-L972 PolarHBondContact N-O 3.06Å; L972-Q974 HydrophobicContact CD2-CG 4.22Å; L972-Q974 HydrophobicContact CG-CG 4.16Å; L972-R1123 CarbonylContact C-O 3.48Å; L972-R1123 WeakPolarHBondContact CA-O 3.34Å; L972-R1123 HydrophobicContact CD1-CB 4.24Å; L972-R1123 HydrophobicContact CD1-CG 4.13Å; L972-W1248 HydrophobicContact CD1-CZ2 4.25Å; L972-W1248 HydrophobicContact CD2-CH2 3.53Å; L972-W1248 VanDerWaalsContact CD2-CH2 3.41Å; L972-W1248 HydrophobicContact CD2-CZ2 3.51Å; L972-W1248 VanDerWaalsContact CD2-CZ2 3.46Å; L972-W1248 HydrophobicContact CD2-CZ3 4.37Å
973	V	93.7	Very high	89.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	111.9	176.7	-172.9	0	0	0	0	109	M971 L977 V1122 R1123 Y1124 S1125 A1128	M971-V973 HydrophobicContact CE-CG2 3.96Å; M971-V973 HydrophobicContact CG-CG2 4.26Å; M971-V973 HydrophobicContact SD-CG2 4.44Å; V973-L977 HydrophobicContact CG1-CB 4.12Å; V973-L977 HydrophobicContact CG2-CB 4.4Å; V973-L977 HydrophobicContact CG2-CD2 4.37Å; V973-V1122 HydrophobicContact CG2-CG1 4.28Å; V973-R1123 PolarHBondContact N-O 2.8Å; V973-Y1124 HydrophobicContact CB-CD1 4.21Å; V973-Y1124 HydrophobicContact CB-CD2 4.2Å; V973-Y1124 HydrophobicContact CB-CE1 4.22Å; V973-Y1124 HydrophobicContact CB-CE2 4.19Å; V973-Y1124 HydrophobicContact CB-CG 4.21Å; V973-Y1124 HydrophobicContact CG1-CD1 4.16Å; V973-Y1124 HydrophobicContact CG1-CE1 3.84Å; V973-Y1124 HydrophobicContact CG1-CE2 4.45Å; V973-Y1124 HydrophobicContact CG2-CD2 4.26Å; V973-Y1124 HydrophobicContact CG2-CE2 3.94Å; V973-S1125 PolarHBondContact O-N 3.16Å; V973-A1128 WeakPolarHBondContact O-CB 3.28Å
974	Q	89	Confident	88.1	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	20%	0.197	C	C	.	.	S	Bend	trans	-117.3	-23.5	169.1	-62.8	-173.3	-47.2	0	0	112.4	H948 V949 P951 L972 S1125 L1127 A1128 W1248	H948-Q974 PolarHBondContact CE1-OE1 3.01Å; H948-Q974 PolarHBondContact NE2-OE1 3.09Å; V949-Q974 CarbonylContact O-C 3.57Å; V949-Q974 WeakPolarHBondContact O-CA 3.4Å; V949-Q974 VanDerWaalsContact O-CB 3.3Å; V949-Q974 WeakPolarHBondContact O-CB 3.4Å; V949-Q974 PolarHBondContact O-N 3Å; P951-Q974 WeakPolarHBondContact CA-O 3.42Å; P951-Q974 HydrophobicContact CG-CB 3.91Å; L972-Q974 HydrophobicContact CD2-CG 4.22Å; L972-Q974 HydrophobicContact CG-CG 4.16Å; Q974-S1125 VanDerWaalsContact CG-CB 3.48Å; Q974-S1125 PolarHBondContact NE2-OG 3.1Å; Q974-L1127 HydrophobicContact CB-CB 4.2Å; Q974-L1127 HydrophobicContact CG-CB 4.14Å; Q974-L1127 CarbonylContact O-C 3.54Å; Q974-L1127 VanDerWaalsContact O-C 3.3Å; Q974-A1128 VanDerWaalsContact O-CA 3.28Å; Q974-A1128 WeakPolarHBondContact O-CA 3.37Å; Q974-W1248 VanDerWaalsContact NE2-CZ3 3.32Å
975	G	87.3	Confident	87.4	Confident	0.75 Å²	0.75	40.9 Å²	40.9	1%	0.008	19%	0.192	C	C	.	.	S	Bend	trans	-86.4	-135.7	166.1	0	0	0	0	0	111.2	V949 S950 S953 S1129	V949-G975 PolarHBondContact O-N 2.97Å; V949-G975 VanDerWaalsContact O-N 3.08Å; S950-G975 VanDerWaalsContact O-CA 3.24Å; S950-G975 WeakPolarHBondContact O-CA 3.3Å; S950-G975 PolarHBondContact O-N 2.97Å; S950-G975 VanDerWaalsContact O-N 3.13Å; S953-G975 CarbonylContact O-C 3.57Å; S953-G975 VanDerWaalsContact O-CA 3.27Å; S953-G975 WeakPolarHBondContact O-CA 3.45Å; G975-S1129 PolarHBondContact O-N 3.1Å
976	E	88.1	Confident	86.8	Confident	56.5 Å²	56.5	46 Å²	46	26%	0.264	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138.1	177.3	-80.8	-177.3	177.2	0	0	111	S953 I954 L955 V978	S953-E976 PolarHBondContact O-N 2.94Å; I954-E976 WeakPolarHBondContact CA-O 3.39Å; I954-E976 HydrophobicContact CB-CB 4.44Å; I954-E976 HydrophobicContact CG1-CB 4.1Å; I954-E976 HydrophobicContact CG1-CG 4.46Å; I954-E976 HydrophobicContact CG2-CB 4.21Å; L955-E976 PolarHBondContact N-O 3.06Å; E976-V978 HydrophobicContact CB-CG2 4.17Å; E976-V978 HydrophobicContact CG-CG2 3.59Å; E976-V978 VanDerWaalsContact OE1-CG2 3.26Å; E976-V978 WeakPolarHBondContact OE1-CG2 3.18Å
977	L	91.1	Very high	86.6	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	109.7	171.5	-178.8	67.1	0	0	0	108.5	L955 L957 M971 V973 F991 I1139	L955-L977 HydrophobicContact CB-CD1 4.06Å; L955-L977 HydrophobicContact CD2-CD1 3.89Å; L955-L977 HydrophobicContact CG-CD1 4.01Å; L955-L977 WeakPolarHBondContact O-CA 3.25Å; L957-L977 HydrophobicContact CD1-CD1 3.96Å; L957-L977 HydrophobicContact CG-CD1 4.16Å; M971-L977 HydrophobicContact CE-CD1 3.62Å; M971-L977 HydrophobicContact CE-CD2 3.8Å; M971-L977 HydrophobicContact CE-CG 4.26Å; M971-L977 HydrophobicContact SD-CD2 4.37Å; V973-L977 HydrophobicContact CG1-CB 4.12Å; V973-L977 HydrophobicContact CG2-CB 4.4Å; V973-L977 HydrophobicContact CG2-CD2 4.37Å; L977-F991 HydrophobicContact CD2-CE2 4.4Å; L977-F991 HydrophobicContact CD2-CZ 4.32Å; L977-I1139 HydrophobicContact CD2-CD1 3.6Å; L977-I1139 HydrophobicContact CG-CD1 3.78Å
978	V	89.5	Confident	86.7	Confident	45.25 Å²	45.25	48.1 Å²	48.1	27%	0.274	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.6	-169.5	-179.8	0	0	0	0	110.4	I954 L955 T956 L957 E976	I954-V978 HydrophobicContact CG2-CB 4.29Å; I954-V978 HydrophobicContact CG2-CG2 3.79Å; L955-V978 PolarHBondContact O-N 3.42Å; T956-V978 CarbonylContact C-O 3.44Å; T956-V978 VanDerWaalsContact CA-O 3.31Å; T956-V978 WeakPolarHBondContact CA-O 3.33Å; T956-V978 HydrophobicContact CG2-CB 4.16Å; T956-V978 HydrophobicContact CG2-CG1 4.16Å; L957-V978 PolarHBondContact N-O 2.99Å; E976-V978 HydrophobicContact CB-CG2 4.17Å; E976-V978 HydrophobicContact CG-CG2 3.59Å; E976-V978 VanDerWaalsContact OE1-CG2 3.26Å; E976-V978 WeakPolarHBondContact OE1-CG2 3.18Å
979	R	89	Confident	86.9	Confident	14.75 Å²	14.75	48.1 Å²	48.1	6%	0.056	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.7	167.8	172.7	179.1	171.9	144	2.9	109.3	L957 D981 S985 E987 I989 K1140 H1141	L957-R979 WeakPolarHBondContact O-CA 3.25Å; R979-D981 IonicContact NE-OD1 3.25Å; R979-D981 PolarHBondContact O-N 3.24Å; R979-S985 PolarHBondContact NH2-O 2.84Å; R979-E987 VanDerWaalsContact CZ-O 3.24Å; R979-E987 PolarHBondContact NH1-O 3.01Å; R979-E987 PolarHBondContact NH2-O 3.25Å; R979-I989 HydrophobicContact CB-CD1 3.93Å; R979-I989 HydrophobicContact CG-CD1 3.89Å; R979-K1140 WeakPolarHBondContact CD-O 3.28Å; R979-K1140 PolarHBondContact NH1-O 2.69Å; R979-H1141 VanDerWaalsContact CZ-CB 3.45Å; R979-H1141 PolarHBondContact NH1-ND1 3.03Å; R979-H1141 PolarHBondContact NH1-O 3.02Å; R979-H1141 VanDerWaalsContact NH1-O 3.08Å
980	T	83.3	Confident	86.9	Confident	21.25 Å²	21.25	50 Å²	50	13%	0.13	25%	0.249	C	C	.	.			trans	-71.1	128.6	172.1	57.5	0	0	0	0	111	T956 L957 Q958 P959 Y982	T956-T980 HydrophobicContact CG2-CG2 3.25Å; L957-T980 PolarHBondContact O-N 2.92Å; L957-T980 PolarHBondContact O-OG1 3.05Å; Q958-T980 WeakPolarHBondContact CA-OG1 3.35Å; Q958-T980 HydrophobicContact CG-CG2 4.32Å; Q958-T980 WeakPolarHBondContact CG-OG1 3.47Å; P959-T980 WeakPolarHBondContact CD-O 3.26Å; P959-T980 VanDerWaalsContact CD-OG1 3.23Å; P959-T980 WeakPolarHBondContact CD-OG1 3.38Å; P959-T980 VanDerWaalsContact CG-O 3.29Å; P959-T980 WeakPolarHBondContact CG-O 3.36Å; T980-Y982 HydrophobicContact CG2-CD2 4.33Å; T980-Y982 HydrophobicContact CG2-CE2 4.28Å
981	D	71	Confident	87	Confident	73.5 Å²	73.5	50 Å²	50	39%	0.393	25%	0.249	S	C	.	.			trans	-104.9	3.6	-179.3	-76.1	-29.3	0	0	0	114.6	R979 S983 R984 K1140	R979-D981 IonicContact NE-OD1 3.25Å; R979-D981 PolarHBondContact O-N 3.24Å; D981-S983 PolarHBondContact O-N 3.29Å; D981-S983 VanDerWaalsContact O-N 3.13Å; D981-R984 PolarHBondContact O-N 3.09Å; D981-R984 VanDerWaalsContact O-N 3.12Å; D981-K1140 WeakPolarHBondContact OD1-CE 3.35Å; D981-K1140 IonicContact OD1-NZ 3.04Å; D981-K1140 PolarHBondContact OD1-NZ 3.14Å; D981-K1140 VanDerWaalsContact OD1-NZ 3.16Å; D981-K1140 WeakPolarHBondContact OD2-CE 3.3Å; D981-K1140 IonicContact OD2-NZ 3.27Å; D981-K1140 PolarHBondContact OD2-NZ 3Å
982	Y	73.3	Confident	87.1	Confident	223 Å²	223	50.1 Å²	50.1	88%	0.875	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.8	-174.1	-61.4	-65.4	0	0	0	114	T980	T980-Y982 HydrophobicContact CG2-CD2 4.33Å; T980-Y982 HydrophobicContact CG2-CE2 4.28Å
983	S	67.2	Low	87.1	Confident	78.25 Å²	78.25	51.3 Å²	51.3	55%	0.547	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-7	-176.6	62.1	0	0	0	0	114.6	D981 S985	D981-S983 PolarHBondContact O-N 3.29Å; D981-S983 VanDerWaalsContact O-N 3.13Å; S983-S985 PolarHBondContact O-N 3Å; S983-S985 VanDerWaalsContact OG-CB 3.31Å; S983-S985 WeakPolarHBondContact OG-CB 3.26Å; S983-S985 PolarHBondContact OG-N 3.02Å
984	R	74.5	Confident	87	Confident	235.25 Å²	235.25	52 Å²	52	89%	0.888	26%	0.261	S	S	*	.			trans	45.9	26.4	-167.5	-62.5	-174.6	-176.3	-174.8	1.2	113.7	D981	D981-R984 PolarHBondContact O-N 3.09Å; D981-R984 VanDerWaalsContact O-N 3.12Å
985	S	82.1	Confident	86.8	Confident	28.25 Å²	28.25	60.6 Å²	60.6	20%	0.198	30%	0.301	C	S	.	.			trans	-67.2	132.4	-179.1	176.2	0	0	0	0	110.4	R979 S983 E987	R979-S985 PolarHBondContact NH2-O 2.84Å; S983-S985 PolarHBondContact O-N 3Å; S983-S985 VanDerWaalsContact OG-CB 3.31Å; S983-S985 WeakPolarHBondContact OG-CB 3.26Å; S983-S985 PolarHBondContact OG-N 3.02Å; S985-E987 PolarHBondContact O-N 3.08Å; S985-E987 WeakPolarHBondContact OG-CB 3.32Å; S985-E987 WeakPolarHBondContact OG-CG 3.33Å; S985-E987 PolarHBondContact OG-N 3.11Å; S985-E987 PolarHBondContact OG-OE2 3.41Å
986	P	84.8	Confident	86.2	Confident	107.75 Å²	107.75	64.8 Å²	64.8	70%	0.7	32%	0.317	S	S	*	.			trans	-76.5	-6.8	174.3	33.1	-35.5	0	0	0	112.7
987	E	90	Very high	85.4	Confident	69 Å²	69	69.3 Å²	69.3	32%	0.322	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-63.6	127.9	-176.7	-68.1	177.9	148.6	0	0	111.1	R938 P959 R979 S985	R938-E987 IonicContact CZ-OE1 2.86Å; R938-E987 IonicContact CZ-OE2 3.28Å; R938-E987 IonicContact NE-OE2 2.87Å; R938-E987 IonicContact NH1-OE1 3.16Å; R938-E987 PolarHBondContact NH1-OE1 3.11Å; R938-E987 IonicContact NH1-OE2 3.2Å; R938-E987 PolarHBondContact NH1-OE2 3.03Å; R938-E987 IonicContact NH2-OE1 3.16Å; R938-E987 PolarHBondContact NH2-OE1 2.88Å; R938-E987 IonicContact NH2-OE2 3.17Å; R938-E987 PolarHBondContact NH2-OE2 3.33Å; P959-E987 HydrophobicContact CB-CB 4.45Å; R979-E987 VanDerWaalsContact CZ-O 3.24Å; R979-E987 PolarHBondContact NH1-O 3.01Å; R979-E987 PolarHBondContact NH2-O 3.25Å; S985-E987 PolarHBondContact O-N 3.08Å; S985-E987 WeakPolarHBondContact OG-CB 3.32Å; S985-E987 WeakPolarHBondContact OG-CG 3.33Å; S985-E987 PolarHBondContact OG-N 3.11Å; S985-E987 PolarHBondContact OG-OE2 3.41Å
988	P	93	Very high	84.1	Confident	53.25 Å²	53.25	76.2 Å²	76.2	35%	0.346	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-74.9	157.7	177.6	29.9	-33.2	0	0	0	112	G960 H1141 I1143	G960-P988 PolarHBondContact N-O 3Å; P988-H1141 CarbonylContact C-O 3.45Å; P988-H1141 VanDerWaalsContact CA-O 3.24Å; P988-H1141 WeakPolarHBondContact CA-O 3.2Å; P988-H1141 HydrophobicContact CB-CB 4.3Å; P988-H1141 WeakPolarHBondContact CB-O 3.25Å; P988-I1143 HydrophobicContact CB-CD1 3.73Å; P988-I1143 HydrophobicContact CB-CG1 3.85Å; P988-I1143 HydrophobicContact CG-CD1 3.46Å; P988-I1143 VanDerWaalsContact CG-CD1 3.46Å; P988-I1143 HydrophobicContact CG-CG1 4.17Å
989	I	95.3	Very high	83.1	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	137.5	163.2	-64.8	161.6	0	0	0	107.3	L957 T961 R979 F991 H1141 L1142 I1143	L957-I989 HydrophobicContact CB-CD1 3.66Å; L957-I989 HydrophobicContact CB-CG1 4.4Å; L957-I989 HydrophobicContact CD1-CD1 4.22Å; L957-I989 HydrophobicContact CD1-CG2 3.91Å; T961-I989 WeakPolarHBondContact O-CA 3.21Å; R979-I989 HydrophobicContact CB-CD1 3.93Å; R979-I989 HydrophobicContact CG-CD1 3.89Å; I989-F991 HydrophobicContact CG2-CD1 4.03Å; I989-F991 HydrophobicContact CG2-CE1 3.49Å; I989-F991 VanDerWaalsContact CG2-CE1 3.46Å; I989-F991 HydrophobicContact CG2-CZ 4.22Å; I989-H1141 PolarHBondContact N-O 2.86Å; I989-L1142 HydrophobicContact CB-CD1 3.97Å; I989-L1142 HydrophobicContact CG2-CD1 3.76Å; I989-L1142 CarbonylContact O-C 3.53Å; I989-L1142 WeakPolarHBondContact O-CA 3.39Å; I989-I1143 PolarHBondContact O-N 3.1Å
990	L	96.7	Very high	82.1	Confident	40.25 Å²	40.25	84.8 Å²	84.8	21%	0.211	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.3	-177.3	175.7	63.6	0	0	0	111.4	T961 V962 L963 T992 I1143 E1145	T961-L990 PolarHBondContact O-N 2.81Å; V962-L990 CarbonylContact C-O 3.5Å; V962-L990 VanDerWaalsContact CA-O 3.31Å; V962-L990 WeakPolarHBondContact CA-O 3.31Å; V962-L990 HydrophobicContact CG1-CB 4.33Å; V962-L990 HydrophobicContact CG1-CD2 4.07Å; V962-L990 HydrophobicContact CG1-CG 4.26Å; V962-L990 HydrophobicContact CG2-CB 4.28Å; V962-L990 HydrophobicContact CG2-CD2 4.45Å; L963-L990 PolarHBondContact N-O 2.94Å; L990-T992 HydrophobicContact CD2-CG2 4.24Å; L990-T992 HydrophobicContact CG-CG2 4.22Å; L990-I1143 HydrophobicContact CD1-CB 3.84Å; L990-I1143 HydrophobicContact CD1-CG2 3.64Å; L990-E1145 HydrophobicContact CD1-CG 4.01Å
991	F	97.5	Very high	81.8	Confident	0 Å²	0	85.6 Å²	85.6	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.6	167.5	-62	-10.2	0	0	0	109.1	L957 L963 F965 M971 L977 I989 W1119 V1122 L1142 I1143 I1144 E1145	L957-F991 HydrophobicContact CD1-CE1 3.85Å; L957-F991 HydrophobicContact CD1-CZ 3.81Å; L963-F991 HydrophobicContact CB-CD1 3.71Å; L963-F991 HydrophobicContact CB-CE1 4.08Å; L963-F991 HydrophobicContact CD1-CD1 3.82Å; L963-F991 HydrophobicContact CD1-CE1 3.32Å; L963-F991 HydrophobicContact CD1-CZ 3.9Å; L963-F991 HydrophobicContact CG-CD1 3.77Å; L963-F991 HydrophobicContact CG-CE1 3.6Å; L963-F991 WeakPolarHBondContact O-CA 3.3Å; F965-F991 HydrophobicContact CE2-CB 4.06Å; F965-F991 HydrophobicContact CE2-CD1 4.4Å; F965-F991 HydrophobicContact CE2-CD2 4.49Å; F965-F991 HydrophobicContact CE2-CG 4.11Å; M971-F991 HydrophobicContact SD-CE2 4.03Å; M971-F991 HydrophobicContact SD-CZ 4.29Å; L977-F991 HydrophobicContact CD2-CE2 4.4Å; L977-F991 HydrophobicContact CD2-CZ 4.32Å; I989-F991 HydrophobicContact CG2-CD1 4.03Å; I989-F991 HydrophobicContact CG2-CE1 3.49Å; I989-F991 VanDerWaalsContact CG2-CE1 3.46Å; I989-F991 HydrophobicContact CG2-CZ 4.22Å; F991-W1119 HydrophobicContact CB-CH2 3.89Å; F991-W1119 HydrophobicContact CB-CZ2 3.99Å; F991-W1119 HydrophobicContact CD2-CH2 4.41Å; F991-V1122 HydrophobicContact CD2-CG2 3.67Å; F991-V1122 HydrophobicContact CE2-CG2 3.98Å; F991-L1142 HydrophobicContact CD1-CD1 4.03Å; F991-L1142 HydrophobicContact CD2-CD1 3.78Å; F991-L1142 HydrophobicContact CD2-CD2 4.32Å; F991-L1142 HydrophobicContact CD2-CG 4.47Å; F991-L1142 HydrophobicContact CE1-CD1 3.92Å; F991-L1142 HydrophobicContact CE2-CD1 3.69Å; F991-L1142 HydrophobicContact CE2-CD2 4.03Å; F991-L1142 HydrophobicContact CE2-CG 4.41Å; F991-L1142 HydrophobicContact CG-CD1 3.95Å; F991-L1142 HydrophobicContact CZ-CD1 3.76Å; F991-I1143 PolarHBondContact N-O 3.2Å; F991-I1144 HydrophobicContact CB-CG1 4.45Å; F991-I1144 HydrophobicContact CD2-CG1 4.34Å; F991-E1145 PolarHBondContact O-N 3.25Å
992	T	96.8	Very high	82.2	Confident	2 Å²	2	90.4 Å²	90.4	1%	0.012	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	170.2	-173.8	-168.8	0	0	0	0	111.6	V962 L963 R964 F965 L990 E1145	V962-T992 HydrophobicContact CG1-CG2 4.33Å; L963-T992 PolarHBondContact O-N 3.1Å; R964-T992 CarbonylContact C-O 3.49Å; R964-T992 VanDerWaalsContact CA-O 3.31Å; R964-T992 WeakPolarHBondContact CA-O 3.36Å; R964-T992 HydrophobicContact CG-CG2 4.1Å; F965-T992 PolarHBondContact N-O 3.12Å; L990-T992 HydrophobicContact CD2-CG2 4.24Å; L990-T992 HydrophobicContact CG-CG2 4.22Å; T992-E1145 WeakPolarHBondContact OG1-CG 3.33Å; T992-E1145 PolarHBondContact OG1-OE1 3Å
993	L	95.1	Very high	83.1	Confident	25 Å²	25	81.2 Å²	81.2	13%	0.131	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	138.6	175.5	-175.3	67.9	0	0	0	111.3	M1118 W1119 K1146	L993-M1118 HydrophobicContact CD2-SD 3.92Å; L993-W1119 HydrophobicContact CD1-CB 4.16Å; L993-K1146 HydrophobicContact CB-CB 3.84Å; L993-K1146 HydrophobicContact CB-CD 4.25Å
994	A	93.3	Very high	84.2	Confident	14 Å²	14	77.5 Å²	77.5	12%	0.116	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-68.2	143.4	171.4	0	0	0	0	0	111.6	L942 R964 F965 Q966 R996	L942-A994 HydrophobicContact CD1-CB 3.64Å; R964-A994 HydrophobicContact CB-CB 4.1Å; F965-A994 WeakPolarHBondContact O-CB 3.34Å; F965-A994 PolarHBondContact O-N 3.04Å; Q966-A994 HydrophobicContact CG-CB 4.37Å; A994-R996 PolarHBondContact O-N 3.04Å
995	Q	83.8	Confident	85	Confident	181.75 Å²	181.75	70.5 Å²	70.5	85%	0.849	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-68.7	131.9	176.6	-120.2	176.7	-7.9	0	0	110.1
996	R	74.8	Confident	85.3	Confident	89 Å²	89	69.3 Å²	69.3	34%	0.336	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-90	138.9	-178.5	-157.3	177.8	119.7	-170.4	-1.2	111.3	A994 K998 L1051 G1052	A994-R996 PolarHBondContact O-N 3.04Å; R996-K998 PolarHBondContact O-N 3.01Å; R996-L1051 PolarHBondContact NH2-O 3.37Å; R996-G1052 VanDerWaalsContact CZ-O 3.31Å; R996-G1052 PolarHBondContact NH1-O 3.11Å; R996-G1052 PolarHBondContact NH2-O 3.03Å
997	E	70.2	Confident	85.3	Confident	151.75 Å²	151.75	66.2 Å²	66.2	71%	0.709	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-72.1	121.5	163.6	-67.5	-176.2	178.9	0	0	109.6	Q999	E997-Q999 PolarHBondContact O-N 3Å; E997-Q999 VanDerWaalsContact O-N 3.08Å
998	K	64.9	Low	84.9	Confident	147.75 Å²	147.75	63.7 Å²	63.7	64%	0.642	30%	0.304	S	S	*	.			trans	-77	107.2	178.9	-65.6	-171.8	-178.9	-169.3	0	109.2	R996 D1017	R996-K998 PolarHBondContact O-N 3.01Å; K998-D1017 VanDerWaalsContact NZ-CG 3.32Å; K998-D1017 IonicContact NZ-OD1 3.63Å; K998-D1017 PolarHBondContact NZ-OD1 3.1Å; K998-D1017 IonicContact NZ-OD2 3.06Å; K998-D1017 PolarHBondContact NZ-OD2 3.01Å; K998-D1017 VanDerWaalsContact NZ-OD2 3.09Å
999	Q	69.3	Low	83.8	Confident	107.75 Å²	107.75	65.1 Å²	65.1	50%	0.504	31%	0.308	S	S	.	.			trans	-108.6	124	166.8	-62	-179.1	-6	0	0	108.7	L815 E997	L815-Q999 HydrophobicContact CD1-CB 4.1Å; L815-Q999 HydrophobicContact CD1-CG 4.21Å; L815-Q999 HydrophobicContact CD2-CB 4.39Å; L815-Q999 HydrophobicContact CD2-CG 4.32Å; E997-Q999 PolarHBondContact O-N 3Å; E997-Q999 VanDerWaalsContact O-N 3.08Å
1000	Q	67.7	Low	82.5	Confident	131 Å²	131	68.7 Å²	68.7	61%	0.612	33%	0.328	S	S	*	.			trans	-84.8	125.5	171.8	-71.3	-169.6	-1.1	0	0	109	S1016	Q1000-S1016 VanDerWaalsContact NE2-CB 3.3Å
1001	P	76	Confident	80.7	Confident	39.2 Å²	39.2	74.7 Å²	74.7	26%	0.255	36%	0.36	S	S	.	.			trans	-65.5	146.2	171.7	28.9	-34	0	0	0	110.1	N1003 I1004 L1051	P1001-N1003 VanDerWaalsContact C-N 3.31Å; P1001-N1003 PolarHBondContact O-N 3.17Å; P1001-I1004 HydrophobicContact CB-CG2 3.88Å; P1001-I1004 HydrophobicContact CG-CG2 3.59Å; P1001-I1004 VanDerWaalsContact CG-CG2 3.49Å; P1001-I1004 WeakPolarHBondContact CG-O 3.44Å; P1001-L1051 HydrophobicContact CG-CD2 3.87Å
1002	H	80.7	Confident	79	Confident	173.4 Å²	173.4	82.7 Å²	82.7	80%	0.803	40%	0.402	S	S	*	.	S	Bend	trans	-77.6	-18.6	-171.8	-66.4	-40.4	0	0	0	114
1003	N	90.6	Very high	77.2	Confident	30 Å²	30	87.6 Å²	87.6	16%	0.16	42%	0.424	C	S	.	.	S	Bend	trans	-124.7	1.7	-166.8	62.3	-23.8	0	0	0	115.7	P1001 V1025 L1026 Q1050 D1087 T1089	P1001-N1003 VanDerWaalsContact C-N 3.31Å; P1001-N1003 PolarHBondContact O-N 3.17Å; N1003-V1025 CarbonylContact O-C 3.52Å; N1003-V1025 WeakPolarHBondContact O-CA 3.35Å; N1003-L1026 HydrophobicContact CB-CB 4.21Å; N1003-L1026 PolarHBondContact O-N 3.05Å; N1003-Q1050 VanDerWaalsContact CG-NE2 3.35Å; N1003-Q1050 PolarHBondContact ND2-NE2 3.2Å; N1003-Q1050 VanDerWaalsContact ND2-NE2 3.16Å; N1003-Q1050 PolarHBondContact OD1-NE2 2.84Å; N1003-D1087 VanDerWaalsContact ND2-CG 3.32Å; N1003-D1087 PolarHBondContact ND2-OD1 2.98Å; N1003-D1087 VanDerWaalsContact ND2-OD1 3.1Å; N1003-D1087 PolarHBondContact ND2-OD2 3.03Å; N1003-T1089 HydrophobicContact CB-CG2 4.29Å; N1003-T1089 PolarHBondContact ND2-OG1 3.12Å
1004	I	91.5	Very high	75.6	Confident	2 Å²	2	92.2 Å²	92.2	1%	0.01	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	140.6	-179.6	-170.5	170.6	0	0	0	110.5	P1001 L1023 E1024 V1025 Q1050 L1051 I1088	P1001-I1004 HydrophobicContact CB-CG2 3.88Å; P1001-I1004 HydrophobicContact CG-CG2 3.59Å; P1001-I1004 VanDerWaalsContact CG-CG2 3.49Å; P1001-I1004 WeakPolarHBondContact CG-O 3.44Å; I1004-L1023 HydrophobicContact CD1-CD1 3.94Å; I1004-L1023 HydrophobicContact CG1-CD1 3.78Å; I1004-E1024 WeakPolarHBondContact CA-O 3.4Å; I1004-V1025 HydrophobicContact CB-CG1 4.38Å; I1004-V1025 HydrophobicContact CD1-CG1 4.31Å; I1004-V1025 HydrophobicContact CG1-CG1 3.98Å; I1004-Q1050 HydrophobicContact CD1-CB 4.49Å; I1004-Q1050 HydrophobicContact CG2-CB 4.18Å; I1004-Q1050 HydrophobicContact CG2-CG 3.78Å; I1004-L1051 HydrophobicContact CD1-CG 4.39Å; I1004-L1051 HydrophobicContact CG1-CD2 4.37Å; I1004-L1051 HydrophobicContact CG1-CG 4.41Å; I1004-L1051 HydrophobicContact CG2-CD2 3.89Å; I1004-L1051 HydrophobicContact CG2-CG 4.12Å; I1004-I1088 HydrophobicContact CD1-CD1 3.58Å; I1004-I1088 VanDerWaalsContact CD1-CD1 3.48Å; I1004-I1088 HydrophobicContact CD1-CG1 4.21Å; I1004-I1088 HydrophobicContact CG1-CD1 4.47Å
1005	R	90.7	Very high	74.1	Confident	87.2 Å²	87.2	94.5 Å²	94.5	33%	0.329	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	156.5	177.1	70.3	-171.7	-175.5	-174	0.5	112.3	I1007 E1024 W1031	R1005-I1007 HydrophobicContact CG-CD1 4.22Å; R1005-I1007 HydrophobicContact CG-CG1 4.45Å; R1005-E1024 HydrophobicContact CG-CB 3.96Å; R1005-E1024 IonicContact CZ-OE2 3.31Å; R1005-E1024 VanDerWaalsContact CZ-OE2 3.26Å; R1005-E1024 PolarHBondContact N-O 2.86Å; R1005-E1024 IonicContact NE-OE2 3.47Å; R1005-E1024 PolarHBondContact NE-OE2 3.21Å; R1005-E1024 IonicContact NH2-OE2 3.06Å; R1005-E1024 PolarHBondContact NH2-OE2 2.99Å; R1005-E1024 PolarHBondContact O-N 3.16Å; R1005-W1031 HydrophobicContact CB-CH2 4.32Å; R1005-W1031 HydrophobicContact CB-CZ3 4.35Å; R1005-W1031 HydrophobicContact CG-CE3 4.32Å; R1005-W1031 HydrophobicContact CG-CH2 3.98Å; R1005-W1031 HydrophobicContact CG-CZ3 3.66Å
1006	I	87.8	Confident	73.3	Confident	4.2 Å²	4.2	88.4 Å²	88.4	2%	0.022	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.3	170.6	-61.6	177.1	0	0	0	108.5	A1018 R1022 L1023 L1051 M1053 V1112 C1114	I1006-A1018 HydrophobicContact CB-CB 4.25Å; I1006-A1018 HydrophobicContact CG2-CB 3.94Å; I1006-A1018 WeakPolarHBondContact O-CB 3.45Å; I1006-R1022 WeakPolarHBondContact CA-O 3.16Å; I1006-L1023 HydrophobicContact CG1-CD1 4.2Å; I1006-L1051 HydrophobicContact CD1-CD1 3.55Å; I1006-L1051 VanDerWaalsContact CD1-CD1 3.49Å; I1006-L1051 HydrophobicContact CG1-CD1 3.62Å; I1006-M1053 HydrophobicContact CD1-CE 3.88Å; I1006-V1112 HydrophobicContact CD1-CG1 3.64Å; I1006-V1112 HydrophobicContact CD1-CG2 3.69Å; I1006-V1112 HydrophobicContact CG1-CG1 4.02Å; I1006-V1112 HydrophobicContact CG1-CG2 4.05Å; I1006-C1114 HydrophobicContact CD1-CB 4.33Å
1007	I	86.6	Confident	72.9	Confident	40.8 Å²	40.8	88.2 Å²	88.2	21%	0.209	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.6	171	-58.1	-92.2	0	0	0	108.4	R1005 G1021 R1022 E1024	R1005-I1007 HydrophobicContact CG-CD1 4.22Å; R1005-I1007 HydrophobicContact CG-CG1 4.45Å; I1007-G1021 CarbonylContact O-C 3.56Å; I1007-G1021 VanDerWaalsContact O-CA 3.25Å; I1007-G1021 WeakPolarHBondContact O-CA 3.27Å; I1007-R1022 PolarHBondContact N-O 2.9Å; I1007-R1022 PolarHBondContact O-N 3.05Å; I1007-E1024 VanDerWaalsContact CD1-OE1 3.26Å; I1007-E1024 WeakPolarHBondContact CD1-OE1 3.31Å; I1007-E1024 WeakPolarHBondContact CD1-OE2 3.41Å; I1007-E1024 VanDerWaalsContact CG1-CD 3.44Å; I1007-E1024 HydrophobicContact CG1-CG 4.3Å; I1007-E1024 WeakPolarHBondContact CG1-OE1 3.24Å; I1007-E1024 WeakPolarHBondContact CG1-OE2 3.43Å
1008	S	80.6	Confident	73.3	Confident	17.6 Å²	17.6	81.1 Å²	81.1	12%	0.123	41%	0.414	C	S	.	.			trans	-69	146.5	174.8	-157.6	0	0	0	0	110.5	D1010 S1020	S1008-D1010 PolarHBondContact O-N 2.98Å; S1008-D1010 PolarHBondContact OG-N 3.06Å; S1008-S1020 PolarHBondContact OG-O 3.2Å
1009	D	69.6	Low	74.1	Confident	81.8 Å²	81.8	77.3 Å²	77.3	44%	0.437	40%	0.401	S	S	.	.	S	Bend	trans	-73.5	-14.3	168.9	-63.6	-46.2	0	0	0	111.7	D1011 R1022 P1067 S1068	D1009-D1011 PolarHBondContact O-N 3.31Å; D1009-R1022 IonicContact OD1-NH1 3.3Å; D1009-P1067 WeakPolarHBondContact OD2-CA 3.37Å; D1009-P1067 WeakPolarHBondContact OD2-CB 3.18Å; D1009-S1068 PolarHBondContact OD1-N 3.21Å; D1009-S1068 VanDerWaalsContact OD1-N 3.15Å
1010	D	67.7	Low	74.9	Confident	76.8 Å²	76.8	74 Å²	74	41%	0.411	39%	0.39	S	S	.	.			trans	-82.1	107.5	173.9	-68.8	-26.9	0	0	0	110.5	S1008 N1012 K1013 K1857	S1008-D1010 PolarHBondContact O-N 2.98Å; S1008-D1010 PolarHBondContact OG-N 3.06Å; D1010-N1012 PolarHBondContact O-N 3.18Å; D1010-K1013 HydrophobicContact CB-CD 4.4Å; D1010-K1013 HydrophobicContact CB-CG 4.47Å; D1010-K1013 PolarHBondContact O-N 2.92Å; D1010-K1013 VanDerWaalsContact O-N 3.09Å; D1010-K1013 IonicContact OD2-NZ 3.22Å; D1010-K1013 PolarHBondContact OD2-NZ 3.24Å; D1010-K1857 IonicContact OD1-NZ 3.66Å; D1010-K1857 PolarHBondContact OD1-NZ 3.29Å; D1010-K1857 IonicContact OD2-NZ 2.84Å; D1010-K1857 PolarHBondContact OD2-NZ 3.28Å
1011	D	60.6	Low	75.8	Confident	166.6 Å²	166.6	67.9 Å²	67.9	89%	0.891	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.5	177.7	-71.2	-33.9	0	0	0	114.1	D1009	D1009-D1011 PolarHBondContact O-N 3.31Å
1012	N	60.4	Low	76.5	Confident	166.2 Å²	166.2	67.1 Å²	67.1	89%	0.889	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-5.3	-177	-74.7	-19.7	0	0	0	114.9	D1010	D1010-N1012 PolarHBondContact O-N 3.18Å
1013	K	58.6	Low	76.9	Confident	105.4 Å²	105.4	58.9 Å²	58.9	46%	0.458	32%	0.315	S	S	.	.	S	Bend	trans	-107	127	179.6	-73.5	177.8	-175.6	150.4	0	110.9	D1010 S1015	D1010-K1013 HydrophobicContact CB-CD 4.4Å; D1010-K1013 HydrophobicContact CB-CG 4.47Å; D1010-K1013 PolarHBondContact O-N 2.92Å; D1010-K1013 VanDerWaalsContact O-N 3.09Å; D1010-K1013 IonicContact OD2-NZ 3.22Å; D1010-K1013 PolarHBondContact OD2-NZ 3.24Å; K1013-S1015 PolarHBondContact O-N 3.3Å
1014	N	62.5	Low	77	Confident	122.6 Å²	122.6	57.7 Å²	57.7	66%	0.656	31%	0.309	S	S	*	.			trans	-55.4	135	167.8	-77.7	-9.8	0	0	0	109.8	S1016 D1017 A1018	N1014-S1016 PolarHBondContact O-N 3.06Å; N1014-D1017 PolarHBondContact O-N 2.99Å; N1014-D1017 VanDerWaalsContact O-N 3.08Å; N1014-A1018 PolarHBondContact O-N 3.26Å
1015	S	62.5	Low	77.1	Confident	62.2 Å²	62.2	57.6 Å²	57.6	44%	0.435	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-55.8	-25.1	179	60.1	0	0	0	0	113.3	K1013 D1017 A1018	K1013-S1015 PolarHBondContact O-N 3.3Å; S1015-D1017 VanDerWaalsContact C-N 3.28Å; S1015-D1017 PolarHBondContact O-N 2.97Å; S1015-A1018 PolarHBondContact O-N 3.1Å
1016	S	65.1	Low	77.2	Confident	53.6 Å²	53.6	55.8 Å²	55.8	38%	0.375	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-65.9	-24.1	176.6	67	0	0	0	0	114.4	Q1000 N1014	Q1000-S1016 VanDerWaalsContact NE2-CB 3.3Å; N1014-S1016 PolarHBondContact O-N 3.06Å
1017	D	67	Low	77.3	Confident	83.6 Å²	83.6	56.3 Å²	56.3	45%	0.447	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-111.9	7.1	-175.2	-67.7	-3.8	0	0	0	111.7	K998 N1014 S1015 L1019	K998-D1017 VanDerWaalsContact NZ-CG 3.32Å; K998-D1017 IonicContact NZ-OD1 3.63Å; K998-D1017 PolarHBondContact NZ-OD1 3.1Å; K998-D1017 IonicContact NZ-OD2 3.06Å; K998-D1017 PolarHBondContact NZ-OD2 3.01Å; K998-D1017 VanDerWaalsContact NZ-OD2 3.09Å; N1014-D1017 PolarHBondContact O-N 2.99Å; N1014-D1017 VanDerWaalsContact O-N 3.08Å; S1015-D1017 VanDerWaalsContact C-N 3.28Å; S1015-D1017 PolarHBondContact O-N 2.97Å; D1017-L1019 PolarHBondContact O-N 3.19Å; D1017-L1019 VanDerWaalsContact O-N 3.12Å
1018	A	78.2	Confident	77.3	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.033	34%	0.339	C	S	.	.			trans	-71.3	106.7	179.1	0	0	0	0	0	110.8	I1006 N1014 S1015 S1020	I1006-A1018 HydrophobicContact CB-CB 4.25Å; I1006-A1018 HydrophobicContact CG2-CB 3.94Å; I1006-A1018 WeakPolarHBondContact O-CB 3.45Å; N1014-A1018 PolarHBondContact O-N 3.26Å; S1015-A1018 PolarHBondContact O-N 3.1Å; A1018-S1020 VanDerWaalsContact C-N 3.3Å
1019	L	83.5	Confident	77.6	Confident	67.6 Å²	67.6	64.5 Å²	64.5	35%	0.354	37%	0.368	S	S	.	.	S	Bend	trans	-78.5	-19.4	170.9	-65.7	-179.1	0	0	0	112.4	D1017 M1053 R1113 C1114 Q1116	D1017-L1019 PolarHBondContact O-N 3.19Å; D1017-L1019 VanDerWaalsContact O-N 3.12Å; L1019-M1053 HydrophobicContact CD2-SD 3.58Å; L1019-M1053 VanDerWaalsContact CD2-SD 3.57Å; L1019-M1053 WeakPolarHBondContact CD2-SD 3.45Å; L1019-R1113 CarbonylContact O-C 3.51Å; L1019-R1113 VanDerWaalsContact O-CA 3.26Å; L1019-R1113 WeakPolarHBondContact O-CA 3.3Å; L1019-C1114 WeakPolarHBondContact CB-O 3.5Å; L1019-C1114 PolarHBondContact O-N 3.04Å; L1019-C1114 VanDerWaalsContact O-O 3.11Å; L1019-Q1116 HydrophobicContact CD1-CG 4.45Å; L1019-Q1116 HydrophobicContact CD2-CG 3.99Å
1020	S	85.6	Confident	78.6	Confident	39.2 Å²	39.2	65.3 Å²	65.3	27%	0.274	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	142.6	179.8	60.4	0	0	0	0	112.3	S1008 A1018 V1112	S1008-S1020 PolarHBondContact OG-O 3.2Å; A1018-S1020 VanDerWaalsContact C-N 3.3Å; S1020-V1112 VanDerWaalsContact CA-O 3.27Å; S1020-V1112 WeakPolarHBondContact CA-O 3.29Å
1021	G	87.1	Confident	79.8	Confident	2.2 Å²	2.2	64.9 Å²	64.9	2%	0.023	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.3	-161.3	176.7	0	0	0	0	0	113	I1007 G1111 V1112	I1007-G1021 CarbonylContact O-C 3.56Å; I1007-G1021 VanDerWaalsContact O-CA 3.25Å; I1007-G1021 WeakPolarHBondContact O-CA 3.27Å; G1021-G1111 CarbonylContact O-C 3.52Å; G1021-G1111 VanDerWaalsContact O-CA 3.25Å; G1021-G1111 WeakPolarHBondContact O-CA 3.37Å; G1021-V1112 PolarHBondContact N-O 3.01Å; G1021-V1112 VanDerWaalsContact N-O 3.09Å; G1021-V1112 PolarHBondContact O-N 3.14Å
1022	R	88.9	Confident	81.2	Confident	22.8 Å²	22.8	56.9 Å²	56.9	9%	0.086	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.2	176.7	-172.9	171.2	59.8	-97.9	-9.1	111.1	I1006 I1007 D1009 E1024 T1033 P1067 S1068 P1069 V1109	I1006-R1022 WeakPolarHBondContact CA-O 3.16Å; I1007-R1022 PolarHBondContact N-O 2.9Å; I1007-R1022 PolarHBondContact O-N 3.05Å; D1009-R1022 IonicContact OD1-NH1 3.3Å; R1022-E1024 HydrophobicContact CG-CG 4.46Å; R1022-E1024 IonicContact CZ-OE1 2.99Å; R1022-E1024 IonicContact NE-OE1 3.62Å; R1022-E1024 PolarHBondContact NE-OE1 3.13Å; R1022-E1024 VanDerWaalsContact NE-OE1 3.13Å; R1022-E1024 IonicContact NH2-OE1 3.3Å; R1022-E1024 PolarHBondContact NH2-OE1 3.07Å; R1022-T1033 HydrophobicContact CG-CG2 4.29Å; R1022-P1067 HydrophobicContact CB-CB 3.83Å; R1022-P1067 HydrophobicContact CB-CG 3.77Å; R1022-P1067 HydrophobicContact CG-CB 4.38Å; R1022-P1067 HydrophobicContact CG-CG 4.05Å; R1022-S1068 VanDerWaalsContact CD-O 3.29Å; R1022-S1068 WeakPolarHBondContact CD-O 3.34Å; R1022-S1068 PolarHBondContact NH1-O 2.99Å; R1022-P1069 WeakPolarHBondContact CD-O 3.32Å; R1022-V1109 HydrophobicContact CG-CG1 3.73Å; R1022-V1109 HydrophobicContact CG-CG2 4.42Å
1023	L	90.7	Very high	82.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.4	176.2	-171.2	61.5	0	0	0	110	I1004 I1006 I1034 W1039 L1051 I1088 V1110 V1112	I1004-L1023 HydrophobicContact CD1-CD1 3.94Å; I1004-L1023 HydrophobicContact CG1-CD1 3.78Å; I1006-L1023 HydrophobicContact CG1-CD1 4.2Å; L1023-I1034 HydrophobicContact CD2-CD1 3.64Å; L1023-I1034 HydrophobicContact CG-CD1 3.98Å; L1023-W1039 HydrophobicContact CD2-CH2 3.48Å; L1023-W1039 VanDerWaalsContact CD2-CH2 3.46Å; L1023-W1039 HydrophobicContact CD2-CZ2 3.94Å; L1023-W1039 HydrophobicContact CD2-CZ3 4.31Å; L1023-L1051 HydrophobicContact CD1-CD1 4.44Å; L1023-I1088 HydrophobicContact CD2-CD1 4.46Å; L1023-V1110 HydrophobicContact CB-CG1 4.24Å; L1023-V1110 HydrophobicContact CD2-CG1 4.34Å; L1023-V1110 PolarHBondContact N-O 2.97Å; L1023-V1110 VanDerWaalsContact N-O 3.13Å; L1023-V1112 HydrophobicContact CB-CG1 4.39Å; L1023-V1112 HydrophobicContact CB-CG2 4.3Å; L1023-V1112 HydrophobicContact CD1-CG1 4.21Å; L1023-V1112 HydrophobicContact CD1-CG2 4.08Å; L1023-V1112 HydrophobicContact CD2-CG1 4.15Å; L1023-V1112 HydrophobicContact CD2-CG2 4.37Å; L1023-V1112 HydrophobicContact CG-CG2 4.39Å
1024	E	91.9	Very high	84.2	Confident	4.6 Å²	4.6	44.1 Å²	44.1	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142	176.3	-65.2	178.4	-178.4	0	0	109.8	I1004 R1005 I1007 R1022 W1031 G1032 T1033 L1072	I1004-E1024 WeakPolarHBondContact CA-O 3.4Å; R1005-E1024 HydrophobicContact CG-CB 3.96Å; R1005-E1024 IonicContact CZ-OE2 3.31Å; R1005-E1024 VanDerWaalsContact CZ-OE2 3.26Å; R1005-E1024 PolarHBondContact N-O 2.86Å; R1005-E1024 IonicContact NE-OE2 3.47Å; R1005-E1024 PolarHBondContact NE-OE2 3.21Å; R1005-E1024 IonicContact NH2-OE2 3.06Å; R1005-E1024 PolarHBondContact NH2-OE2 2.99Å; R1005-E1024 PolarHBondContact O-N 3.16Å; I1007-E1024 VanDerWaalsContact CD1-OE1 3.26Å; I1007-E1024 WeakPolarHBondContact CD1-OE1 3.31Å; I1007-E1024 WeakPolarHBondContact CD1-OE2 3.41Å; I1007-E1024 VanDerWaalsContact CG1-CD 3.44Å; I1007-E1024 HydrophobicContact CG1-CG 4.3Å; I1007-E1024 WeakPolarHBondContact CG1-OE1 3.24Å; I1007-E1024 WeakPolarHBondContact CG1-OE2 3.43Å; R1022-E1024 HydrophobicContact CG-CG 4.46Å; R1022-E1024 IonicContact CZ-OE1 2.99Å; R1022-E1024 IonicContact NE-OE1 3.62Å; R1022-E1024 PolarHBondContact NE-OE1 3.13Å; R1022-E1024 VanDerWaalsContact NE-OE1 3.13Å; R1022-E1024 IonicContact NH2-OE1 3.3Å; R1022-E1024 PolarHBondContact NH2-OE1 3.07Å; E1024-W1031 HydrophobicContact CB-CE3 4.07Å; E1024-W1031 HydrophobicContact CB-CZ3 4.36Å; E1024-W1031 WeakPolarHBondContact O-CZ3 3.23Å; E1024-G1032 VanDerWaalsContact CA-O 3.31Å; E1024-G1032 WeakPolarHBondContact CA-O 3.32Å; E1024-T1033 HydrophobicContact CG-CG2 4.43Å; E1024-L1072 VanDerWaalsContact CD-CD1 3.46Å; E1024-L1072 HydrophobicContact CG-CD1 4.1Å; E1024-L1072 WeakPolarHBondContact OE1-CD1 3.36Å; E1024-L1072 WeakPolarHBondContact OE2-CD1 3.31Å
1025	V	93.4	Very high	85.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	150.4	-177.4	-72.5	0	0	0	0	111	N1003 I1004 V1027 W1031 G1032 I1034 V1075 M1076 I1088 T1089	N1003-V1025 CarbonylContact O-C 3.52Å; N1003-V1025 WeakPolarHBondContact O-CA 3.35Å; I1004-V1025 HydrophobicContact CB-CG1 4.38Å; I1004-V1025 HydrophobicContact CD1-CG1 4.31Å; I1004-V1025 HydrophobicContact CG1-CG1 3.98Å; V1025-V1027 HydrophobicContact CB-CG2 4.5Å; V1025-V1027 HydrophobicContact CG2-CG2 4.26Å; V1025-W1031 VanDerWaalsContact C-CE3 3.44Å; V1025-W1031 WeakPolarHBondContact O-CA 3.3Å; V1025-G1032 PolarHBondContact N-O 3.12Å; V1025-G1032 PolarHBondContact O-N 3.09Å; V1025-I1034 HydrophobicContact CG1-CD1 3.82Å; V1025-I1034 HydrophobicContact CG1-CG1 4.45Å; V1025-I1034 HydrophobicContact CG2-CD1 4.12Å; V1025-I1034 HydrophobicContact CG2-CG1 3.84Å; V1025-V1075 HydrophobicContact CG2-CG2 3.98Å; V1025-M1076 HydrophobicContact CB-SD 4.4Å; V1025-M1076 HydrophobicContact CG2-CG 4.29Å; V1025-M1076 HydrophobicContact CG2-SD 3.65Å; V1025-I1088 HydrophobicContact CG1-CD1 3.96Å; V1025-I1088 HydrophobicContact CG1-CG1 4.41Å; V1025-T1089 HydrophobicContact CB-CG2 4.08Å; V1025-T1089 HydrophobicContact CG1-CG2 4.17Å
1026	L	93	Very high	86.6	Confident	50.6 Å²	50.6	36.8 Å²	36.8	27%	0.265	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	107.1	175.8	-176.8	62.6	0	0	0	109.3	N1003 G1029 Q1030 W1031	N1003-L1026 HydrophobicContact CB-CB 4.21Å; N1003-L1026 PolarHBondContact O-N 3.05Å; L1026-G1029 VanDerWaalsContact CD1-C 3.46Å; L1026-Q1030 VanDerWaalsContact CD1-C 3.49Å; L1026-W1031 HydrophobicContact CB-CD2 4.05Å; L1026-W1031 HydrophobicContact CB-CE3 4.19Å; L1026-W1031 HydrophobicContact CB-CH2 4.16Å; L1026-W1031 HydrophobicContact CB-CZ2 4.01Å; L1026-W1031 HydrophobicContact CB-CZ3 4.24Å; L1026-W1031 HydrophobicContact CD1-CD2 4.27Å; L1026-W1031 HydrophobicContact CD1-CG 4.07Å; L1026-W1031 HydrophobicContact CD2-CZ2 4.42Å
1027	V	89.3	Confident	87.3	Confident	14 Å²	14	39.3 Å²	39.3	9%	0.085	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133.9	177.7	-179.7	0	0	0	0	108.4	V1025 G1029 Q1030 M1076 T1089 H1093	V1025-V1027 HydrophobicContact CB-CG2 4.5Å; V1025-V1027 HydrophobicContact CG2-CG2 4.26Å; V1027-G1029 PolarHBondContact O-N 2.97Å; V1027-G1029 VanDerWaalsContact O-N 3.1Å; V1027-Q1030 PolarHBondContact N-O 3.14Å; V1027-Q1030 VanDerWaalsContact N-O 3.08Å; V1027-Q1030 PolarHBondContact O-N 3.13Å; V1027-Q1030 VanDerWaalsContact O-O 3.1Å; V1027-M1076 HydrophobicContact CG2-CE 4.42Å; V1027-M1076 HydrophobicContact CG2-CG 3.91Å; V1027-M1076 HydrophobicContact CG2-SD 3.66Å; V1027-M1076 WeakPolarHBondContact CG2-SD 3.47Å; V1027-T1089 HydrophobicContact CG2-CG2 4.41Å; V1027-H1093 WeakPolarHBondContact CG1-NE2 3.3Å
1028	N	86.4	Confident	87.9	Confident	158.8 Å²	158.8	36.6 Å²	36.6	85%	0.849	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	32.4	-178.7	-59.9	-26	0	0	0	114.3	Q1030	N1028-Q1030 VanDerWaalsContact C-N 3.29Å; N1028-Q1030 PolarHBondContact O-N 3.1Å
1029	G	87.9	Confident	88.3	Confident	71.6 Å²	71.6	36.9 Å²	36.9	74%	0.738	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	79	2.2	-179.2	0	0	0	0	0	115.4	L1026 V1027	L1026-G1029 VanDerWaalsContact CD1-C 3.46Å; V1027-G1029 PolarHBondContact O-N 2.97Å; V1027-G1029 VanDerWaalsContact O-N 3.1Å
1030	Q	90.1	Very high	88.3	Confident	99.6 Å²	99.6	36.8 Å²	36.8	47%	0.465	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.2	177.7	-175.7	174.3	2.8	0	0	111.4	L1026 V1027 N1028	L1026-Q1030 VanDerWaalsContact CD1-C 3.49Å; V1027-Q1030 PolarHBondContact N-O 3.14Å; V1027-Q1030 VanDerWaalsContact N-O 3.08Å; V1027-Q1030 PolarHBondContact O-N 3.13Å; V1027-Q1030 VanDerWaalsContact O-O 3.1Å; N1028-Q1030 VanDerWaalsContact C-N 3.29Å; N1028-Q1030 PolarHBondContact O-N 3.1Å
1031	W	92.2	Very high	88.3	Confident	67.2 Å²	67.2	37.4 Å²	37.4	26%	0.255	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135.3	170	-77.7	98.7	0	0	0	110.4	R1005 E1024 V1025 L1026 L1072	R1005-W1031 HydrophobicContact CB-CH2 4.32Å; R1005-W1031 HydrophobicContact CB-CZ3 4.35Å; R1005-W1031 HydrophobicContact CG-CE3 4.32Å; R1005-W1031 HydrophobicContact CG-CH2 3.98Å; R1005-W1031 HydrophobicContact CG-CZ3 3.66Å; E1024-W1031 HydrophobicContact CB-CE3 4.07Å; E1024-W1031 HydrophobicContact CB-CZ3 4.36Å; E1024-W1031 WeakPolarHBondContact O-CZ3 3.23Å; V1025-W1031 VanDerWaalsContact C-CE3 3.44Å; V1025-W1031 WeakPolarHBondContact O-CA 3.3Å; L1026-W1031 HydrophobicContact CB-CD2 4.05Å; L1026-W1031 HydrophobicContact CB-CE3 4.19Å; L1026-W1031 HydrophobicContact CB-CH2 4.16Å; L1026-W1031 HydrophobicContact CB-CZ2 4.01Å; L1026-W1031 HydrophobicContact CB-CZ3 4.24Å; L1026-W1031 HydrophobicContact CD1-CD2 4.27Å; L1026-W1031 HydrophobicContact CD1-CG 4.07Å; L1026-W1031 HydrophobicContact CD2-CZ2 4.42Å; W1031-L1072 HydrophobicContact CB-CD1 4.18Å
1032	G	91.6	Very high	88.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	177.8	176.4	0	0	0	0	0	113.6	E1024 V1025 P1073 V1075	E1024-G1032 VanDerWaalsContact CA-O 3.31Å; E1024-G1032 WeakPolarHBondContact CA-O 3.32Å; V1025-G1032 PolarHBondContact N-O 3.12Å; V1025-G1032 PolarHBondContact O-N 3.09Å; G1032-P1073 CarbonylContact C-O 3.4Å; G1032-P1073 VanDerWaalsContact CA-O 3.25Å; G1032-P1073 WeakPolarHBondContact CA-O 3.45Å; G1032-V1075 VanDerWaalsContact CA-CG2 3.48Å
1033	T	91.1	Very high	88.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	164.3	179.8	57.7	0	0	0	0	111.4	R1022 E1024 L1072 P1073 V1074 V1075 V1109	R1022-T1033 HydrophobicContact CG-CG2 4.29Å; E1024-T1033 HydrophobicContact CG-CG2 4.43Å; T1033-L1072 HydrophobicContact CG2-CB 4.31Å; T1033-P1073 PolarHBondContact N-O 3.16Å; T1033-P1073 PolarHBondContact OG1-O 3.18Å; T1033-V1074 CarbonylContact O-C 3.54Å; T1033-V1074 WeakPolarHBondContact O-CA 3.29Å; T1033-V1074 WeakPolarHBondContact OG1-CA 3.28Å; T1033-V1074 PolarHBondContact OG1-N 3.37Å; T1033-V1075 PolarHBondContact O-N 2.86Å; T1033-V1109 HydrophobicContact CG2-CG1 4.03Å; T1033-V1109 HydrophobicContact CG2-CG2 4.41Å
1034	I	91.1	Very high	88.2	Confident	0.4 Å²	0.4	42.8 Å²	42.8	0%	0.002	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.4	179.1	-60.5	159.3	0	0	0	109.2	L1023 V1025 W1039 M1076 I1079 I1088 V1109 V1110	L1023-I1034 HydrophobicContact CD2-CD1 3.64Å; L1023-I1034 HydrophobicContact CG-CD1 3.98Å; V1025-I1034 HydrophobicContact CG1-CD1 3.82Å; V1025-I1034 HydrophobicContact CG1-CG1 4.45Å; V1025-I1034 HydrophobicContact CG2-CD1 4.12Å; V1025-I1034 HydrophobicContact CG2-CG1 3.84Å; I1034-W1039 HydrophobicContact CD1-CH2 4.26Å; I1034-W1039 HydrophobicContact CD1-CZ3 4.15Å; I1034-W1039 HydrophobicContact CG2-CE3 4.06Å; I1034-W1039 HydrophobicContact CG2-CZ3 4.16Å; I1034-M1076 WeakPolarHBondContact CA-O 3.32Å; I1034-M1076 HydrophobicContact CG1-CB 4.22Å; I1034-M1076 HydrophobicContact CG1-SD 4.46Å; I1034-M1076 HydrophobicContact CG2-CB 4.48Å; I1034-I1079 HydrophobicContact CD1-CD1 4.43Å; I1034-I1079 HydrophobicContact CG1-CD1 4.48Å; I1034-I1079 HydrophobicContact CG2-CD1 3.63Å; I1034-I1088 HydrophobicContact CD1-CD1 4.21Å; I1034-V1109 CarbonylContact O-C 3.56Å; I1034-V1109 WeakPolarHBondContact O-CA 3.15Å; I1034-V1110 HydrophobicContact CB-CB 4.27Å; I1034-V1110 HydrophobicContact CB-CG2 4.14Å; I1034-V1110 HydrophobicContact CG2-CB 4.49Å; I1034-V1110 HydrophobicContact CG2-CG2 3.94Å; I1034-V1110 WeakPolarHBondContact O-CG2 3.41Å; I1034-V1110 PolarHBondContact O-N 3.04Å; I1034-V1110 VanDerWaalsContact O-N 3.1Å
1035	C	88.6	Confident	88.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-73.4	136.4	174.1	-168.9	0	0	0	0	112	R1037 V1074 M1076 D1077 C1104 E1108	C1035-R1037 VanDerWaalsContact C-N 3.33Å; C1035-R1037 PolarHBondContact O-N 3.03Å; C1035-V1074 HydrophobicContact CB-CG1 3.9Å; C1035-M1076 PolarHBondContact N-O 3.05Å; C1035-D1077 HydrophobicContact CB-CB 3.81Å; C1035-D1077 VanDerWaalsContact CB-CG 3.45Å; C1035-D1077 WeakPolarHBondContact CB-OD1 3.45Å; C1035-C1104 VanDerWaalsContact CA-SG 3.6Å; C1035-C1104 HydrophobicContact CB-CB 3.93Å; C1035-C1104 WeakPolarHBondContact CB-SG 3.25Å; C1035-C1104 WeakPolarHBondContact SG-CB 3.28Å; C1035-C1104 CovalentContact SG-SG 2.04Å; C1035-C1104 PolarHBondContact SG-SG 3.21Å; C1035-E1108 WeakPolarHBondContact CA-O 3.29Å
1036	N	85.3	Confident	87.9	Confident	32.8 Å²	32.8	44.4 Å²	44.4	18%	0.175	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-77	-12.1	-177.5	147.3	17.8	0	0	0	114.8	S1038 W1039 W1063 R1064 E1108 V1109 V1110	N1036-S1038 VanDerWaalsContact C-N 3.29Å; N1036-S1038 PolarHBondContact O-N 3.2Å; N1036-S1038 VanDerWaalsContact O-N 3.14Å; N1036-W1039 VanDerWaalsContact O-CB 3.31Å; N1036-W1039 WeakPolarHBondContact O-CB 3.26Å; N1036-W1039 PolarHBondContact O-N 3.38Å; N1036-W1063 HydrophobicContact CB-CE3 4.14Å; N1036-W1063 HydrophobicContact CB-CH2 4.44Å; N1036-W1063 HydrophobicContact CB-CZ3 3.6Å; N1036-R1064 PolarHBondContact OD1-NE 3.21Å; N1036-E1108 HydrophobicContact CB-CB 4.49Å; N1036-E1108 WeakPolarHBondContact CB-O 3.44Å; N1036-E1108 PolarHBondContact N-O 2.84Å; N1036-V1109 PolarHBondContact ND2-O 3.01Å; N1036-V1110 HydrophobicContact CB-CG2 4Å
1037	R	80.8	Confident	87.8	Confident	104.4 Å²	104.4	42 Å²	42	39%	0.394	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-58.7	-41.1	-172.3	-141.6	179.1	17.2	-160.1	-0.6	114.3	C1035 W1039 D1077 N1078 S1103	C1035-R1037 VanDerWaalsContact C-N 3.33Å; C1035-R1037 PolarHBondContact O-N 3.03Å; R1037-W1039 VanDerWaalsContact C-N 3.34Å; R1037-D1077 IonicContact CZ-OD2 3.49Å; R1037-D1077 VanDerWaalsContact CZ-OD2 3.3Å; R1037-D1077 IonicContact NE-OD1 3.3Å; R1037-D1077 IonicContact NE-OD2 3.12Å; R1037-D1077 PolarHBondContact NE-OD2 2.9Å; R1037-D1077 IonicContact NH1-OD2 3.51Å; R1037-D1077 IonicContact NH2-OD1 3.88Å; R1037-D1077 IonicContact NH2-OD2 3.23Å; R1037-D1077 PolarHBondContact NH2-OD2 3.21Å; R1037-N1078 PolarHBondContact NH2-ND2 2.78Å; R1037-S1103 PolarHBondContact NH1-O 3.19Å; R1037-S1103 PolarHBondContact NH1-OG 2.88Å; R1037-S1103 VanDerWaalsContact NH2-CB 3.29Å; R1037-S1103 PolarHBondContact NH2-O 3Å; R1037-S1103 PolarHBondContact NH2-OG 2.93Å
1038	S	78.9	Confident	87.9	Confident	27 Å²	27	41.3 Å²	41.3	19%	0.189	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-104.6	11.9	179.9	60	0	0	0	0	113	N1036 T1040 L1043 D1077 N1078 I1079	N1036-S1038 VanDerWaalsContact C-N 3.29Å; N1036-S1038 PolarHBondContact O-N 3.2Å; N1036-S1038 VanDerWaalsContact O-N 3.14Å; S1038-T1040 PolarHBondContact O-N 3.2Å; S1038-L1043 WeakPolarHBondContact O-CD1 3.44Å; S1038-D1077 PolarHBondContact OG-OD1 3.32Å; S1038-N1078 WeakPolarHBondContact CB-OD1 3.48Å; S1038-N1078 VanDerWaalsContact OG-CA 3.23Å; S1038-N1078 WeakPolarHBondContact OG-CA 3.33Å; S1038-N1078 PolarHBondContact OG-N 3.21Å; S1038-I1079 PolarHBondContact OG-N 2.96Å; S1038-I1079 VanDerWaalsContact OG-N 3.07Å
1039	W	86.1	Confident	88	Confident	12 Å²	12	34.6 Å²	34.6	5%	0.045	20%	0.196	C	C	.	.			trans	-74.6	131.9	-175.3	-168.4	-107.1	0	0	0	111.3	L1023 I1034 N1036 R1037 L1043 A1044 S1047 W1063 R1064 I1079 I1088 V1110 V1112	L1023-W1039 HydrophobicContact CD2-CH2 3.48Å; L1023-W1039 VanDerWaalsContact CD2-CH2 3.46Å; L1023-W1039 HydrophobicContact CD2-CZ2 3.94Å; L1023-W1039 HydrophobicContact CD2-CZ3 4.31Å; I1034-W1039 HydrophobicContact CD1-CH2 4.26Å; I1034-W1039 HydrophobicContact CD1-CZ3 4.15Å; I1034-W1039 HydrophobicContact CG2-CE3 4.06Å; I1034-W1039 HydrophobicContact CG2-CZ3 4.16Å; N1036-W1039 VanDerWaalsContact O-CB 3.31Å; N1036-W1039 WeakPolarHBondContact O-CB 3.26Å; N1036-W1039 PolarHBondContact O-N 3.38Å; R1037-W1039 VanDerWaalsContact C-N 3.34Å; W1039-L1043 HydrophobicContact CD2-CB 4.23Å; W1039-L1043 HydrophobicContact CD2-CD1 4.49Å; W1039-L1043 HydrophobicContact CE3-CB 3.86Å; W1039-L1043 HydrophobicContact CE3-CD1 4.03Å; W1039-L1043 HydrophobicContact CH2-CB 3.96Å; W1039-L1043 HydrophobicContact CZ2-CB 4.19Å; W1039-L1043 HydrophobicContact CZ3-CB 3.71Å; W1039-L1043 HydrophobicContact CZ3-CD1 4.35Å; W1039-L1043 HydrophobicContact CZ3-CG 4.5Å; W1039-A1044 HydrophobicContact CH2-CB 4.43Å; W1039-A1044 VanDerWaalsContact CZ2-CA 3.43Å; W1039-A1044 HydrophobicContact CZ2-CB 3.86Å; W1039-A1044 VanDerWaalsContact CZ2-CB 3.5Å; W1039-S1047 WeakPolarHBondContact CH2-OG 3.12Å; W1039-W1063 HydrophobicContact CB-CH2 4.4Å; W1039-W1063 HydrophobicContact CB-CZ3 4.24Å; W1039-W1063 AromaticContact CD1-CE3 3.66Å; W1039-W1063 VanDerWaalsContact CD1-CE3 3.48Å; W1039-W1063 AromaticContact CD1-CG 3.8Å; W1039-W1063 AromaticContact CD1-CH2 3.54Å; W1039-W1063 AromaticContact CD1-CZ3 2.92Å; W1039-W1063 HydrophobicContact CG-CH2 4.34Å; W1039-W1063 AromaticContact CG-CZ3 3.83Å; W1039-W1063 HydrophobicContact CG-CZ3 3.83Å; W1039-W1063 AromaticContact NE1-CE3 3.79Å; W1039-W1063 AromaticContact NE1-CZ3 3.56Å; W1039-W1063 PolarHBondContact NE1-O 3.17Å; W1039-W1063 WeakPolarHBondContact O-CH2 3.28Å; W1039-R1064 PolarHBondContact O-NH2 3.03Å; W1039-I1079 HydrophobicContact CE3-CD1 4.17Å; W1039-I1079 HydrophobicContact CZ3-CD1 4.19Å; W1039-I1088 HydrophobicContact CH2-CD1 4.3Å; W1039-V1110 HydrophobicContact CB-CG2 3.98Å; W1039-V1110 HydrophobicContact CD2-CB 4.38Å; W1039-V1110 HydrophobicContact CD2-CG1 3.68Å; W1039-V1110 HydrophobicContact CD2-CG2 3.75Å; W1039-V1110 VanDerWaalsContact CE2-CG1 3.42Å; W1039-V1110 HydrophobicContact CE3-CG1 4.18Å; W1039-V1110 HydrophobicContact CE3-CG2 3.97Å; W1039-V1110 HydrophobicContact CG-CG1 4.12Å; W1039-V1110 HydrophobicContact CG-CG2 3.77Å; W1039-V1110 HydrophobicContact CH2-CG1 4.14Å; W1039-V1110 HydrophobicContact CZ2-CG1 3.62Å; W1039-V1110 VanDerWaalsContact CZ2-CG1 3.5Å; W1039-V1110 HydrophobicContact CZ3-CG1 4.34Å; W1039-V1110 HydrophobicContact CZ3-CG2 4.45Å; W1039-V1112 HydrophobicContact CH2-CG1 4.44Å; W1039-V1112 HydrophobicContact CZ2-CG1 3.69Å
1040	T	84.8	Confident	88.1	Confident	63.6 Å²	63.6	32.5 Å²	32.5	39%	0.39	17%	0.167	S	C	.	.			trans	-126.2	160.6	-178.2	66.7	0	0	0	0	110.8	S1038 N1042 L1043 A1044	S1038-T1040 PolarHBondContact O-N 3.2Å; T1040-N1042 PolarHBondContact O-N 2.99Å; T1040-L1043 PolarHBondContact O-N 3.32Å; T1040-L1043 VanDerWaalsContact O-N 3.12Å; T1040-L1043 WeakPolarHBondContact OG1-CG 3.28Å; T1040-L1043 PolarHBondContact OG1-N 3.08Å; T1040-A1044 PolarHBondContact O-N 3.06Å; T1040-A1044 VanDerWaalsContact O-N 3.09Å
1041	V	85.3	Confident	88.1	Confident	53.2 Å²	53.2	28.7 Å²	28.7	32%	0.322	15%	0.15	S	C	.	.	H	α-helix	trans	-57.6	-33.3	174.8	107.1	0	0	0	0	112	A1044 A1045 L1055 P1057 L1060 W1063	V1041-A1044 WeakPolarHBondContact O-CB 3.47Å; V1041-A1044 PolarHBondContact O-N 3.14Å; V1041-A1045 WeakPolarHBondContact O-CB 3.34Å; V1041-A1045 PolarHBondContact O-N 2.99Å; V1041-L1055 HydrophobicContact CG1-CD2 3.85Å; V1041-L1055 HydrophobicContact CG2-CD2 3.83Å; V1041-P1057 HydrophobicContact CG2-CB 4.04Å; V1041-L1060 HydrophobicContact CG1-CD2 4.22Å; V1041-L1060 HydrophobicContact CG2-CD2 4.24Å; V1041-W1063 HydrophobicContact CB-CD2 4.14Å; V1041-W1063 HydrophobicContact CB-CE3 4.42Å; V1041-W1063 HydrophobicContact CB-CG 4.29Å; V1041-W1063 HydrophobicContact CB-CZ2 4.22Å; V1041-W1063 HydrophobicContact CG2-CD2 4.36Å; V1041-W1063 HydrophobicContact CG2-CG 4.24Å
1042	N	85.9	Confident	87.9	Confident	127.4 Å²	127.4	25.7 Å²	25.7	68%	0.681	14%	0.14	S	C	*	.	H	α-helix	trans	-68.3	-40	178.1	-66.7	-11.9	0	0	0	111.9	T1040 A1044 A1045 A1046	T1040-N1042 PolarHBondContact O-N 2.99Å; N1042-A1044 VanDerWaalsContact C-N 3.33Å; N1042-A1045 PolarHBondContact O-N 3.09Å; N1042-A1046 WeakPolarHBondContact O-CB 3.25Å; N1042-A1046 PolarHBondContact O-N 3.08Å
1043	L	89.5	Confident	87.8	Confident	10.2 Å²	10.2	26.7 Å²	26.7	5%	0.053	15%	0.145	C	C	.	.	H	α-helix	trans	-66.4	-38.8	173.9	-68.6	172.4	0	0	0	111.4	S1038 W1039 T1040 A1046 S1047 I1079 C1081 I1088	S1038-L1043 WeakPolarHBondContact O-CD1 3.44Å; W1039-L1043 HydrophobicContact CD2-CB 4.23Å; W1039-L1043 HydrophobicContact CD2-CD1 4.49Å; W1039-L1043 HydrophobicContact CE3-CB 3.86Å; W1039-L1043 HydrophobicContact CE3-CD1 4.03Å; W1039-L1043 HydrophobicContact CH2-CB 3.96Å; W1039-L1043 HydrophobicContact CZ2-CB 4.19Å; W1039-L1043 HydrophobicContact CZ3-CB 3.71Å; W1039-L1043 HydrophobicContact CZ3-CD1 4.35Å; W1039-L1043 HydrophobicContact CZ3-CG 4.5Å; T1040-L1043 PolarHBondContact O-N 3.32Å; T1040-L1043 VanDerWaalsContact O-N 3.12Å; T1040-L1043 WeakPolarHBondContact OG1-CG 3.28Å; T1040-L1043 PolarHBondContact OG1-N 3.08Å; L1043-A1046 PolarHBondContact O-N 2.95Å; L1043-S1047 WeakPolarHBondContact O-CB 3.26Å; L1043-S1047 PolarHBondContact O-N 3.05Å; L1043-S1047 PolarHBondContact O-OG 2.85Å; L1043-I1079 HydrophobicContact CD1-CB 4Å; L1043-I1079 HydrophobicContact CD1-CG2 4.31Å; L1043-I1079 HydrophobicContact CD2-CB 4.3Å; L1043-I1079 HydrophobicContact CD2-CG2 3.78Å; L1043-C1081 HydrophobicContact CD2-CB 4.46Å; L1043-C1081 VanDerWaalsContact CD2-SG 3.51Å; L1043-I1088 HydrophobicContact CD2-CG2 4.28Å
1044	A	89.6	Confident	87.7	Confident	1.4 Å²	1.4	26.8 Å²	26.8	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-62.7	-43.3	173.6	0	0	0	0	0	112.1	W1039 T1040 V1041 N1042 S1047 C1048 L1055 W1063 V1112	W1039-A1044 HydrophobicContact CH2-CB 4.43Å; W1039-A1044 VanDerWaalsContact CZ2-CA 3.43Å; W1039-A1044 HydrophobicContact CZ2-CB 3.86Å; W1039-A1044 VanDerWaalsContact CZ2-CB 3.5Å; T1040-A1044 PolarHBondContact O-N 3.06Å; T1040-A1044 VanDerWaalsContact O-N 3.09Å; V1041-A1044 WeakPolarHBondContact O-CB 3.47Å; V1041-A1044 PolarHBondContact O-N 3.14Å; N1042-A1044 VanDerWaalsContact C-N 3.33Å; A1044-S1047 WeakPolarHBondContact CA-OG 3.44Å; A1044-S1047 PolarHBondContact O-N 3.05Å; A1044-S1047 PolarHBondContact O-OG 2.99Å; A1044-C1048 WeakPolarHBondContact O-CB 3.32Å; A1044-C1048 PolarHBondContact O-N 2.99Å; A1044-C1048 VanDerWaalsContact O-N 3.07Å; A1044-C1048 PolarHBondContact O-SG 2.91Å; A1044-C1048 VanDerWaalsContact O-SG 3.39Å; A1044-L1055 HydrophobicContact CB-CD1 4.27Å; A1044-L1055 HydrophobicContact CB-CD2 3.94Å; A1044-W1063 HydrophobicContact CB-CB 3.75Å; A1044-W1063 VanDerWaalsContact CB-CB 3.48Å; A1044-W1063 HydrophobicContact CB-CG 4.49Å; A1044-V1112 HydrophobicContact CB-CG1 4.13Å; A1044-V1112 HydrophobicContact CB-CG2 4.23Å
1045	A	89.3	Confident	87.5	Confident	20.4 Å²	20.4	27.3 Å²	27.3	17%	0.169	15%	0.148	C	C	.	.	H	α-helix	trans	-63.2	-48.4	175.5	0	0	0	0	0	111.3	V1041 N1042 S1047 C1048 H1049 L1055	V1041-A1045 WeakPolarHBondContact O-CB 3.34Å; V1041-A1045 PolarHBondContact O-N 2.99Å; N1042-A1045 PolarHBondContact O-N 3.09Å; A1045-S1047 VanDerWaalsContact C-N 3.32Å; A1045-S1047 PolarHBondContact O-N 3.12Å; A1045-C1048 PolarHBondContact O-N 3.01Å; A1045-C1048 VanDerWaalsContact O-N 3.17Å; A1045-H1049 PolarHBondContact O-CD2 3.07Å; A1045-H1049 VanDerWaalsContact O-CD2 3.25Å; A1045-H1049 PolarHBondContact O-N 2.99Å; A1045-H1049 PolarHBondContact O-ND1 2.99Å; A1045-L1055 HydrophobicContact CB-CB 4.19Å; A1045-L1055 HydrophobicContact CB-CD2 4.14Å
1046	A	89.1	Confident	87.4	Confident	16.4 Å²	16.4	27.5 Å²	27.5	14%	0.136	15%	0.149	C	C	.	.	H	α-helix	trans	-57.6	-43.1	176.9	0	0	0	0	0	112.2	N1042 L1043 C1048 H1049 Q1050 I1088	N1042-A1046 WeakPolarHBondContact O-CB 3.25Å; N1042-A1046 PolarHBondContact O-N 3.08Å; L1043-A1046 PolarHBondContact O-N 2.95Å; A1046-C1048 PolarHBondContact O-N 2.96Å; A1046-H1049 PolarHBondContact O-N 2.92Å; A1046-Q1050 WeakPolarHBondContact O-CB 3.35Å; A1046-Q1050 WeakPolarHBondContact O-CG 3.19Å; A1046-Q1050 PolarHBondContact O-N 3.15Å; A1046-I1088 HydrophobicContact CB-CG2 4Å
1047	S	90.8	Very high	87	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.3	-44	176.8	53.8	0	0	0	0	112.5	W1039 L1043 A1044 A1045 H1049 Q1050 L1051 I1088	W1039-S1047 WeakPolarHBondContact CH2-OG 3.12Å; L1043-S1047 WeakPolarHBondContact O-CB 3.26Å; L1043-S1047 PolarHBondContact O-N 3.05Å; L1043-S1047 PolarHBondContact O-OG 2.85Å; A1044-S1047 WeakPolarHBondContact CA-OG 3.44Å; A1044-S1047 PolarHBondContact O-N 3.05Å; A1044-S1047 PolarHBondContact O-OG 2.99Å; A1045-S1047 VanDerWaalsContact C-N 3.32Å; A1045-S1047 PolarHBondContact O-N 3.12Å; S1047-H1049 VanDerWaalsContact C-N 3.32Å; S1047-H1049 PolarHBondContact O-N 2.85Å; S1047-Q1050 PolarHBondContact O-N 2.85Å; S1047-L1051 WeakPolarHBondContact O-CD1 3.24Å; S1047-L1051 WeakPolarHBondContact O-CG 3.26Å; S1047-L1051 PolarHBondContact O-N 3.18Å; S1047-L1051 VanDerWaalsContact O-N 3.15Å; S1047-I1088 WeakPolarHBondContact OG-CD1 3.43Å
1048	C	90.7	Very high	86.8	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62	-41.8	173.9	-70.2	0	0	0	0	111.5	A1044 A1045 A1046 Q1050 L1051 G1052 M1053 L1055 C1114	A1044-C1048 WeakPolarHBondContact O-CB 3.32Å; A1044-C1048 PolarHBondContact O-N 2.99Å; A1044-C1048 VanDerWaalsContact O-N 3.07Å; A1044-C1048 PolarHBondContact O-SG 2.91Å; A1044-C1048 VanDerWaalsContact O-SG 3.39Å; A1045-C1048 PolarHBondContact O-N 3.01Å; A1045-C1048 VanDerWaalsContact O-N 3.17Å; A1046-C1048 PolarHBondContact O-N 2.96Å; C1048-Q1050 PolarHBondContact O-N 3.16Å; C1048-L1051 CarbonylContact O-C 3.54Å; C1048-L1051 WeakPolarHBondContact O-CA 3.27Å; C1048-L1051 WeakPolarHBondContact O-CB 3.37Å; C1048-L1051 PolarHBondContact O-N 3.16Å; C1048-L1051 VanDerWaalsContact O-N 3.14Å; C1048-G1052 PolarHBondContact O-N 3.04Å; C1048-M1053 CarbonylContact C-O 3.52Å; C1048-M1053 VanDerWaalsContact C-O 3.27Å; C1048-M1053 HydrophobicContact CB-CB 4.47Å; C1048-M1053 CarbonylContact O-C 3.54Å; C1048-M1053 VanDerWaalsContact O-C 3.27Å; C1048-M1053 WeakPolarHBondContact O-CA 3.4Å; C1048-M1053 WeakPolarHBondContact O-CB 3.5Å; C1048-M1053 PolarHBondContact O-N 3.2Å; C1048-L1055 HydrophobicContact CB-CB 4.4Å; C1048-C1114 WeakPolarHBondContact CA-SG 3.3Å; C1048-C1114 HydrophobicContact CB-CB 3.86Å; C1048-C1114 WeakPolarHBondContact CB-SG 3.33Å; C1048-C1114 VanDerWaalsContact SG-CA 3.51Å; C1048-C1114 WeakPolarHBondContact SG-CB 3.34Å; C1048-C1114 CovalentContact SG-SG 2.04Å; C1048-C1114 PolarHBondContact SG-SG 2.96Å
1049	H	90.2	Very high	86.5	Confident	17.2 Å²	17.2	27.5 Å²	27.5	8%	0.08	15%	0.152	C	C	.	.	H	α-helix	trans	-64.7	-40.2	179.2	-59	161.2	0	0	0	112.3	Y813 L816 A1045 A1046 S1047 L1051 G1052 M1053 F1152	Y813-H1049 HydrophobicContact CD1-CB 3.81Å; Y813-H1049 WeakPolarHBondContact CD1-O 3.3Å; Y813-H1049 HydrophobicContact CD2-CB 4.46Å; Y813-H1049 HydrophobicContact CE1-CB 3.48Å; Y813-H1049 HydrophobicContact CE2-CB 4.18Å; Y813-H1049 HydrophobicContact CG-CB 4.29Å; L816-H1049 HydrophobicContact CD1-CB 4.04Å; A1045-H1049 PolarHBondContact O-CD2 3.07Å; A1045-H1049 VanDerWaalsContact O-CD2 3.25Å; A1045-H1049 PolarHBondContact O-N 2.99Å; A1045-H1049 PolarHBondContact O-ND1 2.99Å; A1046-H1049 PolarHBondContact O-N 2.92Å; S1047-H1049 VanDerWaalsContact C-N 3.32Å; S1047-H1049 PolarHBondContact O-N 2.85Å; H1049-L1051 VanDerWaalsContact C-N 3.26Å; H1049-L1051 PolarHBondContact O-N 3.18Å; H1049-G1052 VanDerWaalsContact O-CA 3.29Å; H1049-G1052 WeakPolarHBondContact O-CA 3.41Å; H1049-G1052 PolarHBondContact O-N 3.04Å; H1049-M1053 WeakPolarHBondContact CA-O 3.29Å; H1049-M1053 PolarHBondContact CD2-O 3.14Å; H1049-M1053 PolarHBondContact N-O 3.06Å; H1049-F1152 HydrophobicContact CB-CE2 4.46Å; H1049-F1152 AromaticContact CD2-CD2 3.72Å; H1049-F1152 AromaticContact CE1-CD2 3.79Å; H1049-F1152 PolarHBondContact CE1-O 3Å; H1049-F1152 VanDerWaalsContact CE1-O 3.3Å; H1049-F1152 AromaticContact CG-CD2 3.91Å; H1049-F1152 AromaticContact CG-CE2 3.98Å; H1049-F1152 AromaticContact ND1-CD2 3.87Å; H1049-F1152 AromaticContact ND1-CE2 3.91Å; H1049-F1152 AromaticContact NE2-CD2 3.67Å; H1049-F1152 PolarHBondContact NE2-O 2.95Å
1050	Q	89.7	Confident	85.6	Confident	27.6 Å²	27.6	31.5 Å²	31.5	13%	0.129	17%	0.174	C	C	.	.	H	α-helix	trans	-63.1	-30.7	174.3	-132.6	179.3	-46.7	0	0	112.4	Y813 N1003 I1004 A1046 S1047 C1048 G1052 Y1086 D1087 I1088	Y813-Q1050 HydrophobicContact CE1-CG 4.03Å; N1003-Q1050 VanDerWaalsContact CG-NE2 3.35Å; N1003-Q1050 PolarHBondContact ND2-NE2 3.2Å; N1003-Q1050 VanDerWaalsContact ND2-NE2 3.16Å; N1003-Q1050 PolarHBondContact OD1-NE2 2.84Å; I1004-Q1050 HydrophobicContact CD1-CB 4.49Å; I1004-Q1050 HydrophobicContact CG2-CB 4.18Å; I1004-Q1050 HydrophobicContact CG2-CG 3.78Å; A1046-Q1050 WeakPolarHBondContact O-CB 3.35Å; A1046-Q1050 WeakPolarHBondContact O-CG 3.19Å; A1046-Q1050 PolarHBondContact O-N 3.15Å; S1047-Q1050 PolarHBondContact O-N 2.85Å; C1048-Q1050 PolarHBondContact O-N 3.16Å; Q1050-G1052 PolarHBondContact O-N 2.91Å; Q1050-Y1086 VanDerWaalsContact CD-O 3.29Å; Q1050-Y1086 VanDerWaalsContact CG-O 3.3Å; Q1050-Y1086 WeakPolarHBondContact CG-O 3.37Å; Q1050-D1087 VanDerWaalsContact NE2-CA 3.3Å; Q1050-D1087 VanDerWaalsContact NE2-CG 3.28Å; Q1050-D1087 PolarHBondContact NE2-OD1 2.98Å; Q1050-D1087 PolarHBondContact OE1-OD1 2.98Å; Q1050-I1088 VanDerWaalsContact OE1-N 3.15Å
1051	L	88.7	Confident	84.7	Confident	19.6 Å²	19.6	33.5 Å²	33.5	10%	0.103	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	1.2	171.7	-65.3	160.7	0	0	0	113.5	R996 P1001 I1004 I1006 L1023 S1047 C1048 H1049 M1053	R996-L1051 PolarHBondContact NH2-O 3.37Å; P1001-L1051 HydrophobicContact CG-CD2 3.87Å; I1004-L1051 HydrophobicContact CD1-CG 4.39Å; I1004-L1051 HydrophobicContact CG1-CD2 4.37Å; I1004-L1051 HydrophobicContact CG1-CG 4.41Å; I1004-L1051 HydrophobicContact CG2-CD2 3.89Å; I1004-L1051 HydrophobicContact CG2-CG 4.12Å; I1006-L1051 HydrophobicContact CD1-CD1 3.55Å; I1006-L1051 VanDerWaalsContact CD1-CD1 3.49Å; I1006-L1051 HydrophobicContact CG1-CD1 3.62Å; L1023-L1051 HydrophobicContact CD1-CD1 4.44Å; S1047-L1051 WeakPolarHBondContact O-CD1 3.24Å; S1047-L1051 WeakPolarHBondContact O-CG 3.26Å; S1047-L1051 PolarHBondContact O-N 3.18Å; S1047-L1051 VanDerWaalsContact O-N 3.15Å; C1048-L1051 CarbonylContact O-C 3.54Å; C1048-L1051 WeakPolarHBondContact O-CA 3.27Å; C1048-L1051 WeakPolarHBondContact O-CB 3.37Å; C1048-L1051 PolarHBondContact O-N 3.16Å; C1048-L1051 VanDerWaalsContact O-N 3.14Å; H1049-L1051 VanDerWaalsContact C-N 3.26Å; H1049-L1051 PolarHBondContact O-N 3.18Å; L1051-M1053 VanDerWaalsContact C-N 3.26Å; L1051-M1053 HydrophobicContact CB-CE 3.62Å; L1051-M1053 HydrophobicContact CB-CG 4.47Å; L1051-M1053 HydrophobicContact CD1-CE 3.86Å; L1051-M1053 HydrophobicContact CG-CE 4.27Å; L1051-M1053 PolarHBondContact O-N 3.12Å
1052	G	87.9	Confident	83.9	Confident	4.6 Å²	4.6	32.1 Å²	32.1	5%	0.047	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	23.7	-174.4	0	0	0	0	0	113.4	R996 C1048 H1049 Q1050	R996-G1052 VanDerWaalsContact CZ-O 3.31Å; R996-G1052 PolarHBondContact NH1-O 3.11Å; R996-G1052 PolarHBondContact NH2-O 3.03Å; C1048-G1052 PolarHBondContact O-N 3.04Å; H1049-G1052 VanDerWaalsContact O-CA 3.29Å; H1049-G1052 WeakPolarHBondContact O-CA 3.41Å; H1049-G1052 PolarHBondContact O-N 3.04Å; Q1050-G1052 PolarHBondContact O-N 2.91Å
1053	M	89.3	Confident	83.2	Confident	22.2 Å²	22.2	27.9 Å²	27.9	11%	0.109	14%	0.144	C	C	.	.			trans	-117.3	178.6	177.4	-64.5	-169.8	-79.9	0	0	109.9	L816 I1006 L1019 C1048 H1049 L1051 C1114 V1115	L816-M1053 WeakPolarHBondContact CD1-O 3.47Å; I1006-M1053 HydrophobicContact CD1-CE 3.88Å; L1019-M1053 HydrophobicContact CD2-SD 3.58Å; L1019-M1053 VanDerWaalsContact CD2-SD 3.57Å; L1019-M1053 WeakPolarHBondContact CD2-SD 3.45Å; C1048-M1053 CarbonylContact C-O 3.52Å; C1048-M1053 VanDerWaalsContact C-O 3.27Å; C1048-M1053 HydrophobicContact CB-CB 4.47Å; C1048-M1053 CarbonylContact O-C 3.54Å; C1048-M1053 VanDerWaalsContact O-C 3.27Å; C1048-M1053 WeakPolarHBondContact O-CA 3.4Å; C1048-M1053 WeakPolarHBondContact O-CB 3.5Å; C1048-M1053 PolarHBondContact O-N 3.2Å; H1049-M1053 WeakPolarHBondContact CA-O 3.29Å; H1049-M1053 PolarHBondContact CD2-O 3.14Å; H1049-M1053 PolarHBondContact N-O 3.06Å; L1051-M1053 VanDerWaalsContact C-N 3.26Å; L1051-M1053 HydrophobicContact CB-CE 3.62Å; L1051-M1053 HydrophobicContact CB-CG 4.47Å; L1051-M1053 HydrophobicContact CD1-CE 3.86Å; L1051-M1053 HydrophobicContact CG-CE 4.27Å; L1051-M1053 PolarHBondContact O-N 3.12Å; M1053-C1114 HydrophobicContact CB-CB 3.71Å; M1053-C1114 HydrophobicContact CE-CB 3.87Å; M1053-C1114 HydrophobicContact CG-CB 4.42Å; M1053-C1114 HydrophobicContact SD-CB 3.86Å; M1053-V1115 WeakPolarHBondContact CA-O 3.37Å; M1053-V1115 WeakPolarHBondContact CB-O 3.25Å
1054	I	88.9	Confident	82.1	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.015	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	157.2	176.4	45.1	162.2	0	0	0	110.4	L816 C1114 V1115 P1117 L1149 L1150 F1152 F1157	L816-I1054 HydrophobicContact CD2-CG1 4.23Å; L816-I1054 HydrophobicContact CD2-CG2 4.2Å; I1054-C1114 CarbonylContact O-C 3.46Å; I1054-C1114 WeakPolarHBondContact O-CA 3.28Å; I1054-C1114 WeakPolarHBondContact O-CB 3.43Å; I1054-V1115 HydrophobicContact CB-CG2 4.34Å; I1054-V1115 HydrophobicContact CD1-CB 4.24Å; I1054-V1115 HydrophobicContact CD1-CG1 3.99Å; I1054-V1115 HydrophobicContact CD1-CG2 3.63Å; I1054-V1115 HydrophobicContact CG1-CB 3.86Å; I1054-V1115 HydrophobicContact CG1-CG1 4.01Å; I1054-V1115 HydrophobicContact CG1-CG2 3.37Å; I1054-V1115 VanDerWaalsContact CG1-CG2 3.46Å; I1054-V1115 VanDerWaalsContact CG1-O 3.24Å; I1054-V1115 WeakPolarHBondContact CG1-O 3.38Å; I1054-V1115 PolarHBondContact N-O 2.91Å; I1054-V1115 WeakPolarHBondContact O-CG2 3.36Å; I1054-V1115 PolarHBondContact O-N 3.04Å; I1054-P1117 HydrophobicContact CD1-CB 3.58Å; I1054-P1117 HydrophobicContact CG1-CB 4.11Å; I1054-P1117 HydrophobicContact CG2-CB 4.14Å; I1054-L1149 HydrophobicContact CD1-CD1 3.71Å; I1054-L1149 HydrophobicContact CD1-CD2 3.86Å; I1054-L1149 HydrophobicContact CD1-CG 4.29Å; I1054-L1149 HydrophobicContact CG1-CD2 4.46Å; I1054-L1149 HydrophobicContact CG2-CD2 4.12Å; I1054-L1150 HydrophobicContact CB-CD2 4.13Å; I1054-L1150 WeakPolarHBondContact CD1-O 3.47Å; I1054-L1150 HydrophobicContact CG2-CD2 3.61Å; I1054-L1150 HydrophobicContact CG2-CG 3.86Å; I1054-F1152 HydrophobicContact CB-CB 4.47Å; I1054-F1152 HydrophobicContact CD1-CB 3.7Å; I1054-F1152 HydrophobicContact CG1-CB 3.77Å; I1054-F1152 HydrophobicContact CG2-CB 3.65Å; I1054-F1152 VanDerWaalsContact CG2-CB 3.49Å; I1054-F1152 HydrophobicContact CG2-CG 4.49Å; I1054-F1157 HydrophobicContact CD1-CE1 3.9Å; I1054-F1157 HydrophobicContact CD1-CZ 4.33Å
1055	L	88.7	Confident	81.1	Confident	10.8 Å²	10.8	34.9 Å²	34.9	6%	0.057	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	136.5	171.7	-174.5	72.8	0	0	0	110	V1041 A1044 A1045 C1048 P1057 L1060 N1062 W1063 V1112 R1113	V1041-L1055 HydrophobicContact CG1-CD2 3.85Å; V1041-L1055 HydrophobicContact CG2-CD2 3.83Å; A1044-L1055 HydrophobicContact CB-CD1 4.27Å; A1044-L1055 HydrophobicContact CB-CD2 3.94Å; A1045-L1055 HydrophobicContact CB-CB 4.19Å; A1045-L1055 HydrophobicContact CB-CD2 4.14Å; C1048-L1055 HydrophobicContact CB-CB 4.4Å; L1055-P1057 WeakPolarHBondContact O-CD 3.29Å; L1055-L1060 HydrophobicContact CD2-CD2 3.69Å; L1055-L1060 HydrophobicContact CG-CD2 4.35Å; L1055-N1062 HydrophobicContact CD1-CB 4.01Å; L1055-W1063 HydrophobicContact CD1-CB 4.34Å; L1055-W1063 HydrophobicContact CD2-CB 4.29Å; L1055-V1112 HydrophobicContact CD1-CG2 4.25Å; L1055-R1113 WeakPolarHBondContact CD1-O 3.33Å
1056	D	84.7	Confident	80.2	Confident	3.2 Å²	3.2	41.7 Å²	41.7	2%	0.017	20%	0.197	C	C	.	.			trans	-86.6	111.2	172.9	-177.6	-4.7	0	0	0	110.7	E1058 F1059 N1062 R1113 V1115 F1157 F1179 R1205	D1056-E1058 VanDerWaalsContact C-N 3.29Å; D1056-E1058 PolarHBondContact O-N 2.96Å; D1056-E1058 VanDerWaalsContact OD1-CB 3.27Å; D1056-E1058 WeakPolarHBondContact OD1-CB 3.27Å; D1056-E1058 PolarHBondContact OD1-N 3.07Å; D1056-E1058 VanDerWaalsContact OD1-N 3.15Å; D1056-F1059 PolarHBondContact O-N 3.26Å; D1056-F1059 VanDerWaalsContact O-N 3.16Å; D1056-F1059 WeakPolarHBondContact OD2-CD2 3.43Å; D1056-F1059 VanDerWaalsContact OD2-CE2 3.31Å; D1056-F1059 WeakPolarHBondContact OD2-CE2 3.31Å; D1056-N1062 VanDerWaalsContact O-CB 3.3Å; D1056-N1062 WeakPolarHBondContact O-CB 3.26Å; D1056-N1062 PolarHBondContact O-ND2 3.03Å; D1056-N1062 PolarHBondContact OD2-ND2 2.89Å; D1056-R1113 HydrophobicContact CB-CG 3.98Å; D1056-R1113 PolarHBondContact N-O 2.93Å; D1056-R1113 IonicContact OD2-CZ 2.81Å; D1056-R1113 IonicContact OD2-NE 3.34Å; D1056-R1113 PolarHBondContact OD2-NE 3.25Å; D1056-R1113 IonicContact OD2-NH2 3.37Å; D1056-V1115 HydrophobicContact CB-CG1 4.01Å; D1056-V1115 HydrophobicContact CB-CG2 4.13Å; D1056-F1157 HydrophobicContact CB-CE2 4.16Å; D1056-F1157 HydrophobicContact CB-CZ 3.95Å; D1056-F1157 WeakPolarHBondContact OD1-CE2 3.24Å; D1056-F1157 WeakPolarHBondContact OD1-CZ 3.31Å; D1056-F1179 HydrophobicContact CB-CZ 4.2Å; D1056-R1205 VanDerWaalsContact CG-NH1 3.33Å; D1056-R1205 VanDerWaalsContact CG-NH2 3.29Å; D1056-R1205 IonicContact OD1-CZ 3.27Å; D1056-R1205 IonicContact OD1-NH1 3.3Å; D1056-R1205 PolarHBondContact OD1-NH1 3.01Å; D1056-R1205 IonicContact OD1-NH2 3.56Å; D1056-R1205 PolarHBondContact OD1-NH2 2.88Å; D1056-R1205 VanDerWaalsContact OD1-NH2 3.15Å; D1056-R1205 IonicContact OD2-CZ 3.05Å; D1056-R1205 VanDerWaalsContact OD2-CZ 3.24Å; D1056-R1205 IonicContact OD2-NH1 3.31Å; D1056-R1205 PolarHBondContact OD2-NH1 2.95Å; D1056-R1205 IonicContact OD2-NH2 3.35Å; D1056-R1205 PolarHBondContact OD2-NH2 3.17Å
1057	P	78.7	Confident	79.5	Confident	44.4 Å²	44.4	41.4 Å²	41.4	29%	0.288	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.8	-177.1	34.2	-40.6	0	0	0	113.7	V1041 L1055 F1059 L1060 L1150 P1155 F1157 F1179 W1180	V1041-P1057 HydrophobicContact CG2-CB 4.04Å; L1055-P1057 WeakPolarHBondContact O-CD 3.29Å; P1057-F1059 VanDerWaalsContact C-N 3.28Å; P1057-F1059 PolarHBondContact O-N 3.12Å; P1057-L1060 WeakPolarHBondContact O-CD1 3.5Å; P1057-L1060 WeakPolarHBondContact O-CG 3.48Å; P1057-L1150 HydrophobicContact CG-CD1 4.15Å; P1057-P1155 HydrophobicContact CB-CB 4.24Å; P1057-P1155 HydrophobicContact CB-CG 4.33Å; P1057-P1155 HydrophobicContact CG-CB 4Å; P1057-P1155 HydrophobicContact CG-CG 3.67Å; P1057-F1157 HydrophobicContact CB-CD2 4.27Å; P1057-F1157 HydrophobicContact CB-CE2 3.48Å; P1057-F1157 VanDerWaalsContact CB-CE2 3.48Å; P1057-F1157 HydrophobicContact CB-CZ 3.91Å; P1057-F1157 HydrophobicContact CG-CD2 4.26Å; P1057-F1157 HydrophobicContact CG-CE1 4.09Å; P1057-F1157 HydrophobicContact CG-CE2 3.54Å; P1057-F1157 HydrophobicContact CG-CZ 3.81Å; P1057-F1179 HydrophobicContact CG-CE1 4.43Å; P1057-W1180 HydrophobicContact CG-CZ3 4.19Å
1058	E	75	Confident	78.9	Confident	66.4 Å²	66.4	44.8 Å²	44.8	31%	0.31	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-18.3	-178.4	-82.2	-175.8	163.7	0	0	112.9	D1056 F1157 W1180 R1205 R1206	D1056-E1058 VanDerWaalsContact C-N 3.29Å; D1056-E1058 PolarHBondContact O-N 2.96Å; D1056-E1058 VanDerWaalsContact OD1-CB 3.27Å; D1056-E1058 WeakPolarHBondContact OD1-CB 3.27Å; D1056-E1058 PolarHBondContact OD1-N 3.07Å; D1056-E1058 VanDerWaalsContact OD1-N 3.15Å; E1058-F1157 HydrophobicContact CG-CD2 4.35Å; E1058-F1157 HydrophobicContact CG-CE2 3.82Å; E1058-F1157 HydrophobicContact CG-CZ 4.19Å; E1058-W1180 PolarHBondContact OE1-NE1 3.12Å; E1058-R1205 IonicContact OE2-NH2 3.66Å; E1058-R1206 VanDerWaalsContact CD-CZ 3.44Å; E1058-R1206 IonicContact OE1-CZ 3.36Å; E1058-R1206 IonicContact OE1-NE 3.5Å; E1058-R1206 PolarHBondContact OE1-NE 3.25Å; E1058-R1206 IonicContact OE1-NH1 3.48Å; E1058-R1206 PolarHBondContact OE1-NH1 2.79Å; E1058-R1206 IonicContact OE1-NH2 3.29Å; E1058-R1206 PolarHBondContact OE1-NH2 2.99Å; E1058-R1206 IonicContact OE2-CZ 3.75Å; E1058-R1206 VanDerWaalsContact OE2-CZ 3.28Å; E1058-R1206 IonicContact OE2-NE 3.26Å; E1058-R1206 PolarHBondContact OE2-NE 3.12Å; E1058-R1206 IonicContact OE2-NH1 3.42Å; E1058-R1206 PolarHBondContact OE2-NH1 2.81Å; E1058-R1206 IonicContact OE2-NH2 3.09Å; E1058-R1206 PolarHBondContact OE2-NH2 3.07Å
1059	F	73.2	Confident	78.2	Confident	54 Å²	54	47.2 Å²	47.2	24%	0.237	23%	0.232	C	C	.	.			trans	-119	84.4	-179.4	-65.6	-80.9	0	0	0	111.2	D1056 P1057 E1061 N1062 W1063 R1113 V1861 Y1862 L1867	D1056-F1059 PolarHBondContact O-N 3.26Å; D1056-F1059 VanDerWaalsContact O-N 3.16Å; D1056-F1059 WeakPolarHBondContact OD2-CD2 3.43Å; D1056-F1059 VanDerWaalsContact OD2-CE2 3.31Å; D1056-F1059 WeakPolarHBondContact OD2-CE2 3.31Å; P1057-F1059 VanDerWaalsContact C-N 3.28Å; P1057-F1059 PolarHBondContact O-N 3.12Å; F1059-E1061 PolarHBondContact O-N 2.93Å; F1059-E1061 VanDerWaalsContact O-N 3.14Å; F1059-N1062 HydrophobicContact CB-CB 4.33Å; F1059-N1062 WeakPolarHBondContact CB-ND2 3.38Å; F1059-N1062 HydrophobicContact CD1-CB 3.96Å; F1059-N1062 WeakPolarHBondContact O-CB 3.41Å; F1059-N1062 PolarHBondContact O-N 3.27Å; F1059-N1062 VanDerWaalsContact O-N 3.13Å; F1059-W1063 PolarHBondContact O-N 3.02Å; F1059-R1113 VanDerWaalsContact CZ-NH1 3.25Å; F1059-V1861 HydrophobicContact CB-CG1 3.95Å; F1059-V1861 HydrophobicContact CD1-CG1 4.12Å; F1059-V1861 HydrophobicContact CD2-CG1 3.88Å; F1059-V1861 HydrophobicContact CG-CG1 3.68Å; F1059-Y1862 HydrophobicContact CE1-CE1 4.32Å; F1059-Y1862 AromaticContact CE2-CE1 3.75Å; F1059-Y1862 HydrophobicContact CE2-CE1 3.75Å; F1059-Y1862 AromaticContact CE2-CZ 3.68Å; F1059-Y1862 WeakPolarHBondContact CE2-OH 3.15Å; F1059-Y1862 HydrophobicContact CZ-CD1 4.34Å; F1059-Y1862 AromaticContact CZ-CE1 3.42Å; F1059-Y1862 HydrophobicContact CZ-CE1 3.42Å; F1059-Y1862 VanDerWaalsContact CZ-CE1 3.42Å; F1059-Y1862 AromaticContact CZ-CZ 3.85Å; F1059-L1867 HydrophobicContact CE1-CD2 4.1Å
1060	L	66.9	Low	77.7	Confident	95 Å²	95	48.3 Å²	48.3	50%	0.497	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-57	-30.8	179.2	-86	150.9	0	0	0	112.7	V1041 L1055 P1057 N1062 W1063 R1064 T1899	V1041-L1060 HydrophobicContact CG1-CD2 4.22Å; V1041-L1060 HydrophobicContact CG2-CD2 4.24Å; L1055-L1060 HydrophobicContact CD2-CD2 3.69Å; L1055-L1060 HydrophobicContact CG-CD2 4.35Å; P1057-L1060 WeakPolarHBondContact O-CD1 3.5Å; P1057-L1060 WeakPolarHBondContact O-CG 3.48Å; L1060-N1062 VanDerWaalsContact C-N 3.28Å; L1060-N1062 PolarHBondContact O-N 3Å; L1060-N1062 VanDerWaalsContact O-N 3.17Å; L1060-W1063 HydrophobicContact CD1-CD2 4.39Å; L1060-W1063 HydrophobicContact CD1-CH2 3.7Å; L1060-W1063 HydrophobicContact CD1-CZ2 3.21Å; L1060-W1063 HydrophobicContact CD1-CZ3 4.47Å; L1060-W1063 HydrophobicContact CD2-CZ2 4.43Å; L1060-W1063 PolarHBondContact O-N 3.05Å; L1060-W1063 VanDerWaalsContact O-N 3.12Å; L1060-W1063 PolarHBondContact O-NE1 2.82Å; L1060-R1064 HydrophobicContact CD1-CB 4.46Å; L1060-R1064 HydrophobicContact CD1-CG 4.24Å; L1060-R1064 PolarHBondContact O-N 2.86Å; L1060-T1899 HydrophobicContact CD2-CG2 3.76Å
1061	E	67.4	Low	77.4	Confident	105.6 Å²	105.6	52.8 Å²	52.8	49%	0.493	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-74.7	-17	-179.8	-60.4	117.6	179.9	0	0	113	F1059 W1063 R1064 V1065 R1113 F1865 R1870	F1059-E1061 PolarHBondContact O-N 2.93Å; F1059-E1061 VanDerWaalsContact O-N 3.14Å; E1061-W1063 VanDerWaalsContact C-N 3.3Å; E1061-W1063 PolarHBondContact O-N 2.97Å; E1061-W1063 VanDerWaalsContact O-N 3.17Å; E1061-R1064 CarbonylContact O-C 3.55Å; E1061-R1064 PolarHBondContact O-N 2.91Å; E1061-V1065 VanDerWaalsContact O-CG2 3.3Å; E1061-V1065 WeakPolarHBondContact O-CG2 3.33Å; E1061-R1113 PolarHBondContact O-NH1 3.15Å; E1061-F1865 HydrophobicContact CB-CD2 3.73Å; E1061-F1865 HydrophobicContact CB-CE2 3.62Å; E1061-F1865 HydrophobicContact CB-CG 4.4Å; E1061-F1865 HydrophobicContact CB-CZ 4.2Å; E1061-F1865 HydrophobicContact CG-CD1 3.93Å; E1061-F1865 HydrophobicContact CG-CD2 3.59Å; E1061-F1865 HydrophobicContact CG-CE1 3.89Å; E1061-F1865 HydrophobicContact CG-CE2 3.55Å; E1061-F1865 HydrophobicContact CG-CG 3.79Å; E1061-F1865 HydrophobicContact CG-CZ 3.7Å; E1061-F1865 WeakPolarHBondContact OE1-CD1 3.3Å; E1061-F1865 WeakPolarHBondContact OE1-CG 3.34Å; E1061-R1870 IonicContact OE1-CZ 2.8Å; E1061-R1870 IonicContact OE1-NH2 2.85Å; E1061-R1870 PolarHBondContact OE1-NH2 3.17Å; E1061-R1870 IonicContact OE2-NH2 3.97Å; E1061-R1870 PolarHBondContact OE2-NH2 3.02Å
1062	N	67.8	Low	77.3	Confident	25.2 Å²	25.2	54.3 Å²	54.3	14%	0.135	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-84.1	-7.5	-175.7	-71.3	-18.9	0	0	0	113.5	L1055 D1056 F1059 L1060 R1064 V1065 V1112 R1113 V1861	L1055-N1062 HydrophobicContact CD1-CB 4.01Å; D1056-N1062 VanDerWaalsContact O-CB 3.3Å; D1056-N1062 WeakPolarHBondContact O-CB 3.26Å; D1056-N1062 PolarHBondContact O-ND2 3.03Å; D1056-N1062 PolarHBondContact OD2-ND2 2.89Å; F1059-N1062 HydrophobicContact CB-CB 4.33Å; F1059-N1062 WeakPolarHBondContact CB-ND2 3.38Å; F1059-N1062 HydrophobicContact CD1-CB 3.96Å; F1059-N1062 WeakPolarHBondContact O-CB 3.41Å; F1059-N1062 PolarHBondContact O-N 3.27Å; F1059-N1062 VanDerWaalsContact O-N 3.13Å; L1060-N1062 VanDerWaalsContact C-N 3.28Å; L1060-N1062 PolarHBondContact O-N 3Å; L1060-N1062 VanDerWaalsContact O-N 3.17Å; N1062-R1064 CarbonylContact O-C 3.52Å; N1062-R1064 PolarHBondContact O-N 3.02Å; N1062-R1064 VanDerWaalsContact O-N 3.13Å; N1062-V1065 PolarHBondContact O-N 3.33Å; N1062-V1065 VanDerWaalsContact O-N 3.07Å; N1062-V1112 CarbonylContact O-C 3.52Å; N1062-R1113 HydrophobicContact CB-CB 4.25Å; N1062-R1113 WeakPolarHBondContact O-CB 3.38Å; N1062-R1113 PolarHBondContact O-N 3.12Å; N1062-R1113 WeakPolarHBondContact OD1-CD 3.38Å; N1062-V1861 WeakPolarHBondContact OD1-CG2 3.36Å
1063	W	70.4	Confident	77.3	Confident	38.8 Å²	38.8	56.8 Å²	56.8	15%	0.147	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-90.7	-8.4	174.7	64.4	-92	0	0	0	112.7	N1036 W1039 V1041 A1044 L1055 F1059 L1060 E1061 V1065 G1111	N1036-W1063 HydrophobicContact CB-CE3 4.14Å; N1036-W1063 HydrophobicContact CB-CH2 4.44Å; N1036-W1063 HydrophobicContact CB-CZ3 3.6Å; W1039-W1063 HydrophobicContact CB-CH2 4.4Å; W1039-W1063 HydrophobicContact CB-CZ3 4.24Å; W1039-W1063 AromaticContact CD1-CE3 3.66Å; W1039-W1063 VanDerWaalsContact CD1-CE3 3.48Å; W1039-W1063 AromaticContact CD1-CG 3.8Å; W1039-W1063 AromaticContact CD1-CH2 3.54Å; W1039-W1063 AromaticContact CD1-CZ3 2.92Å; W1039-W1063 HydrophobicContact CG-CH2 4.34Å; W1039-W1063 AromaticContact CG-CZ3 3.83Å; W1039-W1063 HydrophobicContact CG-CZ3 3.83Å; W1039-W1063 AromaticContact NE1-CE3 3.79Å; W1039-W1063 AromaticContact NE1-CZ3 3.56Å; W1039-W1063 PolarHBondContact NE1-O 3.17Å; W1039-W1063 WeakPolarHBondContact O-CH2 3.28Å; V1041-W1063 HydrophobicContact CB-CD2 4.14Å; V1041-W1063 HydrophobicContact CB-CE3 4.42Å; V1041-W1063 HydrophobicContact CB-CG 4.29Å; V1041-W1063 HydrophobicContact CB-CZ2 4.22Å; V1041-W1063 HydrophobicContact CG2-CD2 4.36Å; V1041-W1063 HydrophobicContact CG2-CG 4.24Å; A1044-W1063 HydrophobicContact CB-CB 3.75Å; A1044-W1063 VanDerWaalsContact CB-CB 3.48Å; A1044-W1063 HydrophobicContact CB-CG 4.49Å; L1055-W1063 HydrophobicContact CD1-CB 4.34Å; L1055-W1063 HydrophobicContact CD2-CB 4.29Å; F1059-W1063 PolarHBondContact O-N 3.02Å; L1060-W1063 HydrophobicContact CD1-CD2 4.39Å; L1060-W1063 HydrophobicContact CD1-CH2 3.7Å; L1060-W1063 HydrophobicContact CD1-CZ2 3.21Å; L1060-W1063 HydrophobicContact CD1-CZ3 4.47Å; L1060-W1063 HydrophobicContact CD2-CZ2 4.43Å; L1060-W1063 PolarHBondContact O-N 3.05Å; L1060-W1063 VanDerWaalsContact O-N 3.12Å; L1060-W1063 PolarHBondContact O-NE1 2.82Å; E1061-W1063 VanDerWaalsContact C-N 3.3Å; E1061-W1063 PolarHBondContact O-N 2.97Å; E1061-W1063 VanDerWaalsContact O-N 3.17Å; W1063-V1065 PolarHBondContact O-N 3.02Å; W1063-G1111 PolarHBondContact O-N 2.79Å
1064	R	67.7	Low	77.2	Confident	119.8 Å²	119.8	56.7 Å²	56.7	45%	0.452	31%	0.307	S	S	.	.			trans	-107.9	66.3	169	-65.4	-173.9	175.8	179	-0.4	110.7	N1036 W1039 L1060 E1061 N1062 Y1066	N1036-R1064 PolarHBondContact OD1-NE 3.21Å; W1039-R1064 PolarHBondContact O-NH2 3.03Å; L1060-R1064 HydrophobicContact CD1-CB 4.46Å; L1060-R1064 HydrophobicContact CD1-CG 4.24Å; L1060-R1064 PolarHBondContact O-N 2.86Å; E1061-R1064 CarbonylContact O-C 3.55Å; E1061-R1064 PolarHBondContact O-N 2.91Å; N1062-R1064 CarbonylContact O-C 3.52Å; N1062-R1064 PolarHBondContact O-N 3.02Å; N1062-R1064 VanDerWaalsContact O-N 3.13Å; R1064-Y1066 HydrophobicContact CB-CE1 4.48Å; R1064-Y1066 HydrophobicContact CB-CE2 4.36Å; R1064-Y1066 PolarHBondContact O-N 2.92Å
1065	V	67.3	Low	77.3	Confident	38.2 Å²	38.2	56.9 Å²	56.9	23%	0.232	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-78.4	136.7	160.8	-174.8	0	0	0	0	106.6	E1061 N1062 W1063 P1067 G1111 R1113	E1061-V1065 VanDerWaalsContact O-CG2 3.3Å; E1061-V1065 WeakPolarHBondContact O-CG2 3.33Å; N1062-V1065 PolarHBondContact O-N 3.33Å; N1062-V1065 VanDerWaalsContact O-N 3.07Å; W1063-V1065 PolarHBondContact O-N 3.02Å; V1065-P1067 VanDerWaalsContact C-CD 3.48Å; V1065-P1067 VanDerWaalsContact C-N 3.31Å; V1065-P1067 WeakPolarHBondContact O-CD 3.39Å; V1065-G1111 PolarHBondContact N-O 3.29Å; V1065-G1111 VanDerWaalsContact N-O 3.16Å; V1065-G1111 WeakPolarHBondContact O-CA 3.45Å; V1065-G1111 PolarHBondContact O-N 2.97Å; V1065-R1113 HydrophobicContact CG2-CB 4.21Å
1066	Y	71.1	Confident	77.4	Confident	164 Å²	164	56.4 Å²	56.4	64%	0.643	31%	0.305	S	S	*	.			trans	-101.5	78.1	174.1	-63.1	-79.8	0	0	0	108.9	R1064	R1064-Y1066 HydrophobicContact CB-CE1 4.48Å; R1064-Y1066 HydrophobicContact CB-CE2 4.36Å; R1064-Y1066 PolarHBondContact O-N 2.92Å
1067	P	74.9	Confident	77.5	Confident	10.6 Å²	10.6	56.2 Å²	56.2	7%	0.069	30%	0.304	C	S	.	.			trans	-73.7	167.3	-179.5	35	-38	0	0	0	110.2	D1009 R1022 V1065 V1109	D1009-P1067 WeakPolarHBondContact OD2-CA 3.37Å; D1009-P1067 WeakPolarHBondContact OD2-CB 3.18Å; R1022-P1067 HydrophobicContact CB-CB 3.83Å; R1022-P1067 HydrophobicContact CB-CG 3.77Å; R1022-P1067 HydrophobicContact CG-CB 4.38Å; R1022-P1067 HydrophobicContact CG-CG 4.05Å; V1065-P1067 VanDerWaalsContact C-CD 3.48Å; V1065-P1067 VanDerWaalsContact C-N 3.31Å; V1065-P1067 WeakPolarHBondContact O-CD 3.39Å; P1067-V1109 HydrophobicContact CG-CG2 3.84Å
1068	S	78.4	Confident	77.9	Confident	70.8 Å²	70.8	55.8 Å²	55.8	50%	0.495	30%	0.3	S	S	.	.			trans	-58.1	137.2	168.4	177.3	0	0	0	0	109.9	D1009 R1022 G1070	D1009-S1068 PolarHBondContact OD1-N 3.21Å; D1009-S1068 VanDerWaalsContact OD1-N 3.15Å; R1022-S1068 VanDerWaalsContact CD-O 3.29Å; R1022-S1068 WeakPolarHBondContact CD-O 3.34Å; R1022-S1068 PolarHBondContact NH1-O 2.99Å; S1068-G1070 PolarHBondContact O-N 3.07Å; S1068-G1070 VanDerWaalsContact O-N 3.14Å
1069	P	74.9	Confident	78.5	Confident	49.8 Å²	49.8	53.2 Å²	53.2	32%	0.323	29%	0.288	S	S	.	.			trans	-60.6	-22.3	-177.9	20	-30.4	0	0	0	114.1	R1022 P1106 V1109	R1022-P1069 WeakPolarHBondContact CD-O 3.32Å; P1069-P1106 VanDerWaalsContact CB-O 3.27Å; P1069-P1106 WeakPolarHBondContact CB-O 3.42Å; P1069-P1106 HydrophobicContact CG-CB 4.47Å; P1069-V1109 HydrophobicContact CB-CG2 4.05Å
1070	G	80.2	Confident	79.2	Confident	40 Å²	40	56.1 Å²	56.1	41%	0.412	30%	0.297	S	S	.	.			trans	67.6	-165.4	-174.3	0	0	0	0	0	112.6	S1068	S1068-G1070 PolarHBondContact O-N 3.07Å; S1068-G1070 VanDerWaalsContact O-N 3.14Å
1071	S	83.5	Confident	80.1	Confident	122.4 Å²	122.4	53.8 Å²	53.8	86%	0.856	29%	0.288	S	S	*	.	S	Bend	trans	-105	-4.4	-179	61.2	0	0	0	0	114.2
1072	L	86.8	Confident	80.7	Confident	52 Å²	52	51.6 Å²	51.6	27%	0.272	28%	0.278	S	S	.	.	S	Bend	trans	-82.6	146.9	-177.9	-66.6	-179.7	0	0	0	111.4	E1024 W1031 T1033	E1024-L1072 VanDerWaalsContact CD-CD1 3.46Å; E1024-L1072 HydrophobicContact CG-CD1 4.1Å; E1024-L1072 WeakPolarHBondContact OE1-CD1 3.36Å; E1024-L1072 WeakPolarHBondContact OE2-CD1 3.31Å; W1031-L1072 HydrophobicContact CB-CD1 4.18Å; T1033-L1072 HydrophobicContact CG2-CB 4.31Å
1073	P	88	Confident	80.9	Confident	55.6 Å²	55.6	56 Å²	56	36%	0.361	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-73	156.4	176.9	30.5	-33.4	0	0	0	111.7	G1032 T1033 V1075	G1032-P1073 CarbonylContact C-O 3.4Å; G1032-P1073 VanDerWaalsContact CA-O 3.25Å; G1032-P1073 WeakPolarHBondContact CA-O 3.45Å; T1033-P1073 PolarHBondContact N-O 3.16Å; T1033-P1073 PolarHBondContact OG1-O 3.18Å; P1073-V1075 HydrophobicContact CG-CG1 4.23Å; P1073-V1075 PolarHBondContact O-N 2.72Å
1074	V	87.8	Confident	81.1	Confident	21.6 Å²	21.6	57.6 Å²	57.6	13%	0.131	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	116.6	167.8	-175.6	0	0	0	0	108.3	T1033 C1035 I1100 C1104	T1033-V1074 CarbonylContact O-C 3.54Å; T1033-V1074 WeakPolarHBondContact O-CA 3.29Å; T1033-V1074 WeakPolarHBondContact OG1-CA 3.28Å; T1033-V1074 PolarHBondContact OG1-N 3.37Å; C1035-V1074 HydrophobicContact CB-CG1 3.9Å; V1074-I1100 HydrophobicContact CB-CG2 4.32Å; V1074-I1100 HydrophobicContact CG1-CD1 4.31Å; V1074-I1100 HydrophobicContact CG1-CG2 3.8Å; V1074-I1100 WeakPolarHBondContact O-CD1 3.13Å; V1074-C1104 HydrophobicContact CG1-CB 4.49Å
1075	V	90.1	Very high	81.9	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.036	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-17.4	-175.6	-67	0	0	0	0	113.6	V1025 G1032 T1033 P1073 G1095 V1096	V1025-V1075 HydrophobicContact CG2-CG2 3.98Å; G1032-V1075 VanDerWaalsContact CA-CG2 3.48Å; T1033-V1075 PolarHBondContact O-N 2.86Å; P1073-V1075 HydrophobicContact CG-CG1 4.23Å; P1073-V1075 PolarHBondContact O-N 2.72Å; V1075-G1095 WeakPolarHBondContact O-CA 3.45Å; V1075-V1096 HydrophobicContact CB-CG2 4.25Å; V1075-V1096 HydrophobicContact CG1-CG2 4Å
1076	M	90	Very high	82.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	135.8	179.6	-66.2	-179.1	79.6	0	0	111.5	V1025 V1027 I1034 C1035 I1079 I1088 H1093 D1094	V1025-M1076 HydrophobicContact CB-SD 4.4Å; V1025-M1076 HydrophobicContact CG2-CG 4.29Å; V1025-M1076 HydrophobicContact CG2-SD 3.65Å; V1027-M1076 HydrophobicContact CG2-CE 4.42Å; V1027-M1076 HydrophobicContact CG2-CG 3.91Å; V1027-M1076 HydrophobicContact CG2-SD 3.66Å; V1027-M1076 WeakPolarHBondContact CG2-SD 3.47Å; I1034-M1076 WeakPolarHBondContact CA-O 3.32Å; I1034-M1076 HydrophobicContact CG1-CB 4.22Å; I1034-M1076 HydrophobicContact CG1-SD 4.46Å; I1034-M1076 HydrophobicContact CG2-CB 4.48Å; C1035-M1076 PolarHBondContact N-O 3.05Å; M1076-I1079 HydrophobicContact CB-CD1 4.16Å; M1076-I1079 HydrophobicContact CB-CG1 4.32Å; M1076-I1079 HydrophobicContact CE-CD1 3.75Å; M1076-I1079 HydrophobicContact CE-CG1 3.91Å; M1076-I1079 HydrophobicContact CE-CG2 4.38Å; M1076-I1079 HydrophobicContact SD-CD1 4.34Å; M1076-I1088 WeakPolarHBondContact CE-O 3.24Å; M1076-H1093 HydrophobicContact CE-CB 3.85Å; M1076-H1093 WeakPolarHBondContact CE-ND1 2.98Å; M1076-D1094 WeakPolarHBondContact CA-O 3.29Å
1077	D	88.2	Confident	83.5	Confident	0.6 Å²	0.6	48.9 Å²	48.9	0%	0.003	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	168.2	167	-169.9	16.2	0	0	0	110.1	C1035 R1037 S1038 I1079 H1093 D1094 I1100	C1035-D1077 HydrophobicContact CB-CB 3.81Å; C1035-D1077 VanDerWaalsContact CB-CG 3.45Å; C1035-D1077 WeakPolarHBondContact CB-OD1 3.45Å; R1037-D1077 IonicContact CZ-OD2 3.49Å; R1037-D1077 VanDerWaalsContact CZ-OD2 3.3Å; R1037-D1077 IonicContact NE-OD1 3.3Å; R1037-D1077 IonicContact NE-OD2 3.12Å; R1037-D1077 PolarHBondContact NE-OD2 2.9Å; R1037-D1077 IonicContact NH1-OD2 3.51Å; R1037-D1077 IonicContact NH2-OD1 3.88Å; R1037-D1077 IonicContact NH2-OD2 3.23Å; R1037-D1077 PolarHBondContact NH2-OD2 3.21Å; S1038-D1077 PolarHBondContact OG-OD1 3.32Å; D1077-I1079 VanDerWaalsContact C-N 3.26Å; D1077-I1079 PolarHBondContact O-N 3.1Å; D1077-I1079 VanDerWaalsContact O-N 3.1Å; D1077-H1093 CarbonylContact O-C 3.49Å; D1077-H1093 WeakPolarHBondContact O-CA 3.15Å; D1077-H1093 WeakPolarHBondContact O-CB 3.28Å; D1077-D1094 HydrophobicContact CB-CB 4.43Å; D1077-D1094 PolarHBondContact N-O 2.8Å; D1077-D1094 VanDerWaalsContact N-O 3.1Å; D1077-D1094 PolarHBondContact O-N 3.21Å; D1077-I1100 HydrophobicContact CB-CB 4.41Å; D1077-I1100 HydrophobicContact CB-CD1 4.14Å; D1077-I1100 HydrophobicContact CB-CG1 4.28Å; D1077-I1100 HydrophobicContact CB-CG2 3.94Å
1078	N	86.1	Confident	84.3	Confident	36 Å²	36	48.4 Å²	48.4	19%	0.193	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	46.9	47.1	179.8	-82.2	-22.7	0	0	0	113.2	R1037 S1038 R1080 D1094	R1037-N1078 PolarHBondContact NH2-ND2 2.78Å; S1038-N1078 WeakPolarHBondContact CB-OD1 3.48Å; S1038-N1078 VanDerWaalsContact OG-CA 3.23Å; S1038-N1078 WeakPolarHBondContact OG-CA 3.33Å; S1038-N1078 PolarHBondContact OG-N 3.21Å; N1078-R1080 PolarHBondContact ND2-NH2 2.92Å; N1078-R1080 VanDerWaalsContact ND2-NH2 3.18Å; N1078-R1080 WeakPolarHBondContact O-CG 3.36Å; N1078-R1080 PolarHBondContact O-N 3.08Å; N1078-R1080 PolarHBondContact O-NH1 2.59Å; N1078-R1080 PolarHBondContact OD1-NE 3.18Å; N1078-R1080 VanDerWaalsContact OD1-NE 3.14Å; N1078-R1080 PolarHBondContact OD1-NH2 2.93Å; N1078-D1094 HydrophobicContact CB-CB 4.45Å; N1078-D1094 WeakPolarHBondContact CB-OD2 3.37Å; N1078-D1094 PolarHBondContact ND2-OD2 3.22Å
1079	I	88.8	Confident	84.8	Confident	11.2 Å²	11.2	45.6 Å²	45.6	6%	0.057	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	122.3	-177.6	-53.1	176	0	0	0	109.2	I1034 S1038 W1039 L1043 M1076 D1077 C1091 R1092 H1093	I1034-I1079 HydrophobicContact CD1-CD1 4.43Å; I1034-I1079 HydrophobicContact CG1-CD1 4.48Å; I1034-I1079 HydrophobicContact CG2-CD1 3.63Å; S1038-I1079 PolarHBondContact OG-N 2.96Å; S1038-I1079 VanDerWaalsContact OG-N 3.07Å; W1039-I1079 HydrophobicContact CE3-CD1 4.17Å; W1039-I1079 HydrophobicContact CZ3-CD1 4.19Å; L1043-I1079 HydrophobicContact CD1-CB 4Å; L1043-I1079 HydrophobicContact CD1-CG2 4.31Å; L1043-I1079 HydrophobicContact CD2-CB 4.3Å; L1043-I1079 HydrophobicContact CD2-CG2 3.78Å; M1076-I1079 HydrophobicContact CB-CD1 4.16Å; M1076-I1079 HydrophobicContact CB-CG1 4.32Å; M1076-I1079 HydrophobicContact CE-CD1 3.75Å; M1076-I1079 HydrophobicContact CE-CG1 3.91Å; M1076-I1079 HydrophobicContact CE-CG2 4.38Å; M1076-I1079 HydrophobicContact SD-CD1 4.34Å; D1077-I1079 VanDerWaalsContact C-N 3.26Å; D1077-I1079 PolarHBondContact O-N 3.1Å; D1077-I1079 VanDerWaalsContact O-N 3.1Å; I1079-C1091 HydrophobicContact CG2-CB 3.89Å; I1079-R1092 CarbonylContact C-O 3.55Å; I1079-R1092 WeakPolarHBondContact CA-O 3.39Å; I1079-H1093 HydrophobicContact CG1-CB 4.17Å
1080	R	86.5	Confident	85.4	Confident	115.2 Å²	115.2	49.8 Å²	49.8	44%	0.435	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	99.1	178.9	-64.1	174.2	-166.5	136.1	-1.2	108.5	E227 Y691 N1078 R1092 D1094	E227-R1080 IonicContact OE2-CZ 4Å; E227-R1080 IonicContact OE2-NH1 3.02Å; E227-R1080 PolarHBondContact OE2-NH1 3.05Å; E227-R1080 IonicContact OE2-NH2 2.7Å; Y691-R1080 PolarHBondContact OH-O 2.94Å; N1078-R1080 PolarHBondContact ND2-NH2 2.92Å; N1078-R1080 VanDerWaalsContact ND2-NH2 3.18Å; N1078-R1080 WeakPolarHBondContact O-CG 3.36Å; N1078-R1080 PolarHBondContact O-N 3.08Å; N1078-R1080 PolarHBondContact O-NH1 2.59Å; N1078-R1080 PolarHBondContact OD1-NE 3.18Å; N1078-R1080 VanDerWaalsContact OD1-NE 3.14Å; N1078-R1080 PolarHBondContact OD1-NH2 2.93Å; R1080-R1092 VanDerWaalsContact CD-NH2 3.29Å; R1080-R1092 PolarHBondContact N-O 2.94Å; R1080-R1092 PolarHBondContact O-N 3.07Å; R1080-D1094 IonicContact CZ-OD1 3.55Å; R1080-D1094 IonicContact NH1-OD1 2.88Å; R1080-D1094 PolarHBondContact NH1-OD1 2.76Å; R1080-D1094 IonicContact NH2-OD1 2.7Å; R1080-D1094 PolarHBondContact NH2-OD1 3.1Å
1081	C	86.8	Confident	85.9	Confident	46.2 Å²	46.2	48 Å²	48	31%	0.312	25%	0.249	S	C	.	.			trans	-90.2	132.6	172.8	-61.9	0	0	0	0	110.1	L1043 E1085 C1091	L1043-C1081 HydrophobicContact CD2-CB 4.46Å; L1043-C1081 VanDerWaalsContact CD2-SG 3.51Å; C1081-E1085 VanDerWaalsContact CA-OE2 3.27Å; C1081-E1085 WeakPolarHBondContact CA-OE2 3.43Å; C1081-E1085 HydrophobicContact CB-CB 4.21Å; C1081-C1091 VanDerWaalsContact CA-SG 3.53Å; C1081-C1091 WeakPolarHBondContact CA-SG 3.46Å; C1081-C1091 HydrophobicContact CB-CB 3.98Å; C1081-C1091 WeakPolarHBondContact CB-SG 3.34Å; C1081-C1091 WeakPolarHBondContact SG-CB 3.3Å; C1081-C1091 CovalentContact SG-SG 2.04Å; C1081-C1091 PolarHBondContact SG-SG 3.01Å
1082	E	80.1	Confident	86.1	Confident	60.2 Å²	60.2	47.2 Å²	47.2	28%	0.281	23%	0.227	S	C	.	.			trans	-77.3	166.9	169.5	-64.4	-100	156.3	0	0	111.2	Y691 H692 L1084 E1085 R1092	Y691-E1082 HydrophobicContact CE1-CG 3.74Å; Y691-E1082 HydrophobicContact CE2-CG 4.41Å; Y691-E1082 VanDerWaalsContact CZ-CG 3.47Å; Y691-E1082 WeakPolarHBondContact OH-CG 3.4Å; H692-E1082 IonicContact CE1-OE1 3Å; H692-E1082 PolarHBondContact CE1-OE1 3.27Å; H692-E1082 IonicContact CE1-OE2 3.82Å; H692-E1082 IonicContact CG-OE1 2.78Å; H692-E1082 IonicContact ND1-OE1 2.71Å; H692-E1082 PolarHBondContact ND1-OE1 2.88Å; H692-E1082 IonicContact NE2-OE1 2.69Å; H692-E1082 PolarHBondContact NE2-OE1 3.1Å; E1082-L1084 PolarHBondContact O-N 3.19Å; E1082-E1085 HydrophobicContact CB-CG 4.18Å; E1082-E1085 PolarHBondContact N-OE2 3.15Å; E1082-E1085 WeakPolarHBondContact O-CB 3.48Å; E1082-E1085 PolarHBondContact O-N 2.89Å; E1082-E1085 VanDerWaalsContact O-N 3.12Å; E1082-R1092 IonicContact OE1-CZ 2.94Å; E1082-R1092 IonicContact OE1-NE 2.71Å; E1082-R1092 PolarHBondContact OE1-NE 2.73Å; E1082-R1092 IonicContact OE1-NH1 3.5Å; E1082-R1092 IonicContact OE1-NH2 2.87Å; E1082-R1092 PolarHBondContact OE1-NH2 3.21Å
1083	E	71.9	Confident	86.1	Confident	117.4 Å²	117.4	46.9 Å²	46.9	55%	0.549	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	87.6	178.2	-50.8	-178.9	176.8	0	0	112	R726 Q728 E1085	R726-E1083 IonicContact NH1-OE2 2.97Å; R726-E1083 PolarHBondContact NH1-OE2 3.44Å; Q728-E1083 PolarHBondContact NE2-OE1 3.11Å; Q728-E1083 PolarHBondContact NE2-OE2 3.13Å; Q728-E1083 PolarHBondContact OE1-OE2 2.89Å; E1083-E1085 VanDerWaalsContact C-N 3.28Å; E1083-E1085 PolarHBondContact O-N 3.2Å
1084	L	74.9	Confident	86.1	Confident	71.2 Å²	71.2	45.7 Å²	45.7	37%	0.373	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	10	-178.5	-49.8	173.5	0	0	0	114.7	I723 R747 P748 P780 F781 E1082 Y1086	I723-L1084 HydrophobicContact CD1-CD1 4Å; I723-L1084 HydrophobicContact CG1-CD1 4.16Å; R747-L1084 PolarHBondContact NH1-O 3.17Å; R747-L1084 VanDerWaalsContact NH1-O 3.08Å; P748-L1084 HydrophobicContact CB-CD1 4.49Å; P748-L1084 HydrophobicContact CG-CD1 3.93Å; P780-L1084 HydrophobicContact CG-CB 4.48Å; F781-L1084 HydrophobicContact CE1-CD1 3.8Å; F781-L1084 HydrophobicContact CE1-CD2 3.72Å; F781-L1084 HydrophobicContact CE1-CG 4.36Å; F781-L1084 HydrophobicContact CE2-CD1 4.29Å; F781-L1084 HydrophobicContact CZ-CD1 3.51Å; F781-L1084 HydrophobicContact CZ-CD2 4.14Å; F781-L1084 HydrophobicContact CZ-CG 4.3Å; E1082-L1084 PolarHBondContact O-N 3.19Å; L1084-Y1086 HydrophobicContact CB-CE2 4.36Å; L1084-Y1086 WeakPolarHBondContact CD2-OH 3.41Å; L1084-Y1086 VanDerWaalsContact O-CD1 3.29Å; L1084-Y1086 WeakPolarHBondContact O-CD1 3.4Å; L1084-Y1086 VanDerWaalsContact O-CD2 3.3Å; L1084-Y1086 WeakPolarHBondContact O-CD2 3.46Å; L1084-Y1086 WeakPolarHBondContact O-CE1 3.45Å; L1084-Y1086 WeakPolarHBondContact O-CE2 3.29Å
1085	E	84.2	Confident	85.9	Confident	35.8 Å²	35.8	45.2 Å²	45.2	17%	0.167	21%	0.214	C	C	.	.			trans	-84.6	116.5	166.5	-66.7	-173.7	145.7	0	0	109.8	Y691 R747 C1081 E1082 E1083	Y691-E1085 WeakPolarHBondContact CE2-OE1 3.37Å; R747-E1085 IonicContact CZ-OE1 3.2Å; R747-E1085 IonicContact NH2-OE1 3.44Å; R747-E1085 PolarHBondContact NH2-OE1 3.42Å; C1081-E1085 VanDerWaalsContact CA-OE2 3.27Å; C1081-E1085 WeakPolarHBondContact CA-OE2 3.43Å; C1081-E1085 HydrophobicContact CB-CB 4.21Å; E1082-E1085 HydrophobicContact CB-CG 4.18Å; E1082-E1085 PolarHBondContact N-OE2 3.15Å; E1082-E1085 WeakPolarHBondContact O-CB 3.48Å; E1082-E1085 PolarHBondContact O-N 2.89Å; E1082-E1085 VanDerWaalsContact O-N 3.12Å; E1083-E1085 VanDerWaalsContact C-N 3.28Å; E1083-E1085 PolarHBondContact O-N 3.2Å
1086	Y	83.7	Confident	85.4	Confident	71.6 Å²	71.6	48.5 Å²	48.5	28%	0.281	23%	0.234	S	C	.	.			trans	-109.6	-11.4	-175.6	30.9	-95.1	0	0	0	113.3	P780 P812 Y813 Q1050 L1084	P780-Y1086 HydrophobicContact CB-CE1 3.96Å; P780-Y1086 HydrophobicContact CB-CE2 3.62Å; P780-Y1086 WeakPolarHBondContact CB-OH 3.25Å; P780-Y1086 HydrophobicContact CG-CE1 3.93Å; P780-Y1086 HydrophobicContact CG-CE2 3.74Å; P812-Y1086 HydrophobicContact CB-CD1 3.86Å; P812-Y1086 HydrophobicContact CB-CD2 3.39Å; P812-Y1086 HydrophobicContact CB-CE1 4Å; P812-Y1086 HydrophobicContact CB-CE2 3.62Å; P812-Y1086 HydrophobicContact CB-CG 3.39Å; P812-Y1086 HydrophobicContact CG-CD1 3.91Å; P812-Y1086 HydrophobicContact CG-CD2 4.01Å; P812-Y1086 HydrophobicContact CG-CE1 4.28Å; P812-Y1086 HydrophobicContact CG-CE2 4.21Å; P812-Y1086 HydrophobicContact CG-CG 3.83Å; Y813-Y1086 AromaticContact CE2-CD1 3.72Å; Y813-Y1086 HydrophobicContact CE2-CD1 3.72Å; Y813-Y1086 HydrophobicContact CE2-CE1 4.38Å; Y813-Y1086 HydrophobicContact CE2-CG 4.41Å; Y813-Y1086 AromaticContact CZ-CD1 3.88Å; Y813-Y1086 WeakPolarHBondContact OH-CA 3.41Å; Y813-Y1086 VanDerWaalsContact OH-CB 3.24Å; Y813-Y1086 WeakPolarHBondContact OH-CB 3.34Å; Y813-Y1086 PolarHBondContact OH-O 3.32Å; Q1050-Y1086 VanDerWaalsContact CD-O 3.29Å; Q1050-Y1086 VanDerWaalsContact CG-O 3.3Å; Q1050-Y1086 WeakPolarHBondContact CG-O 3.37Å; L1084-Y1086 HydrophobicContact CB-CE2 4.36Å; L1084-Y1086 WeakPolarHBondContact CD2-OH 3.41Å; L1084-Y1086 VanDerWaalsContact O-CD1 3.29Å; L1084-Y1086 WeakPolarHBondContact O-CD1 3.4Å; L1084-Y1086 VanDerWaalsContact O-CD2 3.3Å; L1084-Y1086 WeakPolarHBondContact O-CD2 3.46Å; L1084-Y1086 WeakPolarHBondContact O-CE1 3.45Å; L1084-Y1086 WeakPolarHBondContact O-CE2 3.29Å
1087	D	88.5	Confident	84.9	Confident	32.6 Å²	32.6	55.6 Å²	55.6	17%	0.174	27%	0.272	C	S	.	.			trans	-107.5	108.4	174.8	-173.3	-15.4	0	0	0	109.5	N1003 Q1050 T1089 Q1090 C1091	N1003-D1087 VanDerWaalsContact ND2-CG 3.32Å; N1003-D1087 PolarHBondContact ND2-OD1 2.98Å; N1003-D1087 VanDerWaalsContact ND2-OD1 3.1Å; N1003-D1087 PolarHBondContact ND2-OD2 3.03Å; Q1050-D1087 VanDerWaalsContact NE2-CA 3.3Å; Q1050-D1087 VanDerWaalsContact NE2-CG 3.28Å; Q1050-D1087 PolarHBondContact NE2-OD1 2.98Å; Q1050-D1087 PolarHBondContact OE1-OD1 2.98Å; D1087-T1089 VanDerWaalsContact CG-OG1 3.24Å; D1087-T1089 PolarHBondContact O-N 2.91Å; D1087-T1089 VanDerWaalsContact O-N 3.13Å; D1087-T1089 WeakPolarHBondContact OD1-CB 3.23Å; D1087-T1089 PolarHBondContact OD1-N 2.99Å; D1087-T1089 PolarHBondContact OD1-OG1 2.96Å; D1087-T1089 PolarHBondContact OD2-OG1 3.21Å; D1087-Q1090 HydrophobicContact CB-CB 4.28Å; D1087-Q1090 HydrophobicContact CB-CG 3.96Å; D1087-Q1090 PolarHBondContact O-N 3.16Å; D1087-C1091 PolarHBondContact O-N 2.86Å; D1087-C1091 PolarHBondContact O-SG 3.15Å; D1087-C1091 VanDerWaalsContact O-SG 3.4Å
1088	I	90.4	Very high	84.4	Confident	0.8 Å²	0.8	60.3 Å²	60.3	0%	0.004	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.5	-177.2	67.1	175.3	0	0	0	112.2	I1004 L1023 V1025 I1034 W1039 L1043 A1046 S1047 Q1050 M1076 Q1090 C1091	I1004-I1088 HydrophobicContact CD1-CD1 3.58Å; I1004-I1088 VanDerWaalsContact CD1-CD1 3.48Å; I1004-I1088 HydrophobicContact CD1-CG1 4.21Å; I1004-I1088 HydrophobicContact CG1-CD1 4.47Å; L1023-I1088 HydrophobicContact CD2-CD1 4.46Å; V1025-I1088 HydrophobicContact CG1-CD1 3.96Å; V1025-I1088 HydrophobicContact CG1-CG1 4.41Å; I1034-I1088 HydrophobicContact CD1-CD1 4.21Å; W1039-I1088 HydrophobicContact CH2-CD1 4.3Å; L1043-I1088 HydrophobicContact CD2-CG2 4.28Å; A1046-I1088 HydrophobicContact CB-CG2 4Å; S1047-I1088 WeakPolarHBondContact OG-CD1 3.43Å; Q1050-I1088 VanDerWaalsContact OE1-N 3.15Å; M1076-I1088 WeakPolarHBondContact CE-O 3.24Å; I1088-Q1090 VanDerWaalsContact C-N 3.27Å; I1088-Q1090 PolarHBondContact O-N 3.08Å; I1088-C1091 WeakPolarHBondContact O-CB 3.36Å; I1088-C1091 PolarHBondContact O-N 3.12Å
1089	T	90.5	Very high	83.9	Confident	12.4 Å²	12.4	60.2 Å²	60.2	8%	0.076	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-18.2	179.2	69.7	0	0	0	0	112.8	N1003 V1025 V1027 D1087	N1003-T1089 HydrophobicContact CB-CG2 4.29Å; N1003-T1089 PolarHBondContact ND2-OG1 3.12Å; V1025-T1089 HydrophobicContact CB-CG2 4.08Å; V1025-T1089 HydrophobicContact CG1-CG2 4.17Å; V1027-T1089 HydrophobicContact CG2-CG2 4.41Å; D1087-T1089 VanDerWaalsContact CG-OG1 3.24Å; D1087-T1089 PolarHBondContact O-N 2.91Å; D1087-T1089 VanDerWaalsContact O-N 3.13Å; D1087-T1089 WeakPolarHBondContact OD1-CB 3.23Å; D1087-T1089 PolarHBondContact OD1-N 2.99Å; D1087-T1089 PolarHBondContact OD1-OG1 2.96Å; D1087-T1089 PolarHBondContact OD2-OG1 3.21Å
1090	Q	87.5	Confident	83.4	Confident	137.8 Å²	137.8	59.8 Å²	59.8	64%	0.644	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-13.1	176.7	-59.9	-73.6	-38.5	0	0	112.8	D1087 I1088	D1087-Q1090 HydrophobicContact CB-CB 4.28Å; D1087-Q1090 HydrophobicContact CB-CG 3.96Å; D1087-Q1090 PolarHBondContact O-N 3.16Å; I1088-Q1090 VanDerWaalsContact C-N 3.27Å; I1088-Q1090 PolarHBondContact O-N 3.08Å
1091	C	89.5	Confident	82.8	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.014	31%	0.305	C	S	.	.	S	Bend	trans	-65.3	153.9	175.8	-60.1	0	0	0	0	110.9	I1079 C1081 D1087 I1088 H1093	I1079-C1091 HydrophobicContact CG2-CB 3.89Å; C1081-C1091 VanDerWaalsContact CA-SG 3.53Å; C1081-C1091 WeakPolarHBondContact CA-SG 3.46Å; C1081-C1091 HydrophobicContact CB-CB 3.98Å; C1081-C1091 WeakPolarHBondContact CB-SG 3.34Å; C1081-C1091 WeakPolarHBondContact SG-CB 3.3Å; C1081-C1091 CovalentContact SG-SG 2.04Å; C1081-C1091 PolarHBondContact SG-SG 3.01Å; D1087-C1091 PolarHBondContact O-N 2.86Å; D1087-C1091 PolarHBondContact O-SG 3.15Å; D1087-C1091 VanDerWaalsContact O-SG 3.4Å; I1088-C1091 WeakPolarHBondContact O-CB 3.36Å; I1088-C1091 PolarHBondContact O-N 3.12Å; C1091-H1093 PolarHBondContact O-N 2.99Å; C1091-H1093 PolarHBondContact O-ND1 3.07Å
1092	R	87	Confident	82.3	Confident	105.4 Å²	105.4	64.1 Å²	64.1	40%	0.398	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	129.1	174.4	-104.5	-177.4	-113.7	153.9	5.8	109.5	E227 W656 Y691 I1079 R1080 E1082	E227-R1092 IonicContact OE1-CZ 2.75Å; E227-R1092 VanDerWaalsContact OE1-CZ 3.26Å; E227-R1092 IonicContact OE1-NH1 3.75Å; E227-R1092 IonicContact OE1-NH2 2.66Å; E227-R1092 PolarHBondContact OE1-NH2 2.82Å; E227-R1092 IonicContact OE2-CZ 3.42Å; E227-R1092 IonicContact OE2-NH1 3.42Å; E227-R1092 IonicContact OE2-NH2 3.56Å; W656-R1092 VanDerWaalsContact CH2-NH1 3.25Å; W656-R1092 VanDerWaalsContact CH2-NH2 3.32Å; W656-R1092 VanDerWaalsContact CZ3-NH1 3.33Å; Y691-R1092 HydrophobicContact CE1-CG 4.49Å; Y691-R1092 HydrophobicContact CE2-CB 4.18Å; Y691-R1092 HydrophobicContact CE2-CG 4.03Å; Y691-R1092 VanDerWaalsContact CZ-CD 3.5Å; Y691-R1092 WeakPolarHBondContact OH-CB 3.39Å; Y691-R1092 WeakPolarHBondContact OH-CD 3.07Å; Y691-R1092 WeakPolarHBondContact OH-CG 3.27Å; Y691-R1092 PolarHBondContact OH-NE 3.19Å; I1079-R1092 CarbonylContact C-O 3.55Å; I1079-R1092 WeakPolarHBondContact CA-O 3.39Å; R1080-R1092 VanDerWaalsContact CD-NH2 3.29Å; R1080-R1092 PolarHBondContact N-O 2.94Å; R1080-R1092 PolarHBondContact O-N 3.07Å; E1082-R1092 IonicContact OE1-CZ 2.94Å; E1082-R1092 IonicContact OE1-NE 2.71Å; E1082-R1092 PolarHBondContact OE1-NE 2.73Å; E1082-R1092 IonicContact OE1-NH1 3.5Å; E1082-R1092 IonicContact OE1-NH2 2.87Å; E1082-R1092 PolarHBondContact OE1-NH2 3.21Å
1093	H	88.4	Confident	82	Confident	45.4 Å²	45.4	63.2 Å²	63.2	21%	0.21	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	158.1	-179.7	58.6	-83.4	0	0	0	109.7	V1027 M1076 D1077 I1079 C1091	V1027-H1093 WeakPolarHBondContact CG1-NE2 3.3Å; M1076-H1093 HydrophobicContact CE-CB 3.85Å; M1076-H1093 WeakPolarHBondContact CE-ND1 2.98Å; D1077-H1093 CarbonylContact O-C 3.49Å; D1077-H1093 WeakPolarHBondContact O-CA 3.15Å; D1077-H1093 WeakPolarHBondContact O-CB 3.28Å; I1079-H1093 HydrophobicContact CG1-CB 4.17Å; C1091-H1093 PolarHBondContact O-N 2.99Å; C1091-H1093 PolarHBondContact O-ND1 3.07Å
1094	D	86.6	Confident	82.5	Confident	29.4 Å²	29.4	57.8 Å²	57.8	16%	0.157	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	130.4	165.3	-62.5	-18.8	0	0	0	107	E227 M1076 D1077 N1078 R1080 Q1098 I1100	E227-D1094 PolarHBondContact N-OD2 2.9Å; M1076-D1094 WeakPolarHBondContact CA-O 3.29Å; D1077-D1094 HydrophobicContact CB-CB 4.43Å; D1077-D1094 PolarHBondContact N-O 2.8Å; D1077-D1094 VanDerWaalsContact N-O 3.1Å; D1077-D1094 PolarHBondContact O-N 3.21Å; N1078-D1094 HydrophobicContact CB-CB 4.45Å; N1078-D1094 WeakPolarHBondContact CB-OD2 3.37Å; N1078-D1094 PolarHBondContact ND2-OD2 3.22Å; R1080-D1094 IonicContact CZ-OD1 3.55Å; R1080-D1094 IonicContact NH1-OD1 2.88Å; R1080-D1094 PolarHBondContact NH1-OD1 2.76Å; R1080-D1094 IonicContact NH2-OD1 2.7Å; R1080-D1094 PolarHBondContact NH2-OD1 3.1Å; D1094-Q1098 HydrophobicContact CB-CB 4.38Å; D1094-Q1098 PolarHBondContact OD1-OE1 3.09Å; D1094-I1100 VanDerWaalsContact C-CD1 3.48Å; D1094-I1100 HydrophobicContact CB-CD1 4.29Å; D1094-I1100 HydrophobicContact CB-CG1 4.37Å; D1094-I1100 HydrophobicContact CB-CG2 3.63Å; D1094-I1100 VanDerWaalsContact O-CD1 3.24Å; D1094-I1100 WeakPolarHBondContact O-CD1 3.16Å
1095	G	84	Confident	82.8	Confident	12.8 Å²	12.8	60.4 Å²	60.4	13%	0.132	30%	0.303	C	S	.	.			trans	-109	-177.1	-178	0	0	0	0	0	113.1	V1075 D1097 Q1098 I1100	V1075-G1095 WeakPolarHBondContact O-CA 3.45Å; G1095-D1097 VanDerWaalsContact C-N 3.25Å; G1095-D1097 PolarHBondContact O-N 3.13Å; G1095-D1097 VanDerWaalsContact O-N 3.09Å; G1095-Q1098 VanDerWaalsContact C-OE1 3.26Å; G1095-Q1098 VanDerWaalsContact CA-OE1 3.24Å; G1095-Q1098 WeakPolarHBondContact O-CB 3.28Å; G1095-Q1098 PolarHBondContact O-N 2.99Å; G1095-Q1098 VanDerWaalsContact O-N 3.12Å; G1095-Q1098 PolarHBondContact O-OE1 3.35Å; G1095-Q1098 VanDerWaalsContact O-OE1 3.1Å; G1095-I1100 VanDerWaalsContact O-CD1 3.25Å; G1095-I1100 WeakPolarHBondContact O-CD1 3.39Å; G1095-I1100 VanDerWaalsContact O-CG1 3.29Å; G1095-I1100 WeakPolarHBondContact O-CG1 3.3Å; G1095-I1100 WeakPolarHBondContact O-CG2 3.36Å
1096	V	80.2	Confident	82.4	Confident	74 Å²	74	63.6 Å²	63.6	45%	0.448	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-56.7	-34.2	-177.4	-175.4	0	0	0	0	112.5	V1075 Q1098 A1099	V1075-V1096 HydrophobicContact CB-CG2 4.25Å; V1075-V1096 HydrophobicContact CG1-CG2 4Å; V1096-Q1098 PolarHBondContact O-N 3Å; V1096-Q1098 VanDerWaalsContact O-N 3.15Å; V1096-A1099 PolarHBondContact O-N 3.2Å; V1096-A1099 VanDerWaalsContact O-N 3.13Å
1097	D	78.4	Confident	82.2	Confident	150 Å²	150	63.7 Å²	63.7	80%	0.802	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-64.1	-20.6	179.5	-62	-30.4	0	0	0	113.6	K153 G1095 A1099	K153-D1097 PolarHBondContact NZ-O 3.34Å; G1095-D1097 VanDerWaalsContact C-N 3.25Å; G1095-D1097 PolarHBondContact O-N 3.13Å; G1095-D1097 VanDerWaalsContact O-N 3.09Å; D1097-A1099 VanDerWaalsContact C-N 3.3Å; D1097-A1099 PolarHBondContact O-N 2.93Å
1098	Q	78.8	Confident	81.9	Confident	98.6 Å²	98.6	65.1 Å²	65.1	46%	0.461	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-92.9	16.8	178.6	-66.5	113.4	-5.2	0	0	113.1	M196 L225 D1094 G1095 V1096 I1100	M196-Q1098 HydrophobicContact CE-CB 3.97Å; M196-Q1098 HydrophobicContact CE-CG 3.28Å; M196-Q1098 HydrophobicContact SD-CG 4.27Å; L225-Q1098 WeakPolarHBondContact O-CB 3.19Å; L225-Q1098 VanDerWaalsContact O-O 3.08Å; D1094-Q1098 HydrophobicContact CB-CB 4.38Å; D1094-Q1098 PolarHBondContact OD1-OE1 3.09Å; G1095-Q1098 VanDerWaalsContact C-OE1 3.26Å; G1095-Q1098 VanDerWaalsContact CA-OE1 3.24Å; G1095-Q1098 WeakPolarHBondContact O-CB 3.28Å; G1095-Q1098 PolarHBondContact O-N 2.99Å; G1095-Q1098 VanDerWaalsContact O-N 3.12Å; G1095-Q1098 PolarHBondContact O-OE1 3.35Å; G1095-Q1098 VanDerWaalsContact O-OE1 3.1Å; V1096-Q1098 PolarHBondContact O-N 3Å; V1096-Q1098 VanDerWaalsContact O-N 3.15Å; Q1098-I1100 VanDerWaalsContact C-N 3.27Å; Q1098-I1100 PolarHBondContact O-N 3.16Å
1099	A	76.3	Confident	81.7	Confident	33.8 Å²	33.8	65.2 Å²	65.2	28%	0.279	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	37.3	175.9	0	0	0	0	0	114.9	V1096 D1097 H1101 L1102	V1096-A1099 PolarHBondContact O-N 3.2Å; V1096-A1099 VanDerWaalsContact O-N 3.13Å; D1097-A1099 VanDerWaalsContact C-N 3.3Å; D1097-A1099 PolarHBondContact O-N 2.93Å; A1099-H1101 PolarHBondContact O-N 2.98Å; A1099-H1101 VanDerWaalsContact O-N 3.1Å; A1099-L1102 HydrophobicContact CB-CD1 3.9Å; A1099-L1102 HydrophobicContact CB-CG 4.32Å; A1099-L1102 WeakPolarHBondContact O-CB 3.21Å; A1099-L1102 PolarHBondContact O-N 2.96Å; A1099-L1102 VanDerWaalsContact O-N 3.08Å
1100	I	78.2	Confident	81.5	Confident	3.8 Å²	3.8	64.7 Å²	64.7	2%	0.019	35%	0.346	C	S	.	.	H	α-helix	trans	-51.5	-35.4	178.9	-46.6	170.2	0	0	0	112.8	V1074 D1077 D1094 G1095 Q1098 L1102 S1103 C1104	V1074-I1100 HydrophobicContact CB-CG2 4.32Å; V1074-I1100 HydrophobicContact CG1-CD1 4.31Å; V1074-I1100 HydrophobicContact CG1-CG2 3.8Å; V1074-I1100 WeakPolarHBondContact O-CD1 3.13Å; D1077-I1100 HydrophobicContact CB-CB 4.41Å; D1077-I1100 HydrophobicContact CB-CD1 4.14Å; D1077-I1100 HydrophobicContact CB-CG1 4.28Å; D1077-I1100 HydrophobicContact CB-CG2 3.94Å; D1094-I1100 VanDerWaalsContact C-CD1 3.48Å; D1094-I1100 HydrophobicContact CB-CD1 4.29Å; D1094-I1100 HydrophobicContact CB-CG1 4.37Å; D1094-I1100 HydrophobicContact CB-CG2 3.63Å; D1094-I1100 VanDerWaalsContact O-CD1 3.24Å; D1094-I1100 WeakPolarHBondContact O-CD1 3.16Å; G1095-I1100 VanDerWaalsContact O-CD1 3.25Å; G1095-I1100 WeakPolarHBondContact O-CD1 3.39Å; G1095-I1100 VanDerWaalsContact O-CG1 3.29Å; G1095-I1100 WeakPolarHBondContact O-CG1 3.3Å; G1095-I1100 WeakPolarHBondContact O-CG2 3.36Å; Q1098-I1100 VanDerWaalsContact C-N 3.27Å; Q1098-I1100 PolarHBondContact O-N 3.16Å; I1100-L1102 PolarHBondContact O-N 3.04Å; I1100-L1102 VanDerWaalsContact O-N 3.11Å; I1100-S1103 CarbonylContact O-C 3.51Å; I1100-S1103 WeakPolarHBondContact O-CA 3.36Å; I1100-S1103 PolarHBondContact O-N 3.19Å; I1100-S1103 PolarHBondContact O-OG 3.01Å; I1100-S1103 VanDerWaalsContact O-OG 3.1Å; I1100-C1104 HydrophobicContact CG2-CB 3.98Å; I1100-C1104 PolarHBondContact O-N 3.04Å
1101	H	73.6	Confident	81.5	Confident	132.8 Å²	132.8	58.2 Å²	58.2	62%	0.615	32%	0.315	S	S	*	.	H	α-helix	trans	-58.6	-23.7	179.7	68.4	-84.4	0	0	0	114.3	A1099 S1103	A1099-H1101 PolarHBondContact O-N 2.98Å; A1099-H1101 VanDerWaalsContact O-N 3.1Å; H1101-S1103 VanDerWaalsContact C-N 3.31Å
1102	L	75.4	Confident	81.4	Confident	119.2 Å²	119.2	58.1 Å²	58.1	62%	0.624	32%	0.315	S	S	*	.	H	α-helix	trans	-78.1	-24.2	174.4	-68.2	169.5	0	0	0	112.2	E221 M224 A1099 I1100	E221-L1102 WeakPolarHBondContact O-CD1 3.37Å; E221-L1102 WeakPolarHBondContact O-CD2 3.48Å; M224-L1102 HydrophobicContact CG-CB 4.02Å; M224-L1102 HydrophobicContact CG-CD1 4.38Å; A1099-L1102 HydrophobicContact CB-CD1 3.9Å; A1099-L1102 HydrophobicContact CB-CG 4.32Å; A1099-L1102 WeakPolarHBondContact O-CB 3.21Å; A1099-L1102 PolarHBondContact O-N 2.96Å; A1099-L1102 VanDerWaalsContact O-N 3.08Å; I1100-L1102 PolarHBondContact O-N 3.04Å; I1100-L1102 VanDerWaalsContact O-N 3.11Å
1103	S	75	Confident	81.4	Confident	40.2 Å²	40.2	56.8 Å²	56.8	28%	0.281	31%	0.31	S	S	.	.	H	α-helix	trans	-108.2	-26.1	-168.7	75.3	0	0	0	0	113.6	R1037 I1100 H1101	R1037-S1103 PolarHBondContact NH1-O 3.19Å; R1037-S1103 PolarHBondContact NH1-OG 2.88Å; R1037-S1103 VanDerWaalsContact NH2-CB 3.29Å; R1037-S1103 PolarHBondContact NH2-O 3Å; R1037-S1103 PolarHBondContact NH2-OG 2.93Å; I1100-S1103 CarbonylContact O-C 3.51Å; I1100-S1103 WeakPolarHBondContact O-CA 3.36Å; I1100-S1103 PolarHBondContact O-N 3.19Å; I1100-S1103 PolarHBondContact O-OG 3.01Å; I1100-S1103 VanDerWaalsContact O-OG 3.1Å; H1101-S1103 VanDerWaalsContact C-N 3.31Å
1104	C	81.2	Confident	81.4	Confident	4.6 Å²	4.6	54.7 Å²	54.7	3%	0.031	30%	0.3	C	S	.	.	S	Bend	trans	-112.2	124.6	177.4	-165.4	0	0	0	0	109.8	C1035 V1074 I1100	C1035-C1104 VanDerWaalsContact CA-SG 3.6Å; C1035-C1104 HydrophobicContact CB-CB 3.93Å; C1035-C1104 WeakPolarHBondContact CB-SG 3.25Å; C1035-C1104 WeakPolarHBondContact SG-CB 3.28Å; C1035-C1104 CovalentContact SG-SG 2.04Å; C1035-C1104 PolarHBondContact SG-SG 3.21Å; V1074-C1104 HydrophobicContact CG1-CB 4.49Å; I1100-C1104 HydrophobicContact CG2-CB 3.98Å; I1100-C1104 PolarHBondContact O-N 3.04Å
1105	K	80.8	Confident	81.4	Confident	126.4 Å²	126.4	53.9 Å²	53.9	55%	0.55	30%	0.296	S	S	.	.			trans	-71.6	149.1	179.2	-65	176.5	-176.5	168.8	0	110	A1107 E1108	K1105-A1107 PolarHBondContact O-N 2.99Å; K1105-A1107 VanDerWaalsContact O-N 3.07Å; K1105-E1108 HydrophobicContact CB-CB 4.46Å; K1105-E1108 HydrophobicContact CB-CG 4.06Å; K1105-E1108 PolarHBondContact N-OE2 3.03Å; K1105-E1108 WeakPolarHBondContact O-CB 3.29Å; K1105-E1108 PolarHBondContact O-N 3.1Å
1106	P	77	Confident	81.6	Confident	102.4 Å²	102.4	58.3 Å²	58.3	67%	0.665	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-28.1	177.2	-27.1	34.6	0	0	0	114.3	P1069 E1108 V1109	P1069-P1106 VanDerWaalsContact CB-O 3.27Å; P1069-P1106 WeakPolarHBondContact CB-O 3.42Å; P1069-P1106 HydrophobicContact CG-CB 4.47Å; P1106-E1108 VanDerWaalsContact C-N 3.29Å; P1106-E1108 PolarHBondContact O-N 2.79Å; P1106-V1109 WeakPolarHBondContact O-CG1 3.44Å; P1106-V1109 WeakPolarHBondContact O-CG2 3.42Å
1107	A	78.5	Confident	82	Confident	74 Å²	74	55 Å²	55	61%	0.612	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-10.1	177.4	0	0	0	0	0	114.5	K1105 V1109	K1105-A1107 PolarHBondContact O-N 2.99Å; K1105-A1107 VanDerWaalsContact O-N 3.07Å; A1107-V1109 VanDerWaalsContact C-N 3.28Å; A1107-V1109 PolarHBondContact O-N 2.94Å; A1107-V1109 VanDerWaalsContact O-N 3.13Å
1108	E	82.9	Confident	82.6	Confident	60.6 Å²	60.6	49.1 Å²	49.1	28%	0.283	26%	0.262	S	S	.	.			trans	-92.9	44.5	-175.1	-69	172.6	175.8	0	0	112	C1035 N1036 K1105 P1106	C1035-E1108 WeakPolarHBondContact CA-O 3.29Å; N1036-E1108 HydrophobicContact CB-CB 4.49Å; N1036-E1108 WeakPolarHBondContact CB-O 3.44Å; N1036-E1108 PolarHBondContact N-O 2.84Å; K1105-E1108 HydrophobicContact CB-CB 4.46Å; K1105-E1108 HydrophobicContact CB-CG 4.06Å; K1105-E1108 PolarHBondContact N-OE2 3.03Å; K1105-E1108 WeakPolarHBondContact O-CB 3.29Å; K1105-E1108 PolarHBondContact O-N 3.1Å; P1106-E1108 VanDerWaalsContact C-N 3.29Å; P1106-E1108 PolarHBondContact O-N 2.79Å
1109	V	85.8	Confident	83.4	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.024	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-86.9	147.4	178.2	-105.7	0	0	0	0	111.5	R1022 T1033 I1034 N1036 P1067 P1069 P1106 A1107 G1111	R1022-V1109 HydrophobicContact CG-CG1 3.73Å; R1022-V1109 HydrophobicContact CG-CG2 4.42Å; T1033-V1109 HydrophobicContact CG2-CG1 4.03Å; T1033-V1109 HydrophobicContact CG2-CG2 4.41Å; I1034-V1109 CarbonylContact O-C 3.56Å; I1034-V1109 WeakPolarHBondContact O-CA 3.15Å; N1036-V1109 PolarHBondContact ND2-O 3.01Å; P1067-V1109 HydrophobicContact CG-CG2 3.84Å; P1069-V1109 HydrophobicContact CB-CG2 4.05Å; P1106-V1109 WeakPolarHBondContact O-CG1 3.44Å; P1106-V1109 WeakPolarHBondContact O-CG2 3.42Å; A1107-V1109 VanDerWaalsContact C-N 3.28Å; A1107-V1109 PolarHBondContact O-N 2.94Å; A1107-V1109 VanDerWaalsContact O-N 3.13Å; V1109-G1111 PolarHBondContact O-N 2.82Å
1110	V	87.5	Confident	84.2	Confident	1.6 Å²	1.6	42.9 Å²	42.9	1%	0.01	23%	0.227	C	C	.	.			trans	-78.5	126.6	175.8	173.5	0	0	0	0	111.3	L1023 I1034 N1036 W1039 V1112	L1023-V1110 HydrophobicContact CB-CG1 4.24Å; L1023-V1110 HydrophobicContact CD2-CG1 4.34Å; L1023-V1110 PolarHBondContact N-O 2.97Å; L1023-V1110 VanDerWaalsContact N-O 3.13Å; I1034-V1110 HydrophobicContact CB-CB 4.27Å; I1034-V1110 HydrophobicContact CB-CG2 4.14Å; I1034-V1110 HydrophobicContact CG2-CB 4.49Å; I1034-V1110 HydrophobicContact CG2-CG2 3.94Å; I1034-V1110 WeakPolarHBondContact O-CG2 3.41Å; I1034-V1110 PolarHBondContact O-N 3.04Å; I1034-V1110 VanDerWaalsContact O-N 3.1Å; N1036-V1110 HydrophobicContact CB-CG2 4Å; W1039-V1110 HydrophobicContact CB-CG2 3.98Å; W1039-V1110 HydrophobicContact CD2-CB 4.38Å; W1039-V1110 HydrophobicContact CD2-CG1 3.68Å; W1039-V1110 HydrophobicContact CD2-CG2 3.75Å; W1039-V1110 VanDerWaalsContact CE2-CG1 3.42Å; W1039-V1110 HydrophobicContact CE3-CG1 4.18Å; W1039-V1110 HydrophobicContact CE3-CG2 3.97Å; W1039-V1110 HydrophobicContact CG-CG1 4.12Å; W1039-V1110 HydrophobicContact CG-CG2 3.77Å; W1039-V1110 HydrophobicContact CH2-CG1 4.14Å; W1039-V1110 HydrophobicContact CZ2-CG1 3.62Å; W1039-V1110 VanDerWaalsContact CZ2-CG1 3.5Å; W1039-V1110 HydrophobicContact CZ3-CG1 4.34Å; W1039-V1110 HydrophobicContact CZ3-CG2 4.45Å; V1110-V1112 HydrophobicContact CG1-CG1 4.09Å
1111	G	86.8	Confident	85	Confident	0.2 Å²	0.2	42.9 Å²	42.9	0%	0.002	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.2	158.6	0	0	0	0	0	111.6	G1021 W1063 V1065 V1109	G1021-G1111 CarbonylContact O-C 3.52Å; G1021-G1111 VanDerWaalsContact O-CA 3.25Å; G1021-G1111 WeakPolarHBondContact O-CA 3.37Å; W1063-G1111 PolarHBondContact O-N 2.79Å; V1065-G1111 PolarHBondContact N-O 3.29Å; V1065-G1111 VanDerWaalsContact N-O 3.16Å; V1065-G1111 WeakPolarHBondContact O-CA 3.45Å; V1065-G1111 PolarHBondContact O-N 2.97Å; V1109-G1111 PolarHBondContact O-N 2.82Å
1112	V	88	Confident	86.1	Confident	0.6 Å²	0.6	36.6 Å²	36.6	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	150.2	178.9	28.9	0	0	0	0	110.8	I1006 S1020 G1021 L1023 W1039 A1044 L1055 N1062 V1110	I1006-V1112 HydrophobicContact CD1-CG1 3.64Å; I1006-V1112 HydrophobicContact CD1-CG2 3.69Å; I1006-V1112 HydrophobicContact CG1-CG1 4.02Å; I1006-V1112 HydrophobicContact CG1-CG2 4.05Å; S1020-V1112 VanDerWaalsContact CA-O 3.27Å; S1020-V1112 WeakPolarHBondContact CA-O 3.29Å; G1021-V1112 PolarHBondContact N-O 3.01Å; G1021-V1112 VanDerWaalsContact N-O 3.09Å; G1021-V1112 PolarHBondContact O-N 3.14Å; L1023-V1112 HydrophobicContact CB-CG1 4.39Å; L1023-V1112 HydrophobicContact CB-CG2 4.3Å; L1023-V1112 HydrophobicContact CD1-CG1 4.21Å; L1023-V1112 HydrophobicContact CD1-CG2 4.08Å; L1023-V1112 HydrophobicContact CD2-CG1 4.15Å; L1023-V1112 HydrophobicContact CD2-CG2 4.37Å; L1023-V1112 HydrophobicContact CG-CG2 4.39Å; W1039-V1112 HydrophobicContact CH2-CG1 4.44Å; W1039-V1112 HydrophobicContact CZ2-CG1 3.69Å; A1044-V1112 HydrophobicContact CB-CG1 4.13Å; A1044-V1112 HydrophobicContact CB-CG2 4.23Å; L1055-V1112 HydrophobicContact CD1-CG2 4.25Å; N1062-V1112 CarbonylContact O-C 3.52Å; V1110-V1112 HydrophobicContact CG1-CG1 4.09Å
1113	R	86.9	Confident	87.1	Confident	79.4 Å²	79.4	32 Å²	32	30%	0.3	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	107.3	170.6	177.8	175.5	-139.1	149.1	5	109.2	L1019 L1055 D1056 F1059 E1061 N1062 V1065 D1859	L1019-R1113 CarbonylContact O-C 3.51Å; L1019-R1113 VanDerWaalsContact O-CA 3.26Å; L1019-R1113 WeakPolarHBondContact O-CA 3.3Å; L1055-R1113 WeakPolarHBondContact CD1-O 3.33Å; D1056-R1113 HydrophobicContact CB-CG 3.98Å; D1056-R1113 PolarHBondContact N-O 2.93Å; D1056-R1113 IonicContact OD2-CZ 2.81Å; D1056-R1113 IonicContact OD2-NE 3.34Å; D1056-R1113 PolarHBondContact OD2-NE 3.25Å; D1056-R1113 IonicContact OD2-NH2 3.37Å; F1059-R1113 VanDerWaalsContact CZ-NH1 3.25Å; E1061-R1113 PolarHBondContact O-NH1 3.15Å; N1062-R1113 HydrophobicContact CB-CB 4.25Å; N1062-R1113 WeakPolarHBondContact O-CB 3.38Å; N1062-R1113 PolarHBondContact O-N 3.12Å; N1062-R1113 WeakPolarHBondContact OD1-CD 3.38Å; V1065-R1113 HydrophobicContact CG2-CB 4.21Å; R1113-D1859 WeakPolarHBondContact CD-OD1 3.46Å; R1113-D1859 IonicContact CZ-OD1 2.66Å; R1113-D1859 IonicContact NE-OD1 3.45Å; R1113-D1859 PolarHBondContact NE-OD1 3.24Å
1114	C	88.2	Confident	87.9	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.007	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	167.8	173.4	-52.4	0	0	0	0	110.8	I1006 L1019 C1048 M1053 I1054	I1006-C1114 HydrophobicContact CD1-CB 4.33Å; L1019-C1114 WeakPolarHBondContact CB-O 3.5Å; L1019-C1114 PolarHBondContact O-N 3.04Å; L1019-C1114 VanDerWaalsContact O-O 3.11Å; C1048-C1114 WeakPolarHBondContact CA-SG 3.3Å; C1048-C1114 HydrophobicContact CB-CB 3.86Å; C1048-C1114 WeakPolarHBondContact CB-SG 3.33Å; C1048-C1114 VanDerWaalsContact SG-CA 3.51Å; C1048-C1114 WeakPolarHBondContact SG-CB 3.34Å; C1048-C1114 CovalentContact SG-SG 2.04Å; C1048-C1114 PolarHBondContact SG-SG 2.96Å; M1053-C1114 HydrophobicContact CB-CB 3.71Å; M1053-C1114 HydrophobicContact CE-CB 3.87Å; M1053-C1114 HydrophobicContact CG-CB 4.42Å; M1053-C1114 HydrophobicContact SD-CB 3.86Å; I1054-C1114 CarbonylContact O-C 3.46Å; I1054-C1114 WeakPolarHBondContact O-CA 3.28Å; I1054-C1114 WeakPolarHBondContact O-CB 3.43Å
1115	V	86.4	Confident	88.3	Confident	12.8 Å²	12.8	30 Å²	30	8%	0.078	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	152.5	178.8	-105.1	0	0	0	0	109.8	M1053 I1054 D1056 L1150 F1179	M1053-V1115 WeakPolarHBondContact CA-O 3.37Å; M1053-V1115 WeakPolarHBondContact CB-O 3.25Å; I1054-V1115 HydrophobicContact CB-CG2 4.34Å; I1054-V1115 HydrophobicContact CD1-CB 4.24Å; I1054-V1115 HydrophobicContact CD1-CG1 3.99Å; I1054-V1115 HydrophobicContact CD1-CG2 3.63Å; I1054-V1115 HydrophobicContact CG1-CB 3.86Å; I1054-V1115 HydrophobicContact CG1-CG1 4.01Å; I1054-V1115 HydrophobicContact CG1-CG2 3.37Å; I1054-V1115 VanDerWaalsContact CG1-CG2 3.46Å; I1054-V1115 VanDerWaalsContact CG1-O 3.24Å; I1054-V1115 WeakPolarHBondContact CG1-O 3.38Å; I1054-V1115 PolarHBondContact N-O 2.91Å; I1054-V1115 WeakPolarHBondContact O-CG2 3.36Å; I1054-V1115 PolarHBondContact O-N 3.04Å; D1056-V1115 HydrophobicContact CB-CG1 4.01Å; D1056-V1115 HydrophobicContact CB-CG2 4.13Å; V1115-L1150 HydrophobicContact CG2-CD2 3.92Å; V1115-F1179 HydrophobicContact CB-CE2 3.96Å; V1115-F1179 HydrophobicContact CB-CZ 4.04Å; V1115-F1179 HydrophobicContact CG1-CD1 4.37Å; V1115-F1179 HydrophobicContact CG1-CD2 3.54Å; V1115-F1179 HydrophobicContact CG1-CE1 4.15Å; V1115-F1179 HydrophobicContact CG1-CE2 3.65Å; V1115-F1179 HydrophobicContact CG1-CG 4.24Å; V1115-F1179 HydrophobicContact CG1-CZ 3.83Å; V1115-F1179 VanDerWaalsContact CG1-CZ 3.45Å; V1115-F1179 HydrophobicContact CG2-CD2 4.46Å; V1115-F1179 HydrophobicContact CG2-CE1 4.28Å; V1115-F1179 HydrophobicContact CG2-CE2 3.71Å; V1115-F1179 HydrophobicContact CG2-CZ 3.69Å
1116	Q	87	Confident	88.5	Confident	104.4 Å²	104.4	24 Å²	24	49%	0.488	13%	0.133	S	C	.	.	P	Polyproline II helix	trans	-69	136.4	174.9	-79.9	-177.6	-10.8	0	0	110.7	L1019 M1118	L1019-Q1116 HydrophobicContact CD1-CG 4.45Å; L1019-Q1116 HydrophobicContact CD2-CG 3.99Å; Q1116-M1118 HydrophobicContact CB-CE 4.35Å; Q1116-M1118 PolarHBondContact O-N 2.96Å
1117	P	89	Confident	88.8	Confident	4.8 Å²	4.8	20.2 Å²	20.2	3%	0.031	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-71.4	126.1	177.9	31.9	-36.3	0	0	0	110.1	L816 N967 I1054 L1149	L816-P1117 HydrophobicContact CD2-CB 3.79Å; L816-P1117 HydrophobicContact CD2-CG 3.7Å; N967-P1117 HydrophobicContact CB-CB 3.83Å; N967-P1117 HydrophobicContact CB-CG 4.13Å; I1054-P1117 HydrophobicContact CD1-CB 3.58Å; I1054-P1117 HydrophobicContact CG1-CB 4.11Å; I1054-P1117 HydrophobicContact CG2-CB 4.14Å; P1117-L1149 HydrophobicContact CB-CD2 3.86Å
1118	M	91.7	Very high	89	Confident	26.2 Å²	26.2	16.7 Å²	16.7	13%	0.129	8%	0.078	C	C	.	.	P	Polyproline II helix	trans	-98.3	172.4	179	-62.2	-58	-163	0	0	111.1	N967 S968 L993 Q1116 K1146 L1149 F1179	N967-M1118 CarbonylContact C-O 3.55Å; N967-M1118 VanDerWaalsContact CA-O 3.3Å; N967-M1118 WeakPolarHBondContact CA-O 3.23Å; S968-M1118 PolarHBondContact N-O 2.95Å; L993-M1118 HydrophobicContact CD2-SD 3.92Å; Q1116-M1118 HydrophobicContact CB-CE 4.35Å; Q1116-M1118 PolarHBondContact O-N 2.96Å; M1118-K1146 WeakPolarHBondContact CB-O 3.22Å; M1118-K1146 VanDerWaalsContact CE-CA 3.45Å; M1118-K1146 HydrophobicContact CE-CB 3.74Å; M1118-K1146 HydrophobicContact CE-CG 4.21Å; M1118-K1146 HydrophobicContact SD-CB 4.17Å; M1118-K1146 VanDerWaalsContact SD-O 3.35Å; M1118-L1149 HydrophobicContact CB-CB 4.11Å; M1118-L1149 WeakPolarHBondContact O-CB 3.26Å; M1118-F1179 HydrophobicContact CB-CB 4.47Å; M1118-F1179 HydrophobicContact CE-CB 4.25Å; M1118-F1179 HydrophobicContact CE-CD2 4.19Å; M1118-F1179 HydrophobicContact CE-CG 4.33Å; M1118-F1179 HydrophobicContact CG-CB 3.72Å; M1118-F1179 HydrophobicContact CG-CD1 4.18Å; M1118-F1179 HydrophobicContact CG-CD2 4.43Å; M1118-F1179 HydrophobicContact CG-CG 4.16Å
1119	W	95.3	Very high	88.6	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.076	C	C	.	.	B	Isolated β-bridge	trans	-85.1	165.9	169.2	70.7	-78.2	0	0	0	110.4	F965 Q966 I969 F991 L993 G1121 V1122 I1144 E1145 K1146 A1147 G1148 L1149	F965-W1119 HydrophobicContact CB-CB 3.58Å; F965-W1119 HydrophobicContact CB-CD2 3.76Å; F965-W1119 HydrophobicContact CB-CE3 3.77Å; F965-W1119 HydrophobicContact CB-CG 3.7Å; F965-W1119 AromaticContact CD1-CE3 3.91Å; F965-W1119 HydrophobicContact CD1-CE3 3.91Å; F965-W1119 HydrophobicContact CD1-CZ3 4.21Å; F965-W1119 AromaticContact CD2-CD2 3.98Å; F965-W1119 HydrophobicContact CD2-CD2 4Å; F965-W1119 AromaticContact CD2-CE3 3.67Å; F965-W1119 HydrophobicContact CD2-CE3 3.67Å; F965-W1119 HydrophobicContact CD2-CH2 4.08Å; F965-W1119 HydrophobicContact CD2-CZ2 4.37Å; F965-W1119 AromaticContact CD2-CZ3 3.71Å; F965-W1119 HydrophobicContact CD2-CZ3 3.71Å; F965-W1119 HydrophobicContact CE1-CE3 4.42Å; F965-W1119 HydrophobicContact CE1-CZ3 4.28Å; F965-W1119 HydrophobicContact CE2-CE3 4.22Å; F965-W1119 HydrophobicContact CE2-CH2 4.07Å; F965-W1119 AromaticContact CE2-CZ3 3.79Å; F965-W1119 HydrophobicContact CE2-CZ3 3.79Å; F965-W1119 AromaticContact CG-CD2 3.93Å; F965-W1119 HydrophobicContact CG-CD2 3.93Å; F965-W1119 AromaticContact CG-CE3 3.5Å; F965-W1119 HydrophobicContact CG-CE3 3.5Å; F965-W1119 VanDerWaalsContact CG-CE3 3.46Å; F965-W1119 HydrophobicContact CG-CG 4.4Å; F965-W1119 AromaticContact CG-CZ3 3.94Å; F965-W1119 HydrophobicContact CG-CZ3 3.94Å; F965-W1119 HydrophobicContact CZ-CZ3 4.09Å; Q966-W1119 WeakPolarHBondContact O-CB 3.15Å; I969-W1119 WeakPolarHBondContact O-CB 3.28Å; F991-W1119 HydrophobicContact CB-CH2 3.89Å; F991-W1119 HydrophobicContact CB-CZ2 3.99Å; F991-W1119 HydrophobicContact CD2-CH2 4.41Å; L993-W1119 HydrophobicContact CD1-CB 4.16Å; W1119-G1121 VanDerWaalsContact C-N 3.31Å; W1119-G1121 WeakPolarHBondContact CZ3-O 3.4Å; W1119-G1121 PolarHBondContact O-N 2.91Å; W1119-V1122 HydrophobicContact CH2-CG2 3.82Å; W1119-V1122 HydrophobicContact CZ3-CG2 4.07Å; W1119-I1144 HydrophobicContact CH2-CG2 4.03Å; W1119-I1144 HydrophobicContact CZ2-CG2 3.74Å; W1119-E1145 PolarHBondContact NE1-O 2.89Å; W1119-K1146 PolarHBondContact NE1-O 3.19Å; W1119-A1147 HydrophobicContact CD2-CB 4Å; W1119-A1147 VanDerWaalsContact CE2-CB 3.46Å; W1119-A1147 HydrophobicContact CG-CB 4.35Å; W1119-A1147 HydrophobicContact CH2-CB 4.44Å; W1119-A1147 HydrophobicContact CZ2-CB 3.78Å; W1119-A1147 CarbonylContact O-C 3.53Å; W1119-A1147 WeakPolarHBondContact O-CA 3.25Å; W1119-G1148 PolarHBondContact O-N 2.76Å; W1119-L1149 CarbonylContact C-O 3.42Å; W1119-L1149 PolarHBondContact O-N 3.1Å; W1119-L1149 VanDerWaalsContact O-N 3.08Å
1120	A	93.2	Very high	87.7	Confident	2.8 Å²	2.8	16.9 Å²	16.9	2%	0.023	9%	0.085	C	C	.	.			trans	-76.4	-31.3	-167.4	0	0	0	0	0	114.3	I969 L1149 L1150 A1158	I969-A1120 PolarHBondContact O-N 3.06Å; A1120-L1149 WeakPolarHBondContact CA-O 3.42Å; A1120-L1149 HydrophobicContact CB-CB 4.04Å; A1120-L1149 HydrophobicContact CB-CD1 4.01Å; A1120-L1149 HydrophobicContact CB-CD2 4.25Å; A1120-L1149 HydrophobicContact CB-CG 4.32Å; A1120-L1149 WeakPolarHBondContact CB-O 3.31Å; A1120-L1149 PolarHBondContact N-O 3.08Å; A1120-L1150 HydrophobicContact CB-CD1 3.91Å; A1120-A1158 WeakPolarHBondContact O-CB 3.42Å
1121	G	95.7	Very high	86.5	Confident	3 Å²	3	17.8 Å²	17.8	3%	0.031	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.1	-174.3	-173.2	0	0	0	0	0	112.9	G970 M971 W1119 A1160	G970-G1121 WeakPolarHBondContact CA-O 3.34Å; M971-G1121 PolarHBondContact N-O 3.1Å; W1119-G1121 VanDerWaalsContact C-N 3.31Å; W1119-G1121 WeakPolarHBondContact CZ3-O 3.4Å; W1119-G1121 PolarHBondContact O-N 2.91Å; G1121-A1160 CarbonylContact C-O 3.52Å; G1121-A1160 VanDerWaalsContact CA-O 3.3Å; G1121-A1160 WeakPolarHBondContact CA-O 3.27Å
1122	V	96.5	Very high	85.2	Confident	1.4 Å²	1.4	21.9 Å²	21.9	1%	0.008	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.4	178.7	-174.8	0	0	0	0	109.4	M971 V973 F991 W1119 Y1124 I1144 A1160 F1161 T1162	M971-V1122 HydrophobicContact CB-CB 4.5Å; M971-V1122 HydrophobicContact CB-CG1 4.31Å; M971-V1122 HydrophobicContact CB-CG2 4.29Å; M971-V1122 HydrophobicContact CG-CG1 4.36Å; M971-V1122 CarbonylContact O-C 3.56Å; M971-V1122 WeakPolarHBondContact O-CA 3.36Å; M971-V1122 HydrophobicContact SD-CG1 4.32Å; V973-V1122 HydrophobicContact CG2-CG1 4.28Å; F991-V1122 HydrophobicContact CD2-CG2 3.67Å; F991-V1122 HydrophobicContact CE2-CG2 3.98Å; W1119-V1122 HydrophobicContact CH2-CG2 3.82Å; W1119-V1122 HydrophobicContact CZ3-CG2 4.07Å; V1122-Y1124 HydrophobicContact CG1-CD2 4.24Å; V1122-Y1124 HydrophobicContact CG1-CE2 4.11Å; V1122-I1144 HydrophobicContact CG2-CD1 4.15Å; V1122-A1160 PolarHBondContact N-O 2.86Å; V1122-F1161 HydrophobicContact CB-CD2 3.96Å; V1122-F1161 HydrophobicContact CB-CE2 4.32Å; V1122-F1161 HydrophobicContact CG1-CD2 4.29Å; V1122-F1161 HydrophobicContact CG1-CE2 4.14Å; V1122-F1161 CarbonylContact O-C 3.55Å; V1122-F1161 WeakPolarHBondContact O-CA 3.37Å; V1122-T1162 PolarHBondContact O-N 3.16Å; V1122-T1162 PolarHBondContact O-OG1 2.87Å; V1122-T1162 VanDerWaalsContact O-OG1 3.06Å
1123	R	95.1	Very high	83.7	Confident	21.4 Å²	21.4	26.4 Å²	26.4	8%	0.081	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.3	175.9	-176.7	171	178.1	-173.8	-5.9	111.4	M971 L972 V973 T1162 D1164 D1244	M971-R1123 PolarHBondContact O-N 3.01Å; L972-R1123 CarbonylContact C-O 3.48Å; L972-R1123 WeakPolarHBondContact CA-O 3.34Å; L972-R1123 HydrophobicContact CD1-CB 4.24Å; L972-R1123 HydrophobicContact CD1-CG 4.13Å; V973-R1123 PolarHBondContact N-O 2.8Å; R1123-T1162 CarbonylContact C-O 3.53Å; R1123-T1162 VanDerWaalsContact CA-O 3.29Å; R1123-T1162 WeakPolarHBondContact CA-O 3.3Å; R1123-T1162 WeakPolarHBondContact CA-OG1 3.48Å; R1123-T1162 WeakPolarHBondContact CB-OG1 3.47Å; R1123-T1162 HydrophobicContact CG-CG2 4.33Å; R1123-T1162 VanDerWaalsContact CG-OG1 3.23Å; R1123-T1162 WeakPolarHBondContact CG-OG1 3.29Å; R1123-D1164 IonicContact CZ-OD1 3.24Å; R1123-D1164 IonicContact CZ-OD2 3.31Å; R1123-D1164 IonicContact NE-OD1 3.02Å; R1123-D1164 PolarHBondContact NE-OD1 3.1Å; R1123-D1164 IonicContact NE-OD2 3.41Å; R1123-D1164 PolarHBondContact NE-OD2 3.16Å; R1123-D1164 VanDerWaalsContact NE-OD2 3.13Å; R1123-D1164 IonicContact NH2-OD1 3.77Å; R1123-D1164 PolarHBondContact NH2-OD1 3.36Å; R1123-D1164 IonicContact NH2-OD2 3.25Å; R1123-D1164 PolarHBondContact NH2-OD2 2.9Å; R1123-D1244 IonicContact CZ-OD2 3.44Å; R1123-D1244 IonicContact NH1-OD1 2.81Å; R1123-D1244 IonicContact NH1-OD2 3.5Å; R1123-D1244 PolarHBondContact NH1-OD2 3.37Å; R1123-D1244 IonicContact NH2-OD1 3.1Å; R1123-D1244 IonicContact NH2-OD2 3.22Å; R1123-D1244 PolarHBondContact NH2-OD2 3.05Å
1124	Y	93.1	Very high	82.3	Confident	3 Å²	3	27.3 Å²	27.3	1%	0.012	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117.1	165.7	-84.5	-111	0	0	0	108.7	V973 V1122 A1128 T1138 F1161 T1162 D1164 H1168 F1170	V973-Y1124 HydrophobicContact CB-CD1 4.21Å; V973-Y1124 HydrophobicContact CB-CD2 4.2Å; V973-Y1124 HydrophobicContact CB-CE1 4.22Å; V973-Y1124 HydrophobicContact CB-CE2 4.19Å; V973-Y1124 HydrophobicContact CB-CG 4.21Å; V973-Y1124 HydrophobicContact CG1-CD1 4.16Å; V973-Y1124 HydrophobicContact CG1-CE1 3.84Å; V973-Y1124 HydrophobicContact CG1-CE2 4.45Å; V973-Y1124 HydrophobicContact CG2-CD2 4.26Å; V973-Y1124 HydrophobicContact CG2-CE2 3.94Å; V1122-Y1124 HydrophobicContact CG1-CD2 4.24Å; V1122-Y1124 HydrophobicContact CG1-CE2 4.11Å; Y1124-A1128 HydrophobicContact CD1-CB 3.84Å; Y1124-A1128 HydrophobicContact CG-CB 4.48Å; Y1124-T1138 HydrophobicContact CE1-CG2 4.08Å; Y1124-F1161 AromaticContact CD2-CE2 3.75Å; Y1124-F1161 HydrophobicContact CD2-CE2 3.75Å; Y1124-F1161 AromaticContact CD2-CZ 3.74Å; Y1124-F1161 HydrophobicContact CD2-CZ 3.74Å; Y1124-F1161 AromaticContact CE2-CE2 3.65Å; Y1124-F1161 HydrophobicContact CE2-CE2 3.65Å; Y1124-F1161 AromaticContact CE2-CZ 3.75Å; Y1124-F1161 HydrophobicContact CE2-CZ 3.75Å; Y1124-T1162 PolarHBondContact N-O 3.01Å; Y1124-D1164 WeakPolarHBondContact O-CB 3.21Å; Y1124-D1164 PolarHBondContact O-N 2.89Å; Y1124-H1168 AromaticContact CD1-CD2 3.88Å; Y1124-H1168 AromaticContact CD1-CE1 3.5Å; Y1124-H1168 VanDerWaalsContact CD1-CE1 3.5Å; Y1124-H1168 WeakPolarHBondContact CD1-CE1 3.13Å; Y1124-H1168 AromaticContact CD1-NE2 3.6Å; Y1124-H1168 VanDerWaalsContact CD1-NE2 3.31Å; Y1124-H1168 WeakPolarHBondContact CD1-NE2 3.24Å; Y1124-H1168 AromaticContact CE1-CE1 3.75Å; Y1124-H1168 AromaticContact CE1-NE2 3.99Å; Y1124-F1170 HydrophobicContact CD1-CZ 4.46Å; Y1124-F1170 HydrophobicContact CE1-CE1 4.42Å; Y1124-F1170 HydrophobicContact CE1-CZ 4.46Å; Y1124-F1170 HydrophobicContact CE2-CE1 4.49Å
1125	S	89.5	Confident	81	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	20%	0.196	C	C	.	.			trans	-78.2	166.9	179.5	-175.8	0	0	0	0	111.6	V973 Q974 L1127 A1128 W1248	V973-S1125 PolarHBondContact O-N 3.16Å; Q974-S1125 VanDerWaalsContact CG-CB 3.48Å; Q974-S1125 PolarHBondContact NE2-OG 3.1Å; S1125-L1127 PolarHBondContact O-N 3.07Å; S1125-L1127 VanDerWaalsContact O-N 3.14Å; S1125-A1128 VanDerWaalsContact O-CB 3.26Å; S1125-A1128 WeakPolarHBondContact O-CB 3.27Å; S1125-A1128 PolarHBondContact O-N 3.09Å; S1125-A1128 VanDerWaalsContact O-N 3.08Å; S1125-W1248 VanDerWaalsContact OG-CD1 3.3Å; S1125-W1248 PolarHBondContact OG-NE1 3.06Å
1126	L	85.1	Confident	80.2	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-29.1	169.7	177.6	63.7	0	0	0	113.2	A1128 W1165 Y1167 V1245 L1249 Y1282 I1322	L1126-A1128 VanDerWaalsContact C-N 3.32Å; L1126-W1165 HydrophobicContact CB-CB 4.48Å; L1126-W1165 HydrophobicContact CD1-CB 3.53Å; L1126-W1165 VanDerWaalsContact CD1-CB 3.44Å; L1126-W1165 HydrophobicContact CD1-CD2 3.6Å; L1126-W1165 HydrophobicContact CD1-CE3 3.53Å; L1126-W1165 VanDerWaalsContact CD1-CE3 3.5Å; L1126-W1165 HydrophobicContact CD1-CG 3.64Å; L1126-W1165 HydrophobicContact CD1-CZ3 4.39Å; L1126-Y1167 PolarHBondContact O-OH 2.86Å; L1126-V1245 HydrophobicContact CB-CG1 4.39Å; L1126-V1245 HydrophobicContact CD2-CG1 4.49Å; L1126-L1249 HydrophobicContact CD2-CD1 3.81Å; L1126-L1249 HydrophobicContact CD2-CD2 3.69Å; L1126-L1249 VanDerWaalsContact CD2-CD2 3.49Å; L1126-L1249 HydrophobicContact CD2-CG 3.7Å; L1126-L1249 HydrophobicContact CG-CD2 4.34Å; L1126-Y1282 HydrophobicContact CD1-CE1 4.32Å; L1126-Y1282 HydrophobicContact CD2-CE1 4.38Å; L1126-Y1282 HydrophobicContact CG-CE1 4.44Å; L1126-I1322 HydrophobicContact CD2-CD1 4.49Å; L1126-I1322 HydrophobicContact CD2-CG2 4.33Å
1127	L	82.6	Confident	79.6	Confident	21.8 Å²	21.8	31.4 Å²	31.4	11%	0.114	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-6.9	-178.2	-56.5	-175.1	0	0	0	114.2	P951 Q974 S1125 S1129 W1248 L1249 A1254 F1256	P951-L1127 HydrophobicContact CG-CD1 4.2Å; Q974-L1127 HydrophobicContact CB-CB 4.2Å; Q974-L1127 HydrophobicContact CG-CB 4.14Å; Q974-L1127 CarbonylContact O-C 3.54Å; Q974-L1127 VanDerWaalsContact O-C 3.3Å; S1125-L1127 PolarHBondContact O-N 3.07Å; S1125-L1127 VanDerWaalsContact O-N 3.14Å; L1127-S1129 PolarHBondContact O-N 2.95Å; L1127-S1129 VanDerWaalsContact O-N 3.12Å; L1127-W1248 HydrophobicContact CD1-CB 4.19Å; L1127-W1248 HydrophobicContact CD1-CE3 4.4Å; L1127-W1248 HydrophobicContact CG-CB 4.28Å; L1127-L1249 HydrophobicContact CD2-CD2 3.95Å; L1127-A1254 HydrophobicContact CD1-CB 4.2Å; L1127-F1256 HydrophobicContact CD1-CZ 4.24Å; L1127-F1256 HydrophobicContact CD2-CE1 3.77Å; L1127-F1256 HydrophobicContact CD2-CE2 4.31Å; L1127-F1256 HydrophobicContact CD2-CZ 3.44Å; L1127-F1256 VanDerWaalsContact CD2-CZ 3.44Å; L1127-F1256 HydrophobicContact CG-CZ 4.44Å
1128	A	83.7	Confident	79.2	Confident	1.2 Å²	1.2	32.1 Å²	32.1	1%	0.01	21%	0.206	C	C	.	.			trans	-56.6	122.5	-177.4	0	0	0	0	0	111.2	V973 Q974 Y1124 S1125 L1126 Y1167 H1168	V973-A1128 WeakPolarHBondContact O-CB 3.28Å; Q974-A1128 VanDerWaalsContact O-CA 3.28Å; Q974-A1128 WeakPolarHBondContact O-CA 3.37Å; Y1124-A1128 HydrophobicContact CD1-CB 3.84Å; Y1124-A1128 HydrophobicContact CG-CB 4.48Å; S1125-A1128 VanDerWaalsContact O-CB 3.26Å; S1125-A1128 WeakPolarHBondContact O-CB 3.27Å; S1125-A1128 PolarHBondContact O-N 3.09Å; S1125-A1128 VanDerWaalsContact O-N 3.08Å; L1126-A1128 VanDerWaalsContact C-N 3.32Å; A1128-Y1167 VanDerWaalsContact C-OH 3.32Å; A1128-Y1167 WeakPolarHBondContact CA-OH 3.38Å; A1128-Y1167 WeakPolarHBondContact CB-OH 3.44Å; A1128-Y1167 PolarHBondContact N-OH 2.95Å; A1128-Y1167 WeakPolarHBondContact O-CE2 3.39Å; A1128-Y1167 VanDerWaalsContact O-CZ 3.31Å; A1128-Y1167 PolarHBondContact O-OH 3.02Å; A1128-H1168 PolarHBondContact O-CE1 3.32Å
1129	S	74.3	Confident	79	Confident	34.4 Å²	34.4	31 Å²	31	24%	0.241	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-64.7	129.8	-176	-61.5	0	0	0	0	110.9	G975 L1127	G975-S1129 PolarHBondContact O-N 3.1Å; L1127-S1129 PolarHBondContact O-N 2.95Å; L1127-S1129 VanDerWaalsContact O-N 3.12Å
1130	P	67.1	Low	78.6	Confident	33 Å²	33	33.2 Å²	33.2	21%	0.214	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-67.3	158.5	166.7	29.6	-31.4	0	0	0	109.2	S1132 Y1167 E1278	P1130-S1132 VanDerWaalsContact C-N 3.34Å; P1130-S1132 PolarHBondContact O-N 3.08Å; P1130-Y1167 HydrophobicContact CB-CD2 3.64Å; P1130-Y1167 HydrophobicContact CB-CE2 3.78Å; P1130-Y1167 HydrophobicContact CB-CG 4.15Å; P1130-Y1167 HydrophobicContact CG-CD2 4.23Å; P1130-Y1167 HydrophobicContact CG-CE2 4.07Å; P1130-E1278 WeakPolarHBondContact CD-OE1 3.39Å; P1130-E1278 WeakPolarHBondContact CG-OE1 3.37Å
1131	A	62.1	Low	78.6	Confident	22.4 Å²	22.4	35.6 Å²	35.6	19%	0.185	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-58.6	131.4	171.9	0	0	0	0	0	110.2	V1133 Q1136	A1131-V1133 CarbonylContact O-C 3.54Å; A1131-V1133 PolarHBondContact O-N 3.02Å; A1131-Q1136 HydrophobicContact CB-CB 3.84Å; A1131-Q1136 HydrophobicContact CB-CG 4.01Å
1132	S	58.7	Low	78.5	Confident	86 Å²	86	35.6 Å²	35.6	60%	0.601	22%	0.221	S	C	*	.	S	Bend	trans	-60.2	-23.4	-175.5	57.3	0	0	0	0	113.7	P1130 Q1136	P1130-S1132 VanDerWaalsContact C-N 3.34Å; P1130-S1132 PolarHBondContact O-N 3.08Å; S1132-Q1136 PolarHBondContact OG-OE1 2.92Å
1133	V	57	Low	78.6	Confident	94.2 Å²	94.2	37.2 Å²	37.2	57%	0.571	23%	0.229	S	C	*	.	S	Bend	trans	-115.6	118	179.4	-176.8	0	0	0	0	110.6	A1131 G1135 Q1136	A1131-V1133 CarbonylContact O-C 3.54Å; A1131-V1133 PolarHBondContact O-N 3.02Å; V1133-G1135 PolarHBondContact O-N 2.8Å; V1133-Q1136 HydrophobicContact CB-CB 4.27Å; V1133-Q1136 HydrophobicContact CB-CG 3.97Å; V1133-Q1136 HydrophobicContact CG1-CG 4.41Å; V1133-Q1136 WeakPolarHBondContact O-CB 3.32Å; V1133-Q1136 PolarHBondContact O-N 3Å; V1133-Q1136 VanDerWaalsContact O-N 3.15Å
1134	T	56.8	Low	78.7	Confident	98 Å²	98	36.2 Å²	36.2	60%	0.601	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	114.4	179	-15.3	0	0	0	0	111.8	Q1136 K1192	T1134-Q1136 VanDerWaalsContact CB-CD 3.49Å; T1134-Q1136 PolarHBondContact O-N 3.17Å; T1134-Q1136 VanDerWaalsContact OG1-CB 3.31Å; T1134-Q1136 WeakPolarHBondContact OG1-CB 3.02Å; T1134-Q1136 WeakPolarHBondContact OG1-CG 3.16Å; T1134-Q1136 PolarHBondContact OG1-OE1 3.27Å; T1134-K1192 HydrophobicContact CG2-CD 4.43Å; T1134-K1192 PolarHBondContact OG1-NZ 3.12Å
1135	G	61.7	Low	78.8	Confident	67 Å²	67	37.5 Å²	37.5	69%	0.691	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.8	0.6	-175.6	0	0	0	0	0	114.6	V1133 L1169	V1133-G1135 PolarHBondContact O-N 2.8Å; G1135-L1169 WeakPolarHBondContact O-CD2 3.28Å
1136	Q	69.8	Low	79	Confident	97 Å²	97	41.7 Å²	41.7	45%	0.453	25%	0.249	S	C	.	.			trans	-72.3	141.3	170.7	-142.6	178.7	-2.1	0	0	110.5	A1131 S1132 V1133 T1134 T1138	A1131-Q1136 HydrophobicContact CB-CB 3.84Å; A1131-Q1136 HydrophobicContact CB-CG 4.01Å; S1132-Q1136 PolarHBondContact OG-OE1 2.92Å; V1133-Q1136 HydrophobicContact CB-CB 4.27Å; V1133-Q1136 HydrophobicContact CB-CG 3.97Å; V1133-Q1136 HydrophobicContact CG1-CG 4.41Å; V1133-Q1136 WeakPolarHBondContact O-CB 3.32Å; V1133-Q1136 PolarHBondContact O-N 3Å; V1133-Q1136 VanDerWaalsContact O-N 3.15Å; T1134-Q1136 VanDerWaalsContact CB-CD 3.49Å; T1134-Q1136 PolarHBondContact O-N 3.17Å; T1134-Q1136 VanDerWaalsContact OG1-CB 3.31Å; T1134-Q1136 WeakPolarHBondContact OG1-CB 3.02Å; T1134-Q1136 WeakPolarHBondContact OG1-CG 3.16Å; T1134-Q1136 PolarHBondContact OG1-OE1 3.27Å; Q1136-T1138 PolarHBondContact O-N 3.12Å
1137	T	72.5	Confident	79.5	Confident	40.2 Å²	40.2	41.6 Å²	41.6	25%	0.247	25%	0.249	C	C	.	.			trans	-65.7	132.3	174.6	54.9	0	0	0	0	110	K1140 L1169 E1171	T1137-K1140 VanDerWaalsContact CG2-CE 3.44Å; T1137-K1140 WeakPolarHBondContact OG1-CE 3.38Å; T1137-K1140 WeakPolarHBondContact OG1-CG 3.15Å; T1137-L1169 WeakPolarHBondContact CB-O 3.35Å; T1137-L1169 HydrophobicContact CG2-CB 4.29Å; T1137-L1169 HydrophobicContact CG2-CD2 3.74Å; T1137-L1169 HydrophobicContact CG2-CG 4.08Å; T1137-E1171 HydrophobicContact CG2-CB 4.16Å; T1137-E1171 VanDerWaalsContact CG2-OE2 3.29Å; T1137-E1171 WeakPolarHBondContact CG2-OE2 3.3Å
1138	T	81.1	Confident	79.9	Confident	19.2 Å²	19.2	40.6 Å²	40.6	12%	0.118	24%	0.244	C	C	.	.	S	Bend	trans	-69.1	-53.7	177.3	-40.7	0	0	0	0	110.8	Y1124 Q1136 H1168 L1169 F1170	Y1124-T1138 HydrophobicContact CE1-CG2 4.08Å; Q1136-T1138 PolarHBondContact O-N 3.12Å; T1138-H1168 HydrophobicContact CG2-CB 4.24Å; T1138-H1168 WeakPolarHBondContact CG2-ND1 3.31Å; T1138-H1168 WeakPolarHBondContact OG1-CA 3.2Å; T1138-H1168 VanDerWaalsContact OG1-CB 3.26Å; T1138-H1168 WeakPolarHBondContact OG1-CB 3.23Å; T1138-H1168 PolarHBondContact OG1-ND1 2.97Å; T1138-L1169 PolarHBondContact N-O 2.9Å; T1138-L1169 PolarHBondContact OG1-N 2.94Å; T1138-F1170 HydrophobicContact CG2-CE1 4.22Å; T1138-F1170 VanDerWaalsContact OG1-CD1 3.27Å; T1138-F1170 WeakPolarHBondContact OG1-CD1 3.08Å; T1138-F1170 WeakPolarHBondContact OG1-CE1 3.4Å
1139	I	87.2	Confident	80.2	Confident	3.8 Å²	3.8	40.7 Å²	40.7	2%	0.019	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	144	176.4	-173.5	157.2	0	0	0	109.6	L977 L1142 F1170 E1171 L1173	L977-I1139 HydrophobicContact CD2-CD1 3.6Å; L977-I1139 HydrophobicContact CG-CD1 3.78Å; I1139-L1142 HydrophobicContact CD1-CB 4.31Å; I1139-L1142 HydrophobicContact CD1-CD1 4.39Å; I1139-L1142 HydrophobicContact CD1-CD2 4.05Å; I1139-L1142 HydrophobicContact CD1-CG 4.46Å; I1139-L1142 HydrophobicContact CG1-CB 4.38Å; I1139-L1142 HydrophobicContact CG1-CD2 4.46Å; I1139-F1170 HydrophobicContact CG2-CD1 3.55Å; I1139-F1170 VanDerWaalsContact CG2-CD1 3.5Å; I1139-F1170 HydrophobicContact CG2-CE1 3.74Å; I1139-E1171 PolarHBondContact O-N 2.97Å; I1139-L1173 HydrophobicContact CG2-CD2 4.41Å
1140	K	88.5	Confident	80.8	Confident	46.8 Å²	46.8	40.2 Å²	40.2	20%	0.203	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	151.9	-179.4	55.4	-174.1	-178.1	-166	0	113.7	R979 D981 T1137 E1171	R979-K1140 WeakPolarHBondContact CD-O 3.28Å; R979-K1140 PolarHBondContact NH1-O 2.69Å; D981-K1140 WeakPolarHBondContact OD1-CE 3.35Å; D981-K1140 IonicContact OD1-NZ 3.04Å; D981-K1140 PolarHBondContact OD1-NZ 3.14Å; D981-K1140 VanDerWaalsContact OD1-NZ 3.16Å; D981-K1140 WeakPolarHBondContact OD2-CE 3.3Å; D981-K1140 IonicContact OD2-NZ 3.27Å; D981-K1140 PolarHBondContact OD2-NZ 3Å; T1137-K1140 VanDerWaalsContact CG2-CE 3.44Å; T1137-K1140 WeakPolarHBondContact OG1-CE 3.38Å; T1137-K1140 WeakPolarHBondContact OG1-CG 3.15Å; K1140-E1171 CarbonylContact C-O 3.54Å; K1140-E1171 WeakPolarHBondContact CA-O 3.2Å; K1140-E1171 HydrophobicContact CB-CB 3.99Å; K1140-E1171 WeakPolarHBondContact CB-O 3.29Å; K1140-E1171 HydrophobicContact CD-CB 4.31Å; K1140-E1171 WeakPolarHBondContact CD-OE2 3.38Å; K1140-E1171 WeakPolarHBondContact CE-OE2 3.45Å; K1140-E1171 HydrophobicContact CG-CB 4.06Å; K1140-E1171 IonicContact NZ-OE2 2.86Å; K1140-E1171 PolarHBondContact NZ-OE2 3.08Å
1141	H	92.5	Very high	81.8	Confident	53.8 Å²	53.8	38.8 Å²	38.8	25%	0.249	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.4	61.1	-179	-47	67.8	0	0	0	112.8	R979 P988 I989 E1171 H1172	R979-H1141 VanDerWaalsContact CZ-CB 3.45Å; R979-H1141 PolarHBondContact NH1-ND1 3.03Å; R979-H1141 PolarHBondContact NH1-O 3.02Å; R979-H1141 VanDerWaalsContact NH1-O 3.08Å; P988-H1141 CarbonylContact C-O 3.45Å; P988-H1141 VanDerWaalsContact CA-O 3.24Å; P988-H1141 WeakPolarHBondContact CA-O 3.2Å; P988-H1141 HydrophobicContact CB-CB 4.3Å; P988-H1141 WeakPolarHBondContact CB-O 3.25Å; I989-H1141 PolarHBondContact N-O 2.86Å; H1141-E1171 PolarHBondContact N-O 3.17Å; H1141-E1171 VanDerWaalsContact N-O 3.13Å; H1141-H1172 VanDerWaalsContact CA-O 3.27Å; H1141-H1172 WeakPolarHBondContact CA-O 3.34Å; H1141-H1172 HydrophobicContact CB-CB 4.3Å; H1141-H1172 AromaticContact CD2-CG 3.91Å; H1141-H1172 AromaticContact CE1-CG 3.82Å; H1141-H1172 AromaticContact CE1-ND1 3.75Å; H1141-H1172 PolarHBondContact N-O 2.89Å; H1141-H1172 AromaticContact NE2-CG 3.9Å; H1141-H1172 AromaticContact NE2-ND1 3.86Å
1142	L	94.5	Very high	83	Confident	2 Å²	2	38 Å²	38	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.1	176.2	173.2	69.5	0	0	0	109.1	I989 F991 I1139 I1144 H1172 L1173 T1174	I989-L1142 HydrophobicContact CB-CD1 3.97Å; I989-L1142 HydrophobicContact CG2-CD1 3.76Å; I989-L1142 CarbonylContact O-C 3.53Å; I989-L1142 WeakPolarHBondContact O-CA 3.39Å; F991-L1142 HydrophobicContact CD1-CD1 4.03Å; F991-L1142 HydrophobicContact CD2-CD1 3.78Å; F991-L1142 HydrophobicContact CD2-CD2 4.32Å; F991-L1142 HydrophobicContact CD2-CG 4.47Å; F991-L1142 HydrophobicContact CE1-CD1 3.92Å; F991-L1142 HydrophobicContact CE2-CD1 3.69Å; F991-L1142 HydrophobicContact CE2-CD2 4.03Å; F991-L1142 HydrophobicContact CE2-CG 4.41Å; F991-L1142 HydrophobicContact CG-CD1 3.95Å; F991-L1142 HydrophobicContact CZ-CD1 3.76Å; I1139-L1142 HydrophobicContact CD1-CB 4.31Å; I1139-L1142 HydrophobicContact CD1-CD1 4.39Å; I1139-L1142 HydrophobicContact CD1-CD2 4.05Å; I1139-L1142 HydrophobicContact CD1-CG 4.46Å; I1139-L1142 HydrophobicContact CG1-CB 4.38Å; I1139-L1142 HydrophobicContact CG1-CD2 4.46Å; L1142-I1144 HydrophobicContact CD2-CD1 3.95Å; L1142-I1144 HydrophobicContact CD2-CG1 4.04Å; L1142-I1144 HydrophobicContact CG-CD1 4.43Å; L1142-I1144 HydrophobicContact CG-CG1 4.04Å; L1142-H1172 PolarHBondContact N-O 3.02Å; L1142-L1173 HydrophobicContact CB-CD1 4.32Å; L1142-L1173 HydrophobicContact CB-CD2 3.69Å; L1142-L1173 HydrophobicContact CD2-CD1 4.07Å; L1142-L1173 HydrophobicContact CD2-CD2 4.26Å; L1142-L1173 HydrophobicContact CG-CD1 4.47Å; L1142-L1173 HydrophobicContact CG-CD2 4.41Å; L1142-L1173 CarbonylContact O-C 3.57Å; L1142-L1173 WeakPolarHBondContact O-CA 3.17Å; L1142-T1174 PolarHBondContact O-N 3.04Å
1143	I	97.2	Very high	84.2	Confident	34.4 Å²	34.4	36.9 Å²	36.9	18%	0.176	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.7	173.3	-57.8	176.2	0	0	0	108.5	P988 I989 L990 F991 T1174	P988-I1143 HydrophobicContact CB-CD1 3.73Å; P988-I1143 HydrophobicContact CB-CG1 3.85Å; P988-I1143 HydrophobicContact CG-CD1 3.46Å; P988-I1143 VanDerWaalsContact CG-CD1 3.46Å; P988-I1143 HydrophobicContact CG-CG1 4.17Å; I989-I1143 PolarHBondContact O-N 3.1Å; L990-I1143 HydrophobicContact CD1-CB 3.84Å; L990-I1143 HydrophobicContact CD1-CG2 3.64Å; F991-I1143 PolarHBondContact N-O 3.2Å; I1143-T1174 CarbonylContact C-O 3.41Å; I1143-T1174 VanDerWaalsContact CA-O 3.28Å; I1143-T1174 WeakPolarHBondContact CA-O 3.16Å
1144	I	97.1	Very high	85.1	Confident	0.8 Å²	0.8	35.7 Å²	35.7	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	117.6	174.3	-56.3	178.6	0	0	0	108.2	F991 W1119 V1122 L1142 A1147 A1160 F1161 T1174 V1175 Q1176 N1178	F991-I1144 HydrophobicContact CB-CG1 4.45Å; F991-I1144 HydrophobicContact CD2-CG1 4.34Å; W1119-I1144 HydrophobicContact CH2-CG2 4.03Å; W1119-I1144 HydrophobicContact CZ2-CG2 3.74Å; V1122-I1144 HydrophobicContact CG2-CD1 4.15Å; L1142-I1144 HydrophobicContact CD2-CD1 3.95Å; L1142-I1144 HydrophobicContact CD2-CG1 4.04Å; L1142-I1144 HydrophobicContact CG-CD1 4.43Å; L1142-I1144 HydrophobicContact CG-CG1 4.04Å; I1144-A1147 HydrophobicContact CG2-CB 4.28Å; I1144-A1160 HydrophobicContact CG2-CB 4Å; I1144-F1161 HydrophobicContact CD1-CB 4.08Å; I1144-F1161 HydrophobicContact CD1-CD2 3.53Å; I1144-F1161 VanDerWaalsContact CD1-CD2 3.45Å; I1144-F1161 HydrophobicContact CD1-CE2 4.32Å; I1144-F1161 HydrophobicContact CD1-CG 4.12Å; I1144-T1174 PolarHBondContact N-O 3.06Å; I1144-V1175 HydrophobicContact CB-CG2 4.41Å; I1144-V1175 HydrophobicContact CD1-CG2 4.49Å; I1144-V1175 WeakPolarHBondContact O-CA 3.37Å; I1144-Q1176 PolarHBondContact O-N 3.12Å; I1144-N1178 PolarHBondContact O-ND2 3.06Å
1145	E	96.2	Very high	85.8	Confident	30 Å²	30	33.9 Å²	33.9	14%	0.14	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	157	179	60.7	167.6	-137.3	0	0	113.9	L990 F991 T992 W1119 A1147 Q1176 N1178	L990-E1145 HydrophobicContact CD1-CG 4.01Å; F991-E1145 PolarHBondContact O-N 3.25Å; T992-E1145 WeakPolarHBondContact OG1-CG 3.33Å; T992-E1145 PolarHBondContact OG1-OE1 3Å; W1119-E1145 PolarHBondContact NE1-O 2.89Å; E1145-A1147 VanDerWaalsContact C-N 3.28Å; E1145-A1147 PolarHBondContact O-N 3.06Å; E1145-A1147 VanDerWaalsContact O-N 3.13Å; E1145-Q1176 WeakPolarHBondContact CA-O 3.3Å; E1145-Q1176 HydrophobicContact CB-CG 4.13Å; E1145-Q1176 VanDerWaalsContact CB-O 3.25Å; E1145-Q1176 WeakPolarHBondContact CB-O 3.3Å; E1145-Q1176 PolarHBondContact OE2-NE2 2.92Å; E1145-N1178 VanDerWaalsContact C-OD1 3.28Å; E1145-N1178 WeakPolarHBondContact CA-OD1 3.26Å
1146	K	94.2	Very high	86.7	Confident	88.4 Å²	88.4	34 Å²	34	38%	0.384	17%	0.167	S	C	.	.	S	Bend	trans	58.8	29.5	175.5	-55.7	173	-175.4	154.1	0	114.7	L993 M1118 W1119 D1177 N1178	L993-K1146 HydrophobicContact CB-CB 3.84Å; L993-K1146 HydrophobicContact CB-CD 4.25Å; M1118-K1146 WeakPolarHBondContact CB-O 3.22Å; M1118-K1146 VanDerWaalsContact CE-CA 3.45Å; M1118-K1146 HydrophobicContact CE-CB 3.74Å; M1118-K1146 HydrophobicContact CE-CG 4.21Å; M1118-K1146 HydrophobicContact SD-CB 4.17Å; M1118-K1146 VanDerWaalsContact SD-O 3.35Å; W1119-K1146 PolarHBondContact NE1-O 3.19Å; K1146-D1177 WeakPolarHBondContact CA-O 3.36Å; K1146-D1177 PolarHBondContact N-O 3.1Å; K1146-N1178 PolarHBondContact N-OD1 2.92Å; K1146-N1178 VanDerWaalsContact N-OD1 3.13Å
1147	A	95.2	Very high	87.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-94.3	167.7	173.4	0	0	0	0	0	111.6	W1119 I1144 E1145 A1160 N1178 F1179	W1119-A1147 HydrophobicContact CD2-CB 4Å; W1119-A1147 VanDerWaalsContact CE2-CB 3.46Å; W1119-A1147 HydrophobicContact CG-CB 4.35Å; W1119-A1147 HydrophobicContact CH2-CB 4.44Å; W1119-A1147 HydrophobicContact CZ2-CB 3.78Å; W1119-A1147 CarbonylContact O-C 3.53Å; W1119-A1147 WeakPolarHBondContact O-CA 3.25Å; I1144-A1147 HydrophobicContact CG2-CB 4.28Å; E1145-A1147 VanDerWaalsContact C-N 3.28Å; E1145-A1147 PolarHBondContact O-N 3.06Å; E1145-A1147 VanDerWaalsContact O-N 3.13Å; A1147-A1160 HydrophobicContact CB-CB 3.71Å; A1147-N1178 WeakPolarHBondContact CB-OD1 3.27Å; A1147-N1178 PolarHBondContact N-OD1 3Å; A1147-N1178 CarbonylContact O-C 3.55Å; A1147-N1178 WeakPolarHBondContact O-CA 3.29Å; A1147-N1178 WeakPolarHBondContact O-CB 3.43Å; A1147-F1179 PolarHBondContact O-N 3.06Å
1148	G	91.3	Very high	88.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.147	C	C	.	.			trans	143.1	11.1	168.2	0	0	0	0	0	115.5	W1119 L1150 F1157 A1158	W1119-G1148 PolarHBondContact O-N 2.76Å; G1148-L1150 PolarHBondContact O-N 3.4Å; G1148-F1157 WeakPolarHBondContact O-CA 3.38Å; G1148-F1157 WeakPolarHBondContact O-CB 3.41Å; G1148-F1157 WeakPolarHBondContact O-CD1 3.32Å; G1148-A1158 CarbonylContact C-O 3.57Å; G1148-A1158 VanDerWaalsContact CA-O 3.3Å; G1148-A1158 WeakPolarHBondContact CA-O 3.33Å; G1148-A1158 PolarHBondContact O-N 2.92Å
1149	L	89.8	Confident	89.1	Confident	4.2 Å²	4.2	28.9 Å²	28.9	2%	0.022	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.5	-175.2	177.4	66.9	0	0	0	111	R819 S968 I1054 P1117 M1118 W1119 A1120 D1151 F1152 F1157 A1158	R819-L1149 HydrophobicContact CG-CD1 4.25Å; S968-L1149 WeakPolarHBondContact CA-O 3.5Å; I1054-L1149 HydrophobicContact CD1-CD1 3.71Å; I1054-L1149 HydrophobicContact CD1-CD2 3.86Å; I1054-L1149 HydrophobicContact CD1-CG 4.29Å; I1054-L1149 HydrophobicContact CG1-CD2 4.46Å; I1054-L1149 HydrophobicContact CG2-CD2 4.12Å; P1117-L1149 HydrophobicContact CB-CD2 3.86Å; M1118-L1149 HydrophobicContact CB-CB 4.11Å; M1118-L1149 WeakPolarHBondContact O-CB 3.26Å; W1119-L1149 CarbonylContact C-O 3.42Å; W1119-L1149 PolarHBondContact O-N 3.1Å; W1119-L1149 VanDerWaalsContact O-N 3.08Å; A1120-L1149 WeakPolarHBondContact CA-O 3.42Å; A1120-L1149 HydrophobicContact CB-CB 4.04Å; A1120-L1149 HydrophobicContact CB-CD1 4.01Å; A1120-L1149 HydrophobicContact CB-CD2 4.25Å; A1120-L1149 HydrophobicContact CB-CG 4.32Å; A1120-L1149 WeakPolarHBondContact CB-O 3.31Å; A1120-L1149 PolarHBondContact N-O 3.08Å; L1149-D1151 VanDerWaalsContact CD1-O 3.26Å; L1149-D1151 WeakPolarHBondContact CD1-O 3.45Å; L1149-F1152 HydrophobicContact CD2-CB 4.49Å; L1149-F1157 HydrophobicContact CD1-CD1 4.1Å; L1149-F1157 HydrophobicContact CD1-CE1 3.87Å; L1149-F1157 HydrophobicContact CD1-CZ 4.36Å; L1149-F1157 VanDerWaalsContact O-CA 3.22Å; L1149-F1157 WeakPolarHBondContact O-CA 3.35Å; L1149-A1158 HydrophobicContact CB-CB 3.59Å; L1149-A1158 HydrophobicContact CD2-CB 4.35Å; L1149-A1158 PolarHBondContact O-N 2.89Å
1150	L	87.3	Confident	89.6	Confident	23.6 Å²	23.6	28.7 Å²	28.7	12%	0.124	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-40.1	173.9	-174.7	65.5	0	0	0	110.6	R819 I1054 P1057 V1115 A1120 G1148 F1152 P1155 E1156 F1157 A1158 F1179	R819-L1150 WeakPolarHBondContact CD-O 3.34Å; R819-L1150 PolarHBondContact NE-O 3.15Å; R819-L1150 VanDerWaalsContact NE-O 3.14Å; I1054-L1150 HydrophobicContact CB-CD2 4.13Å; I1054-L1150 WeakPolarHBondContact CD1-O 3.47Å; I1054-L1150 HydrophobicContact CG2-CD2 3.61Å; I1054-L1150 HydrophobicContact CG2-CG 3.86Å; P1057-L1150 HydrophobicContact CG-CD1 4.15Å; V1115-L1150 HydrophobicContact CG2-CD2 3.92Å; A1120-L1150 HydrophobicContact CB-CD1 3.91Å; G1148-L1150 PolarHBondContact O-N 3.4Å; L1150-F1152 PolarHBondContact O-N 3.16Å; L1150-P1155 HydrophobicContact CD1-CB 4.25Å; L1150-E1156 WeakPolarHBondContact CA-O 3.39Å; L1150-E1156 HydrophobicContact CB-CB 4.32Å; L1150-E1156 VanDerWaalsContact CB-O 3.26Å; L1150-E1156 WeakPolarHBondContact CB-O 3.29Å; L1150-E1156 HydrophobicContact CD2-CB 4.39Å; L1150-E1156 PolarHBondContact N-O 3Å; L1150-F1157 HydrophobicContact CB-CD1 4.35Å; L1150-F1157 HydrophobicContact CB-CE1 4.23Å; L1150-F1157 HydrophobicContact CD1-CD1 4.2Å; L1150-F1157 HydrophobicContact CD1-CD2 4.37Å; L1150-F1157 HydrophobicContact CD1-CE1 3.92Å; L1150-F1157 HydrophobicContact CD1-CE2 4.09Å; L1150-F1157 HydrophobicContact CD1-CG 4.44Å; L1150-F1157 HydrophobicContact CD1-CZ 3.86Å; L1150-F1157 HydrophobicContact CD2-CE1 4.22Å; L1150-F1157 HydrophobicContact CD2-CZ 4.3Å; L1150-F1157 HydrophobicContact CG-CE1 4.35Å; L1150-A1158 HydrophobicContact CB-CB 4.05Å; L1150-A1158 HydrophobicContact CD1-CB 4.43Å; L1150-F1179 HydrophobicContact CB-CE1 4.24Å; L1150-F1179 HydrophobicContact CD2-CE1 4.05Å
1151	D	88.2	Confident	89.9	Confident	3.8 Å²	3.8	26.5 Å²	26.5	2%	0.02	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.6	175.8	-168.3	3.6	0	0	0	109.7	R819 T820 L1149 R1153 L1154 P1155 E1156	R819-D1151 HydrophobicContact CB-CB 4.03Å; R819-D1151 HydrophobicContact CG-CB 4.34Å; R819-D1151 PolarHBondContact N-OD1 2.85Å; R819-D1151 PolarHBondContact N-OD2 3.07Å; T820-D1151 VanDerWaalsContact CB-OD2 3.28Å; T820-D1151 WeakPolarHBondContact CB-OD2 3.39Å; T820-D1151 WeakPolarHBondContact CG2-OD2 3.28Å; T820-D1151 PolarHBondContact N-OD2 3.26Å; T820-D1151 PolarHBondContact OG1-OD2 2.91Å; L1149-D1151 VanDerWaalsContact CD1-O 3.26Å; L1149-D1151 WeakPolarHBondContact CD1-O 3.45Å; D1151-R1153 PolarHBondContact O-N 3.39Å; D1151-R1153 PolarHBondContact OD1-N 3.22Å; D1151-R1153 VanDerWaalsContact OD1-N 3.12Å; D1151-L1154 CarbonylContact C-O 3.45Å; D1151-L1154 VanDerWaalsContact C-O 3.26Å; D1151-L1154 WeakPolarHBondContact CB-O 3.32Å; D1151-L1154 CarbonylContact O-C 3.55Å; D1151-L1154 PolarHBondContact O-N 3.22Å; D1151-P1155 WeakPolarHBondContact O-CA 3.35Å; D1151-E1156 PolarHBondContact N-O 2.99Å; D1151-E1156 VanDerWaalsContact N-O 3.16Å; D1151-E1156 PolarHBondContact O-N 3Å; D1151-E1156 VanDerWaalsContact O-N 3.13Å
1152	F	86	Confident	90.1	Very high	4.8 Å²	4.8	24.6 Å²	24.6	2%	0.021	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-25.3	-178.5	77.9	-90.6	0	0	0	113	Y813 L816 N817 G818 H1049 I1054 L1149 L1150	Y813-F1152 AromaticContact CD2-CE2 3.81Å; Y813-F1152 HydrophobicContact CD2-CE2 3.81Å; Y813-F1152 AromaticContact CD2-CZ 3.83Å; Y813-F1152 HydrophobicContact CD2-CZ 3.94Å; Y813-F1152 HydrophobicContact CE2-CE2 4.29Å; Y813-F1152 HydrophobicContact CG-CE2 4.35Å; Y813-F1152 HydrophobicContact CG-CZ 4.32Å; L816-F1152 HydrophobicContact CB-CD1 3.86Å; L816-F1152 HydrophobicContact CB-CD2 4.39Å; L816-F1152 HydrophobicContact CB-CE1 3.61Å; L816-F1152 HydrophobicContact CB-CE2 4.15Å; L816-F1152 HydrophobicContact CB-CG 4.3Å; L816-F1152 HydrophobicContact CB-CZ 3.85Å; L816-F1152 HydrophobicContact CD1-CB 4.45Å; L816-F1152 HydrophobicContact CD1-CD1 4.46Å; L816-F1152 HydrophobicContact CD1-CD2 4.02Å; L816-F1152 HydrophobicContact CD1-CE2 3.9Å; L816-F1152 HydrophobicContact CD1-CG 4.28Å; L816-F1152 HydrophobicContact CD1-CZ 4.33Å; L816-F1152 VanDerWaalsContact O-CE1 3.31Å; L816-F1152 WeakPolarHBondContact O-CE1 3.31Å; N817-F1152 WeakPolarHBondContact O-CD1 3.42Å; G818-F1152 VanDerWaalsContact CA-CE1 3.47Å; H1049-F1152 HydrophobicContact CB-CE2 4.46Å; H1049-F1152 AromaticContact CD2-CD2 3.72Å; H1049-F1152 AromaticContact CE1-CD2 3.79Å; H1049-F1152 PolarHBondContact CE1-O 3Å; H1049-F1152 VanDerWaalsContact CE1-O 3.3Å; H1049-F1152 AromaticContact CG-CD2 3.91Å; H1049-F1152 AromaticContact CG-CE2 3.98Å; H1049-F1152 AromaticContact ND1-CD2 3.87Å; H1049-F1152 AromaticContact ND1-CE2 3.91Å; H1049-F1152 AromaticContact NE2-CD2 3.67Å; H1049-F1152 PolarHBondContact NE2-O 2.95Å; I1054-F1152 HydrophobicContact CB-CB 4.47Å; I1054-F1152 HydrophobicContact CD1-CB 3.7Å; I1054-F1152 HydrophobicContact CG1-CB 3.77Å; I1054-F1152 HydrophobicContact CG2-CB 3.65Å; I1054-F1152 VanDerWaalsContact CG2-CB 3.49Å; I1054-F1152 HydrophobicContact CG2-CG 4.49Å; L1149-F1152 HydrophobicContact CD2-CB 4.49Å; L1150-F1152 PolarHBondContact O-N 3.16Å
1153	R	83.3	Confident	90.1	Very high	62 Å²	62	24.5 Å²	24.5	23%	0.234	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-47.4	-177.1	-67	-154.9	-162.8	-145.5	5.3	112.2	Y813 T820 L821 H823 D1151 P1155	Y813-R1153 PolarHBondContact OH-NH1 2.87Å; T820-R1153 VanDerWaalsContact O-CD 3.29Å; T820-R1153 WeakPolarHBondContact O-CD 3.38Å; T820-R1153 PolarHBondContact O-NE 2.63Å; L821-R1153 VanDerWaalsContact CB-NH1 3.31Å; L821-R1153 HydrophobicContact CD1-CB 4.27Å; L821-R1153 PolarHBondContact O-NH1 3.34Å; L821-R1153 PolarHBondContact O-NH2 3.07Å; H823-R1153 PolarHBondContact CE1-NH2 2.98Å; H823-R1153 VanDerWaalsContact CE1-NH2 3.31Å; H823-R1153 PolarHBondContact NE2-NH2 2.98Å; D1151-R1153 PolarHBondContact O-N 3.39Å; D1151-R1153 PolarHBondContact OD1-N 3.22Å; D1151-R1153 VanDerWaalsContact OD1-N 3.12Å; R1153-P1155 VanDerWaalsContact O-CD 3.27Å; R1153-P1155 WeakPolarHBondContact O-CD 3.47Å
1154	L	77.4	Confident	89.8	Confident	70.4 Å²	70.4	22.9 Å²	22.9	37%	0.369	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	105.1	160.7	-60.1	176.8	0	0	0	104.3	T820 D1151 E1156	T820-L1154 HydrophobicContact CG2-CD1 4.05Å; T820-L1154 WeakPolarHBondContact OG1-CD1 3.22Å; D1151-L1154 CarbonylContact C-O 3.45Å; D1151-L1154 VanDerWaalsContact C-O 3.26Å; D1151-L1154 WeakPolarHBondContact CB-O 3.32Å; D1151-L1154 CarbonylContact O-C 3.55Å; D1151-L1154 PolarHBondContact O-N 3.22Å; L1154-E1156 HydrophobicContact CB-CG 4.15Å; L1154-E1156 PolarHBondContact O-N 3.26Å
1155	P	70.5	Confident	89.4	Confident	60.6 Å²	60.6	22.9 Å²	22.9	39%	0.394	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	70.3	-174.2	28.8	-36.4	0	0	0	111.1	P1057 L1150 D1151 R1153 F1157	P1057-P1155 HydrophobicContact CB-CB 4.24Å; P1057-P1155 HydrophobicContact CB-CG 4.33Å; P1057-P1155 HydrophobicContact CG-CB 4Å; P1057-P1155 HydrophobicContact CG-CG 3.67Å; L1150-P1155 HydrophobicContact CD1-CB 4.25Å; D1151-P1155 WeakPolarHBondContact O-CA 3.35Å; R1153-P1155 VanDerWaalsContact O-CD 3.27Å; R1153-P1155 WeakPolarHBondContact O-CD 3.47Å; P1155-F1157 HydrophobicContact CB-CE2 3.93Å; P1155-F1157 HydrophobicContact CB-CZ 4.37Å; P1155-F1157 WeakPolarHBondContact O-CE2 3.4Å
1156	E	82	Confident	89	Confident	67.2 Å²	67.2	21.5 Å²	21.5	31%	0.314	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121	179.3	-69.1	-168.7	177.3	0	0	107.9	L1150 D1151 L1154 K1240	L1150-E1156 WeakPolarHBondContact CA-O 3.39Å; L1150-E1156 HydrophobicContact CB-CB 4.32Å; L1150-E1156 VanDerWaalsContact CB-O 3.26Å; L1150-E1156 WeakPolarHBondContact CB-O 3.29Å; L1150-E1156 HydrophobicContact CD2-CB 4.39Å; L1150-E1156 PolarHBondContact N-O 3Å; D1151-E1156 PolarHBondContact N-O 2.99Å; D1151-E1156 VanDerWaalsContact N-O 3.16Å; D1151-E1156 PolarHBondContact O-N 3Å; D1151-E1156 VanDerWaalsContact O-N 3.13Å; L1154-E1156 HydrophobicContact CB-CG 4.15Å; L1154-E1156 PolarHBondContact O-N 3.26Å; E1156-K1240 IonicContact OE1-NZ 2.93Å; E1156-K1240 PolarHBondContact OE1-NZ 2.98Å; E1156-K1240 IonicContact OE2-NZ 3.21Å; E1156-K1240 PolarHBondContact OE2-NZ 2.92Å
1157	F	88.4	Confident	88.5	Confident	27.6 Å²	27.6	18.2 Å²	18.2	12%	0.121	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	143.9	176.3	-60.9	-70.4	0	0	0	110.9	I1054 D1056 P1057 E1058 G1148 L1149 L1150 P1155 F1179 W1180	I1054-F1157 HydrophobicContact CD1-CE1 3.9Å; I1054-F1157 HydrophobicContact CD1-CZ 4.33Å; D1056-F1157 HydrophobicContact CB-CE2 4.16Å; D1056-F1157 HydrophobicContact CB-CZ 3.95Å; D1056-F1157 WeakPolarHBondContact OD1-CE2 3.24Å; D1056-F1157 WeakPolarHBondContact OD1-CZ 3.31Å; P1057-F1157 HydrophobicContact CB-CD2 4.27Å; P1057-F1157 HydrophobicContact CB-CE2 3.48Å; P1057-F1157 VanDerWaalsContact CB-CE2 3.48Å; P1057-F1157 HydrophobicContact CB-CZ 3.91Å; P1057-F1157 HydrophobicContact CG-CD2 4.26Å; P1057-F1157 HydrophobicContact CG-CE1 4.09Å; P1057-F1157 HydrophobicContact CG-CE2 3.54Å; P1057-F1157 HydrophobicContact CG-CZ 3.81Å; E1058-F1157 HydrophobicContact CG-CD2 4.35Å; E1058-F1157 HydrophobicContact CG-CE2 3.82Å; E1058-F1157 HydrophobicContact CG-CZ 4.19Å; G1148-F1157 WeakPolarHBondContact O-CA 3.38Å; G1148-F1157 WeakPolarHBondContact O-CB 3.41Å; G1148-F1157 WeakPolarHBondContact O-CD1 3.32Å; L1149-F1157 HydrophobicContact CD1-CD1 4.1Å; L1149-F1157 HydrophobicContact CD1-CE1 3.87Å; L1149-F1157 HydrophobicContact CD1-CZ 4.36Å; L1149-F1157 VanDerWaalsContact O-CA 3.22Å; L1149-F1157 WeakPolarHBondContact O-CA 3.35Å; L1150-F1157 HydrophobicContact CB-CD1 4.35Å; L1150-F1157 HydrophobicContact CB-CE1 4.23Å; L1150-F1157 HydrophobicContact CD1-CD1 4.2Å; L1150-F1157 HydrophobicContact CD1-CD2 4.37Å; L1150-F1157 HydrophobicContact CD1-CE1 3.92Å; L1150-F1157 HydrophobicContact CD1-CE2 4.09Å; L1150-F1157 HydrophobicContact CD1-CG 4.44Å; L1150-F1157 HydrophobicContact CD1-CZ 3.86Å; L1150-F1157 HydrophobicContact CD2-CE1 4.22Å; L1150-F1157 HydrophobicContact CD2-CZ 4.3Å; L1150-F1157 HydrophobicContact CG-CE1 4.35Å; P1155-F1157 HydrophobicContact CB-CE2 3.93Å; P1155-F1157 HydrophobicContact CB-CZ 4.37Å; P1155-F1157 WeakPolarHBondContact O-CE2 3.4Å; F1157-F1179 AromaticContact CD1-CD1 3.88Å; F1157-F1179 HydrophobicContact CD1-CD1 4.03Å; F1157-F1179 AromaticContact CD1-CE1 3.68Å; F1157-F1179 HydrophobicContact CD1-CE1 3.89Å; F1157-F1179 AromaticContact CE1-CD1 3.93Å; F1157-F1179 HydrophobicContact CE1-CD1 3.93Å; F1157-F1179 AromaticContact CE1-CE1 3.4Å; F1157-F1179 HydrophobicContact CE1-CE1 3.4Å; F1157-F1179 VanDerWaalsContact CE1-CE1 3.41Å; F1157-F1179 HydrophobicContact CE1-CZ 4.37Å; F1157-F1179 HydrophobicContact CE2-CE1 4.32Å; F1157-F1179 HydrophobicContact CG-CE1 4.24Å; F1157-F1179 HydrophobicContact CZ-CD1 4.39Å; F1157-F1179 AromaticContact CZ-CE1 3.69Å; F1157-F1179 HydrophobicContact CZ-CE1 3.95Å; F1157-F1179 HydrophobicContact CZ-CZ 4.37Å; F1157-W1180 HydrophobicContact CB-CB 4.33Å; F1157-W1180 HydrophobicContact CB-CD2 3.64Å; F1157-W1180 VanDerWaalsContact CB-CD2 3.5Å; F1157-W1180 HydrophobicContact CB-CE3 4.12Å; F1157-W1180 HydrophobicContact CB-CG 3.81Å; F1157-W1180 HydrophobicContact CB-CH2 4.12Å; F1157-W1180 HydrophobicContact CB-CZ2 4.11Å; F1157-W1180 HydrophobicContact CB-CZ3 4.11Å; F1157-W1180 HydrophobicContact CD1-CB 4.25Å; F1157-W1180 AromaticContact CD1-CD1 3.93Å; F1157-W1180 HydrophobicContact CD1-CE3 4.28Å; F1157-W1180 HydrophobicContact CD1-CG 4.09Å; F1157-W1180 HydrophobicContact CD1-CZ3 4.38Å; F1157-W1180 HydrophobicContact CD2-CH2 4.05Å; F1157-W1180 HydrophobicContact CD2-CZ3 4.09Å; F1157-W1180 AromaticContact CG-CD1 3.85Å; F1157-W1180 HydrophobicContact CG-CD2 4.29Å; F1157-W1180 AromaticContact CG-CE3 3.99Å; F1157-W1180 HydrophobicContact CG-CE3 3.99Å; F1157-W1180 HydrophobicContact CG-CG 4.25Å; F1157-W1180 HydrophobicContact CG-CH2 4.1Å; F1157-W1180 HydrophobicContact CG-CZ2 4.49Å; F1157-W1180 AromaticContact CG-CZ3 3.87Å; F1157-W1180 HydrophobicContact CG-CZ3 3.87Å; F1157-W1180 AromaticContact CG-NE1 3.86Å; F1157-W1180 VanDerWaalsContact O-CH2 3.29Å; F1157-W1180 WeakPolarHBondContact O-CH2 3.41Å; F1157-W1180 WeakPolarHBondContact O-CZ3 3.12Å
1158	A	90.3	Very high	88.1	Confident	19.4 Å²	19.4	18.3 Å²	18.3	16%	0.16	9%	0.094	C	C	.	.			trans	-122.6	155.4	176.3	0	0	0	0	0	110.6	A1120 G1148 L1149 L1150 W1180	A1120-A1158 WeakPolarHBondContact O-CB 3.42Å; G1148-A1158 CarbonylContact C-O 3.57Å; G1148-A1158 VanDerWaalsContact CA-O 3.3Å; G1148-A1158 WeakPolarHBondContact CA-O 3.33Å; G1148-A1158 PolarHBondContact O-N 2.92Å; L1149-A1158 HydrophobicContact CB-CB 3.59Å; L1149-A1158 HydrophobicContact CD2-CB 4.35Å; L1149-A1158 PolarHBondContact O-N 2.89Å; L1150-A1158 HydrophobicContact CB-CB 4.05Å; L1150-A1158 HydrophobicContact CD1-CB 4.43Å; A1158-W1180 VanDerWaalsContact C-CE3 3.42Å; A1158-W1180 WeakPolarHBondContact O-CB 3.33Å; A1158-W1180 VanDerWaalsContact O-CE3 3.31Å
1159	A	94.8	Very high	88	Confident	2.4 Å²	2.4	20.1 Å²	20.1	2%	0.02	10%	0.104	C	C	.	.			trans	-74.9	149.8	175.1	0	0	0	0	0	109.9	F1161 T1162 W1180 T1181 D1184	A1159-F1161 VanDerWaalsContact C-N 3.29Å; A1159-F1161 PolarHBondContact O-N 2.98Å; A1159-F1161 VanDerWaalsContact O-N 3.17Å; A1159-T1162 HydrophobicContact CB-CG2 3.63Å; A1159-W1180 HydrophobicContact CB-CE3 4.26Å; A1159-W1180 HydrophobicContact CB-CZ3 4.39Å; A1159-W1180 VanDerWaalsContact N-CE3 3.3Å; A1159-T1181 CarbonylContact C-O 3.51Å; A1159-T1181 VanDerWaalsContact CA-O 3.25Å; A1159-T1181 WeakPolarHBondContact CA-O 3.31Å; A1159-T1181 HydrophobicContact CB-CG2 4.28Å; A1159-T1181 WeakPolarHBondContact CB-O 3.29Å; A1159-D1184 HydrophobicContact CB-CB 3.59Å
1160	A	96.1	Very high	88.1	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	-60.2	-35	179	0	0	0	0	0	112	G1121 V1122 I1144 A1147 V1175 N1178 T1181 G1182	G1121-A1160 CarbonylContact C-O 3.52Å; G1121-A1160 VanDerWaalsContact CA-O 3.3Å; G1121-A1160 WeakPolarHBondContact CA-O 3.27Å; V1122-A1160 PolarHBondContact N-O 2.86Å; I1144-A1160 HydrophobicContact CG2-CB 4Å; A1147-A1160 HydrophobicContact CB-CB 3.71Å; A1160-V1175 HydrophobicContact CB-CG1 3.96Å; A1160-N1178 HydrophobicContact CB-CB 3.88Å; A1160-N1178 VanDerWaalsContact CB-CG 3.42Å; A1160-N1178 WeakPolarHBondContact CB-OD1 3.28Å; A1160-T1181 PolarHBondContact N-O 3.18Å; A1160-G1182 WeakPolarHBondContact CB-O 3.43Å; A1160-G1182 PolarHBondContact N-O 3.09Å
1161	F	96.6	Very high	88.4	Confident	1.4 Å²	1.4	20.5 Å²	20.5	1%	0.006	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	108.4	176.1	-166.7	-110.8	0	0	0	110.5	V1122 Y1124 I1144 A1159 V1163 F1170 L1173 G1182 V1183 D1184	V1122-F1161 HydrophobicContact CB-CD2 3.96Å; V1122-F1161 HydrophobicContact CB-CE2 4.32Å; V1122-F1161 HydrophobicContact CG1-CD2 4.29Å; V1122-F1161 HydrophobicContact CG1-CE2 4.14Å; V1122-F1161 CarbonylContact O-C 3.55Å; V1122-F1161 WeakPolarHBondContact O-CA 3.37Å; Y1124-F1161 AromaticContact CD2-CE2 3.75Å; Y1124-F1161 HydrophobicContact CD2-CE2 3.75Å; Y1124-F1161 AromaticContact CD2-CZ 3.74Å; Y1124-F1161 HydrophobicContact CD2-CZ 3.74Å; Y1124-F1161 AromaticContact CE2-CE2 3.65Å; Y1124-F1161 HydrophobicContact CE2-CE2 3.65Å; Y1124-F1161 AromaticContact CE2-CZ 3.75Å; Y1124-F1161 HydrophobicContact CE2-CZ 3.75Å; I1144-F1161 HydrophobicContact CD1-CB 4.08Å; I1144-F1161 HydrophobicContact CD1-CD2 3.53Å; I1144-F1161 VanDerWaalsContact CD1-CD2 3.45Å; I1144-F1161 HydrophobicContact CD1-CE2 4.32Å; I1144-F1161 HydrophobicContact CD1-CG 4.12Å; A1159-F1161 VanDerWaalsContact C-N 3.29Å; A1159-F1161 PolarHBondContact O-N 2.98Å; A1159-F1161 VanDerWaalsContact O-N 3.17Å; F1161-V1163 HydrophobicContact CD1-CG2 4.01Å; F1161-V1163 HydrophobicContact CE1-CG2 3.52Å; F1161-V1163 VanDerWaalsContact CE1-CG2 3.49Å; F1161-V1163 HydrophobicContact CZ-CG2 4.13Å; F1161-F1170 HydrophobicContact CE1-CD1 4.43Å; F1161-F1170 HydrophobicContact CE1-CD2 4.19Å; F1161-F1170 HydrophobicContact CE1-CE1 4.12Å; F1161-F1170 AromaticContact CE1-CE2 3.75Å; F1161-F1170 HydrophobicContact CE1-CE2 3.75Å; F1161-F1170 HydrophobicContact CE1-CG 4.49Å; F1161-F1170 AromaticContact CE1-CZ 3.72Å; F1161-F1170 HydrophobicContact CE1-CZ 3.72Å; F1161-F1170 HydrophobicContact CZ-CD1 4.25Å; F1161-F1170 AromaticContact CZ-CE1 3.65Å; F1161-F1170 HydrophobicContact CZ-CE1 3.65Å; F1161-F1170 AromaticContact CZ-CE2 3.97Å; F1161-F1170 HydrophobicContact CZ-CE2 4.07Å; F1161-F1170 AromaticContact CZ-CZ 3.53Å; F1161-F1170 HydrophobicContact CZ-CZ 3.53Å; F1161-F1170 VanDerWaalsContact CZ-CZ 3.49Å; F1161-L1173 HydrophobicContact CE1-CD1 4.34Å; F1161-G1182 PolarHBondContact N-O 2.91Å; F1161-V1183 HydrophobicContact CB-CG2 4.14Å; F1161-V1183 HydrophobicContact CD1-CG1 4.08Å; F1161-V1183 HydrophobicContact CD1-CG2 4.24Å; F1161-V1183 CarbonylContact O-C 3.53Å; F1161-V1183 VanDerWaalsContact O-CA 3.29Å; F1161-V1183 WeakPolarHBondContact O-CA 3.37Å; F1161-D1184 PolarHBondContact O-N 3.12Å
1162	T	95.5	Very high	88.7	Confident	14.2 Å²	14.2	23.4 Å²	23.4	9%	0.087	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135.4	179.5	-39.8	0	0	0	0	110.1	V1122 R1123 Y1124 A1159 D1184 I1186 M1241	V1122-T1162 PolarHBondContact O-N 3.16Å; V1122-T1162 PolarHBondContact O-OG1 2.87Å; V1122-T1162 VanDerWaalsContact O-OG1 3.06Å; R1123-T1162 CarbonylContact C-O 3.53Å; R1123-T1162 VanDerWaalsContact CA-O 3.29Å; R1123-T1162 WeakPolarHBondContact CA-O 3.3Å; R1123-T1162 WeakPolarHBondContact CA-OG1 3.48Å; R1123-T1162 WeakPolarHBondContact CB-OG1 3.47Å; R1123-T1162 HydrophobicContact CG-CG2 4.33Å; R1123-T1162 VanDerWaalsContact CG-OG1 3.23Å; R1123-T1162 WeakPolarHBondContact CG-OG1 3.29Å; Y1124-T1162 PolarHBondContact N-O 3.01Å; A1159-T1162 HydrophobicContact CB-CG2 3.63Å; T1162-D1184 CarbonylContact C-O 3.55Å; T1162-D1184 WeakPolarHBondContact CA-O 3.43Å; T1162-D1184 HydrophobicContact CG2-CB 4.25Å; T1162-I1186 HydrophobicContact CG2-CD1 4.35Å; T1162-M1241 HydrophobicContact CG2-CE 4.13Å
1163	V	94.5	Very high	89.1	Confident	0.2 Å²	0.2	23.3 Å²	23.3	0%	0.001	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	112.3	175	-174.1	0	0	0	0	108.5	F1161 N1166 F1170 D1184 I1185 I1186	F1161-V1163 HydrophobicContact CD1-CG2 4.01Å; F1161-V1163 HydrophobicContact CE1-CG2 3.52Å; F1161-V1163 VanDerWaalsContact CE1-CG2 3.49Å; F1161-V1163 HydrophobicContact CZ-CG2 4.13Å; V1163-N1166 HydrophobicContact CG1-CB 3.76Å; V1163-F1170 HydrophobicContact CG2-CE2 4.07Å; V1163-F1170 HydrophobicContact CG2-CZ 4.3Å; V1163-D1184 PolarHBondContact N-O 3.25Å; V1163-I1185 HydrophobicContact CB-CG1 4.29Å; V1163-I1185 HydrophobicContact CG2-CG1 4.48Å; V1163-I1186 PolarHBondContact O-N 2.95Å
1164	D	91.9	Very high	89.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	-46.1	-179.6	-70.6	-0.4	0	0	0	110.6	R1123 Y1124 I1186 Y1187 V1245	R1123-D1164 IonicContact CZ-OD1 3.24Å; R1123-D1164 IonicContact CZ-OD2 3.31Å; R1123-D1164 IonicContact NE-OD1 3.02Å; R1123-D1164 PolarHBondContact NE-OD1 3.1Å; R1123-D1164 IonicContact NE-OD2 3.41Å; R1123-D1164 PolarHBondContact NE-OD2 3.16Å; R1123-D1164 VanDerWaalsContact NE-OD2 3.13Å; R1123-D1164 IonicContact NH2-OD1 3.77Å; R1123-D1164 PolarHBondContact NH2-OD1 3.36Å; R1123-D1164 IonicContact NH2-OD2 3.25Å; R1123-D1164 PolarHBondContact NH2-OD2 2.9Å; Y1124-D1164 WeakPolarHBondContact O-CB 3.21Å; Y1124-D1164 PolarHBondContact O-N 2.89Å; D1164-I1186 HydrophobicContact CB-CD1 4.45Å; D1164-I1186 WeakPolarHBondContact O-CB 3.42Å; D1164-I1186 WeakPolarHBondContact OD1-CD1 3.3Å; D1164-Y1187 WeakPolarHBondContact O-CB 3.34Å; D1164-Y1187 WeakPolarHBondContact O-CD2 3.45Å; D1164-Y1187 PolarHBondContact O-N 2.94Å; D1164-V1245 HydrophobicContact CB-CG1 4.31Å; D1164-V1245 HydrophobicContact CB-CG2 4.1Å
1165	W	88.1	Confident	90.7	Very high	1 Å²	1	18.2 Å²	18.2	0%	0.004	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	111.9	177.7	-159.2	-72.6	0	0	0	110.9	L1126 Y1167 Y1187 D1189 Q1320 I1322 L1379	L1126-W1165 HydrophobicContact CB-CB 4.48Å; L1126-W1165 HydrophobicContact CD1-CB 3.53Å; L1126-W1165 VanDerWaalsContact CD1-CB 3.44Å; L1126-W1165 HydrophobicContact CD1-CD2 3.6Å; L1126-W1165 HydrophobicContact CD1-CE3 3.53Å; L1126-W1165 VanDerWaalsContact CD1-CE3 3.5Å; L1126-W1165 HydrophobicContact CD1-CG 3.64Å; L1126-W1165 HydrophobicContact CD1-CZ3 4.39Å; W1165-Y1167 HydrophobicContact CB-CE1 4.32Å; W1165-Y1167 HydrophobicContact CB-CE2 3.8Å; W1165-Y1167 AromaticContact CD1-CD1 3.59Å; W1165-Y1167 AromaticContact CD1-CE1 3.52Å; W1165-Y1167 AromaticContact CD1-CE2 3.47Å; W1165-Y1167 VanDerWaalsContact CD1-CE2 3.47Å; W1165-Y1167 AromaticContact CD1-CZ 2.96Å; W1165-Y1167 HydrophobicContact CG-CD1 4.46Å; W1165-Y1167 HydrophobicContact CG-CE1 4.29Å; W1165-Y1167 AromaticContact CG-CE2 3.86Å; W1165-Y1167 HydrophobicContact CG-CE2 3.86Å; W1165-Y1167 AromaticContact CG-CZ 3.55Å; W1165-Y1167 AromaticContact NE1-CD1 3.91Å; W1165-Y1167 AromaticContact NE1-CE1 3.33Å; W1165-Y1167 VanDerWaalsContact NE1-CE1 3.33Å; W1165-Y1167 AromaticContact NE1-CZ 3.49Å; W1165-Y1167 PolarHBondContact NE1-OH 3.48Å; W1165-Y1167 WeakPolarHBondContact O-CD1 3.45Å; W1165-Y1167 WeakPolarHBondContact O-CD2 3.02Å; W1165-Y1167 WeakPolarHBondContact O-CE1 3.34Å; W1165-Y1167 PolarHBondContact O-N 3.07Å; W1165-Y1187 CarbonylContact C-O 3.54Å; W1165-Y1187 WeakPolarHBondContact CA-O 3.28Å; W1165-Y1187 HydrophobicContact CD2-CG 4.4Å; W1165-Y1187 VanDerWaalsContact CE3-CB 3.47Å; W1165-Y1187 HydrophobicContact CE3-CD1 4.45Å; W1165-Y1187 AromaticContact CE3-CD2 3.85Å; W1165-Y1187 HydrophobicContact CE3-CD2 3.85Å; W1165-Y1187 AromaticContact CE3-CG 3.7Å; W1165-Y1187 HydrophobicContact CE3-CG 3.7Å; W1165-Y1187 HydrophobicContact CH2-CG 4.44Å; W1165-Y1187 AromaticContact CZ3-CD1 3.98Å; W1165-Y1187 HydrophobicContact CZ3-CD1 4.18Å; W1165-Y1187 AromaticContact CZ3-CD2 3.88Å; W1165-Y1187 HydrophobicContact CZ3-CD2 4.06Å; W1165-Y1187 AromaticContact CZ3-CG 3.76Å; W1165-Y1187 HydrophobicContact CZ3-CG 3.76Å; W1165-D1189 PolarHBondContact NE1-OD2 2.94Å; W1165-Q1320 HydrophobicContact CH2-CG 3.71Å; W1165-Q1320 HydrophobicContact CZ2-CG 4.04Å; W1165-I1322 HydrophobicContact CH2-CG1 3.91Å; W1165-I1322 HydrophobicContact CZ3-CB 4.43Å; W1165-I1322 HydrophobicContact CZ3-CG1 3.87Å; W1165-I1322 HydrophobicContact CZ3-CG2 4.4Å; W1165-L1379 HydrophobicContact CH2-CD2 4.24Å; W1165-L1379 HydrophobicContact CZ2-CD2 3.64Å
1166	N	86.8	Confident	91.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	105.2	-171.1	-170	22.7	0	0	0	112	V1163 H1168 I1185 Y1187 T1188 D1189 P1194 L1216	V1163-N1166 HydrophobicContact CG1-CB 3.76Å; N1166-H1168 PolarHBondContact OD1-N 3Å; N1166-H1168 VanDerWaalsContact OD1-N 3.12Å; N1166-I1185 HydrophobicContact CB-CG2 3.78Å; N1166-Y1187 WeakPolarHBondContact CB-O 3.1Å; N1166-Y1187 PolarHBondContact N-O 3.19Å; N1166-T1188 HydrophobicContact CB-CG2 4.49Å; N1166-D1189 VanDerWaalsContact O-CB 3.29Å; N1166-D1189 WeakPolarHBondContact O-CB 3.3Å; N1166-D1189 PolarHBondContact O-N 3.01Å; N1166-D1189 VanDerWaalsContact O-N 3.1Å; N1166-P1194 HydrophobicContact CB-CB 4.45Å; N1166-P1194 HydrophobicContact CB-CG 4.47Å; N1166-P1194 WeakPolarHBondContact O-CG 3.39Å; N1166-L1216 WeakPolarHBondContact ND2-CD1 3.28Å
1167	Y	83.7	Confident	92.5	Very high	19.4 Å²	19.4	16.9 Å²	16.9	8%	0.076	9%	0.087	C	C	.	.			trans	-116.6	14.7	163.2	27.3	-99.2	0	0	0	111.7	L1126 A1128 P1130 W1165 D1189 K1192 Y1282	L1126-Y1167 PolarHBondContact O-OH 2.86Å; A1128-Y1167 VanDerWaalsContact C-OH 3.32Å; A1128-Y1167 WeakPolarHBondContact CA-OH 3.38Å; A1128-Y1167 WeakPolarHBondContact CB-OH 3.44Å; A1128-Y1167 PolarHBondContact N-OH 2.95Å; A1128-Y1167 WeakPolarHBondContact O-CE2 3.39Å; A1128-Y1167 VanDerWaalsContact O-CZ 3.31Å; A1128-Y1167 PolarHBondContact O-OH 3.02Å; P1130-Y1167 HydrophobicContact CB-CD2 3.64Å; P1130-Y1167 HydrophobicContact CB-CE2 3.78Å; P1130-Y1167 HydrophobicContact CB-CG 4.15Å; P1130-Y1167 HydrophobicContact CG-CD2 4.23Å; P1130-Y1167 HydrophobicContact CG-CE2 4.07Å; W1165-Y1167 HydrophobicContact CB-CE1 4.32Å; W1165-Y1167 HydrophobicContact CB-CE2 3.8Å; W1165-Y1167 AromaticContact CD1-CD1 3.59Å; W1165-Y1167 AromaticContact CD1-CE1 3.52Å; W1165-Y1167 AromaticContact CD1-CE2 3.47Å; W1165-Y1167 VanDerWaalsContact CD1-CE2 3.47Å; W1165-Y1167 AromaticContact CD1-CZ 2.96Å; W1165-Y1167 HydrophobicContact CG-CD1 4.46Å; W1165-Y1167 HydrophobicContact CG-CE1 4.29Å; W1165-Y1167 AromaticContact CG-CE2 3.86Å; W1165-Y1167 HydrophobicContact CG-CE2 3.86Å; W1165-Y1167 AromaticContact CG-CZ 3.55Å; W1165-Y1167 AromaticContact NE1-CD1 3.91Å; W1165-Y1167 AromaticContact NE1-CE1 3.33Å; W1165-Y1167 VanDerWaalsContact NE1-CE1 3.33Å; W1165-Y1167 AromaticContact NE1-CZ 3.49Å; W1165-Y1167 PolarHBondContact NE1-OH 3.48Å; W1165-Y1167 WeakPolarHBondContact O-CD1 3.45Å; W1165-Y1167 WeakPolarHBondContact O-CD2 3.02Å; W1165-Y1167 WeakPolarHBondContact O-CE1 3.34Å; W1165-Y1167 PolarHBondContact O-N 3.07Å; Y1167-D1189 HydrophobicContact CD1-CB 4.05Å; Y1167-D1189 HydrophobicContact CE1-CB 3.95Å; Y1167-D1189 VanDerWaalsContact CE1-OD2 3.23Å; Y1167-D1189 WeakPolarHBondContact CE1-OD2 3.45Å; Y1167-D1189 HydrophobicContact CG-CB 4.46Å; Y1167-K1192 HydrophobicContact CD1-CG 4.25Å; Y1167-K1192 HydrophobicContact CG-CD 4.35Å; Y1167-Y1282 PolarHBondContact OH-OH 3.15Å; Y1167-Y1282 VanDerWaalsContact OH-OH 3.1Å
1168	H	87.6	Confident	92.9	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.009	8%	0.082	C	C	.	.			trans	-97.6	150.1	-166.2	-58.5	-68.1	0	0	0	111.9	Y1124 A1128 T1138 N1166 F1170 P1194 K1195	Y1124-H1168 AromaticContact CD1-CD2 3.88Å; Y1124-H1168 AromaticContact CD1-CE1 3.5Å; Y1124-H1168 VanDerWaalsContact CD1-CE1 3.5Å; Y1124-H1168 WeakPolarHBondContact CD1-CE1 3.13Å; Y1124-H1168 AromaticContact CD1-NE2 3.6Å; Y1124-H1168 VanDerWaalsContact CD1-NE2 3.31Å; Y1124-H1168 WeakPolarHBondContact CD1-NE2 3.24Å; Y1124-H1168 AromaticContact CE1-CE1 3.75Å; Y1124-H1168 AromaticContact CE1-NE2 3.99Å; A1128-H1168 PolarHBondContact O-CE1 3.32Å; T1138-H1168 HydrophobicContact CG2-CB 4.24Å; T1138-H1168 WeakPolarHBondContact CG2-ND1 3.31Å; T1138-H1168 WeakPolarHBondContact OG1-CA 3.2Å; T1138-H1168 VanDerWaalsContact OG1-CB 3.26Å; T1138-H1168 WeakPolarHBondContact OG1-CB 3.23Å; T1138-H1168 PolarHBondContact OG1-ND1 2.97Å; N1166-H1168 PolarHBondContact OD1-N 3Å; N1166-H1168 VanDerWaalsContact OD1-N 3.12Å; H1168-F1170 HydrophobicContact CB-CD1 4.43Å; H1168-F1170 HydrophobicContact CB-CD2 4.1Å; H1168-F1170 HydrophobicContact CB-CE1 3.98Å; H1168-F1170 HydrophobicContact CB-CE2 3.51Å; H1168-F1170 VanDerWaalsContact CB-CE2 3.46Å; H1168-F1170 HydrophobicContact CB-CG 4.45Å; H1168-F1170 HydrophobicContact CB-CZ 3.43Å; H1168-F1170 VanDerWaalsContact CB-CZ 3.41Å; H1168-F1170 AromaticContact CD2-CZ 3.9Å; H1168-F1170 AromaticContact CG-CZ 3.81Å; H1168-P1194 WeakPolarHBondContact O-CA 3.43Å; H1168-P1194 WeakPolarHBondContact O-CB 3.36Å; H1168-K1195 PolarHBondContact O-N 3.11Å
1169	L	89.4	Confident	92.9	Very high	37.4 Å²	37.4	15.9 Å²	15.9	20%	0.196	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	106.3	167.2	175.3	63.9	0	0	0	108	G1135 T1137 T1138 K1195 L1197	G1135-L1169 WeakPolarHBondContact O-CD2 3.28Å; T1137-L1169 WeakPolarHBondContact CB-O 3.35Å; T1137-L1169 HydrophobicContact CG2-CB 4.29Å; T1137-L1169 HydrophobicContact CG2-CD2 3.74Å; T1137-L1169 HydrophobicContact CG2-CG 4.08Å; T1138-L1169 PolarHBondContact N-O 2.9Å; T1138-L1169 PolarHBondContact OG1-N 2.94Å; L1169-K1195 WeakPolarHBondContact CA-O 3.46Å; L1169-K1195 HydrophobicContact CD1-CB 3.65Å; L1169-K1195 HydrophobicContact CD1-CD 4.39Å; L1169-K1195 HydrophobicContact CD1-CG 4.24Å; L1169-L1197 HydrophobicContact CD1-CB 4.42Å
1170	F	92.5	Very high	92.7	Very high	0.8 Å²	0.8	17.1 Å²	17.1	0%	0.004	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128	177.3	-63	-63.9	0	0	0	110.1	Y1124 T1138 I1139 F1161 V1163 H1168 L1173 K1195 L1196 L1197	Y1124-F1170 HydrophobicContact CD1-CZ 4.46Å; Y1124-F1170 HydrophobicContact CE1-CE1 4.42Å; Y1124-F1170 HydrophobicContact CE1-CZ 4.46Å; Y1124-F1170 HydrophobicContact CE2-CE1 4.49Å; T1138-F1170 HydrophobicContact CG2-CE1 4.22Å; T1138-F1170 VanDerWaalsContact OG1-CD1 3.27Å; T1138-F1170 WeakPolarHBondContact OG1-CD1 3.08Å; T1138-F1170 WeakPolarHBondContact OG1-CE1 3.4Å; I1139-F1170 HydrophobicContact CG2-CD1 3.55Å; I1139-F1170 VanDerWaalsContact CG2-CD1 3.5Å; I1139-F1170 HydrophobicContact CG2-CE1 3.74Å; F1161-F1170 HydrophobicContact CE1-CD1 4.43Å; F1161-F1170 HydrophobicContact CE1-CD2 4.19Å; F1161-F1170 HydrophobicContact CE1-CE1 4.12Å; F1161-F1170 AromaticContact CE1-CE2 3.75Å; F1161-F1170 HydrophobicContact CE1-CE2 3.75Å; F1161-F1170 HydrophobicContact CE1-CG 4.49Å; F1161-F1170 AromaticContact CE1-CZ 3.72Å; F1161-F1170 HydrophobicContact CE1-CZ 3.72Å; F1161-F1170 HydrophobicContact CZ-CD1 4.25Å; F1161-F1170 AromaticContact CZ-CE1 3.65Å; F1161-F1170 HydrophobicContact CZ-CE1 3.65Å; F1161-F1170 AromaticContact CZ-CE2 3.97Å; F1161-F1170 HydrophobicContact CZ-CE2 4.07Å; F1161-F1170 AromaticContact CZ-CZ 3.53Å; F1161-F1170 HydrophobicContact CZ-CZ 3.53Å; F1161-F1170 VanDerWaalsContact CZ-CZ 3.49Å; V1163-F1170 HydrophobicContact CG2-CE2 4.07Å; V1163-F1170 HydrophobicContact CG2-CZ 4.3Å; H1168-F1170 HydrophobicContact CB-CD1 4.43Å; H1168-F1170 HydrophobicContact CB-CD2 4.1Å; H1168-F1170 HydrophobicContact CB-CE1 3.98Å; H1168-F1170 HydrophobicContact CB-CE2 3.51Å; H1168-F1170 VanDerWaalsContact CB-CE2 3.46Å; H1168-F1170 HydrophobicContact CB-CG 4.45Å; H1168-F1170 HydrophobicContact CB-CZ 3.43Å; H1168-F1170 VanDerWaalsContact CB-CZ 3.41Å; H1168-F1170 AromaticContact CD2-CZ 3.9Å; H1168-F1170 AromaticContact CG-CZ 3.81Å; F1170-L1173 HydrophobicContact CB-CD1 3.51Å; F1170-L1173 VanDerWaalsContact CB-CD1 3.48Å; F1170-L1173 HydrophobicContact CB-CG 3.97Å; F1170-L1173 HydrophobicContact CD1-CD1 4.02Å; F1170-L1173 HydrophobicContact CD2-CD1 4.47Å; F1170-L1173 HydrophobicContact CG-CD1 3.79Å; F1170-K1195 PolarHBondContact N-O 3.06Å; F1170-K1195 VanDerWaalsContact N-O 3.11Å; F1170-L1196 HydrophobicContact CB-CD2 3.72Å; F1170-L1196 HydrophobicContact CD2-CD2 3.64Å; F1170-L1196 HydrophobicContact CG-CD2 4.14Å; F1170-L1197 PolarHBondContact O-N 3.25Å
1171	E	92.3	Very high	92.7	Very high	36.4 Å²	36.4	17.1 Å²	17.1	17%	0.17	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.7	-175.3	-155.8	-165.1	165.6	0	0	111.7	T1137 I1139 K1140 H1141 L1173 L1197 H1198	T1137-E1171 HydrophobicContact CG2-CB 4.16Å; T1137-E1171 VanDerWaalsContact CG2-OE2 3.29Å; T1137-E1171 WeakPolarHBondContact CG2-OE2 3.3Å; I1139-E1171 PolarHBondContact O-N 2.97Å; K1140-E1171 CarbonylContact C-O 3.54Å; K1140-E1171 WeakPolarHBondContact CA-O 3.2Å; K1140-E1171 HydrophobicContact CB-CB 3.99Å; K1140-E1171 WeakPolarHBondContact CB-O 3.29Å; K1140-E1171 HydrophobicContact CD-CB 4.31Å; K1140-E1171 WeakPolarHBondContact CD-OE2 3.38Å; K1140-E1171 WeakPolarHBondContact CE-OE2 3.45Å; K1140-E1171 HydrophobicContact CG-CB 4.06Å; K1140-E1171 IonicContact NZ-OE2 2.86Å; K1140-E1171 PolarHBondContact NZ-OE2 3.08Å; H1141-E1171 PolarHBondContact N-O 3.17Å; H1141-E1171 VanDerWaalsContact N-O 3.13Å; E1171-L1173 VanDerWaalsContact C-N 3.26Å; E1171-L1173 PolarHBondContact O-N 3.23Å; E1171-L1197 CarbonylContact C-O 3.52Å; E1171-L1197 VanDerWaalsContact CA-O 3.28Å; E1171-L1197 WeakPolarHBondContact CA-O 3.28Å; E1171-L1197 HydrophobicContact CG-CB 4.16Å; E1171-L1197 HydrophobicContact CG-CD2 4.03Å; E1171-L1197 HydrophobicContact CG-CG 4.17Å; E1171-H1198 IonicContact OE1-ND1 3.21Å
1172	H	94.4	Very high	92.7	Very high	63.6 Å²	63.6	17.1 Å²	17.1	29%	0.294	8%	0.083	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.2	38.1	177.3	-61.8	96.2	0	0	0	113.5	H1141 L1142 L1197 H1198	H1141-H1172 VanDerWaalsContact CA-O 3.27Å; H1141-H1172 WeakPolarHBondContact CA-O 3.34Å; H1141-H1172 HydrophobicContact CB-CB 4.3Å; H1141-H1172 AromaticContact CD2-CG 3.91Å; H1141-H1172 AromaticContact CE1-CG 3.82Å; H1141-H1172 AromaticContact CE1-ND1 3.75Å; H1141-H1172 PolarHBondContact N-O 2.89Å; H1141-H1172 AromaticContact NE2-CG 3.9Å; H1141-H1172 AromaticContact NE2-ND1 3.86Å; L1142-H1172 PolarHBondContact N-O 3.02Å; H1172-L1197 PolarHBondContact N-O 3.11Å; H1172-H1198 WeakPolarHBondContact CA-O 3.37Å; H1172-H1198 AromaticContact CE1-CG 3.93Å; H1172-H1198 AromaticContact CE1-ND1 3.76Å; H1172-H1198 AromaticContact NE2-CG 3.89Å; H1172-H1198 AromaticContact NE2-ND1 3.95Å
1173	L	95.2	Very high	92.7	Very high	3.6 Å²	3.6	16.5 Å²	16.5	2%	0.019	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	129	174	-102.2	157.8	0	0	0	110.3	I1139 L1142 F1161 F1170 E1171 V1175 V1183 C1199 Q1200 L1201	I1139-L1173 HydrophobicContact CG2-CD2 4.41Å; L1142-L1173 HydrophobicContact CB-CD1 4.32Å; L1142-L1173 HydrophobicContact CB-CD2 3.69Å; L1142-L1173 HydrophobicContact CD2-CD1 4.07Å; L1142-L1173 HydrophobicContact CD2-CD2 4.26Å; L1142-L1173 HydrophobicContact CG-CD1 4.47Å; L1142-L1173 HydrophobicContact CG-CD2 4.41Å; L1142-L1173 CarbonylContact O-C 3.57Å; L1142-L1173 WeakPolarHBondContact O-CA 3.17Å; F1161-L1173 HydrophobicContact CE1-CD1 4.34Å; F1170-L1173 HydrophobicContact CB-CD1 3.51Å; F1170-L1173 VanDerWaalsContact CB-CD1 3.48Å; F1170-L1173 HydrophobicContact CB-CG 3.97Å; F1170-L1173 HydrophobicContact CD1-CD1 4.02Å; F1170-L1173 HydrophobicContact CD2-CD1 4.47Å; F1170-L1173 HydrophobicContact CG-CD1 3.79Å; E1171-L1173 VanDerWaalsContact C-N 3.26Å; E1171-L1173 PolarHBondContact O-N 3.23Å; L1173-V1175 HydrophobicContact CD2-CG2 3.34Å; L1173-V1175 HydrophobicContact CG-CG2 3.84Å; L1173-V1183 HydrophobicContact CD2-CG2 4.1Å; L1173-C1199 HydrophobicContact CB-CB 4.3Å; L1173-C1199 CarbonylContact O-C 3.53Å; L1173-C1199 VanDerWaalsContact O-CA 3.23Å; L1173-C1199 WeakPolarHBondContact O-CA 3.38Å; L1173-C1199 WeakPolarHBondContact O-CB 3.38Å; L1173-Q1200 PolarHBondContact O-N 3.18Å; L1173-L1201 HydrophobicContact CD2-CD2 4.31Å
1174	T	96.9	Very high	92.8	Very high	24.6 Å²	24.6	16.7 Å²	16.7	15%	0.151	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	110.9	172.3	-56.6	0	0	0	0	109.5	L1142 I1143 I1144 Q1176 Q1200	L1142-T1174 PolarHBondContact O-N 3.04Å; I1143-T1174 CarbonylContact C-O 3.41Å; I1143-T1174 VanDerWaalsContact CA-O 3.28Å; I1143-T1174 WeakPolarHBondContact CA-O 3.16Å; I1144-T1174 PolarHBondContact N-O 3.06Å; T1174-Q1176 HydrophobicContact CG2-CB 4.42Å; T1174-Q1176 HydrophobicContact CG2-CG 4.35Å; T1174-Q1200 CarbonylContact C-O 3.55Å; T1174-Q1200 VanDerWaalsContact CA-O 3.3Å; T1174-Q1200 WeakPolarHBondContact CA-O 3.22Å; T1174-Q1200 HydrophobicContact CG2-CB 4.24Å
1175	V	97.1	Very high	92.9	Very high	0.4 Å²	0.4	16.7 Å²	16.7	0%	0.002	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	105.3	178.9	-176.8	0	0	0	0	108.1	I1144 A1160 L1173 N1178 V1183 Q1200 L1201 V1202 N1204	I1144-V1175 HydrophobicContact CB-CG2 4.41Å; I1144-V1175 HydrophobicContact CD1-CG2 4.49Å; I1144-V1175 WeakPolarHBondContact O-CA 3.37Å; A1160-V1175 HydrophobicContact CB-CG1 3.96Å; L1173-V1175 HydrophobicContact CD2-CG2 3.34Å; L1173-V1175 HydrophobicContact CG-CG2 3.84Å; V1175-N1178 VanDerWaalsContact CG1-ND2 3.31Å; V1175-N1178 WeakPolarHBondContact CG1-ND2 3.39Å; V1175-V1183 HydrophobicContact CB-CG2 4.49Å; V1175-V1183 HydrophobicContact CG2-CG2 4.05Å; V1175-Q1200 PolarHBondContact N-O 2.97Å; V1175-L1201 HydrophobicContact CB-CD2 3.64Å; V1175-L1201 HydrophobicContact CG2-CD2 3.78Å; V1175-L1201 WeakPolarHBondContact O-CA 3.36Å; V1175-V1202 PolarHBondContact O-N 3.05Å; V1175-N1204 PolarHBondContact O-ND2 3.01Å; V1175-N1204 VanDerWaalsContact O-ND2 3.15Å
1176	Q	96.1	Very high	93.2	Very high	40.8 Å²	40.8	16.7 Å²	16.7	19%	0.191	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	155	-170.4	69.9	176.1	12.9	0	0	115.3	I1144 E1145 T1174 N1178 V1202 R1203	I1144-Q1176 PolarHBondContact O-N 3.12Å; E1145-Q1176 WeakPolarHBondContact CA-O 3.3Å; E1145-Q1176 HydrophobicContact CB-CG 4.13Å; E1145-Q1176 VanDerWaalsContact CB-O 3.25Å; E1145-Q1176 WeakPolarHBondContact CB-O 3.3Å; E1145-Q1176 PolarHBondContact OE2-NE2 2.92Å; T1174-Q1176 HydrophobicContact CG2-CB 4.42Å; T1174-Q1176 HydrophobicContact CG2-CG 4.35Å; Q1176-N1178 PolarHBondContact N-ND2 3.02Å; Q1176-N1178 PolarHBondContact O-N 3Å; Q1176-N1178 VanDerWaalsContact O-N 3.13Å; Q1176-N1178 PolarHBondContact O-ND2 3.13Å; Q1176-N1178 VanDerWaalsContact O-ND2 3.08Å; Q1176-V1202 WeakPolarHBondContact CA-O 3.2Å; Q1176-V1202 HydrophobicContact CB-CB 4.45Å; Q1176-V1202 WeakPolarHBondContact CB-O 3.41Å; Q1176-R1203 VanDerWaalsContact OE1-NH2 3.08Å
1177	D	95	Very high	93.3	Very high	59.8 Å²	59.8	17 Å²	17	32%	0.32	8%	0.082	S	C	.	.	S	Bend	trans	54.2	36.2	172.4	-56	-53.9	0	0	0	113.3	K1146 V1202 R1203	K1146-D1177 WeakPolarHBondContact CA-O 3.36Å; K1146-D1177 PolarHBondContact N-O 3.1Å; D1177-V1202 PolarHBondContact N-O 3.17Å; D1177-R1203 WeakPolarHBondContact CA-O 3.29Å; D1177-R1203 PolarHBondContact N-O 3.19Å; D1177-R1203 WeakPolarHBondContact OD1-CB 3.34Å; D1177-R1203 IonicContact OD1-CZ 3.26Å; D1177-R1203 IonicContact OD1-NE 3.08Å; D1177-R1203 PolarHBondContact OD1-NE 3.05Å; D1177-R1203 IonicContact OD1-NH2 2.84Å; D1177-R1203 PolarHBondContact OD1-NH2 2.94Å; D1177-R1203 IonicContact OD2-CZ 3.29Å; D1177-R1203 IonicContact OD2-NE 3.53Å; D1177-R1203 IonicContact OD2-NH2 3.56Å; D1177-R1203 PolarHBondContact OD2-NH2 2.94Å
1178	N	95.2	Very high	93.5	Very high	4 Å²	4	16.4 Å²	16.4	2%	0.021	8%	0.08	C	C	.	.			trans	-92.5	145.9	178	-59.3	-71.6	0	0	0	111.1	I1144 E1145 K1146 A1147 A1160 V1175 Q1176 W1180 N1204 R1205	I1144-N1178 PolarHBondContact O-ND2 3.06Å; E1145-N1178 VanDerWaalsContact C-OD1 3.28Å; E1145-N1178 WeakPolarHBondContact CA-OD1 3.26Å; K1146-N1178 PolarHBondContact N-OD1 2.92Å; K1146-N1178 VanDerWaalsContact N-OD1 3.13Å; A1147-N1178 WeakPolarHBondContact CB-OD1 3.27Å; A1147-N1178 PolarHBondContact N-OD1 3Å; A1147-N1178 CarbonylContact O-C 3.55Å; A1147-N1178 WeakPolarHBondContact O-CA 3.29Å; A1147-N1178 WeakPolarHBondContact O-CB 3.43Å; A1160-N1178 HydrophobicContact CB-CB 3.88Å; A1160-N1178 VanDerWaalsContact CB-CG 3.42Å; A1160-N1178 WeakPolarHBondContact CB-OD1 3.28Å; V1175-N1178 VanDerWaalsContact CG1-ND2 3.31Å; V1175-N1178 WeakPolarHBondContact CG1-ND2 3.39Å; Q1176-N1178 PolarHBondContact N-ND2 3.02Å; Q1176-N1178 PolarHBondContact O-N 3Å; Q1176-N1178 VanDerWaalsContact O-N 3.13Å; Q1176-N1178 PolarHBondContact O-ND2 3.13Å; Q1176-N1178 VanDerWaalsContact O-ND2 3.08Å; N1178-W1180 VanDerWaalsContact C-N 3.28Å; N1178-W1180 PolarHBondContact O-N 3.03Å; N1178-N1204 VanDerWaalsContact CB-OD1 3.31Å; N1178-N1204 WeakPolarHBondContact CB-OD1 3.26Å; N1178-N1204 PolarHBondContact ND2-OD1 3.23Å; N1178-R1205 PolarHBondContact O-N 3.11Å
1179	F	90.5	Very high	93.3	Very high	21.4 Å²	21.4	16.6 Å²	16.6	9%	0.094	8%	0.081	C	C	.	.	S	Bend	trans	-73.6	-12.1	-175.4	-175.5	-100.2	0	0	0	113.9	D1056 P1057 V1115 M1118 A1147 L1150 F1157 R1205	D1056-F1179 HydrophobicContact CB-CZ 4.2Å; P1057-F1179 HydrophobicContact CG-CE1 4.43Å; V1115-F1179 HydrophobicContact CB-CE2 3.96Å; V1115-F1179 HydrophobicContact CB-CZ 4.04Å; V1115-F1179 HydrophobicContact CG1-CD1 4.37Å; V1115-F1179 HydrophobicContact CG1-CD2 3.54Å; V1115-F1179 HydrophobicContact CG1-CE1 4.15Å; V1115-F1179 HydrophobicContact CG1-CE2 3.65Å; V1115-F1179 HydrophobicContact CG1-CG 4.24Å; V1115-F1179 HydrophobicContact CG1-CZ 3.83Å; V1115-F1179 VanDerWaalsContact CG1-CZ 3.45Å; V1115-F1179 HydrophobicContact CG2-CD2 4.46Å; V1115-F1179 HydrophobicContact CG2-CE1 4.28Å; V1115-F1179 HydrophobicContact CG2-CE2 3.71Å; V1115-F1179 HydrophobicContact CG2-CZ 3.69Å; M1118-F1179 HydrophobicContact CB-CB 4.47Å; M1118-F1179 HydrophobicContact CE-CB 4.25Å; M1118-F1179 HydrophobicContact CE-CD2 4.19Å; M1118-F1179 HydrophobicContact CE-CG 4.33Å; M1118-F1179 HydrophobicContact CG-CB 3.72Å; M1118-F1179 HydrophobicContact CG-CD1 4.18Å; M1118-F1179 HydrophobicContact CG-CD2 4.43Å; M1118-F1179 HydrophobicContact CG-CG 4.16Å; A1147-F1179 PolarHBondContact O-N 3.06Å; L1150-F1179 HydrophobicContact CB-CE1 4.24Å; L1150-F1179 HydrophobicContact CD2-CE1 4.05Å; F1157-F1179 AromaticContact CD1-CD1 3.88Å; F1157-F1179 HydrophobicContact CD1-CD1 4.03Å; F1157-F1179 AromaticContact CD1-CE1 3.68Å; F1157-F1179 HydrophobicContact CD1-CE1 3.89Å; F1157-F1179 AromaticContact CE1-CD1 3.93Å; F1157-F1179 HydrophobicContact CE1-CD1 3.93Å; F1157-F1179 AromaticContact CE1-CE1 3.4Å; F1157-F1179 HydrophobicContact CE1-CE1 3.4Å; F1157-F1179 VanDerWaalsContact CE1-CE1 3.41Å; F1157-F1179 HydrophobicContact CE1-CZ 4.37Å; F1157-F1179 HydrophobicContact CE2-CE1 4.32Å; F1157-F1179 HydrophobicContact CG-CE1 4.24Å; F1157-F1179 HydrophobicContact CZ-CD1 4.39Å; F1157-F1179 AromaticContact CZ-CE1 3.69Å; F1157-F1179 HydrophobicContact CZ-CE1 3.95Å; F1157-F1179 HydrophobicContact CZ-CZ 4.37Å; F1179-R1205 VanDerWaalsContact CD2-CD 3.41Å; F1179-R1205 VanDerWaalsContact CE1-NH1 3.33Å; F1179-R1205 VanDerWaalsContact CE2-CZ 3.49Å; F1179-R1205 VanDerWaalsContact CZ-CZ 3.46Å; F1179-R1205 VanDerWaalsContact O-CB 3.26Å; F1179-R1205 WeakPolarHBondContact O-CB 3.35Å; F1179-R1205 VanDerWaalsContact O-CD 3.3Å; F1179-R1205 WeakPolarHBondContact O-CD 3.32Å
1180	W	92	Very high	92.7	Very high	28.6 Å²	28.6	15.2 Å²	15.2	11%	0.108	8%	0.075	C	C	.	.	S	Bend	trans	-134.1	-133.9	178.8	-157.3	59.3	0	0	0	111.9	P1057 E1058 F1157 A1158 A1159 N1178 R1205 R1206	P1057-W1180 HydrophobicContact CG-CZ3 4.19Å; E1058-W1180 PolarHBondContact OE1-NE1 3.12Å; F1157-W1180 HydrophobicContact CB-CB 4.33Å; F1157-W1180 HydrophobicContact CB-CD2 3.64Å; F1157-W1180 VanDerWaalsContact CB-CD2 3.5Å; F1157-W1180 HydrophobicContact CB-CE3 4.12Å; F1157-W1180 HydrophobicContact CB-CG 3.81Å; F1157-W1180 HydrophobicContact CB-CH2 4.12Å; F1157-W1180 HydrophobicContact CB-CZ2 4.11Å; F1157-W1180 HydrophobicContact CB-CZ3 4.11Å; F1157-W1180 HydrophobicContact CD1-CB 4.25Å; F1157-W1180 AromaticContact CD1-CD1 3.93Å; F1157-W1180 HydrophobicContact CD1-CE3 4.28Å; F1157-W1180 HydrophobicContact CD1-CG 4.09Å; F1157-W1180 HydrophobicContact CD1-CZ3 4.38Å; F1157-W1180 HydrophobicContact CD2-CH2 4.05Å; F1157-W1180 HydrophobicContact CD2-CZ3 4.09Å; F1157-W1180 AromaticContact CG-CD1 3.85Å; F1157-W1180 HydrophobicContact CG-CD2 4.29Å; F1157-W1180 AromaticContact CG-CE3 3.99Å; F1157-W1180 HydrophobicContact CG-CE3 3.99Å; F1157-W1180 HydrophobicContact CG-CG 4.25Å; F1157-W1180 HydrophobicContact CG-CH2 4.1Å; F1157-W1180 HydrophobicContact CG-CZ2 4.49Å; F1157-W1180 AromaticContact CG-CZ3 3.87Å; F1157-W1180 HydrophobicContact CG-CZ3 3.87Å; F1157-W1180 AromaticContact CG-NE1 3.86Å; F1157-W1180 VanDerWaalsContact O-CH2 3.29Å; F1157-W1180 WeakPolarHBondContact O-CH2 3.41Å; F1157-W1180 WeakPolarHBondContact O-CZ3 3.12Å; A1158-W1180 VanDerWaalsContact C-CE3 3.42Å; A1158-W1180 WeakPolarHBondContact O-CB 3.33Å; A1158-W1180 VanDerWaalsContact O-CE3 3.31Å; A1159-W1180 HydrophobicContact CB-CE3 4.26Å; A1159-W1180 HydrophobicContact CB-CZ3 4.39Å; A1159-W1180 VanDerWaalsContact N-CE3 3.3Å; N1178-W1180 VanDerWaalsContact C-N 3.28Å; N1178-W1180 PolarHBondContact O-N 3.03Å; W1180-R1205 PolarHBondContact O-N 3.21Å; W1180-R1206 VanDerWaalsContact CZ2-NH1 3.28Å; W1180-R1206 VanDerWaalsContact NE1-CD 3.27Å; W1180-R1206 VanDerWaalsContact NE1-NE 3.18Å; W1180-R1206 WeakPolarHBondContact O-CB 3.42Å; W1180-R1206 PolarHBondContact O-N 2.92Å; W1180-R1206 VanDerWaalsContact O-N 3.07Å
1181	T	94.9	Very high	91.9	Very high	0.4 Å²	0.4	16.6 Å²	16.6	0%	0.002	8%	0.082	C	C	.	.			trans	-76.4	138.4	173.7	-61.1	0	0	0	0	110	A1159 A1160 V1183 D1184 H1207 R1210	A1159-T1181 CarbonylContact C-O 3.51Å; A1159-T1181 VanDerWaalsContact CA-O 3.25Å; A1159-T1181 WeakPolarHBondContact CA-O 3.31Å; A1159-T1181 HydrophobicContact CB-CG2 4.28Å; A1159-T1181 WeakPolarHBondContact CB-O 3.29Å; A1160-T1181 PolarHBondContact N-O 3.18Å; T1181-V1183 VanDerWaalsContact CG2-O 3.29Å; T1181-V1183 WeakPolarHBondContact CG2-O 3.23Å; T1181-D1184 HydrophobicContact CG2-CB 4.45Å; T1181-H1207 WeakPolarHBondContact CA-O 3.44Å; T1181-H1207 HydrophobicContact CG2-CB 4.17Å; T1181-R1210 HydrophobicContact CG2-CB 3.85Å
1182	G	96.2	Very high	91.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-64.9	-74.1	174.5	0	0	0	0	0	111.4	A1160 F1161 H1207 G1208	A1160-G1182 WeakPolarHBondContact CB-O 3.43Å; A1160-G1182 PolarHBondContact N-O 3.09Å; F1161-G1182 PolarHBondContact N-O 2.91Å; G1182-H1207 PolarHBondContact N-O 3.06Å; G1182-G1208 WeakPolarHBondContact CA-O 3.26Å
1183	V	96.9	Very high	90.4	Very high	2.6 Å²	2.6	19.4 Å²	19.4	2%	0.016	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134.2	179.6	178.3	0	0	0	0	110.7	F1161 L1173 V1175 T1181 I1185 L1201 G1208 L1209 R1210	F1161-V1183 HydrophobicContact CB-CG2 4.14Å; F1161-V1183 HydrophobicContact CD1-CG1 4.08Å; F1161-V1183 HydrophobicContact CD1-CG2 4.24Å; F1161-V1183 CarbonylContact O-C 3.53Å; F1161-V1183 VanDerWaalsContact O-CA 3.29Å; F1161-V1183 WeakPolarHBondContact O-CA 3.37Å; L1173-V1183 HydrophobicContact CD2-CG2 4.1Å; V1175-V1183 HydrophobicContact CB-CG2 4.49Å; V1175-V1183 HydrophobicContact CG2-CG2 4.05Å; T1181-V1183 VanDerWaalsContact CG2-O 3.29Å; T1181-V1183 WeakPolarHBondContact CG2-O 3.23Å; V1183-I1185 HydrophobicContact CG1-CD1 4.28Å; V1183-I1185 HydrophobicContact CG1-CG1 4.07Å; V1183-L1201 HydrophobicContact CB-CD1 4.32Å; V1183-L1201 HydrophobicContact CG2-CD1 4.14Å; V1183-L1201 HydrophobicContact CG2-CD2 3.61Å; V1183-G1208 PolarHBondContact N-O 3.13Å; V1183-L1209 HydrophobicContact CB-CD1 3.66Å; V1183-L1209 HydrophobicContact CG1-CD1 3.49Å; V1183-L1209 VanDerWaalsContact CG1-CD1 3.48Å; V1183-L1209 CarbonylContact O-C 3.51Å; V1183-L1209 WeakPolarHBondContact O-CA 3.31Å; V1183-R1210 PolarHBondContact O-N 2.94Å
1184	D	95.8	Very high	90.1	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.016	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	115.8	174.5	-171.4	27.2	0	0	0	110.8	A1159 F1161 T1162 V1163 T1181 R1210 R1212	A1159-D1184 HydrophobicContact CB-CB 3.59Å; F1161-D1184 PolarHBondContact O-N 3.12Å; T1162-D1184 CarbonylContact C-O 3.55Å; T1162-D1184 WeakPolarHBondContact CA-O 3.43Å; T1162-D1184 HydrophobicContact CG2-CB 4.25Å; V1163-D1184 PolarHBondContact N-O 3.25Å; T1181-D1184 HydrophobicContact CG2-CB 4.45Å; D1184-R1210 WeakPolarHBondContact CA-O 3.23Å; D1184-R1210 HydrophobicContact CB-CB 4.45Å; D1184-R1210 VanDerWaalsContact CG-NE 3.29Å; D1184-R1210 VanDerWaalsContact CG-NH2 3.31Å; D1184-R1210 WeakPolarHBondContact OD1-CB 3.39Å; D1184-R1210 VanDerWaalsContact OD1-CD 3.31Å; D1184-R1210 WeakPolarHBondContact OD1-CD 3.36Å; D1184-R1210 WeakPolarHBondContact OD1-CG 3.16Å; D1184-R1210 IonicContact OD1-CZ 3.42Å; D1184-R1210 IonicContact OD1-NE 2.91Å; D1184-R1210 PolarHBondContact OD1-NE 3.1Å; D1184-R1210 IonicContact OD1-NH2 3.11Å; D1184-R1210 PolarHBondContact OD1-NH2 2.93Å; D1184-R1210 IonicContact OD2-CZ 3.17Å; D1184-R1210 IonicContact OD2-NE 3.04Å; D1184-R1210 PolarHBondContact OD2-NE 2.7Å; D1184-R1210 IonicContact OD2-NH2 3.4Å; D1184-R1210 PolarHBondContact OD2-NH2 2.87Å; D1184-R1212 IonicContact OD1-CZ 3.88Å; D1184-R1212 IonicContact OD1-NE 3.48Å; D1184-R1212 PolarHBondContact OD1-NE 3.41Å; D1184-R1212 IonicContact OD1-NH1 2.82Å; D1184-R1212 PolarHBondContact OD1-NH1 2.95Å; D1184-R1212 IonicContact OD1-NH2 3.44Å; D1184-R1212 IonicContact OD2-CZ 3.26Å; D1184-R1212 IonicContact OD2-NE 3.5Å; D1184-R1212 IonicContact OD2-NH1 3.3Å; D1184-R1212 PolarHBondContact OD2-NH1 2.79Å; D1184-R1212 IonicContact OD2-NH2 3.07Å; D1184-R1212 PolarHBondContact OD2-NH2 3.34Å
1185	I	95.1	Very high	89.8	Confident	0.8 Å²	0.8	22 Å²	22	0%	0.004	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.5	179	-62.4	168	0	0	0	108.8	V1163 N1166 V1183 Y1187 T1188 L1209 R1210 L1211 R1212 L1216	V1163-I1185 HydrophobicContact CB-CG1 4.29Å; V1163-I1185 HydrophobicContact CG2-CG1 4.48Å; N1166-I1185 HydrophobicContact CB-CG2 3.78Å; V1183-I1185 HydrophobicContact CG1-CD1 4.28Å; V1183-I1185 HydrophobicContact CG1-CG1 4.07Å; I1185-Y1187 WeakPolarHBondContact CG2-O 3.45Å; I1185-T1188 WeakPolarHBondContact CG2-OG1 3.34Å; I1185-L1209 HydrophobicContact CD1-CD1 4.15Å; I1185-L1209 HydrophobicContact CG1-CD1 4.5Å; I1185-R1210 PolarHBondContact N-O 3.1Å; I1185-L1211 HydrophobicContact CB-CD2 3.94Å; I1185-L1211 HydrophobicContact CD1-CD2 3.9Å; I1185-L1211 HydrophobicContact CG1-CD2 4.35Å; I1185-R1212 PolarHBondContact O-N 3.18Å; I1185-L1216 HydrophobicContact CD1-CD1 4.42Å; I1185-L1216 HydrophobicContact CD1-CD2 3.59Å
1186	I	92.8	Very high	89.6	Confident	0.2 Å²	0.2	22.1 Å²	22.1	0%	0.001	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-71	-176.9	-52.6	177	0	0	0	109.8	T1162 V1163 D1164 S1213 I1237 M1241 V1245	T1162-I1186 HydrophobicContact CG2-CD1 4.35Å; V1163-I1186 PolarHBondContact O-N 2.95Å; D1164-I1186 HydrophobicContact CB-CD1 4.45Å; D1164-I1186 WeakPolarHBondContact O-CB 3.42Å; D1164-I1186 WeakPolarHBondContact OD1-CD1 3.3Å; I1186-S1213 WeakPolarHBondContact O-CB 3.31Å; I1186-S1213 PolarHBondContact O-OG 3.02Å; I1186-I1237 HydrophobicContact CG2-CD1 3.52Å; I1186-I1237 VanDerWaalsContact CG2-CD1 3.47Å; I1186-I1237 HydrophobicContact CG2-CG1 4.09Å; I1186-M1241 HydrophobicContact CD1-CE 3.69Å; I1186-M1241 HydrophobicContact CD1-CG 3.96Å; I1186-M1241 HydrophobicContact CD1-SD 4.03Å; I1186-M1241 VanDerWaalsContact CD1-SD 3.55Å; I1186-M1241 HydrophobicContact CG1-CE 4.33Å; I1186-M1241 HydrophobicContact CG1-SD 4.01Å; I1186-V1245 HydrophobicContact CD1-CG2 3.99Å
1187	Y	89.7	Confident	89.6	Confident	7.8 Å²	7.8	21.8 Å²	21.8	3%	0.031	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	146.5	175.3	-62.3	-78.2	0	0	0	110.3	D1164 W1165 N1166 I1185 S1213 I1237 Q1242 V1245 I1322 L1424	D1164-Y1187 WeakPolarHBondContact O-CB 3.34Å; D1164-Y1187 WeakPolarHBondContact O-CD2 3.45Å; D1164-Y1187 PolarHBondContact O-N 2.94Å; W1165-Y1187 CarbonylContact C-O 3.54Å; W1165-Y1187 WeakPolarHBondContact CA-O 3.28Å; W1165-Y1187 HydrophobicContact CD2-CG 4.4Å; W1165-Y1187 VanDerWaalsContact CE3-CB 3.47Å; W1165-Y1187 HydrophobicContact CE3-CD1 4.45Å; W1165-Y1187 AromaticContact CE3-CD2 3.85Å; W1165-Y1187 HydrophobicContact CE3-CD2 3.85Å; W1165-Y1187 AromaticContact CE3-CG 3.7Å; W1165-Y1187 HydrophobicContact CE3-CG 3.7Å; W1165-Y1187 HydrophobicContact CH2-CG 4.44Å; W1165-Y1187 AromaticContact CZ3-CD1 3.98Å; W1165-Y1187 HydrophobicContact CZ3-CD1 4.18Å; W1165-Y1187 AromaticContact CZ3-CD2 3.88Å; W1165-Y1187 HydrophobicContact CZ3-CD2 4.06Å; W1165-Y1187 AromaticContact CZ3-CG 3.76Å; W1165-Y1187 HydrophobicContact CZ3-CG 3.76Å; N1166-Y1187 WeakPolarHBondContact CB-O 3.1Å; N1166-Y1187 PolarHBondContact N-O 3.19Å; I1185-Y1187 WeakPolarHBondContact CG2-O 3.45Å; Y1187-S1213 VanDerWaalsContact C-OG 3.31Å; Y1187-S1213 VanDerWaalsContact CA-OG 3.32Å; Y1187-S1213 WeakPolarHBondContact CA-OG 3.4Å; Y1187-I1237 HydrophobicContact CE1-CD1 3.83Å; Y1187-I1237 HydrophobicContact CE2-CD1 3.76Å; Y1187-I1237 VanDerWaalsContact OH-CD1 3.26Å; Y1187-I1237 WeakPolarHBondContact OH-CD1 3.4Å; Y1187-Q1242 PolarHBondContact OH-OE1 2.48Å; Y1187-V1245 HydrophobicContact CD2-CG1 4.34Å; Y1187-V1245 HydrophobicContact CE2-CG1 4.27Å; Y1187-I1322 PolarHBondContact OH-O 3.06Å; Y1187-L1424 HydrophobicContact CD1-CD1 4.22Å; Y1187-L1424 HydrophobicContact CE1-CD1 3.89Å; Y1187-L1424 HydrophobicContact CE1-CD2 3.98Å
1188	T	88.3	Confident	89.6	Confident	5.6 Å²	5.6	22.2 Å²	22.2	3%	0.034	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134	175.8	-55.8	0	0	0	0	107.6	N1166 I1185 P1190 P1194 S1213 V1214 G1215 L1216	N1166-T1188 HydrophobicContact CB-CG2 4.49Å; I1185-T1188 WeakPolarHBondContact CG2-OG1 3.34Å; T1188-P1190 WeakPolarHBondContact O-CD 3.31Å; T1188-P1194 HydrophobicContact CG2-CG 3.42Å; T1188-S1213 PolarHBondContact N-OG 2.98Å; T1188-S1213 PolarHBondContact OG1-OG 3.28Å; T1188-S1213 VanDerWaalsContact OG1-OG 3.08Å; T1188-V1214 WeakPolarHBondContact CB-O 3.25Å; T1188-G1215 VanDerWaalsContact CG2-C 3.45Å; T1188-G1215 VanDerWaalsContact CG2-O 3.3Å; T1188-G1215 WeakPolarHBondContact CG2-O 3.32Å; T1188-L1216 HydrophobicContact CG2-CB 4.29Å
1189	D	83.3	Confident	89.7	Confident	6.8 Å²	6.8	22.1 Å²	22.1	4%	0.036	10%	0.101	C	C	.	.			trans	-68.9	131	-178.4	-167.9	-87.4	0	0	0	110.8	W1165 N1166 Y1167 I1191 K1192 R1280	W1165-D1189 PolarHBondContact NE1-OD2 2.94Å; N1166-D1189 VanDerWaalsContact O-CB 3.29Å; N1166-D1189 WeakPolarHBondContact O-CB 3.3Å; N1166-D1189 PolarHBondContact O-N 3.01Å; N1166-D1189 VanDerWaalsContact O-N 3.1Å; Y1167-D1189 HydrophobicContact CD1-CB 4.05Å; Y1167-D1189 HydrophobicContact CE1-CB 3.95Å; Y1167-D1189 VanDerWaalsContact CE1-OD2 3.23Å; Y1167-D1189 WeakPolarHBondContact CE1-OD2 3.45Å; Y1167-D1189 HydrophobicContact CG-CB 4.46Å; D1189-I1191 VanDerWaalsContact C-N 3.3Å; D1189-I1191 PolarHBondContact O-N 3.16Å; D1189-I1191 PolarHBondContact OD1-N 3.04Å; D1189-I1191 VanDerWaalsContact OD1-N 3.13Å; D1189-K1192 HydrophobicContact CB-CB 4.31Å; D1189-K1192 WeakPolarHBondContact OD1-CB 3.36Å; D1189-K1192 WeakPolarHBondContact OD1-CG 3.24Å; D1189-K1192 PolarHBondContact OD1-N 3.13Å; D1189-R1280 IonicContact OD1-CZ 3.01Å; D1189-R1280 IonicContact OD1-NH2 3.69Å; D1189-R1280 PolarHBondContact OD1-NH2 2.75Å; D1189-R1280 IonicContact OD2-CZ 3.04Å; D1189-R1280 VanDerWaalsContact OD2-CZ 3.31Å; D1189-R1280 IonicContact OD2-NH1 3.42Å; D1189-R1280 PolarHBondContact OD2-NH1 3.06Å; D1189-R1280 IonicContact OD2-NH2 3.24Å; D1189-R1280 PolarHBondContact OD2-NH2 3.02Å
1190	P	75.9	Confident	90	Very high	7.8 Å²	7.8	25.5 Å²	25.5	5%	0.051	12%	0.118	C	C	.	.	S	Bend	trans	-73.5	-17.9	-174.5	25.4	-31.9	0	0	0	114.5	T1188 P1355 F1381 L1389 D1390	T1188-P1190 WeakPolarHBondContact O-CD 3.31Å; P1190-P1355 HydrophobicContact CB-CB 4.38Å; P1190-P1355 HydrophobicContact CB-CG 4.27Å; P1190-P1355 HydrophobicContact CG-CB 4.46Å; P1190-F1381 HydrophobicContact CB-CZ 4.09Å; P1190-F1381 HydrophobicContact CG-CE1 4.05Å; P1190-F1381 HydrophobicContact CG-CE2 4.21Å; P1190-F1381 HydrophobicContact CG-CZ 3.62Å; P1190-F1381 VanDerWaalsContact CG-CZ 3.47Å; P1190-L1389 HydrophobicContact CB-CD2 3.61Å; P1190-L1389 VanDerWaalsContact CB-CD2 3.45Å; P1190-L1389 HydrophobicContact CG-CD2 4.39Å; P1190-D1390 PolarHBondContact O-N 2.97Å
1191	I	75.5	Confident	90.2	Very high	30.2 Å²	30.2	24.2 Å²	24.2	16%	0.155	11%	0.113	C	C	.	.	S	Bend	trans	-113.5	-40.8	-173.8	-52.6	166.3	0	0	0	112.2	D1189 K1193 F1381 H1382 I1383	D1189-I1191 VanDerWaalsContact C-N 3.3Å; D1189-I1191 PolarHBondContact O-N 3.16Å; D1189-I1191 PolarHBondContact OD1-N 3.04Å; D1189-I1191 VanDerWaalsContact OD1-N 3.13Å; I1191-K1193 VanDerWaalsContact O-CG 3.22Å; I1191-K1193 WeakPolarHBondContact O-CG 3.34Å; I1191-K1193 PolarHBondContact O-N 3.06Å; I1191-K1193 VanDerWaalsContact O-N 3.08Å; I1191-F1381 HydrophobicContact CD1-CB 4.16Å; I1191-F1381 HydrophobicContact CD1-CD2 3.07Å; I1191-F1381 HydrophobicContact CD1-CE2 3.37Å; I1191-F1381 VanDerWaalsContact CD1-CE2 3.41Å; I1191-F1381 HydrophobicContact CD1-CG 3.93Å; I1191-F1381 HydrophobicContact CD1-CZ 4.31Å; I1191-F1381 HydrophobicContact CG1-CD2 3.95Å; I1191-F1381 HydrophobicContact CG1-CE2 3.72Å; I1191-H1382 WeakPolarHBondContact CD1-O 3.35Å; I1191-I1383 HydrophobicContact CD1-CG1 4.02Å; I1191-I1383 HydrophobicContact CG1-CG1 4.41Å
1192	K	76.6	Confident	90.3	Very high	82.8 Å²	82.8	25.2 Å²	25.2	36%	0.36	12%	0.119	S	C	.	.	S	Bend	trans	-71	-2.4	-170.4	-70.2	-85.1	-179.2	-179.6	0	114.5	T1134 Y1167 D1189	T1134-K1192 HydrophobicContact CG2-CD 4.43Å; T1134-K1192 PolarHBondContact OG1-NZ 3.12Å; Y1167-K1192 HydrophobicContact CD1-CG 4.25Å; Y1167-K1192 HydrophobicContact CG-CD 4.35Å; D1189-K1192 HydrophobicContact CB-CB 4.31Å; D1189-K1192 WeakPolarHBondContact OD1-CB 3.36Å; D1189-K1192 WeakPolarHBondContact OD1-CG 3.24Å; D1189-K1192 PolarHBondContact OD1-N 3.13Å
1193	K	79.2	Confident	90.2	Very high	75.8 Å²	75.8	30.7 Å²	30.7	33%	0.33	14%	0.139	S	C	.	.			trans	45.5	60.2	176.7	-52.8	-164.3	175.8	-169.3	0	112.6	I1191 K1195 Y1388 D1390	I1191-K1193 VanDerWaalsContact O-CG 3.22Å; I1191-K1193 WeakPolarHBondContact O-CG 3.34Å; I1191-K1193 PolarHBondContact O-N 3.06Å; I1191-K1193 VanDerWaalsContact O-N 3.08Å; K1193-K1195 VanDerWaalsContact O-CG 3.31Å; K1193-K1195 WeakPolarHBondContact O-CG 3.35Å; K1193-Y1388 VanDerWaalsContact NZ-CZ 3.3Å; K1193-Y1388 PolarHBondContact NZ-OH 3.03Å; K1193-D1390 VanDerWaalsContact CD-OD2 3.25Å; K1193-D1390 WeakPolarHBondContact CD-OD2 3.35Å; K1193-D1390 WeakPolarHBondContact CE-OD2 3.3Å; K1193-D1390 VanDerWaalsContact CG-OD2 3.29Å; K1193-D1390 WeakPolarHBondContact CG-OD2 3.29Å; K1193-D1390 IonicContact NZ-OD1 3.61Å; K1193-D1390 PolarHBondContact NZ-OD1 3.27Å; K1193-D1390 IonicContact NZ-OD2 3.22Å; K1193-D1390 PolarHBondContact NZ-OD2 2.74Å
1194	P	88.4	Confident	90.1	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.019	14%	0.138	C	C	.	.			trans	-61	151.1	-176.6	28	-36.2	0	0	0	111.8	N1166 H1168 T1188 G1215 L1216 T1217	N1166-P1194 HydrophobicContact CB-CB 4.45Å; N1166-P1194 HydrophobicContact CB-CG 4.47Å; N1166-P1194 WeakPolarHBondContact O-CG 3.39Å; H1168-P1194 WeakPolarHBondContact O-CA 3.43Å; H1168-P1194 WeakPolarHBondContact O-CB 3.36Å; T1188-P1194 HydrophobicContact CG2-CG 3.42Å; P1194-G1215 WeakPolarHBondContact CD-O 3.4Å; P1194-G1215 WeakPolarHBondContact CG-O 3.23Å; P1194-L1216 HydrophobicContact CB-CD1 4.3Å; P1194-L1216 HydrophobicContact CG-CD1 4.31Å; P1194-T1217 PolarHBondContact O-N 3.23Å; P1194-T1217 VanDerWaalsContact O-N 3.15Å
1195	K	91.5	Very high	89.7	Confident	79.8 Å²	79.8	31.7 Å²	31.7	35%	0.347	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	147.6	-179.2	-39	-173.1	173.7	177.7	0	113.5	H1168 L1169 F1170 K1193 T1217	H1168-K1195 PolarHBondContact O-N 3.11Å; L1169-K1195 WeakPolarHBondContact CA-O 3.46Å; L1169-K1195 HydrophobicContact CD1-CB 3.65Å; L1169-K1195 HydrophobicContact CD1-CD 4.39Å; L1169-K1195 HydrophobicContact CD1-CG 4.24Å; F1170-K1195 PolarHBondContact N-O 3.06Å; F1170-K1195 VanDerWaalsContact N-O 3.11Å; K1193-K1195 VanDerWaalsContact O-CG 3.31Å; K1193-K1195 WeakPolarHBondContact O-CG 3.35Å; K1195-T1217 CarbonylContact C-O 3.5Å; K1195-T1217 WeakPolarHBondContact CA-O 3.41Å; K1195-T1217 WeakPolarHBondContact CB-O 3.49Å; K1195-T1217 HydrophobicContact CD-CG2 4.47Å
1196	L	93.8	Very high	89.5	Confident	3 Å²	3	34.6 Å²	34.6	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116	161.9	-59.4	-175.3	0	0	0	108.1	F1170 L1209 L1216 T1217 L1218 E1219 V1221	F1170-L1196 HydrophobicContact CB-CD2 3.72Å; F1170-L1196 HydrophobicContact CD2-CD2 3.64Å; F1170-L1196 HydrophobicContact CG-CD2 4.14Å; L1196-L1209 HydrophobicContact CD1-CD1 4.44Å; L1196-L1209 HydrophobicContact CD1-CD2 4.35Å; L1196-L1216 HydrophobicContact CD1-CD2 4.45Å; L1196-L1216 HydrophobicContact CG-CD1 4.47Å; L1196-T1217 PolarHBondContact N-O 2.84Å; L1196-L1218 HydrophobicContact CB-CD2 3.7Å; L1196-L1218 HydrophobicContact CB-CG 4.49Å; L1196-L1218 HydrophobicContact CD1-CD2 3.59Å; L1196-L1218 HydrophobicContact CD1-CG 4.47Å; L1196-L1218 HydrophobicContact CG-CD2 3.78Å; L1196-E1219 PolarHBondContact O-N 3.27Å; L1196-V1221 HydrophobicContact CB-CG2 4.17Å; L1196-V1221 WeakPolarHBondContact O-CG2 3.31Å
1197	L	94.3	Very high	89.5	Confident	33.6 Å²	33.6	35.1 Å²	35.1	18%	0.176	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.7	-173.3	-177.7	66.4	0	0	0	110.7	L1169 F1170 E1171 H1172 C1199 E1219	L1169-L1197 HydrophobicContact CD1-CB 4.42Å; F1170-L1197 PolarHBondContact O-N 3.25Å; E1171-L1197 CarbonylContact C-O 3.52Å; E1171-L1197 VanDerWaalsContact CA-O 3.28Å; E1171-L1197 WeakPolarHBondContact CA-O 3.28Å; E1171-L1197 HydrophobicContact CG-CB 4.16Å; E1171-L1197 HydrophobicContact CG-CD2 4.03Å; E1171-L1197 HydrophobicContact CG-CG 4.17Å; H1172-L1197 PolarHBondContact N-O 3.11Å; L1197-C1199 VanDerWaalsContact C-N 3.26Å; L1197-C1199 PolarHBondContact O-N 3.28Å; L1197-C1199 PolarHBondContact O-SG 3.16Å; L1197-C1199 VanDerWaalsContact O-SG 3.41Å; L1197-E1219 WeakPolarHBondContact CA-O 3.35Å; L1197-E1219 HydrophobicContact CD1-CB 3.75Å; L1197-E1219 HydrophobicContact CD1-CG 3.76Å
1198	H	96.1	Very high	89.8	Confident	70 Å²	70	34.7 Å²	34.7	32%	0.324	15%	0.154	S	C	.	.	S	Bend	trans	57.5	29.8	179.7	-54.9	118.3	0	0	0	114.5	E1171 H1172 E1219 N1220	E1171-H1198 IonicContact OE1-ND1 3.21Å; H1172-H1198 WeakPolarHBondContact CA-O 3.37Å; H1172-H1198 AromaticContact CE1-CG 3.93Å; H1172-H1198 AromaticContact CE1-ND1 3.76Å; H1172-H1198 AromaticContact NE2-CG 3.89Å; H1172-H1198 AromaticContact NE2-ND1 3.95Å; H1198-E1219 PolarHBondContact N-O 3.22Å; H1198-E1219 VanDerWaalsContact N-O 3.07Å; H1198-N1220 WeakPolarHBondContact CA-O 3.28Å; H1198-N1220 VanDerWaalsContact CD2-CB 3.46Å; H1198-N1220 WeakPolarHBondContact CD2-CB 3.38Å; H1198-N1220 PolarHBondContact CD2-ND2 3.05Å; H1198-N1220 PolarHBondContact NE2-ND2 3.11Å
1199	C	96.6	Very high	90.2	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.007	15%	0.153	C	C	.	.			trans	-88.6	152.2	-177	-59.7	0	0	0	0	113.1	L1173 L1197 V1221 T1222	L1173-C1199 HydrophobicContact CB-CB 4.3Å; L1173-C1199 CarbonylContact O-C 3.53Å; L1173-C1199 VanDerWaalsContact O-CA 3.23Å; L1173-C1199 WeakPolarHBondContact O-CA 3.38Å; L1173-C1199 WeakPolarHBondContact O-CB 3.38Å; L1197-C1199 VanDerWaalsContact C-N 3.26Å; L1197-C1199 PolarHBondContact O-N 3.28Å; L1197-C1199 PolarHBondContact O-SG 3.16Å; L1197-C1199 VanDerWaalsContact O-SG 3.41Å; C1199-V1221 HydrophobicContact CB-CG1 4.36Å; C1199-V1221 HydrophobicContact CB-CG2 4.25Å; C1199-V1221 CarbonylContact O-C 3.56Å; C1199-V1221 VanDerWaalsContact O-CA 3.31Å; C1199-V1221 WeakPolarHBondContact O-CA 3.44Å; C1199-V1221 WeakPolarHBondContact O-CG1 3.48Å; C1199-T1222 PolarHBondContact O-N 2.97Å
1200	Q	96.9	Very high	90.8	Very high	93.6 Å²	93.6	35.7 Å²	35.7	44%	0.437	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	116.3	176.7	-59.3	-173.8	-5.5	0	0	110.3	L1173 T1174 V1175 V1202 T1222	L1173-Q1200 PolarHBondContact O-N 3.18Å; T1174-Q1200 CarbonylContact C-O 3.55Å; T1174-Q1200 VanDerWaalsContact CA-O 3.3Å; T1174-Q1200 WeakPolarHBondContact CA-O 3.22Å; T1174-Q1200 HydrophobicContact CG2-CB 4.24Å; V1175-Q1200 PolarHBondContact N-O 2.97Å; Q1200-V1202 HydrophobicContact CB-CG2 4.13Å; Q1200-T1222 CarbonylContact C-O 3.09Å; Q1200-T1222 WeakPolarHBondContact CA-O 3.16Å; Q1200-T1222 WeakPolarHBondContact CA-OG1 3.38Å; Q1200-T1222 WeakPolarHBondContact CG-OG1 3.22Å
1201	L	97.1	Very high	91.7	Very high	0.6 Å²	0.6	35.3 Å²	35.3	0%	0.003	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	94	179.1	-50	-178.7	0	0	0	108.8	L1173 V1175 V1183 G1208 L1209 T1222 L1223 A1224 N1226	L1173-L1201 HydrophobicContact CD2-CD2 4.31Å; V1175-L1201 HydrophobicContact CB-CD2 3.64Å; V1175-L1201 HydrophobicContact CG2-CD2 3.78Å; V1175-L1201 WeakPolarHBondContact O-CA 3.36Å; V1183-L1201 HydrophobicContact CB-CD1 4.32Å; V1183-L1201 HydrophobicContact CG2-CD1 4.14Å; V1183-L1201 HydrophobicContact CG2-CD2 3.61Å; L1201-G1208 WeakPolarHBondContact CD1-O 3.49Å; L1201-L1209 HydrophobicContact CD1-CB 3.85Å; L1201-T1222 PolarHBondContact N-O 3.08Å; L1201-L1223 HydrophobicContact CB-CD2 4.07Å; L1201-L1223 HydrophobicContact CB-CG 4.34Å; L1201-L1223 HydrophobicContact CD1-CD2 3.73Å; L1201-L1223 VanDerWaalsContact CD1-CD2 3.47Å; L1201-L1223 HydrophobicContact CD1-CG 4.38Å; L1201-L1223 HydrophobicContact CG-CD2 4.12Å; L1201-L1223 WeakPolarHBondContact O-CA 3.33Å; L1201-A1224 PolarHBondContact O-N 2.93Å; L1201-A1224 VanDerWaalsContact O-N 3.13Å; L1201-N1226 PolarHBondContact O-ND2 2.93Å; L1201-N1226 VanDerWaalsContact O-ND2 3.15Å; L1201-N1226 PolarHBondContact O-OD1 3.28Å
1202	V	96	Very high	92.6	Very high	20.8 Å²	20.8	34.6 Å²	34.6	13%	0.126	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.1	-159.2	-179.4	0	0	0	0	112.5	V1175 Q1176 D1177 Q1200 N1204 A1224	V1175-V1202 PolarHBondContact O-N 3.05Å; Q1176-V1202 WeakPolarHBondContact CA-O 3.2Å; Q1176-V1202 HydrophobicContact CB-CB 4.45Å; Q1176-V1202 WeakPolarHBondContact CB-O 3.41Å; D1177-V1202 PolarHBondContact N-O 3.17Å; Q1200-V1202 HydrophobicContact CB-CG2 4.13Å; V1202-N1204 VanDerWaalsContact C-N 3.28Å; V1202-N1204 PolarHBondContact N-ND2 3.02Å; V1202-N1204 PolarHBondContact O-N 3.15Å; V1202-N1204 PolarHBondContact O-ND2 2.92Å; V1202-A1224 CarbonylContact C-O 3.54Å; V1202-A1224 WeakPolarHBondContact CA-O 3.3Å; V1202-A1224 HydrophobicContact CG1-CB 4.48Å; V1202-A1224 WeakPolarHBondContact CG1-O 3.12Å; V1202-A1224 HydrophobicContact CG2-CB 4.27Å
1203	R	94.8	Very high	93.3	Very high	115.2 Å²	115.2	31.1 Å²	31.1	44%	0.435	14%	0.136	S	C	.	.	S	Bend	trans	53.7	37.6	175.8	-63.9	-178.1	-50.5	-82.3	-6.3	114.6	Q1176 D1177 A1224 G1225	Q1176-R1203 VanDerWaalsContact OE1-NH2 3.08Å; D1177-R1203 WeakPolarHBondContact CA-O 3.29Å; D1177-R1203 PolarHBondContact N-O 3.19Å; D1177-R1203 WeakPolarHBondContact OD1-CB 3.34Å; D1177-R1203 IonicContact OD1-CZ 3.26Å; D1177-R1203 IonicContact OD1-NE 3.08Å; D1177-R1203 PolarHBondContact OD1-NE 3.05Å; D1177-R1203 IonicContact OD1-NH2 2.84Å; D1177-R1203 PolarHBondContact OD1-NH2 2.94Å; D1177-R1203 IonicContact OD2-CZ 3.29Å; D1177-R1203 IonicContact OD2-NE 3.53Å; D1177-R1203 IonicContact OD2-NH2 3.56Å; D1177-R1203 PolarHBondContact OD2-NH2 2.94Å; R1203-A1224 PolarHBondContact N-O 3.23Å; R1203-G1225 WeakPolarHBondContact CA-O 3.37Å
1204	N	94.1	Very high	93.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	12%	0.121	C	C	.	.			trans	-84.7	138.7	169.9	-55.4	-76.7	0	0	0	109.6	V1175 N1178 V1202 R1206 N1226 E1227	V1175-N1204 PolarHBondContact O-ND2 3.01Å; V1175-N1204 VanDerWaalsContact O-ND2 3.15Å; N1178-N1204 VanDerWaalsContact CB-OD1 3.31Å; N1178-N1204 WeakPolarHBondContact CB-OD1 3.26Å; N1178-N1204 PolarHBondContact ND2-OD1 3.23Å; V1202-N1204 VanDerWaalsContact C-N 3.28Å; V1202-N1204 PolarHBondContact N-ND2 3.02Å; V1202-N1204 PolarHBondContact O-N 3.15Å; V1202-N1204 PolarHBondContact O-ND2 2.92Å; N1204-R1206 VanDerWaalsContact C-N 3.28Å; N1204-R1206 PolarHBondContact O-N 3.07Å; N1204-R1206 VanDerWaalsContact O-N 3.16Å; N1204-N1226 VanDerWaalsContact CB-OD1 3.3Å; N1204-N1226 WeakPolarHBondContact CB-OD1 3.31Å; N1204-N1226 PolarHBondContact N-OD1 3.14Å; N1204-N1226 VanDerWaalsContact N-OD1 3.09Å; N1204-N1226 PolarHBondContact ND2-OD1 2.88Å; N1204-N1226 CarbonylContact O-C 3.54Å; N1204-N1226 VanDerWaalsContact O-CA 3.27Å; N1204-N1226 WeakPolarHBondContact O-CA 3.39Å; N1204-E1227 PolarHBondContact O-N 2.98Å; N1204-E1227 VanDerWaalsContact O-N 3.09Å
1205	R	88.5	Confident	93.8	Very high	27.8 Å²	27.8	27.7 Å²	27.7	11%	0.105	12%	0.122	C	C	.	.	S	Bend	trans	-61.2	-30.3	-175.1	-166.7	-168.2	170.9	-154.6	-4.9	113.6	D1056 E1058 N1178 F1179 W1180 E1227 D1859 Y1862	D1056-R1205 VanDerWaalsContact CG-NH1 3.33Å; D1056-R1205 VanDerWaalsContact CG-NH2 3.29Å; D1056-R1205 IonicContact OD1-CZ 3.27Å; D1056-R1205 IonicContact OD1-NH1 3.3Å; D1056-R1205 PolarHBondContact OD1-NH1 3.01Å; D1056-R1205 IonicContact OD1-NH2 3.56Å; D1056-R1205 PolarHBondContact OD1-NH2 2.88Å; D1056-R1205 VanDerWaalsContact OD1-NH2 3.15Å; D1056-R1205 IonicContact OD2-CZ 3.05Å; D1056-R1205 VanDerWaalsContact OD2-CZ 3.24Å; D1056-R1205 IonicContact OD2-NH1 3.31Å; D1056-R1205 PolarHBondContact OD2-NH1 2.95Å; D1056-R1205 IonicContact OD2-NH2 3.35Å; D1056-R1205 PolarHBondContact OD2-NH2 3.17Å; E1058-R1205 IonicContact OE2-NH2 3.66Å; N1178-R1205 PolarHBondContact O-N 3.11Å; F1179-R1205 VanDerWaalsContact CD2-CD 3.41Å; F1179-R1205 VanDerWaalsContact CE1-NH1 3.33Å; F1179-R1205 VanDerWaalsContact CE2-CZ 3.49Å; F1179-R1205 VanDerWaalsContact CZ-CZ 3.46Å; F1179-R1205 VanDerWaalsContact O-CB 3.26Å; F1179-R1205 WeakPolarHBondContact O-CB 3.35Å; F1179-R1205 VanDerWaalsContact O-CD 3.3Å; F1179-R1205 WeakPolarHBondContact O-CD 3.32Å; W1180-R1205 PolarHBondContact O-N 3.21Å; R1205-E1227 WeakPolarHBondContact CG-OE2 3.28Å; R1205-E1227 VanDerWaalsContact O-CB 3.26Å; R1205-E1227 WeakPolarHBondContact O-CB 3.32Å; R1205-D1859 IonicContact CZ-OD2 3.22Å; R1205-D1859 IonicContact NE-OD2 2.65Å; R1205-D1859 PolarHBondContact NE-OD2 3.34Å; R1205-D1859 IonicContact NH2-OD2 3.62Å; R1205-D1859 PolarHBondContact NH2-OD2 2.87Å; R1205-Y1862 HydrophobicContact CG-CE2 4.36Å; R1205-Y1862 VanDerWaalsContact O-CE2 3.26Å; R1205-Y1862 WeakPolarHBondContact O-CE2 3.35Å
1206	R	89.2	Confident	93.8	Very high	60.4 Å²	60.4	23.9 Å²	23.9	23%	0.228	11%	0.106	C	C	.	.	S	Bend	trans	-108.1	-106.9	172.9	-90.6	-165.3	177.5	-174.4	-3.5	110.9	E1058 W1180 N1204 N1228	E1058-R1206 VanDerWaalsContact CD-CZ 3.44Å; E1058-R1206 IonicContact OE1-CZ 3.36Å; E1058-R1206 IonicContact OE1-NE 3.5Å; E1058-R1206 PolarHBondContact OE1-NE 3.25Å; E1058-R1206 IonicContact OE1-NH1 3.48Å; E1058-R1206 PolarHBondContact OE1-NH1 2.79Å; E1058-R1206 IonicContact OE1-NH2 3.29Å; E1058-R1206 PolarHBondContact OE1-NH2 2.99Å; E1058-R1206 IonicContact OE2-CZ 3.75Å; E1058-R1206 VanDerWaalsContact OE2-CZ 3.28Å; E1058-R1206 IonicContact OE2-NE 3.26Å; E1058-R1206 PolarHBondContact OE2-NE 3.12Å; E1058-R1206 IonicContact OE2-NH1 3.42Å; E1058-R1206 PolarHBondContact OE2-NH1 2.81Å; E1058-R1206 IonicContact OE2-NH2 3.09Å; E1058-R1206 PolarHBondContact OE2-NH2 3.07Å; W1180-R1206 VanDerWaalsContact CZ2-NH1 3.28Å; W1180-R1206 VanDerWaalsContact NE1-CD 3.27Å; W1180-R1206 VanDerWaalsContact NE1-NE 3.18Å; W1180-R1206 WeakPolarHBondContact O-CB 3.42Å; W1180-R1206 PolarHBondContact O-N 2.92Å; W1180-R1206 VanDerWaalsContact O-N 3.07Å; N1204-R1206 VanDerWaalsContact C-N 3.28Å; N1204-R1206 PolarHBondContact O-N 3.07Å; N1204-R1206 VanDerWaalsContact O-N 3.16Å; R1206-N1228 HydrophobicContact CG-CB 4.38Å; R1206-N1228 WeakPolarHBondContact O-CA 3.37Å; R1206-N1228 VanDerWaalsContact O-CB 3.29Å; R1206-N1228 WeakPolarHBondContact O-CB 3.31Å; R1206-N1228 PolarHBondContact O-N 3.13Å
1207	H	94.2	Very high	93.8	Very high	11.6 Å²	11.6	24.5 Å²	24.5	5%	0.054	11%	0.109	C	C	.	.			trans	-99	147	-173.9	-48.5	-61.8	0	0	0	110.1	T1181 G1182 N1228 A1229 R1232	T1181-H1207 WeakPolarHBondContact CA-O 3.44Å; T1181-H1207 HydrophobicContact CG2-CB 4.17Å; G1182-H1207 PolarHBondContact N-O 3.06Å; H1207-N1228 VanDerWaalsContact CE1-CG 3.44Å; H1207-N1228 PolarHBondContact CE1-ND2 3.1Å; H1207-N1228 VanDerWaalsContact CE1-ND2 3.3Å; H1207-N1228 PolarHBondContact CE1-OD1 3.04Å; H1207-A1229 CarbonylContact C-O 3.57Å; H1207-A1229 WeakPolarHBondContact CA-O 3.28Å; H1207-A1229 WeakPolarHBondContact CB-O 3.35Å; H1207-A1229 WeakPolarHBondContact ND1-CB 3.34Å; H1207-A1229 PolarHBondContact ND1-N 3.1Å; H1207-R1232 HydrophobicContact CB-CB 4.11Å
1208	G	95.5	Very high	93.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-65.4	-54.6	167.2	0	0	0	0	0	110.1	G1182 V1183 L1201 N1226 A1229 G1230	G1182-G1208 WeakPolarHBondContact CA-O 3.26Å; V1183-G1208 PolarHBondContact N-O 3.13Å; L1201-G1208 WeakPolarHBondContact CD1-O 3.49Å; G1208-N1226 WeakPolarHBondContact CA-OD1 3.27Å; G1208-A1229 PolarHBondContact N-O 3.29Å; G1208-A1229 VanDerWaalsContact N-O 3.12Å; G1208-G1230 WeakPolarHBondContact CA-O 3.25Å; G1208-G1230 PolarHBondContact N-O 3.14Å
1209	L	96.8	Very high	93.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	129.3	179	176.4	63.6	0	0	0	111	V1183 I1185 L1196 L1201 L1211 L1216 L1218 L1223 G1230 I1231 R1232	V1183-L1209 HydrophobicContact CB-CD1 3.66Å; V1183-L1209 HydrophobicContact CG1-CD1 3.49Å; V1183-L1209 VanDerWaalsContact CG1-CD1 3.48Å; V1183-L1209 CarbonylContact O-C 3.51Å; V1183-L1209 WeakPolarHBondContact O-CA 3.31Å; I1185-L1209 HydrophobicContact CD1-CD1 4.15Å; I1185-L1209 HydrophobicContact CG1-CD1 4.5Å; L1196-L1209 HydrophobicContact CD1-CD1 4.44Å; L1196-L1209 HydrophobicContact CD1-CD2 4.35Å; L1201-L1209 HydrophobicContact CD1-CB 3.85Å; L1209-L1211 HydrophobicContact CD1-CD2 3.87Å; L1209-L1211 HydrophobicContact CD1-CG 4.42Å; L1209-L1211 HydrophobicContact CD2-CD1 4.19Å; L1209-L1211 HydrophobicContact CD2-CD2 3.99Å; L1209-L1211 HydrophobicContact CD2-CG 4.09Å; L1209-L1211 HydrophobicContact CG-CD2 3.92Å; L1209-L1211 HydrophobicContact CG-CG 4Å; L1209-L1216 HydrophobicContact CD2-CD2 4.39Å; L1209-L1218 HydrophobicContact CD2-CD1 4.01Å; L1209-L1218 HydrophobicContact CD2-CD2 3.71Å; L1209-L1218 HydrophobicContact CD2-CG 4.35Å; L1209-L1223 HydrophobicContact CB-CD2 3.98Å; L1209-G1230 PolarHBondContact N-O 3.01Å; L1209-I1231 CarbonylContact O-C 3.57Å; L1209-I1231 WeakPolarHBondContact O-CA 3.39Å; L1209-R1232 PolarHBondContact O-N 3.08Å
1210	R	96	Very high	93.9	Very high	32 Å²	32	25.2 Å²	25.2	12%	0.121	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.9	169	-176.1	175.8	141.7	-176.1	-0.3	109.9	T1181 V1183 D1184 I1185 R1232 N1234	T1181-R1210 HydrophobicContact CG2-CB 3.85Å; V1183-R1210 PolarHBondContact O-N 2.94Å; D1184-R1210 WeakPolarHBondContact CA-O 3.23Å; D1184-R1210 HydrophobicContact CB-CB 4.45Å; D1184-R1210 VanDerWaalsContact CG-NE 3.29Å; D1184-R1210 VanDerWaalsContact CG-NH2 3.31Å; D1184-R1210 WeakPolarHBondContact OD1-CB 3.39Å; D1184-R1210 VanDerWaalsContact OD1-CD 3.31Å; D1184-R1210 WeakPolarHBondContact OD1-CD 3.36Å; D1184-R1210 WeakPolarHBondContact OD1-CG 3.16Å; D1184-R1210 IonicContact OD1-CZ 3.42Å; D1184-R1210 IonicContact OD1-NE 2.91Å; D1184-R1210 PolarHBondContact OD1-NE 3.1Å; D1184-R1210 IonicContact OD1-NH2 3.11Å; D1184-R1210 PolarHBondContact OD1-NH2 2.93Å; D1184-R1210 IonicContact OD2-CZ 3.17Å; D1184-R1210 IonicContact OD2-NE 3.04Å; D1184-R1210 PolarHBondContact OD2-NE 2.7Å; D1184-R1210 IonicContact OD2-NH2 3.4Å; D1184-R1210 PolarHBondContact OD2-NH2 2.87Å; I1185-R1210 PolarHBondContact N-O 3.1Å; R1210-R1232 CarbonylContact C-O 3.45Å; R1210-R1232 VanDerWaalsContact CA-O 3.3Å; R1210-R1232 WeakPolarHBondContact CA-O 3.26Å; R1210-R1232 HydrophobicContact CB-CB 4.46Å; R1210-R1232 HydrophobicContact CG-CB 4.44Å; R1210-R1232 HydrophobicContact CG-CG 4.37Å; R1210-N1234 PolarHBondContact NH2-ND2 3.26Å
1211	L	95.2	Very high	93.9	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	133.2	178.1	-61	179.7	0	0	0	109.6	I1185 L1209 L1216 I1231 R1232 Y1233 N1234 V1393	I1185-L1211 HydrophobicContact CB-CD2 3.94Å; I1185-L1211 HydrophobicContact CD1-CD2 3.9Å; I1185-L1211 HydrophobicContact CG1-CD2 4.35Å; L1209-L1211 HydrophobicContact CD1-CD2 3.87Å; L1209-L1211 HydrophobicContact CD1-CG 4.42Å; L1209-L1211 HydrophobicContact CD2-CD1 4.19Å; L1209-L1211 HydrophobicContact CD2-CD2 3.99Å; L1209-L1211 HydrophobicContact CD2-CG 4.09Å; L1209-L1211 HydrophobicContact CG-CD2 3.92Å; L1209-L1211 HydrophobicContact CG-CG 4Å; L1211-L1216 HydrophobicContact CD1-CD2 4.24Å; L1211-L1216 HydrophobicContact CD2-CD2 3.51Å; L1211-L1216 VanDerWaalsContact CD2-CD2 3.48Å; L1211-L1216 HydrophobicContact CG-CD2 4.48Å; L1211-I1231 HydrophobicContact CD1-CG2 4.3Å; L1211-R1232 PolarHBondContact N-O 3.04Å; L1211-Y1233 HydrophobicContact CB-CD2 4.1Å; L1211-Y1233 CarbonylContact O-C 3.53Å; L1211-Y1233 WeakPolarHBondContact O-CA 3.26Å; L1211-N1234 PolarHBondContact O-N 2.94Å; L1211-V1393 HydrophobicContact CD1-CB 4.47Å; L1211-V1393 HydrophobicContact CD1-CG1 3.7Å; L1211-V1393 HydrophobicContact CD1-CG2 4.07Å
1212	R	93.1	Very high	93.9	Very high	14.8 Å²	14.8	23 Å²	23	6%	0.056	11%	0.107	C	C	.	.	S	Bend	trans	-110.7	-10.5	174.2	-50	-175.5	178.9	173.7	4.1	113.4	D1184 I1185 N1234 P1235 Q1236 M1241 L1424	D1184-R1212 IonicContact OD1-CZ 3.88Å; D1184-R1212 IonicContact OD1-NE 3.48Å; D1184-R1212 PolarHBondContact OD1-NE 3.41Å; D1184-R1212 IonicContact OD1-NH1 2.82Å; D1184-R1212 PolarHBondContact OD1-NH1 2.95Å; D1184-R1212 IonicContact OD1-NH2 3.44Å; D1184-R1212 IonicContact OD2-CZ 3.26Å; D1184-R1212 IonicContact OD2-NE 3.5Å; D1184-R1212 IonicContact OD2-NH1 3.3Å; D1184-R1212 PolarHBondContact OD2-NH1 2.79Å; D1184-R1212 IonicContact OD2-NH2 3.07Å; D1184-R1212 PolarHBondContact OD2-NH2 3.34Å; I1185-R1212 PolarHBondContact O-N 3.18Å; R1212-N1234 WeakPolarHBondContact CA-O 3.31Å; R1212-N1234 WeakPolarHBondContact CG-O 3.37Å; R1212-P1235 VanDerWaalsContact O-CA 3.26Å; R1212-P1235 WeakPolarHBondContact O-CA 3.29Å; R1212-P1235 WeakPolarHBondContact O-CB 3.37Å; R1212-Q1236 VanDerWaalsContact CD-O 3.27Å; R1212-Q1236 WeakPolarHBondContact CD-O 3.36Å; R1212-Q1236 PolarHBondContact NE-O 2.89Å; R1212-Q1236 VanDerWaalsContact NE-O 3.1Å; R1212-Q1236 PolarHBondContact NH1-O 3.1Å; R1212-M1241 VanDerWaalsContact CZ-SD 3.5Å; R1212-M1241 PolarHBondContact NH1-SD 3.28Å; R1212-M1241 PolarHBondContact NH2-SD 3.2Å; R1212-L1424 HydrophobicContact CB-CD1 4.43Å; R1212-L1424 VanDerWaalsContact O-CD1 3.26Å; R1212-L1424 WeakPolarHBondContact O-CD1 3.39Å
1213	S	90.8	Very high	93.9	Very high	9 Å²	9	22 Å²	22	6%	0.063	10%	0.101	C	C	.	.	S	Bend	trans	-139	159.7	179.1	50.6	0	0	0	0	111	I1186 Y1187 T1188	I1186-S1213 WeakPolarHBondContact O-CB 3.31Å; I1186-S1213 PolarHBondContact O-OG 3.02Å; Y1187-S1213 VanDerWaalsContact C-OG 3.31Å; Y1187-S1213 VanDerWaalsContact CA-OG 3.32Å; Y1187-S1213 WeakPolarHBondContact CA-OG 3.4Å; T1188-S1213 PolarHBondContact N-OG 2.98Å; T1188-S1213 PolarHBondContact OG1-OG 3.28Å; T1188-S1213 VanDerWaalsContact OG1-OG 3.08Å
1214	V	89.8	Confident	94	Very high	4.8 Å²	4.8	17.5 Å²	17.5	3%	0.029	9%	0.088	C	C	.	.	S	Bend	trans	-91.2	167.1	173.7	-57.9	0	0	0	0	111.1	T1188 Y1233 D1391 V1393	T1188-V1214 WeakPolarHBondContact CB-O 3.25Å; V1214-Y1233 HydrophobicContact CG1-CE2 3.93Å; V1214-D1391 WeakPolarHBondContact CG2-O 3.31Å; V1214-V1393 HydrophobicContact CB-CG2 4.2Å; V1214-V1393 HydrophobicContact CG1-CG2 4.16Å
1215	G	88.4	Confident	94	Very high	3.4 Å²	3.4	18.4 Å²	18.4	4%	0.035	10%	0.097	C	C	.	.			trans	111.9	18.1	-179.8	0	0	0	0	0	114.7	T1188 P1194 D1390 F1392	T1188-G1215 VanDerWaalsContact CG2-C 3.45Å; T1188-G1215 VanDerWaalsContact CG2-O 3.3Å; T1188-G1215 WeakPolarHBondContact CG2-O 3.32Å; P1194-G1215 WeakPolarHBondContact CD-O 3.4Å; P1194-G1215 WeakPolarHBondContact CG-O 3.23Å; G1215-D1390 VanDerWaalsContact CA-O 3.29Å; G1215-D1390 WeakPolarHBondContact CA-O 3.32Å; G1215-F1392 VanDerWaalsContact CA-O 3.3Å; G1215-F1392 WeakPolarHBondContact CA-O 3.35Å; G1215-F1392 PolarHBondContact N-O 3.02Å
1216	L	92.5	Very high	94.2	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.093	C	C	.	.			trans	-113.4	135.3	-176	-178.9	66.6	0	0	0	111.4	N1166 I1185 T1188 P1194 L1196 L1209 L1211 L1218 F1392 V1393 H1394	N1166-L1216 WeakPolarHBondContact ND2-CD1 3.28Å; I1185-L1216 HydrophobicContact CD1-CD1 4.42Å; I1185-L1216 HydrophobicContact CD1-CD2 3.59Å; T1188-L1216 HydrophobicContact CG2-CB 4.29Å; P1194-L1216 HydrophobicContact CB-CD1 4.3Å; P1194-L1216 HydrophobicContact CG-CD1 4.31Å; L1196-L1216 HydrophobicContact CD1-CD2 4.45Å; L1196-L1216 HydrophobicContact CG-CD1 4.47Å; L1209-L1216 HydrophobicContact CD2-CD2 4.39Å; L1211-L1216 HydrophobicContact CD1-CD2 4.24Å; L1211-L1216 HydrophobicContact CD2-CD2 3.51Å; L1211-L1216 VanDerWaalsContact CD2-CD2 3.48Å; L1211-L1216 HydrophobicContact CG-CD2 4.48Å; L1216-L1218 HydrophobicContact CD2-CD1 3.8Å; L1216-L1218 HydrophobicContact CD2-CD2 3.75Å; L1216-L1218 HydrophobicContact CD2-CG 4.45Å; L1216-L1218 HydrophobicContact CG-CD1 3.91Å; L1216-L1218 HydrophobicContact CG-CD2 4.09Å; L1216-F1392 PolarHBondContact N-O 3.1Å; L1216-V1393 CarbonylContact O-C 3.55Å; L1216-V1393 WeakPolarHBondContact O-CA 3.31Å; L1216-H1394 PolarHBondContact O-N 3.21Å
1217	T	93.8	Very high	94.2	Very high	15.4 Å²	15.4	18.1 Å²	18.1	9%	0.094	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.2	169.3	-54.3	0	0	0	0	111.2	P1194 K1195 L1196 H1394	P1194-T1217 PolarHBondContact O-N 3.23Å; P1194-T1217 VanDerWaalsContact O-N 3.15Å; K1195-T1217 CarbonylContact C-O 3.5Å; K1195-T1217 WeakPolarHBondContact CA-O 3.41Å; K1195-T1217 WeakPolarHBondContact CB-O 3.49Å; K1195-T1217 HydrophobicContact CD-CG2 4.47Å; L1196-T1217 PolarHBondContact N-O 2.84Å; T1217-H1394 CarbonylContact C-O 3.47Å; T1217-H1394 WeakPolarHBondContact CA-O 3.33Å; T1217-H1394 HydrophobicContact CG2-CB 4.29Å
1218	L	95.6	Very high	94	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	120.9	171.1	-62.1	119.6	0	0	0	108.2	L1196 L1209 L1216 V1221 L1223 I1231 V1393 H1394 V1395 R1396	L1196-L1218 HydrophobicContact CB-CD2 3.7Å; L1196-L1218 HydrophobicContact CB-CG 4.49Å; L1196-L1218 HydrophobicContact CD1-CD2 3.59Å; L1196-L1218 HydrophobicContact CD1-CG 4.47Å; L1196-L1218 HydrophobicContact CG-CD2 3.78Å; L1209-L1218 HydrophobicContact CD2-CD1 4.01Å; L1209-L1218 HydrophobicContact CD2-CD2 3.71Å; L1209-L1218 HydrophobicContact CD2-CG 4.35Å; L1216-L1218 HydrophobicContact CD2-CD1 3.8Å; L1216-L1218 HydrophobicContact CD2-CD2 3.75Å; L1216-L1218 HydrophobicContact CD2-CG 4.45Å; L1216-L1218 HydrophobicContact CG-CD1 3.91Å; L1216-L1218 HydrophobicContact CG-CD2 4.09Å; L1218-V1221 HydrophobicContact CB-CB 4.43Å; L1218-V1221 HydrophobicContact CB-CG2 3.96Å; L1218-V1221 HydrophobicContact CD2-CB 4.42Å; L1218-V1221 HydrophobicContact CD2-CG1 4.35Å; L1218-V1221 HydrophobicContact CD2-CG2 4.44Å; L1218-V1221 HydrophobicContact CG-CG2 4.47Å; L1218-L1223 HydrophobicContact CD2-CD1 4.48Å; L1218-I1231 HydrophobicContact CD1-CD1 3.78Å; L1218-I1231 HydrophobicContact CD2-CD1 4.27Å; L1218-V1393 HydrophobicContact CD1-CG1 4.06Å; L1218-H1394 PolarHBondContact N-O 2.93Å; L1218-V1395 HydrophobicContact CB-CG1 4.39Å; L1218-V1395 HydrophobicContact CB-CG2 4.37Å; L1218-V1395 HydrophobicContact CD1-CG1 4.44Å; L1218-V1395 HydrophobicContact CD1-CG2 3.97Å; L1218-V1395 HydrophobicContact CD2-CG2 4.38Å; L1218-V1395 HydrophobicContact CG-CG2 4.4Å; L1218-R1396 PolarHBondContact O-N 3.11Å
1219	E	95.9	Very high	93.9	Very high	55.4 Å²	55.4	19.2 Å²	19.2	26%	0.259	11%	0.106	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.2	-179.8	-179.6	170.3	-163.8	0	0	110.6	L1196 L1197 H1198 V1221 R1396	L1196-E1219 PolarHBondContact O-N 3.27Å; L1197-E1219 WeakPolarHBondContact CA-O 3.35Å; L1197-E1219 HydrophobicContact CD1-CB 3.75Å; L1197-E1219 HydrophobicContact CD1-CG 3.76Å; H1198-E1219 PolarHBondContact N-O 3.22Å; H1198-E1219 VanDerWaalsContact N-O 3.07Å; E1219-V1221 VanDerWaalsContact C-N 3.27Å; E1219-V1221 PolarHBondContact O-N 3.13Å; E1219-R1396 WeakPolarHBondContact CA-O 3.42Å
1220	N	97.1	Very high	93.8	Very high	62.8 Å²	62.8	19.2 Å²	19.2	34%	0.336	11%	0.106	S	C	.	.	S	Bend	trans	53.8	40.5	-175.8	-62.8	-22.5	0	0	0	113.1	H1198 R1396 S1397	H1198-N1220 WeakPolarHBondContact CA-O 3.28Å; H1198-N1220 VanDerWaalsContact CD2-CB 3.46Å; H1198-N1220 WeakPolarHBondContact CD2-CB 3.38Å; H1198-N1220 PolarHBondContact CD2-ND2 3.05Å; H1198-N1220 PolarHBondContact NE2-ND2 3.11Å; N1220-R1396 PolarHBondContact N-O 3.17Å; N1220-R1396 VanDerWaalsContact N-O 3.17Å; N1220-S1397 WeakPolarHBondContact CA-O 3.4Å; N1220-S1397 VanDerWaalsContact OD1-CB 3.3Å; N1220-S1397 WeakPolarHBondContact OD1-CB 3.35Å; N1220-S1397 PolarHBondContact OD1-O 3.06Å
1221	V	97.1	Very high	93.9	Very high	0.6 Å²	0.6	17.8 Å²	17.8	0%	0.004	10%	0.101	C	C	.	.			trans	-95.1	137.9	180	179.4	0	0	0	0	110.5	L1196 C1199 L1218 E1219 L1223 S1398 A1399	L1196-V1221 HydrophobicContact CB-CG2 4.17Å; L1196-V1221 WeakPolarHBondContact O-CG2 3.31Å; C1199-V1221 HydrophobicContact CB-CG1 4.36Å; C1199-V1221 HydrophobicContact CB-CG2 4.25Å; C1199-V1221 CarbonylContact O-C 3.56Å; C1199-V1221 VanDerWaalsContact O-CA 3.31Å; C1199-V1221 WeakPolarHBondContact O-CA 3.44Å; C1199-V1221 WeakPolarHBondContact O-CG1 3.48Å; L1218-V1221 HydrophobicContact CB-CB 4.43Å; L1218-V1221 HydrophobicContact CB-CG2 3.96Å; L1218-V1221 HydrophobicContact CD2-CB 4.42Å; L1218-V1221 HydrophobicContact CD2-CG1 4.35Å; L1218-V1221 HydrophobicContact CD2-CG2 4.44Å; L1218-V1221 HydrophobicContact CG-CG2 4.47Å; E1219-V1221 VanDerWaalsContact C-N 3.27Å; E1219-V1221 PolarHBondContact O-N 3.13Å; V1221-L1223 HydrophobicContact CB-CD1 4.42Å; V1221-L1223 HydrophobicContact CG1-CD1 3.89Å; V1221-L1223 HydrophobicContact CG1-CD2 3.87Å; V1221-L1223 HydrophobicContact CG1-CG 4.09Å; V1221-S1398 PolarHBondContact N-OG 2.8Å; V1221-S1398 VanDerWaalsContact N-OG 3.11Å; V1221-S1398 CarbonylContact O-C 3.56Å; V1221-S1398 VanDerWaalsContact O-CA 3.27Å; V1221-S1398 WeakPolarHBondContact O-CA 3.32Å; V1221-S1398 WeakPolarHBondContact O-CB 3.37Å; V1221-S1398 PolarHBondContact O-OG 2.89Å; V1221-A1399 PolarHBondContact O-N 3.1Å
1222	T	97.1	Very high	93.9	Very high	48 Å²	48	19.5 Å²	19.5	29%	0.294	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.3	173.6	22	0	0	0	0	110.4	C1199 Q1200 L1201 A1224 A1399	C1199-T1222 PolarHBondContact O-N 2.97Å; Q1200-T1222 CarbonylContact C-O 3.09Å; Q1200-T1222 WeakPolarHBondContact CA-O 3.16Å; Q1200-T1222 WeakPolarHBondContact CA-OG1 3.38Å; Q1200-T1222 WeakPolarHBondContact CG-OG1 3.22Å; L1201-T1222 PolarHBondContact N-O 3.08Å; T1222-A1224 HydrophobicContact CG2-CB 4.07Å; T1222-A1399 CarbonylContact C-O 3.4Å; T1222-A1399 WeakPolarHBondContact CA-O 3.31Å; T1222-A1399 HydrophobicContact CG2-CB 4.42Å
1223	L	96.9	Very high	94	Very high	0.4 Å²	0.4	19 Å²	19	0%	0.002	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	97.3	176.5	-61	127.9	0	0	0	108.5	L1201 L1209 L1218 V1221 G1230 I1231 A1399 I1400 R1401 N1403	L1201-L1223 HydrophobicContact CB-CD2 4.07Å; L1201-L1223 HydrophobicContact CB-CG 4.34Å; L1201-L1223 HydrophobicContact CD1-CD2 3.73Å; L1201-L1223 VanDerWaalsContact CD1-CD2 3.47Å; L1201-L1223 HydrophobicContact CD1-CG 4.38Å; L1201-L1223 HydrophobicContact CG-CD2 4.12Å; L1201-L1223 WeakPolarHBondContact O-CA 3.33Å; L1209-L1223 HydrophobicContact CB-CD2 3.98Å; L1218-L1223 HydrophobicContact CD2-CD1 4.48Å; V1221-L1223 HydrophobicContact CB-CD1 4.42Å; V1221-L1223 HydrophobicContact CG1-CD1 3.89Å; V1221-L1223 HydrophobicContact CG1-CD2 3.87Å; V1221-L1223 HydrophobicContact CG1-CG 4.09Å; L1223-G1230 VanDerWaalsContact CD2-O 3.23Å; L1223-G1230 WeakPolarHBondContact CD2-O 3.4Å; L1223-I1231 HydrophobicContact CD1-CD1 4.04Å; L1223-I1231 HydrophobicContact CD1-CG1 3.85Å; L1223-I1231 HydrophobicContact CD2-CG1 3.91Å; L1223-A1399 PolarHBondContact N-O 3.06Å; L1223-I1400 HydrophobicContact CB-CG1 4.38Å; L1223-I1400 HydrophobicContact CD1-CD1 4.29Å; L1223-I1400 HydrophobicContact CD1-CG1 3.93Å; L1223-I1400 CarbonylContact O-C 3.57Å; L1223-I1400 WeakPolarHBondContact O-CA 3.28Å; L1223-R1401 PolarHBondContact O-N 2.94Å; L1223-N1403 PolarHBondContact O-ND2 3.12Å
1224	A	96.2	Very high	94.2	Very high	20.4 Å²	20.4	19.5 Å²	19.5	17%	0.169	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.4	-167.1	0	0	0	0	0	114.5	L1201 V1202 R1203 T1222 N1226 R1401	L1201-A1224 PolarHBondContact O-N 2.93Å; L1201-A1224 VanDerWaalsContact O-N 3.13Å; V1202-A1224 CarbonylContact C-O 3.54Å; V1202-A1224 WeakPolarHBondContact CA-O 3.3Å; V1202-A1224 HydrophobicContact CG1-CB 4.48Å; V1202-A1224 WeakPolarHBondContact CG1-O 3.12Å; V1202-A1224 HydrophobicContact CG2-CB 4.27Å; R1203-A1224 PolarHBondContact N-O 3.23Å; T1222-A1224 HydrophobicContact CG2-CB 4.07Å; A1224-N1226 VanDerWaalsContact C-N 3.27Å; A1224-N1226 PolarHBondContact N-ND2 3.25Å; A1224-N1226 PolarHBondContact O-N 3.01Å; A1224-N1226 VanDerWaalsContact O-N 3.15Å; A1224-R1401 CarbonylContact C-O 3.54Å; A1224-R1401 VanDerWaalsContact CA-O 3.22Å; A1224-R1401 WeakPolarHBondContact CA-O 3.33Å; A1224-R1401 HydrophobicContact CB-CB 4.43Å
1225	G	93.4	Very high	94.3	Very high	18.6 Å²	18.6	19.5 Å²	19.5	19%	0.192	11%	0.107	C	C	.	.	S	Bend	trans	64.7	22	170.1	0	0	0	0	0	114.9	R1203 R1401 Q1402 N1403 R1858	R1203-G1225 WeakPolarHBondContact CA-O 3.37Å; G1225-R1401 PolarHBondContact N-O 3.04Å; G1225-Q1402 WeakPolarHBondContact CA-O 3.35Å; G1225-N1403 PolarHBondContact N-OD1 3.13Å; G1225-R1858 PolarHBondContact O-NH1 2.97Å
1226	N	94	Very high	94.4	Very high	0.6 Å²	0.6	20.8 Å²	20.8	0%	0.003	11%	0.113	C	C	.	.			trans	-75.7	137.8	173	-53.6	-78.5	0	0	0	108.9	L1201 N1204 G1208 A1224 N1228 N1403	L1201-N1226 PolarHBondContact O-ND2 2.93Å; L1201-N1226 VanDerWaalsContact O-ND2 3.15Å; L1201-N1226 PolarHBondContact O-OD1 3.28Å; N1204-N1226 VanDerWaalsContact CB-OD1 3.3Å; N1204-N1226 WeakPolarHBondContact CB-OD1 3.31Å; N1204-N1226 PolarHBondContact N-OD1 3.14Å; N1204-N1226 VanDerWaalsContact N-OD1 3.09Å; N1204-N1226 PolarHBondContact ND2-OD1 2.88Å; N1204-N1226 CarbonylContact O-C 3.54Å; N1204-N1226 VanDerWaalsContact O-CA 3.27Å; N1204-N1226 WeakPolarHBondContact O-CA 3.39Å; G1208-N1226 WeakPolarHBondContact CA-OD1 3.27Å; A1224-N1226 VanDerWaalsContact C-N 3.27Å; A1224-N1226 PolarHBondContact N-ND2 3.25Å; A1224-N1226 PolarHBondContact O-N 3.01Å; A1224-N1226 VanDerWaalsContact O-N 3.15Å; N1226-N1228 VanDerWaalsContact C-N 3.27Å; N1226-N1228 PolarHBondContact O-N 3.16Å; N1226-N1403 VanDerWaalsContact CB-OD1 3.3Å; N1226-N1403 WeakPolarHBondContact CB-OD1 3.42Å; N1226-N1403 PolarHBondContact N-OD1 3.32Å; N1226-N1403 PolarHBondContact ND2-OD1 3Å; N1226-N1403 VanDerWaalsContact O-CA 3.32Å; N1226-N1403 WeakPolarHBondContact O-CA 3.33Å
1227	E	88.8	Confident	94.3	Very high	82.2 Å²	82.2	20.8 Å²	20.8	38%	0.384	11%	0.113	S	C	.	.	S	Bend	trans	-72	-19.3	-169.1	-47.9	-178.9	156.3	0	0	113.2	N1204 R1205 Q1404 R1442 D1859 Y1862	N1204-E1227 PolarHBondContact O-N 2.98Å; N1204-E1227 VanDerWaalsContact O-N 3.09Å; R1205-E1227 WeakPolarHBondContact CG-OE2 3.28Å; R1205-E1227 VanDerWaalsContact O-CB 3.26Å; R1205-E1227 WeakPolarHBondContact O-CB 3.32Å; E1227-Q1404 WeakPolarHBondContact O-CB 3.28Å; E1227-Q1404 PolarHBondContact O-OE1 3.06Å; E1227-Q1404 VanDerWaalsContact O-OE1 3.11Å; E1227-R1442 PolarHBondContact O-NH2 3.11Å; E1227-R1442 VanDerWaalsContact O-NH2 3.12Å; E1227-D1859 PolarHBondContact OE1-N 3.06Å; E1227-D1859 WeakPolarHBondContact OE2-CB 3.48Å; E1227-Y1862 HydrophobicContact CB-CD2 3.87Å; E1227-Y1862 HydrophobicContact CB-CG 4.45Å; E1227-Y1862 WeakPolarHBondContact O-CB 3.42Å
1228	N	90.4	Very high	94.1	Very high	33.4 Å²	33.4	23.1 Å²	23.1	18%	0.179	13%	0.127	C	C	.	.	S	Bend	trans	-112.3	-122.4	174.6	-162.5	-36.3	0	0	0	110.6	R1206 H1207 N1226 Q1404 Y1405 Y1862	R1206-N1228 HydrophobicContact CG-CB 4.38Å; R1206-N1228 WeakPolarHBondContact O-CA 3.37Å; R1206-N1228 VanDerWaalsContact O-CB 3.29Å; R1206-N1228 WeakPolarHBondContact O-CB 3.31Å; R1206-N1228 PolarHBondContact O-N 3.13Å; H1207-N1228 VanDerWaalsContact CE1-CG 3.44Å; H1207-N1228 PolarHBondContact CE1-ND2 3.1Å; H1207-N1228 VanDerWaalsContact CE1-ND2 3.3Å; H1207-N1228 PolarHBondContact CE1-OD1 3.04Å; N1226-N1228 VanDerWaalsContact C-N 3.27Å; N1226-N1228 PolarHBondContact O-N 3.16Å; N1228-Q1404 WeakPolarHBondContact O-CA 3.27Å; N1228-Q1404 VanDerWaalsContact O-CB 3.25Å; N1228-Q1404 WeakPolarHBondContact O-CB 3.38Å; N1228-Q1404 PolarHBondContact O-N 3.15Å; N1228-Y1405 PolarHBondContact O-N 3.02Å; N1228-Y1405 VanDerWaalsContact O-N 3.16Å; N1228-Y1405 WeakPolarHBondContact OD1-CD2 3.42Å; N1228-Y1862 HydrophobicContact CB-CD1 4.45Å; N1228-Y1862 HydrophobicContact CB-CE1 4.35Å
1229	A	93.2	Very high	93.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	140.4	-179	0	0	0	0	0	113.2	H1207 G1208 I1231 R1232 Y1405	H1207-A1229 CarbonylContact C-O 3.57Å; H1207-A1229 WeakPolarHBondContact CA-O 3.28Å; H1207-A1229 WeakPolarHBondContact CB-O 3.35Å; H1207-A1229 WeakPolarHBondContact ND1-CB 3.34Å; H1207-A1229 PolarHBondContact ND1-N 3.1Å; G1208-A1229 PolarHBondContact N-O 3.29Å; G1208-A1229 VanDerWaalsContact N-O 3.12Å; A1229-I1231 WeakPolarHBondContact CB-O 3.09Å; A1229-R1232 HydrophobicContact CB-CB 4.34Å; A1229-Y1405 CarbonylContact C-O 3.53Å; A1229-Y1405 VanDerWaalsContact CA-O 3.26Å; A1229-Y1405 WeakPolarHBondContact CA-O 3.46Å; A1229-Y1405 HydrophobicContact CB-CD2 4.44Å
1230	G	95	Very high	93	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	-59.2	165.5	0	0	0	0	0	110	G1208 L1209 L1223 Y1405 G1406	G1208-G1230 WeakPolarHBondContact CA-O 3.25Å; G1208-G1230 PolarHBondContact N-O 3.14Å; L1209-G1230 PolarHBondContact N-O 3.01Å; L1223-G1230 VanDerWaalsContact CD2-O 3.23Å; L1223-G1230 WeakPolarHBondContact CD2-O 3.4Å; G1230-Y1405 PolarHBondContact N-O 3.04Å; G1230-G1406 WeakPolarHBondContact CA-O 3.42Å; G1230-G1406 PolarHBondContact N-O 3.12Å
1231	I	96.8	Very high	92.6	Very high	2.2 Å²	2.2	28.7 Å²	28.7	1%	0.011	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.5	172.3	-55.8	176.2	0	0	0	109.5	L1209 L1211 L1218 L1223 A1229 V1395 I1400 G1406 L1407 S1408 F1433	L1209-I1231 CarbonylContact O-C 3.57Å; L1209-I1231 WeakPolarHBondContact O-CA 3.39Å; L1211-I1231 HydrophobicContact CD1-CG2 4.3Å; L1218-I1231 HydrophobicContact CD1-CD1 3.78Å; L1218-I1231 HydrophobicContact CD2-CD1 4.27Å; L1223-I1231 HydrophobicContact CD1-CD1 4.04Å; L1223-I1231 HydrophobicContact CD1-CG1 3.85Å; L1223-I1231 HydrophobicContact CD2-CG1 3.91Å; A1229-I1231 WeakPolarHBondContact CB-O 3.09Å; I1231-V1395 HydrophobicContact CD1-CG2 3.94Å; I1231-I1400 HydrophobicContact CD1-CD1 3.94Å; I1231-I1400 HydrophobicContact CG1-CD1 4.34Å; I1231-G1406 PolarHBondContact N-O 3.1Å; I1231-G1406 VanDerWaalsContact N-O 3.11Å; I1231-L1407 HydrophobicContact CB-CD1 3.69Å; I1231-L1407 HydrophobicContact CG2-CD1 3.65Å; I1231-L1407 CarbonylContact O-C 3.54Å; I1231-L1407 WeakPolarHBondContact O-CA 3.4Å; I1231-S1408 PolarHBondContact O-N 3.18Å; I1231-F1433 HydrophobicContact CD1-CE1 4.34Å
1232	R	95.8	Very high	92.1	Very high	37.6 Å²	37.6	29.2 Å²	29.2	14%	0.142	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	107.9	173	180	68.7	179.4	159.1	0.6	109.6	H1207 L1209 R1210 L1211 A1229 N1234 S1408 V1410	H1207-R1232 HydrophobicContact CB-CB 4.11Å; L1209-R1232 PolarHBondContact O-N 3.08Å; R1210-R1232 CarbonylContact C-O 3.45Å; R1210-R1232 VanDerWaalsContact CA-O 3.3Å; R1210-R1232 WeakPolarHBondContact CA-O 3.26Å; R1210-R1232 HydrophobicContact CB-CB 4.46Å; R1210-R1232 HydrophobicContact CG-CB 4.44Å; R1210-R1232 HydrophobicContact CG-CG 4.37Å; L1211-R1232 PolarHBondContact N-O 3.04Å; A1229-R1232 HydrophobicContact CB-CB 4.34Å; R1232-N1234 HydrophobicContact CG-CB 4.38Å; R1232-S1408 CarbonylContact C-O 3.56Å; R1232-S1408 VanDerWaalsContact CA-O 3.26Å; R1232-S1408 WeakPolarHBondContact CA-O 3.4Å; R1232-S1408 WeakPolarHBondContact CD-O 3.33Å; R1232-S1408 WeakPolarHBondContact CD-OG 3.47Å; R1232-S1408 PolarHBondContact NH1-O 3.09Å; R1232-S1408 PolarHBondContact NH1-OG 2.85Å; R1232-V1410 VanDerWaalsContact NH2-CG2 3.27Å
1233	Y	95.7	Very high	91.5	Very high	5.2 Å²	5.2	31.7 Å²	31.7	2%	0.02	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	107.8	169.1	-177.4	-100.7	0	0	0	109.3	L1211 V1214 P1235 S1408 G1409 V1410 H1411 L1431	L1211-Y1233 HydrophobicContact CB-CD2 4.1Å; L1211-Y1233 CarbonylContact O-C 3.53Å; L1211-Y1233 WeakPolarHBondContact O-CA 3.26Å; V1214-Y1233 HydrophobicContact CG1-CE2 3.93Å; Y1233-P1235 HydrophobicContact CE1-CB 4.38Å; Y1233-P1235 HydrophobicContact CE1-CG 3.89Å; Y1233-S1408 PolarHBondContact N-O 3.03Å; Y1233-G1409 CarbonylContact O-C 3.54Å; Y1233-G1409 WeakPolarHBondContact O-CA 3.37Å; Y1233-V1410 PolarHBondContact O-N 3.05Å; Y1233-H1411 AromaticContact CD1-CE1 3.83Å; Y1233-H1411 AromaticContact CE1-CE1 3.5Å; Y1233-H1411 VanDerWaalsContact CE1-CE1 3.48Å; Y1233-H1411 WeakPolarHBondContact CE1-CE1 3.3Å; Y1233-H1411 AromaticContact CE1-ND1 3.93Å; Y1233-L1431 HydrophobicContact CD1-CD1 4.36Å; Y1233-L1431 HydrophobicContact CD2-CD2 4.21Å; Y1233-L1431 HydrophobicContact CG-CD1 4.33Å; Y1233-L1431 HydrophobicContact CG-CD2 4.36Å
1234	N	94.2	Very high	91	Very high	17.6 Å²	17.6	33.4 Å²	33.4	9%	0.094	17%	0.165	C	C	.	.			trans	-135.9	96.6	177.3	-176.4	9.7	0	0	0	109.9	R1210 L1211 R1212 R1232 Q1236 V1410 Y1412	R1210-N1234 PolarHBondContact NH2-ND2 3.26Å; L1211-N1234 PolarHBondContact O-N 2.94Å; R1212-N1234 WeakPolarHBondContact CA-O 3.31Å; R1212-N1234 WeakPolarHBondContact CG-O 3.37Å; R1232-N1234 HydrophobicContact CG-CB 4.38Å; N1234-Q1236 PolarHBondContact O-N 3.16Å; N1234-Q1236 WeakPolarHBondContact OD1-CB 3.38Å; N1234-V1410 HydrophobicContact CB-CG2 4.45Å; N1234-Y1412 WeakPolarHBondContact OD1-CE2 3.28Å; N1234-Y1412 PolarHBondContact OD1-OH 2.96Å; N1234-Y1412 VanDerWaalsContact OD1-OH 3.05Å
1235	P	92.5	Very high	90.6	Very high	4.8 Å²	4.8	32.5 Å²	32.5	3%	0.031	16%	0.157	C	C	.	.			trans	-77.6	53.1	-177.4	33.7	-34.6	0	0	0	112.1	R1212 Y1233 V1410 Y1412 L1423 L1424	R1212-P1235 VanDerWaalsContact O-CA 3.26Å; R1212-P1235 WeakPolarHBondContact O-CA 3.29Å; R1212-P1235 WeakPolarHBondContact O-CB 3.37Å; Y1233-P1235 HydrophobicContact CE1-CB 4.38Å; Y1233-P1235 HydrophobicContact CE1-CG 3.89Å; P1235-V1410 WeakPolarHBondContact CD-O 3.31Å; P1235-V1410 WeakPolarHBondContact CG-O 3.31Å; P1235-Y1412 HydrophobicContact CG-CD2 4.08Å; P1235-Y1412 HydrophobicContact CG-CE2 4.27Å; P1235-L1423 CarbonylContact O-C 3.54Å; P1235-L1423 VanDerWaalsContact O-CA 3.3Å; P1235-L1423 WeakPolarHBondContact O-CA 3.27Å; P1235-L1424 HydrophobicContact CB-CB 3.98Å; P1235-L1424 PolarHBondContact O-N 3.17Å
1236	Q	90.6	Very high	90.2	Very high	32 Å²	32	31.9 Å²	31.9	15%	0.15	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.8	177.5	-178.3	-173.1	-1	0	0	110.2	R1212 N1234 Y1412 S1421 V1422 L1423	R1212-Q1236 VanDerWaalsContact CD-O 3.27Å; R1212-Q1236 WeakPolarHBondContact CD-O 3.36Å; R1212-Q1236 PolarHBondContact NE-O 2.89Å; R1212-Q1236 VanDerWaalsContact NE-O 3.1Å; R1212-Q1236 PolarHBondContact NH1-O 3.1Å; N1234-Q1236 PolarHBondContact O-N 3.16Å; N1234-Q1236 WeakPolarHBondContact OD1-CB 3.38Å; Q1236-Y1412 HydrophobicContact CB-CE2 4.07Å; Q1236-Y1412 PolarHBondContact OE1-OH 2.94Å; Q1236-Y1412 VanDerWaalsContact OE1-OH 3.14Å; Q1236-S1421 PolarHBondContact NE2-OG 2.91Å; Q1236-V1422 WeakPolarHBondContact CA-O 3.47Å; Q1236-L1423 HydrophobicContact CB-CD2 4Å; Q1236-L1423 HydrophobicContact CG-CD2 3.85Å
1237	I	91	Very high	89.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.8	172.9	-59	178.8	0	0	0	108.2	I1186 Y1187 M1241 Q1242 S1421 V1422 L1424	I1186-I1237 HydrophobicContact CG2-CD1 3.52Å; I1186-I1237 VanDerWaalsContact CG2-CD1 3.47Å; I1186-I1237 HydrophobicContact CG2-CG1 4.09Å; Y1187-I1237 HydrophobicContact CE1-CD1 3.83Å; Y1187-I1237 HydrophobicContact CE2-CD1 3.76Å; Y1187-I1237 VanDerWaalsContact OH-CD1 3.26Å; Y1187-I1237 WeakPolarHBondContact OH-CD1 3.4Å; I1237-M1241 HydrophobicContact CG2-CB 4.06Å; I1237-M1241 HydrophobicContact CG2-CG 4.3Å; I1237-M1241 HydrophobicContact CG2-SD 4.43Å; I1237-Q1242 HydrophobicContact CG2-CB 3.82Å; I1237-S1421 CarbonylContact O-C 3.54Å; I1237-S1421 WeakPolarHBondContact O-CA 3.32Å; I1237-S1421 WeakPolarHBondContact O-CB 3.42Å; I1237-V1422 HydrophobicContact CB-CB 4.45Å; I1237-V1422 PolarHBondContact N-O 3.11Å; I1237-V1422 PolarHBondContact O-N 3.14Å; I1237-L1424 HydrophobicContact CD1-CD1 3.48Å; I1237-L1424 VanDerWaalsContact CD1-CD1 3.48Å; I1237-L1424 HydrophobicContact CD1-CD2 4.2Å; I1237-L1424 HydrophobicContact CD1-CG 3.91Å; I1237-L1424 HydrophobicContact CG1-CD1 4.15Å; I1237-L1424 HydrophobicContact CG1-CG 4.36Å
1238	T	89.1	Confident	89.2	Confident	64 Å²	64	29.4 Å²	29.4	39%	0.393	14%	0.14	S	C	.	.			trans	-72	151.2	175.5	58.3	0	0	0	0	110.2	K1240 M1241 Q1242	T1238-K1240 VanDerWaalsContact C-N 3.26Å; T1238-K1240 PolarHBondContact O-N 2.81Å; T1238-M1241 PolarHBondContact O-N 3.12Å; T1238-M1241 VanDerWaalsContact O-N 3.07Å; T1238-M1241 VanDerWaalsContact OG1-CB 3.31Å; T1238-M1241 WeakPolarHBondContact OG1-CB 3.25Å; T1238-M1241 PolarHBondContact OG1-N 3.17Å; T1238-Q1242 WeakPolarHBondContact O-CB 3.28Å; T1238-Q1242 PolarHBondContact O-N 3.03Å
1239	Q	83.7	Confident	88.7	Confident	91.2 Å²	91.2	27.9 Å²	27.9	43%	0.426	13%	0.132	S	C	.	.	H	α-helix	trans	-55	-42.3	179.2	-168.1	-176	19.3	0	0	112.1	M1241 Q1242 R1243	Q1239-M1241 VanDerWaalsContact C-N 3.33Å; Q1239-M1241 PolarHBondContact O-N 3.02Å; Q1239-Q1242 WeakPolarHBondContact O-CB 3.14Å; Q1239-Q1242 PolarHBondContact O-N 2.96Å; Q1239-R1243 WeakPolarHBondContact O-CB 3.4Å; Q1239-R1243 WeakPolarHBondContact O-CG 3.38Å; Q1239-R1243 PolarHBondContact O-N 3.11Å
1240	K	84.2	Confident	87.8	Confident	106.4 Å²	106.4	33.3 Å²	33.3	46%	0.463	15%	0.152	S	C	.	.	H	α-helix	trans	-55.7	-47.6	174.5	-174.1	-176.1	-178.3	-172.5	0	111.8	N854 E1156 T1238 R1243 D1244	N854-K1240 WeakPolarHBondContact ND2-CE 3Å; E1156-K1240 IonicContact OE1-NZ 2.93Å; E1156-K1240 PolarHBondContact OE1-NZ 2.98Å; E1156-K1240 IonicContact OE2-NZ 3.21Å; E1156-K1240 PolarHBondContact OE2-NZ 2.92Å; T1238-K1240 VanDerWaalsContact C-N 3.26Å; T1238-K1240 PolarHBondContact O-N 2.81Å; K1240-R1243 PolarHBondContact O-N 2.91Å; K1240-D1244 VanDerWaalsContact O-CB 3.27Å; K1240-D1244 WeakPolarHBondContact O-CB 3.37Å; K1240-D1244 PolarHBondContact O-N 3.12Å
1241	M	88.8	Confident	86.6	Confident	37.6 Å²	37.6	36 Å²	36	19%	0.185	16%	0.163	C	C	.	.	H	α-helix	trans	-68.5	-40.7	-179.5	-170	111.1	-168.3	0	0	111.9	T1162 I1186 R1212 I1237 T1238 Q1239 R1243 D1244 V1245	T1162-M1241 HydrophobicContact CG2-CE 4.13Å; I1186-M1241 HydrophobicContact CD1-CE 3.69Å; I1186-M1241 HydrophobicContact CD1-CG 3.96Å; I1186-M1241 HydrophobicContact CD1-SD 4.03Å; I1186-M1241 VanDerWaalsContact CD1-SD 3.55Å; I1186-M1241 HydrophobicContact CG1-CE 4.33Å; I1186-M1241 HydrophobicContact CG1-SD 4.01Å; R1212-M1241 VanDerWaalsContact CZ-SD 3.5Å; R1212-M1241 PolarHBondContact NH1-SD 3.28Å; R1212-M1241 PolarHBondContact NH2-SD 3.2Å; I1237-M1241 HydrophobicContact CG2-CB 4.06Å; I1237-M1241 HydrophobicContact CG2-CG 4.3Å; I1237-M1241 HydrophobicContact CG2-SD 4.43Å; T1238-M1241 PolarHBondContact O-N 3.12Å; T1238-M1241 VanDerWaalsContact O-N 3.07Å; T1238-M1241 VanDerWaalsContact OG1-CB 3.31Å; T1238-M1241 WeakPolarHBondContact OG1-CB 3.25Å; T1238-M1241 PolarHBondContact OG1-N 3.17Å; Q1239-M1241 VanDerWaalsContact C-N 3.33Å; Q1239-M1241 PolarHBondContact O-N 3.02Å; M1241-R1243 PolarHBondContact O-N 2.76Å; M1241-D1244 PolarHBondContact O-N 3.05Å; M1241-V1245 WeakPolarHBondContact O-CG2 3.41Å; M1241-V1245 PolarHBondContact O-N 3.38Å
1242	Q	87.2	Confident	84.9	Confident	11.8 Å²	11.8	43.7 Å²	43.7	6%	0.055	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-45	177.2	-173.7	162.1	16.5	0	0	111.7	Y1187 I1237 T1238 Q1239 D1244 V1245 S1246 I1322 N1323 V1422	Y1187-Q1242 PolarHBondContact OH-OE1 2.48Å; I1237-Q1242 HydrophobicContact CG2-CB 3.82Å; T1238-Q1242 WeakPolarHBondContact O-CB 3.28Å; T1238-Q1242 PolarHBondContact O-N 3.03Å; Q1239-Q1242 WeakPolarHBondContact O-CB 3.14Å; Q1239-Q1242 PolarHBondContact O-N 2.96Å; Q1242-D1244 VanDerWaalsContact C-N 3.33Å; Q1242-D1244 PolarHBondContact O-N 3.22Å; Q1242-V1245 PolarHBondContact O-N 2.91Å; Q1242-S1246 WeakPolarHBondContact O-CB 3.41Å; Q1242-S1246 PolarHBondContact O-N 3.04Å; Q1242-S1246 VanDerWaalsContact O-N 3.07Å; Q1242-S1246 PolarHBondContact O-OG 3.04Å; Q1242-S1246 VanDerWaalsContact O-OG 3.1Å; Q1242-I1322 PolarHBondContact NE2-O 3.12Å; Q1242-N1323 WeakPolarHBondContact CG-OD1 3.41Å; Q1242-N1323 PolarHBondContact NE2-OD1 3.05Å; Q1242-V1422 HydrophobicContact CG-CG2 4.44Å
1243	R	84	Confident	83.1	Confident	99.8 Å²	99.8	46 Å²	46	38%	0.377	22%	0.219	S	C	.	.	H	α-helix	trans	-59.9	-46	174	-113.9	179.8	171.5	170.5	-1	111	E855 Q1239 K1240 M1241 V1245 S1246 S1247 E1375	E855-R1243 VanDerWaalsContact CD-NH2 3.3Å; E855-R1243 IonicContact OE1-CZ 3.41Å; E855-R1243 IonicContact OE1-NE 3.48Å; E855-R1243 PolarHBondContact OE1-NE 2.85Å; E855-R1243 IonicContact OE1-NH1 2.78Å; E855-R1243 IonicContact OE1-NH2 3.02Å; E855-R1243 PolarHBondContact OE1-NH2 3.13Å; E855-R1243 IonicContact OE2-CZ 3.2Å; E855-R1243 VanDerWaalsContact OE2-CZ 3.28Å; E855-R1243 IonicContact OE2-NE 3.08Å; E855-R1243 PolarHBondContact OE2-NE 3.39Å; E855-R1243 IonicContact OE2-NH2 3.29Å; E855-R1243 PolarHBondContact OE2-NH2 3.13Å; Q1239-R1243 WeakPolarHBondContact O-CB 3.4Å; Q1239-R1243 WeakPolarHBondContact O-CG 3.38Å; Q1239-R1243 PolarHBondContact O-N 3.11Å; K1240-R1243 PolarHBondContact O-N 2.91Å; M1241-R1243 PolarHBondContact O-N 2.76Å; R1243-V1245 VanDerWaalsContact C-N 3.32Å; R1243-V1245 PolarHBondContact O-N 3.25Å; R1243-S1246 WeakPolarHBondContact CA-OG 3.47Å; R1243-S1246 CarbonylContact O-C 3.6Å; R1243-S1246 PolarHBondContact O-N 2.92Å; R1243-S1246 PolarHBondContact O-OG 3.26Å; R1243-S1247 VanDerWaalsContact O-CB 3.27Å; R1243-S1247 WeakPolarHBondContact O-CB 3.35Å; R1243-S1247 PolarHBondContact O-N 3Å; R1243-S1247 PolarHBondContact O-OG 3.01Å; R1243-E1375 IonicContact CZ-OE1 3.4Å; R1243-E1375 IonicContact NE-OE1 3.14Å; R1243-E1375 IonicContact NH2-OE1 3.17Å; R1243-E1375 PolarHBondContact NH2-OE1 3.04Å
1244	D	86.5	Confident	81.1	Confident	35.8 Å²	35.8	46.9 Å²	46.9	19%	0.191	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-34	179.7	-177.1	47.5	0	0	0	113.5	H856 R1123 K1240 M1241 Q1242 S1246 S1247 W1248	H856-D1244 IonicContact CD2-OD1 3.93Å; H856-D1244 PolarHBondContact CD2-OD1 3.23Å; H856-D1244 PolarHBondContact CE1-O 3.24Å; H856-D1244 VanDerWaalsContact CE1-O 3.24Å; H856-D1244 IonicContact CE1-OD1 2.71Å; H856-D1244 PolarHBondContact CE1-OD1 3.3Å; H856-D1244 IonicContact ND1-OD1 3.14Å; H856-D1244 PolarHBondContact ND1-OD1 3.08Å; H856-D1244 VanDerWaalsContact ND1-OD1 3.09Å; H856-D1244 PolarHBondContact NE2-O 2.87Å; H856-D1244 IonicContact NE2-OD1 2.74Å; H856-D1244 PolarHBondContact NE2-OD1 2.92Å; R1123-D1244 IonicContact CZ-OD2 3.44Å; R1123-D1244 IonicContact NH1-OD1 2.81Å; R1123-D1244 IonicContact NH1-OD2 3.5Å; R1123-D1244 PolarHBondContact NH1-OD2 3.37Å; R1123-D1244 IonicContact NH2-OD1 3.1Å; R1123-D1244 IonicContact NH2-OD2 3.22Å; R1123-D1244 PolarHBondContact NH2-OD2 3.05Å; K1240-D1244 VanDerWaalsContact O-CB 3.27Å; K1240-D1244 WeakPolarHBondContact O-CB 3.37Å; K1240-D1244 PolarHBondContact O-N 3.12Å; M1241-D1244 PolarHBondContact O-N 3.05Å; Q1242-D1244 VanDerWaalsContact C-N 3.33Å; Q1242-D1244 PolarHBondContact O-N 3.22Å; D1244-S1246 PolarHBondContact O-N 2.63Å; D1244-S1247 WeakPolarHBondContact CA-OG 3.17Å; D1244-S1247 PolarHBondContact O-N 2.73Å; D1244-S1247 PolarHBondContact O-OG 3.11Å; D1244-W1248 VanDerWaalsContact O-CD1 3.24Å; D1244-W1248 PolarHBondContact O-NE1 2.99Å
1245	V	87.3	Confident	79.1	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-72	-45.5	172.2	173.3	0	0	0	0	111.5	L1126 D1164 I1186 Y1187 M1241 Q1242 R1243 S1247	L1126-V1245 HydrophobicContact CB-CG1 4.39Å; L1126-V1245 HydrophobicContact CD2-CG1 4.49Å; D1164-V1245 HydrophobicContact CB-CG1 4.31Å; D1164-V1245 HydrophobicContact CB-CG2 4.1Å; I1186-V1245 HydrophobicContact CD1-CG2 3.99Å; Y1187-V1245 HydrophobicContact CD2-CG1 4.34Å; Y1187-V1245 HydrophobicContact CE2-CG1 4.27Å; M1241-V1245 WeakPolarHBondContact O-CG2 3.41Å; M1241-V1245 PolarHBondContact O-N 3.38Å; Q1242-V1245 PolarHBondContact O-N 2.91Å; R1243-V1245 VanDerWaalsContact C-N 3.32Å; R1243-V1245 PolarHBondContact O-N 3.25Å; V1245-S1247 VanDerWaalsContact C-N 3.33Å; V1245-S1247 PolarHBondContact O-N 3.38Å
1246	S	84.8	Confident	77.3	Confident	7.4 Å²	7.4	52.8 Å²	52.8	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-76.4	-27.6	-174.9	62.5	0	0	0	0	113.9	Q1242 R1243 D1244 W1248 L1249	Q1242-S1246 WeakPolarHBondContact O-CB 3.41Å; Q1242-S1246 PolarHBondContact O-N 3.04Å; Q1242-S1246 VanDerWaalsContact O-N 3.07Å; Q1242-S1246 PolarHBondContact O-OG 3.04Å; Q1242-S1246 VanDerWaalsContact O-OG 3.1Å; R1243-S1246 WeakPolarHBondContact CA-OG 3.47Å; R1243-S1246 CarbonylContact O-C 3.6Å; R1243-S1246 PolarHBondContact O-N 2.92Å; R1243-S1246 PolarHBondContact O-OG 3.26Å; D1244-S1246 PolarHBondContact O-N 2.63Å; S1246-W1248 VanDerWaalsContact C-N 3.28Å; S1246-W1248 PolarHBondContact O-N 3.1Å; S1246-L1249 WeakPolarHBondContact O-CB 3.3Å; S1246-L1249 PolarHBondContact O-N 3.05Å; S1246-L1249 VanDerWaalsContact O-N 3.13Å
1247	S	82.9	Confident	75.5	Confident	18.2 Å²	18.2	57.3 Å²	57.3	13%	0.127	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-67.1	-24.9	-177.4	60.3	0	0	0	0	113.3	H856 A857 R1243 D1244 V1245 L1249 R1250 R1251	H856-S1247 PolarHBondContact CE1-OG 2.9Å; H856-S1247 PolarHBondContact NE2-OG 3.22Å; H856-S1247 VanDerWaalsContact NE2-OG 3.15Å; A857-S1247 WeakPolarHBondContact CB-O 3.28Å; R1243-S1247 VanDerWaalsContact O-CB 3.27Å; R1243-S1247 WeakPolarHBondContact O-CB 3.35Å; R1243-S1247 PolarHBondContact O-N 3Å; R1243-S1247 PolarHBondContact O-OG 3.01Å; D1244-S1247 WeakPolarHBondContact CA-OG 3.17Å; D1244-S1247 PolarHBondContact O-N 2.73Å; D1244-S1247 PolarHBondContact O-OG 3.11Å; V1245-S1247 VanDerWaalsContact C-N 3.33Å; V1245-S1247 PolarHBondContact O-N 3.38Å; S1247-L1249 PolarHBondContact O-N 3.16Å; S1247-L1249 VanDerWaalsContact O-N 3.13Å; S1247-R1250 PolarHBondContact O-N 3.19Å; S1247-R1250 VanDerWaalsContact O-N 3.08Å; S1247-R1251 PolarHBondContact O-N 2.88Å
1248	W	80.2	Confident	73.8	Confident	12.2 Å²	12.2	64.5 Å²	64.5	5%	0.046	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-56.5	-29.1	171.9	-72.9	111.4	0	0	0	113.3	H856 L972 Q974 S1125 L1127 D1244 S1246 R1250	H856-W1248 HydrophobicContact CB-CH2 4.01Å; H856-W1248 HydrophobicContact CB-CZ2 4.17Å; H856-W1248 HydrophobicContact CB-CZ3 4.38Å; H856-W1248 AromaticContact CD2-CD2 3.27Å; H856-W1248 AromaticContact CD2-CE2 3.49Å; H856-W1248 AromaticContact CD2-CE3 3.33Å; H856-W1248 AromaticContact CD2-CG 3.96Å; H856-W1248 AromaticContact CD2-CH2 3.45Å; H856-W1248 WeakPolarHBondContact CD2-CH2 3.24Å; H856-W1248 AromaticContact CD2-CZ2 3.47Å; H856-W1248 VanDerWaalsContact CD2-CZ2 3.49Å; H856-W1248 WeakPolarHBondContact CD2-CZ2 3.31Å; H856-W1248 AromaticContact CD2-CZ3 3.45Å; H856-W1248 VanDerWaalsContact CD2-CZ3 3.45Å; H856-W1248 WeakPolarHBondContact CD2-CZ3 3.38Å; H856-W1248 AromaticContact CD2-NE1 3.78Å; H856-W1248 AromaticContact CE1-CD1 3.84Å; H856-W1248 AromaticContact CE1-CD2 3.51Å; H856-W1248 AromaticContact CE1-CE2 3.52Å; H856-W1248 VanDerWaalsContact CE1-CE2 3.47Å; H856-W1248 AromaticContact CE1-CE3 3.47Å; H856-W1248 VanDerWaalsContact CE1-CE3 3.47Å; H856-W1248 AromaticContact CE1-CG 3.61Å; H856-W1248 AromaticContact CE1-CH2 3.97Å; H856-W1248 AromaticContact CE1-CZ2 3.82Å; H856-W1248 AromaticContact CE1-CZ3 3.86Å; H856-W1248 AromaticContact CE1-NE1 3.56Å; H856-W1248 PolarHBondContact CE1-NE1 2.92Å; H856-W1248 AromaticContact CG-CE2 3.82Å; H856-W1248 AromaticContact CG-CH2 3.71Å; H856-W1248 AromaticContact CG-CZ2 3.62Å; H856-W1248 AromaticContact CG-CZ3 3.89Å; H856-W1248 AromaticContact ND1-CD2 3.62Å; H856-W1248 AromaticContact ND1-CE2 3.8Å; H856-W1248 AromaticContact ND1-CE3 3.39Å; H856-W1248 AromaticContact ND1-CH2 3.6Å; H856-W1248 AromaticContact ND1-CZ2 3.79Å; H856-W1248 AromaticContact ND1-CZ3 3.39Å; H856-W1248 WeakPolarHBondContact ND1-CZ3 3.33Å; H856-W1248 AromaticContact ND1-NE1 3.99Å; H856-W1248 AromaticContact NE2-CD1 3.44Å; H856-W1248 AromaticContact NE2-CD2 3.33Å; H856-W1248 AromaticContact NE2-CE2 3.24Å; H856-W1248 AromaticContact NE2-CE3 3.65Å; H856-W1248 AromaticContact NE2-CG 3.32Å; H856-W1248 VanDerWaalsContact NE2-CG 3.32Å; H856-W1248 AromaticContact NE2-CZ2 3.72Å; H856-W1248 PolarHBondContact NE2-N 3.13Å; H856-W1248 AromaticContact NE2-NE1 3.4Å; H856-W1248 PolarHBondContact NE2-NE1 2.82Å; L972-W1248 HydrophobicContact CD1-CZ2 4.25Å; L972-W1248 HydrophobicContact CD2-CH2 3.53Å; L972-W1248 VanDerWaalsContact CD2-CH2 3.41Å; L972-W1248 HydrophobicContact CD2-CZ2 3.51Å; L972-W1248 VanDerWaalsContact CD2-CZ2 3.46Å; L972-W1248 HydrophobicContact CD2-CZ3 4.37Å; Q974-W1248 VanDerWaalsContact NE2-CZ3 3.32Å; S1125-W1248 VanDerWaalsContact OG-CD1 3.3Å; S1125-W1248 PolarHBondContact OG-NE1 3.06Å; L1127-W1248 HydrophobicContact CD1-CB 4.19Å; L1127-W1248 HydrophobicContact CD1-CE3 4.4Å; L1127-W1248 HydrophobicContact CG-CB 4.28Å; D1244-W1248 VanDerWaalsContact O-CD1 3.24Å; D1244-W1248 PolarHBondContact O-NE1 2.99Å; S1246-W1248 VanDerWaalsContact C-N 3.28Å; S1246-W1248 PolarHBondContact O-N 3.1Å; W1248-R1250 VanDerWaalsContact C-N 3.32Å; W1248-R1250 PolarHBondContact O-N 3.14Å
1249	L	78.9	Confident	72.6	Confident	1.6 Å²	1.6	63.3 Å²	63.3	1%	0.008	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-79.9	-13.9	179.1	-59	171.7	0	0	0	113.8	L1126 L1127 S1246 S1247 R1251 F1256 L1261 Y1282 I1284 I1322 A1377	L1126-L1249 HydrophobicContact CD2-CD1 3.81Å; L1126-L1249 HydrophobicContact CD2-CD2 3.69Å; L1126-L1249 VanDerWaalsContact CD2-CD2 3.49Å; L1126-L1249 HydrophobicContact CD2-CG 3.7Å; L1126-L1249 HydrophobicContact CG-CD2 4.34Å; L1127-L1249 HydrophobicContact CD2-CD2 3.95Å; S1246-L1249 WeakPolarHBondContact O-CB 3.3Å; S1246-L1249 PolarHBondContact O-N 3.05Å; S1246-L1249 VanDerWaalsContact O-N 3.13Å; S1247-L1249 PolarHBondContact O-N 3.16Å; S1247-L1249 VanDerWaalsContact O-N 3.13Å; L1249-R1251 VanDerWaalsContact C-N 3.33Å; L1249-F1256 HydrophobicContact CD2-CE1 4.22Å; L1249-F1256 HydrophobicContact CD2-CZ 3.86Å; L1249-L1261 HydrophobicContact CB-CD1 4.41Å; L1249-L1261 HydrophobicContact CD2-CD1 4.2Å; L1249-L1261 VanDerWaalsContact O-CD2 3.3Å; L1249-L1261 WeakPolarHBondContact O-CD2 3.32Å; L1249-Y1282 HydrophobicContact CD1-CD1 4.26Å; L1249-Y1282 HydrophobicContact CD2-CD1 3.94Å; L1249-Y1282 HydrophobicContact CD2-CD2 4.46Å; L1249-Y1282 HydrophobicContact CD2-CE1 4.29Å; L1249-Y1282 HydrophobicContact CD2-CG 4.07Å; L1249-I1284 HydrophobicContact CB-CD1 3.26Å; L1249-I1284 HydrophobicContact CD1-CD1 3.8Å; L1249-I1284 HydrophobicContact CD1-CG1 4.37Å; L1249-I1284 HydrophobicContact CD2-CD1 4.48Å; L1249-I1284 HydrophobicContact CG-CD1 4.09Å; L1249-I1322 HydrophobicContact CD1-CD1 3.94Å; L1249-I1322 HydrophobicContact CD1-CG2 4.21Å; L1249-A1377 HydrophobicContact CD1-CB 4.3Å
1250	R	74.2	Confident	72.1	Confident	112 Å²	112	59.4 Å²	59.4	42%	0.423	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-97.4	5.8	-177	-66.7	-174.5	175.5	173.5	-1.3	113.5	S1247 W1248 I1284 A1285 N1323 A1374 E1375	S1247-R1250 PolarHBondContact O-N 3.19Å; S1247-R1250 VanDerWaalsContact O-N 3.08Å; W1248-R1250 VanDerWaalsContact C-N 3.32Å; W1248-R1250 PolarHBondContact O-N 3.14Å; R1250-I1284 HydrophobicContact CG-CG2 4.36Å; R1250-A1285 PolarHBondContact NH2-O 3.12Å; R1250-N1323 PolarHBondContact NH2-ND2 3.42Å; R1250-A1374 PolarHBondContact NH1-O 2.7Å; R1250-A1374 PolarHBondContact NH2-O 3.28Å; R1250-E1375 VanDerWaalsContact NH2-CA 3.3Å; R1250-E1375 PolarHBondContact NH2-O 3.24Å
1251	R	69.8	Low	71.7	Confident	58 Å²	58	56.1 Å²	56.1	22%	0.219	29%	0.29	C	S	.	.			trans	-82.8	128.9	-175.5	-147.2	-178.8	135.3	172.4	3.1	110.4	Q882 S1247 L1249 D1253 A1254	Q882-R1251 VanDerWaalsContact OE1-NH1 3.13Å; S1247-R1251 PolarHBondContact O-N 2.88Å; L1249-R1251 VanDerWaalsContact C-N 3.33Å; R1251-D1253 VanDerWaalsContact C-N 3.28Å; R1251-D1253 HydrophobicContact CG-CB 4.13Å; R1251-D1253 IonicContact CZ-OD2 3.35Å; R1251-D1253 IonicContact NE-OD2 3.31Å; R1251-D1253 PolarHBondContact NE-OD2 2.93Å; R1251-D1253 VanDerWaalsContact NE-OD2 3.15Å; R1251-D1253 PolarHBondContact NH2-O 3.08Å; R1251-D1253 VanDerWaalsContact NH2-O 3.14Å; R1251-D1253 IonicContact NH2-OD2 3.87Å; R1251-D1253 PolarHBondContact NH2-OD2 3.22Å; R1251-D1253 PolarHBondContact O-N 2.94Å; R1251-A1254 HydrophobicContact CB-CB 4.25Å; R1251-A1254 VanDerWaalsContact O-CB 3.25Å; R1251-A1254 WeakPolarHBondContact O-CB 3.41Å; R1251-A1254 PolarHBondContact O-N 3.09Å; R1251-A1254 VanDerWaalsContact O-N 3.14Å
1252	D	61.6	Low	71.3	Confident	163.4 Å²	163.4	55.1 Å²	55.1	87%	0.874	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.9	174.9	-67.4	-27.6	0	0	0	112.5	A1254	D1252-A1254 VanDerWaalsContact C-N 3.26Å; D1252-A1254 PolarHBondContact O-N 3Å
1253	D	58.7	Low	70.8	Confident	85.8 Å²	85.8	58.4 Å²	58.4	46%	0.459	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	9.3	177.6	-61.4	-20.3	0	0	0	112.4	K890 R1251 V1255	K890-D1253 IonicContact NZ-OD1 3.18Å; K890-D1253 IonicContact NZ-OD2 3.34Å; K890-D1253 PolarHBondContact NZ-OD2 2.9Å; R1251-D1253 VanDerWaalsContact C-N 3.28Å; R1251-D1253 HydrophobicContact CG-CB 4.13Å; R1251-D1253 IonicContact CZ-OD2 3.35Å; R1251-D1253 IonicContact NE-OD2 3.31Å; R1251-D1253 PolarHBondContact NE-OD2 2.93Å; R1251-D1253 VanDerWaalsContact NE-OD2 3.15Å; R1251-D1253 PolarHBondContact NH2-O 3.08Å; R1251-D1253 VanDerWaalsContact NH2-O 3.14Å; R1251-D1253 IonicContact NH2-OD2 3.87Å; R1251-D1253 PolarHBondContact NH2-OD2 3.22Å; R1251-D1253 PolarHBondContact O-N 2.94Å; D1253-V1255 VanDerWaalsContact C-N 3.29Å; D1253-V1255 HydrophobicContact CB-CG2 4.24Å; D1253-V1255 PolarHBondContact O-N 2.85Å
1254	A	52.4	Low	70.5	Confident	24.8 Å²	24.8	53.9 Å²	53.9	21%	0.205	29%	0.286	C	S	.	.			trans	-71	84.9	-180	0	0	0	0	0	110.2	L1127 R1251 D1252 F1256 H1257	L1127-A1254 HydrophobicContact CD1-CB 4.2Å; R1251-A1254 HydrophobicContact CB-CB 4.25Å; R1251-A1254 VanDerWaalsContact O-CB 3.25Å; R1251-A1254 WeakPolarHBondContact O-CB 3.41Å; R1251-A1254 PolarHBondContact O-N 3.09Å; R1251-A1254 VanDerWaalsContact O-N 3.14Å; D1252-A1254 VanDerWaalsContact C-N 3.26Å; D1252-A1254 PolarHBondContact O-N 3Å; A1254-F1256 VanDerWaalsContact C-N 3.29Å; A1254-F1256 HydrophobicContact CB-CD2 3.7Å; A1254-F1256 HydrophobicContact CB-CE2 3.49Å; A1254-F1256 VanDerWaalsContact CB-CE2 3.49Å; A1254-F1256 HydrophobicContact CB-CZ 4.4Å; A1254-F1256 WeakPolarHBondContact O-CD2 3.36Å; A1254-F1256 PolarHBondContact O-N 2.91Å; A1254-H1257 WeakPolarHBondContact CB-NE2 3.43Å; A1254-H1257 PolarHBondContact O-CD2 3.02Å; A1254-H1257 PolarHBondContact O-NE2 2.78Å
1255	V	52.8	Low	69.7	Low	105.8 Å²	105.8	55.2 Å²	55.2	64%	0.641	30%	0.296	S	S	*	.			trans	-66.5	61.3	173	-178.2	0	0	0	0	109.1	P951 D1253 H1257	P951-V1255 HydrophobicContact CB-CG1 3.57Å; P951-V1255 HydrophobicContact CG-CG1 3.61Å; D1253-V1255 VanDerWaalsContact C-N 3.29Å; D1253-V1255 HydrophobicContact CB-CG2 4.24Å; D1253-V1255 PolarHBondContact O-N 2.85Å; V1255-H1257 WeakPolarHBondContact CG1-CE1 3.34Å; V1255-H1257 WeakPolarHBondContact CG1-ND1 3.37Å; V1255-H1257 VanDerWaalsContact CG1-NE2 3.3Å; V1255-H1257 WeakPolarHBondContact CG1-NE2 3.33Å; V1255-H1257 PolarHBondContact O-N 2.89Å
1256	F	55.5	Low	68.6	Low	39.4 Å²	39.4	59.9 Å²	59.9	17%	0.173	32%	0.318	C	S	.	.			trans	-76.9	112.7	165.1	-70.1	-79.8	0	0	0	108.7	L1127 L1249 A1254 D1258 G1259 S1260 L1261 Y1282	L1127-F1256 HydrophobicContact CD1-CZ 4.24Å; L1127-F1256 HydrophobicContact CD2-CE1 3.77Å; L1127-F1256 HydrophobicContact CD2-CE2 4.31Å; L1127-F1256 HydrophobicContact CD2-CZ 3.44Å; L1127-F1256 VanDerWaalsContact CD2-CZ 3.44Å; L1127-F1256 HydrophobicContact CG-CZ 4.44Å; L1249-F1256 HydrophobicContact CD2-CE1 4.22Å; L1249-F1256 HydrophobicContact CD2-CZ 3.86Å; A1254-F1256 VanDerWaalsContact C-N 3.29Å; A1254-F1256 HydrophobicContact CB-CD2 3.7Å; A1254-F1256 HydrophobicContact CB-CE2 3.49Å; A1254-F1256 VanDerWaalsContact CB-CE2 3.49Å; A1254-F1256 HydrophobicContact CB-CZ 4.4Å; A1254-F1256 WeakPolarHBondContact O-CD2 3.36Å; A1254-F1256 PolarHBondContact O-N 2.91Å; F1256-D1258 PolarHBondContact O-N 3.24Å; F1256-D1258 VanDerWaalsContact O-N 3.08Å; F1256-G1259 PolarHBondContact O-N 3.44Å; F1256-G1259 VanDerWaalsContact O-N 3.11Å; F1256-S1260 WeakPolarHBondContact CB-OG 3.19Å; F1256-S1260 WeakPolarHBondContact CD1-OG 3.47Å; F1256-L1261 HydrophobicContact CB-CB 4.14Å; F1256-L1261 HydrophobicContact CD1-CB 4.19Å; F1256-L1261 HydrophobicContact CD2-CB 3.83Å; F1256-L1261 VanDerWaalsContact CD2-CB 3.5Å; F1256-L1261 HydrophobicContact CD2-CD1 4.32Å; F1256-L1261 HydrophobicContact CD2-CD2 3.76Å; F1256-L1261 HydrophobicContact CD2-CG 4.25Å; F1256-L1261 HydrophobicContact CE1-CB 4.43Å; F1256-L1261 HydrophobicContact CE1-CD1 4.33Å; F1256-L1261 HydrophobicContact CE2-CB 4.11Å; F1256-L1261 HydrophobicContact CE2-CD1 4.22Å; F1256-L1261 HydrophobicContact CE2-CD2 3.8Å; F1256-L1261 HydrophobicContact CE2-CG 4.34Å; F1256-L1261 HydrophobicContact CG-CB 3.9Å; F1256-L1261 VanDerWaalsContact CG-CB 3.49Å; F1256-L1261 HydrophobicContact CG-CD2 4.09Å; F1256-L1261 HydrophobicContact CG-CG 4.41Å; F1256-L1261 HydrophobicContact CZ-CB 4.23Å; F1256-L1261 HydrophobicContact CZ-CD1 4.02Å; F1256-L1261 HydrophobicContact CZ-CD2 4.46Å; F1256-Y1282 HydrophobicContact CD1-CD2 4.48Å; F1256-Y1282 AromaticContact CE1-CD2 3.93Å; F1256-Y1282 HydrophobicContact CE1-CD2 4.15Å; F1256-Y1282 HydrophobicContact CE1-CE2 4.13Å
1257	H	51.8	Low	68	Low	127.8 Å²	127.8	62 Å²	62	59%	0.592	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	95.6	168.3	-73.3	-35.1	0	0	0	110.2	A1254 V1255 G1259 S1260 E1278	A1254-H1257 WeakPolarHBondContact CB-NE2 3.43Å; A1254-H1257 PolarHBondContact O-CD2 3.02Å; A1254-H1257 PolarHBondContact O-NE2 2.78Å; V1255-H1257 WeakPolarHBondContact CG1-CE1 3.34Å; V1255-H1257 WeakPolarHBondContact CG1-ND1 3.37Å; V1255-H1257 VanDerWaalsContact CG1-NE2 3.3Å; V1255-H1257 WeakPolarHBondContact CG1-NE2 3.33Å; V1255-H1257 PolarHBondContact O-N 2.89Å; H1257-G1259 PolarHBondContact O-N 3.06Å; H1257-G1259 VanDerWaalsContact O-N 3.11Å; H1257-S1260 PolarHBondContact N-OG 3.01Å; H1257-S1260 PolarHBondContact O-N 2.88Å; H1257-S1260 VanDerWaalsContact O-N 3.11Å; H1257-S1260 PolarHBondContact O-OG 3.05Å; H1257-S1260 VanDerWaalsContact O-OG 3.07Å; H1257-E1278 IonicContact CD2-OE1 2.92Å; H1257-E1278 PolarHBondContact CD2-OE1 3.33Å; H1257-E1278 VanDerWaalsContact CD2-OE1 3.23Å; H1257-E1278 IonicContact CG-OE1 2.74Å
1258	D	55.9	Low	67.8	Low	151 Å²	151	66.4 Å²	66.4	81%	0.807	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	75.8	-176	-74.1	-20.8	0	0	0	112.4	F1256 S1260 Y1277	F1256-D1258 PolarHBondContact O-N 3.24Å; F1256-D1258 VanDerWaalsContact O-N 3.08Å; D1258-S1260 VanDerWaalsContact C-N 3.25Å; D1258-S1260 PolarHBondContact O-N 3.18Å; D1258-Y1277 HydrophobicContact CB-CD1 3.94Å; D1258-Y1277 WeakPolarHBondContact OD2-CD1 3.34Å; D1258-Y1277 VanDerWaalsContact OD2-CE1 3.27Å; D1258-Y1277 WeakPolarHBondContact OD2-CE1 3.48Å
1259	G	63.8	Low	67.9	Low	37.8 Å²	37.8	70.6 Å²	70.6	39%	0.39	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	12.1	175.7	0	0	0	0	0	116.2	F1256 H1257 L1262 K1281	F1256-G1259 PolarHBondContact O-N 3.44Å; F1256-G1259 VanDerWaalsContact O-N 3.11Å; H1257-G1259 PolarHBondContact O-N 3.06Å; H1257-G1259 VanDerWaalsContact O-N 3.11Å; G1259-L1262 WeakPolarHBondContact O-CD2 3.37Å; G1259-K1281 VanDerWaalsContact C-NZ 3.33Å; G1259-K1281 VanDerWaalsContact O-CD 3.24Å; G1259-K1281 WeakPolarHBondContact O-CD 3.23Å; G1259-K1281 WeakPolarHBondContact O-CE 3.28Å; G1259-K1281 PolarHBondContact O-NZ 3Å
1260	S	72.1	Confident	68.1	Low	10.4 Å²	10.4	71 Å²	71	7%	0.073	39%	0.389	C	S	.	.			trans	-76.8	-25.9	174.3	55	0	0	0	0	113.5	F1256 H1257 D1258 E1278 K1281 Y1282	F1256-S1260 WeakPolarHBondContact CB-OG 3.19Å; F1256-S1260 WeakPolarHBondContact CD1-OG 3.47Å; H1257-S1260 PolarHBondContact N-OG 3.01Å; H1257-S1260 PolarHBondContact O-N 2.88Å; H1257-S1260 VanDerWaalsContact O-N 3.11Å; H1257-S1260 PolarHBondContact O-OG 3.05Å; H1257-S1260 VanDerWaalsContact O-OG 3.07Å; D1258-S1260 VanDerWaalsContact C-N 3.25Å; D1258-S1260 PolarHBondContact O-N 3.18Å; S1260-E1278 WeakPolarHBondContact CB-OE2 3.45Å; S1260-E1278 PolarHBondContact OG-OE2 3.29Å; S1260-E1278 VanDerWaalsContact OG-OE2 3.11Å; S1260-K1281 CarbonylContact O-C 3.52Å; S1260-K1281 VanDerWaalsContact O-CA 3.3Å; S1260-K1281 WeakPolarHBondContact O-CA 3.15Å; S1260-Y1282 PolarHBondContact O-N 3.02Å
1261	L	76.7	Confident	68.5	Low	37.2 Å²	37.2	68.7 Å²	68.7	20%	0.195	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.9	173.7	-176.7	70.7	0	0	0	110.4	L1249 F1256 I1263 I1284	L1249-L1261 HydrophobicContact CB-CD1 4.41Å; L1249-L1261 HydrophobicContact CD2-CD1 4.2Å; L1249-L1261 VanDerWaalsContact O-CD2 3.3Å; L1249-L1261 WeakPolarHBondContact O-CD2 3.32Å; F1256-L1261 HydrophobicContact CB-CB 4.14Å; F1256-L1261 HydrophobicContact CD1-CB 4.19Å; F1256-L1261 HydrophobicContact CD2-CB 3.83Å; F1256-L1261 VanDerWaalsContact CD2-CB 3.5Å; F1256-L1261 HydrophobicContact CD2-CD1 4.32Å; F1256-L1261 HydrophobicContact CD2-CD2 3.76Å; F1256-L1261 HydrophobicContact CD2-CG 4.25Å; F1256-L1261 HydrophobicContact CE1-CB 4.43Å; F1256-L1261 HydrophobicContact CE1-CD1 4.33Å; F1256-L1261 HydrophobicContact CE2-CB 4.11Å; F1256-L1261 HydrophobicContact CE2-CD1 4.22Å; F1256-L1261 HydrophobicContact CE2-CD2 3.8Å; F1256-L1261 HydrophobicContact CE2-CG 4.34Å; F1256-L1261 HydrophobicContact CG-CB 3.9Å; F1256-L1261 VanDerWaalsContact CG-CB 3.49Å; F1256-L1261 HydrophobicContact CG-CD2 4.09Å; F1256-L1261 HydrophobicContact CG-CG 4.41Å; F1256-L1261 HydrophobicContact CZ-CB 4.23Å; F1256-L1261 HydrophobicContact CZ-CD1 4.02Å; F1256-L1261 HydrophobicContact CZ-CD2 4.46Å; L1261-I1263 HydrophobicContact CG-CG1 4.46Å; L1261-I1284 HydrophobicContact CD1-CD1 3.29Å; L1261-I1284 HydrophobicContact CD1-CG1 3.96Å; L1261-I1284 HydrophobicContact CD2-CD1 4.48Å; L1261-I1284 HydrophobicContact CG-CD1 4.15Å
1262	L	79.2	Confident	69	Low	16 Å²	16	66 Å²	66	8%	0.084	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	119.2	-179.6	-56.1	176.5	0	0	0	109.4	G1259 H1266 I1270 K1281 Y1282 L1283 I1284	G1259-L1262 WeakPolarHBondContact O-CD2 3.37Å; L1262-H1266 WeakPolarHBondContact CD2-CD2 3.35Å; L1262-H1266 WeakPolarHBondContact CD2-NE2 3.46Å; L1262-I1270 HydrophobicContact CD1-CB 4.43Å; L1262-I1270 HydrophobicContact CD1-CD1 3.41Å; L1262-I1270 VanDerWaalsContact CD1-CD1 3.44Å; L1262-I1270 HydrophobicContact CD1-CG1 3.76Å; L1262-I1270 HydrophobicContact CD1-CG2 4.15Å; L1262-K1281 HydrophobicContact CD1-CB 3.96Å; L1262-K1281 HydrophobicContact CD1-CD 4.26Å; L1262-K1281 HydrophobicContact CD1-CG 4.18Å; L1262-K1281 HydrophobicContact CG-CB 4.47Å; L1262-Y1282 PolarHBondContact N-O 3.33Å; L1262-L1283 HydrophobicContact CB-CD1 3.99Å; L1262-L1283 CarbonylContact O-C 3.58Å; L1262-L1283 WeakPolarHBondContact O-CA 3.26Å; L1262-I1284 PolarHBondContact O-N 3.14Å
1263	I	78.2	Confident	69.5	Low	80.4 Å²	80.4	60.4 Å²	60.4	41%	0.412	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.8	-179.7	-58.5	173.6	0	0	0	108.9	L1261 P1265 H1266 I1284 S1286	L1261-I1263 HydrophobicContact CG-CG1 4.46Å; I1263-P1265 CarbonylContact O-C 3.58Å; I1263-P1265 VanDerWaalsContact O-C 3.25Å; I1263-H1266 VanDerWaalsContact O-CB 3.3Å; I1263-H1266 WeakPolarHBondContact O-CB 3.4Å; I1263-H1266 PolarHBondContact O-CD2 2.85Å; I1263-H1266 PolarHBondContact O-N 3.18Å; I1263-I1284 CarbonylContact C-O 3.48Å; I1263-I1284 WeakPolarHBondContact CA-O 3.37Å; I1263-S1286 VanDerWaalsContact CG2-CB 3.45Å
1264	M	76.8	Confident	69.9	Low	5.6 Å²	5.6	58.8 Å²	58.8	3%	0.028	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	135.4	176.8	-67.4	-176.1	-74.1	0	0	111.1	L1283 I1284 A1285 S1289 Y1300 L1302 L1333 Y1367 V1376	M1264-L1283 HydrophobicContact CE-CD2 4.27Å; M1264-L1283 HydrophobicContact CE-CG 3.96Å; M1264-L1283 HydrophobicContact CG-CD1 3.4Å; M1264-L1283 VanDerWaalsContact CG-CD1 3.43Å; M1264-L1283 HydrophobicContact CG-CD2 4.27Å; M1264-L1283 HydrophobicContact CG-CG 3.76Å; M1264-L1283 HydrophobicContact SD-CD1 3.97Å; M1264-L1283 HydrophobicContact SD-CD2 3.68Å; M1264-L1283 VanDerWaalsContact SD-CD2 3.59Å; M1264-L1283 HydrophobicContact SD-CG 3.7Å; M1264-I1284 PolarHBondContact N-O 3.05Å; M1264-A1285 HydrophobicContact CE-CB 3.89Å; M1264-S1289 PolarHBondContact O-OG 3.4Å; M1264-Y1300 HydrophobicContact CB-CD1 4.15Å; M1264-Y1300 HydrophobicContact CB-CE1 4.27Å; M1264-Y1300 HydrophobicContact CG-CD1 4.09Å; M1264-Y1300 HydrophobicContact CG-CE1 3.95Å; M1264-Y1300 HydrophobicContact SD-CD1 4.18Å; M1264-Y1300 HydrophobicContact SD-CE1 4.33Å; M1264-L1302 HydrophobicContact CG-CD2 4.47Å; M1264-L1302 HydrophobicContact SD-CD2 4.28Å; M1264-L1333 HydrophobicContact CE-CD1 4.46Å; M1264-L1333 HydrophobicContact SD-CD1 4.46Å; M1264-Y1367 HydrophobicContact CE-CD2 4.08Å; M1264-Y1367 HydrophobicContact CE-CE2 4.4Å; M1264-Y1367 HydrophobicContact CE-CG 4.38Å; M1264-Y1367 HydrophobicContact SD-CD2 4.41Å; M1264-Y1367 HydrophobicContact SD-CG 4.3Å; M1264-V1376 HydrophobicContact CE-CG1 4.48Å
1265	P	69.9	Low	70.2	Confident	62.8 Å²	62.8	60.2 Å²	60.2	41%	0.408	35%	0.351	S	S	.	.	S	Bend	cis	-81	129.1	-3.1	32	-29.8	0	0	0	112.6	I1263 Y1300	I1263-P1265 CarbonylContact O-C 3.58Å; I1263-P1265 VanDerWaalsContact O-C 3.25Å; P1265-Y1300 HydrophobicContact CB-CD1 4.32Å; P1265-Y1300 HydrophobicContact CB-CD2 3.35Å; P1265-Y1300 VanDerWaalsContact CB-CD2 3.42Å; P1265-Y1300 HydrophobicContact CB-CE1 4.38Å; P1265-Y1300 HydrophobicContact CB-CE2 3.47Å; P1265-Y1300 VanDerWaalsContact CB-CE2 3.46Å; P1265-Y1300 HydrophobicContact CB-CG 3.81Å
1266	H	64.9	Low	70.4	Confident	100.8 Å²	100.8	62 Å²	62	47%	0.467	36%	0.356	S	S	.	.			trans	-137.9	109.4	175.2	-167.6	-44.5	0	0	0	111.5	L1262 I1263 Y1300	L1262-H1266 WeakPolarHBondContact CD2-CD2 3.35Å; L1262-H1266 WeakPolarHBondContact CD2-NE2 3.46Å; I1263-H1266 VanDerWaalsContact O-CB 3.3Å; I1263-H1266 WeakPolarHBondContact O-CB 3.4Å; I1263-H1266 PolarHBondContact O-CD2 2.85Å; I1263-H1266 PolarHBondContact O-N 3.18Å; H1266-Y1300 PolarHBondContact N-OH 3.07Å; H1266-Y1300 VanDerWaalsContact N-OH 3.12Å; H1266-Y1300 PolarHBondContact O-OH 3.3Å; H1266-Y1300 VanDerWaalsContact O-OH 3.1Å
1267	G	72.5	Confident	70.3	Confident	51.6 Å²	51.6	68.7 Å²	68.7	53%	0.532	38%	0.381	S	S	.	.			trans	62.2	-179.4	177.7	0	0	0	0	0	114	Y1300	G1267-Y1300 PolarHBondContact N-OH 2.84Å; G1267-Y1300 WeakPolarHBondContact O-CE2 3.26Å; G1267-Y1300 PolarHBondContact O-OH 2.94Å
1268	T	77.3	Confident	70.6	Confident	109.4 Å²	109.4	66.2 Å²	66.2	67%	0.671	37%	0.37	S	S	*	.	S	Bend	trans	-109.1	-19.3	178	52	0	0	0	0	113.7	L1302 T1303	T1268-L1302 VanDerWaalsContact C-CD1 3.48Å; T1268-L1302 WeakPolarHBondContact O-CA 3.39Å; T1268-T1303 PolarHBondContact O-N 2.78Å; T1268-T1303 PolarHBondContact O-OG1 2.89Å; T1268-T1303 VanDerWaalsContact O-OG1 3.11Å
1269	E	83.4	Confident	71.2	Confident	101.4 Å²	101.4	60.5 Å²	60.5	47%	0.474	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.8	-176.7	-170.7	174.3	-170.6	0	0	110.9	V1271 T1303	E1269-V1271 HydrophobicContact CG-CG2 4.37Å; E1269-T1303 CarbonylContact C-O 3.56Å; E1269-T1303 VanDerWaalsContact CA-O 3.26Å; E1269-T1303 WeakPolarHBondContact CA-O 3.3Å; E1269-T1303 WeakPolarHBondContact CA-OG1 3.38Å; E1269-T1303 WeakPolarHBondContact CB-OG1 3.45Å
1270	I	83.2	Confident	71.8	Confident	9.8 Å²	9.8	60.6 Å²	60.6	5%	0.05	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	121.9	170.9	-63	172.9	0	0	0	107.7	L1262 L1272 K1281 L1283 L1302 T1303 V1304 R1305 L1380	L1262-I1270 HydrophobicContact CD1-CB 4.43Å; L1262-I1270 HydrophobicContact CD1-CD1 3.41Å; L1262-I1270 VanDerWaalsContact CD1-CD1 3.44Å; L1262-I1270 HydrophobicContact CD1-CG1 3.76Å; L1262-I1270 HydrophobicContact CD1-CG2 4.15Å; I1270-L1272 HydrophobicContact CG2-CD2 4.31Å; I1270-L1272 HydrophobicContact CG2-CG 4.44Å; I1270-K1281 HydrophobicContact CG2-CB 4.39Å; I1270-K1281 HydrophobicContact CG2-CD 3.41Å; I1270-K1281 VanDerWaalsContact CG2-CD 3.41Å; I1270-K1281 HydrophobicContact CG2-CG 4.16Å; I1270-L1283 HydrophobicContact CD1-CD1 4.27Å; I1270-L1302 HydrophobicContact CD1-CD1 3.95Å; I1270-L1302 HydrophobicContact CD1-CD2 3.61Å; I1270-L1302 VanDerWaalsContact CD1-CD2 3.45Å; I1270-L1302 HydrophobicContact CD1-CG 4.13Å; I1270-L1302 HydrophobicContact CG1-CD1 4Å; I1270-L1302 HydrophobicContact CG1-CD2 4.1Å; I1270-L1302 HydrophobicContact CG1-CG 4.33Å; I1270-T1303 PolarHBondContact N-O 3.05Å; I1270-V1304 HydrophobicContact CB-CG1 4.35Å; I1270-V1304 HydrophobicContact CB-CG2 4.35Å; I1270-V1304 HydrophobicContact CD1-CG2 4.37Å; I1270-V1304 HydrophobicContact CG2-CG1 4.37Å; I1270-V1304 CarbonylContact O-C 3.45Å; I1270-V1304 WeakPolarHBondContact O-CA 3.2Å; I1270-R1305 PolarHBondContact O-N 2.99Å; I1270-L1380 HydrophobicContact CD1-CD1 3.87Å; I1270-L1380 HydrophobicContact CG2-CD1 4.47Å
1271	V	82	Confident	72.4	Confident	63.2 Å²	63.2	61.9 Å²	61.9	38%	0.383	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.3	173	-175.5	0	0	0	0	109.4	E1269 T1273 K1281 R1305 T1307	E1269-V1271 HydrophobicContact CG-CG2 4.37Å; V1271-T1273 HydrophobicContact CG1-CG2 4.06Å; V1271-K1281 PolarHBondContact O-NZ 3.37Å; V1271-R1305 CarbonylContact C-O 3.56Å; V1271-R1305 WeakPolarHBondContact CA-O 3.27Å; V1271-T1307 HydrophobicContact CG1-CG2 3.62Å; V1271-T1307 VanDerWaalsContact CG1-CG2 3.41Å; V1271-T1307 WeakPolarHBondContact CG1-OG1 3.44Å
1272	L	81.1	Confident	72.8	Confident	0.8 Å²	0.8	60.8 Å²	60.8	0%	0.004	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.3	171.1	-61.4	173.3	0	0	0	108.3	I1270 K1281 V1304 R1305 T1307 V1317 L1380 H1382	I1270-L1272 HydrophobicContact CG2-CD2 4.31Å; I1270-L1272 HydrophobicContact CG2-CG 4.44Å; L1272-K1281 HydrophobicContact CD2-CB 4.24Å; L1272-K1281 HydrophobicContact CD2-CD 4.06Å; L1272-K1281 HydrophobicContact CD2-CG 3.82Å; L1272-V1304 HydrophobicContact CD1-CG1 3.69Å; L1272-V1304 HydrophobicContact CG-CG1 3.98Å; L1272-R1305 PolarHBondContact N-O 2.96Å; L1272-T1307 PolarHBondContact O-N 3.1Å; L1272-T1307 PolarHBondContact O-OG1 3.06Å; L1272-V1317 HydrophobicContact CD1-CB 4.45Å; L1272-V1317 HydrophobicContact CD1-CG1 3.84Å; L1272-V1317 HydrophobicContact CD1-CG2 4.28Å; L1272-L1380 HydrophobicContact CD1-CB 4.37Å; L1272-L1380 HydrophobicContact CD2-CB 4.29Å; L1272-H1382 HydrophobicContact CB-CB 4.39Å
1273	T	72.2	Confident	73.1	Confident	47.6 Å²	47.6	60.2 Å²	60.2	29%	0.292	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	156.1	178.3	68.6	0	0	0	0	110.4	V1271 S1275 E1278 S1279 T1307	V1271-T1273 HydrophobicContact CG1-CG2 4.06Å; T1273-S1275 VanDerWaalsContact C-N 3.27Å; T1273-S1275 PolarHBondContact O-N 3.15Å; T1273-S1275 WeakPolarHBondContact OG1-CB 3.46Å; T1273-S1275 PolarHBondContact OG1-N 2.79Å; T1273-S1275 PolarHBondContact OG1-OG 3.2Å; T1273-E1278 WeakPolarHBondContact CB-OE2 3.29Å; T1273-E1278 HydrophobicContact CG2-CB 4.45Å; T1273-E1278 WeakPolarHBondContact CG2-OE2 3.46Å; T1273-E1278 PolarHBondContact N-O 3.06Å; T1273-E1278 CarbonylContact O-C 3.57Å; T1273-E1278 VanDerWaalsContact OG1-CB 3.32Å; T1273-E1278 WeakPolarHBondContact OG1-CB 3.39Å; T1273-E1278 PolarHBondContact OG1-OE2 2.93Å; T1273-S1279 VanDerWaalsContact O-CA 3.28Å; T1273-S1279 WeakPolarHBondContact O-CA 3.26Å; T1273-S1279 WeakPolarHBondContact O-CB 3.43Å; T1273-S1279 PolarHBondContact O-N 3.04Å; T1273-T1307 WeakPolarHBondContact CA-OG1 3.43Å; T1273-T1307 HydrophobicContact CG2-CG2 4.28Å; T1273-T1307 WeakPolarHBondContact CG2-OG1 3.13Å
1274	T	66.3	Low	73.5	Confident	52 Å²	52	56.7 Å²	56.7	32%	0.319	31%	0.307	S	S	.	.			trans	-81.3	10	177.3	55.8	0	0	0	0	113.9	L1276 I1309 H1382	T1274-L1276 PolarHBondContact O-N 2.91Å; T1274-I1309 HydrophobicContact CG2-CD1 4.03Å; T1274-I1309 HydrophobicContact CG2-CG1 3.53Å; T1274-I1309 WeakPolarHBondContact OG1-CD1 3.31Å; T1274-I1309 WeakPolarHBondContact OG1-CG1 3.36Å; T1274-H1382 VanDerWaalsContact CG2-CD2 3.5Å; T1274-H1382 WeakPolarHBondContact CG2-CD2 2.96Å; T1274-H1382 WeakPolarHBondContact CG2-CE1 3.24Å; T1274-H1382 VanDerWaalsContact CG2-NE2 3.27Å; T1274-H1382 WeakPolarHBondContact CG2-NE2 3.22Å
1275	S	59.5	Low	73.8	Confident	54 Å²	54	56.5 Å²	56.5	38%	0.378	31%	0.307	S	S	.	.			trans	-59.1	146.9	-177.1	76.8	0	0	0	0	111.6	T1273 Y1277 E1278 S1279	T1273-S1275 VanDerWaalsContact C-N 3.27Å; T1273-S1275 PolarHBondContact O-N 3.15Å; T1273-S1275 WeakPolarHBondContact OG1-CB 3.46Å; T1273-S1275 PolarHBondContact OG1-N 2.79Å; T1273-S1275 PolarHBondContact OG1-OG 3.2Å; S1275-Y1277 PolarHBondContact O-N 2.84Å; S1275-Y1277 VanDerWaalsContact O-N 3.08Å; S1275-E1278 PolarHBondContact O-N 3.09Å; S1275-E1278 VanDerWaalsContact O-N 3.08Å; S1275-E1278 WeakPolarHBondContact OG-CB 3.38Å; S1275-E1278 PolarHBondContact OG-N 2.88Å; S1275-E1278 PolarHBondContact OG-OE2 3.03Å; S1275-S1279 VanDerWaalsContact O-CB 3.28Å; S1275-S1279 WeakPolarHBondContact O-CB 3.39Å; S1275-S1279 PolarHBondContact O-N 2.92Å
1276	L	55.5	Low	74.2	Confident	143 Å²	143	55 Å²	55	75%	0.749	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-24.8	-177.6	-78.7	159.5	0	0	0	113.7	T1274 E1278	T1274-L1276 PolarHBondContact O-N 2.91Å; L1276-E1278 PolarHBondContact O-N 3.32Å
1277	Y	54.8	Low	74.4	Confident	179.2 Å²	179.2	53 Å²	53	70%	0.703	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-14.6	-173.9	-66.2	-75.1	0	0	0	114.2	D1258 S1275	D1258-Y1277 HydrophobicContact CB-CD1 3.94Å; D1258-Y1277 WeakPolarHBondContact OD2-CD1 3.34Å; D1258-Y1277 VanDerWaalsContact OD2-CE1 3.27Å; D1258-Y1277 WeakPolarHBondContact OD2-CE1 3.48Å; S1275-Y1277 PolarHBondContact O-N 2.84Å; S1275-Y1277 VanDerWaalsContact O-N 3.08Å
1278	E	57.7	Low	74	Confident	76.4 Å²	76.4	55.2 Å²	55.2	36%	0.357	30%	0.302	S	S	.	.			trans	-155.6	71.8	-179.7	-80.2	175.4	-179.2	0	0	115.1	P1130 H1257 S1260 T1273 S1275 L1276 R1280	P1130-E1278 WeakPolarHBondContact CD-OE1 3.39Å; P1130-E1278 WeakPolarHBondContact CG-OE1 3.37Å; H1257-E1278 IonicContact CD2-OE1 2.92Å; H1257-E1278 PolarHBondContact CD2-OE1 3.33Å; H1257-E1278 VanDerWaalsContact CD2-OE1 3.23Å; H1257-E1278 IonicContact CG-OE1 2.74Å; S1260-E1278 WeakPolarHBondContact CB-OE2 3.45Å; S1260-E1278 PolarHBondContact OG-OE2 3.29Å; S1260-E1278 VanDerWaalsContact OG-OE2 3.11Å; T1273-E1278 WeakPolarHBondContact CB-OE2 3.29Å; T1273-E1278 HydrophobicContact CG2-CB 4.45Å; T1273-E1278 WeakPolarHBondContact CG2-OE2 3.46Å; T1273-E1278 PolarHBondContact N-O 3.06Å; T1273-E1278 CarbonylContact O-C 3.57Å; T1273-E1278 VanDerWaalsContact OG1-CB 3.32Å; T1273-E1278 WeakPolarHBondContact OG1-CB 3.39Å; T1273-E1278 PolarHBondContact OG1-OE2 2.93Å; S1275-E1278 PolarHBondContact O-N 3.09Å; S1275-E1278 VanDerWaalsContact O-N 3.08Å; S1275-E1278 WeakPolarHBondContact OG-CB 3.38Å; S1275-E1278 PolarHBondContact OG-N 2.88Å; S1275-E1278 PolarHBondContact OG-OE2 3.03Å; L1276-E1278 PolarHBondContact O-N 3.32Å; E1278-R1280 VanDerWaalsContact C-N 3.3Å; E1278-R1280 HydrophobicContact CG-CG 4.44Å; E1278-R1280 PolarHBondContact O-N 3.27Å
1279	S	68.3	Low	73.1	Confident	31.6 Å²	31.6	52.7 Å²	52.7	22%	0.221	29%	0.289	C	S	.	.			trans	-80.6	3.1	178	63.6	0	0	0	0	114.7	T1273 S1275 F1381 H1382	T1273-S1279 VanDerWaalsContact O-CA 3.28Å; T1273-S1279 WeakPolarHBondContact O-CA 3.26Å; T1273-S1279 WeakPolarHBondContact O-CB 3.43Å; T1273-S1279 PolarHBondContact O-N 3.04Å; S1275-S1279 VanDerWaalsContact O-CB 3.28Å; S1275-S1279 WeakPolarHBondContact O-CB 3.39Å; S1275-S1279 PolarHBondContact O-N 2.92Å; S1279-F1381 CarbonylContact O-C 3.53Å; S1279-F1381 VanDerWaalsContact O-CA 3.26Å; S1279-F1381 WeakPolarHBondContact O-CA 3.41Å; S1279-H1382 PolarHBondContact O-N 3.19Å; S1279-H1382 VanDerWaalsContact O-N 3.16Å
1280	R	77.2	Confident	72	Confident	39.2 Å²	39.2	49.2 Å²	49.2	15%	0.148	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.8	-168.7	-23	175.3	-178.7	-165.4	-9.8	111.3	D1189 E1278 Y1282 L1379 L1380 F1381	D1189-R1280 IonicContact OD1-CZ 3.01Å; D1189-R1280 IonicContact OD1-NH2 3.69Å; D1189-R1280 PolarHBondContact OD1-NH2 2.75Å; D1189-R1280 IonicContact OD2-CZ 3.04Å; D1189-R1280 VanDerWaalsContact OD2-CZ 3.31Å; D1189-R1280 IonicContact OD2-NH1 3.42Å; D1189-R1280 PolarHBondContact OD2-NH1 3.06Å; D1189-R1280 IonicContact OD2-NH2 3.24Å; D1189-R1280 PolarHBondContact OD2-NH2 3.02Å; E1278-R1280 VanDerWaalsContact C-N 3.3Å; E1278-R1280 HydrophobicContact CG-CG 4.44Å; E1278-R1280 PolarHBondContact O-N 3.27Å; R1280-Y1282 PolarHBondContact NH1-OH 3.44Å; R1280-L1379 HydrophobicContact CB-CD1 4.12Å; R1280-L1379 HydrophobicContact CG-CD1 4.45Å; R1280-L1380 CarbonylContact C-O 3.55Å; R1280-L1380 WeakPolarHBondContact CA-O 3.25Å; R1280-F1381 HydrophobicContact CG-CB 4.4Å
1281	K	83.5	Confident	70.6	Confident	38.6 Å²	38.6	51.4 Å²	51.4	17%	0.168	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.4	174.7	-61.8	-77.9	-179	-174.9	0	110	G1259 S1260 L1262 I1270 V1271 L1272 L1380	G1259-K1281 VanDerWaalsContact C-NZ 3.33Å; G1259-K1281 VanDerWaalsContact O-CD 3.24Å; G1259-K1281 WeakPolarHBondContact O-CD 3.23Å; G1259-K1281 WeakPolarHBondContact O-CE 3.28Å; G1259-K1281 PolarHBondContact O-NZ 3Å; S1260-K1281 CarbonylContact O-C 3.52Å; S1260-K1281 VanDerWaalsContact O-CA 3.3Å; S1260-K1281 WeakPolarHBondContact O-CA 3.15Å; L1262-K1281 HydrophobicContact CD1-CB 3.96Å; L1262-K1281 HydrophobicContact CD1-CD 4.26Å; L1262-K1281 HydrophobicContact CD1-CG 4.18Å; L1262-K1281 HydrophobicContact CG-CB 4.47Å; I1270-K1281 HydrophobicContact CG2-CB 4.39Å; I1270-K1281 HydrophobicContact CG2-CD 3.41Å; I1270-K1281 VanDerWaalsContact CG2-CD 3.41Å; I1270-K1281 HydrophobicContact CG2-CG 4.16Å; V1271-K1281 PolarHBondContact O-NZ 3.37Å; L1272-K1281 HydrophobicContact CD2-CB 4.24Å; L1272-K1281 HydrophobicContact CD2-CD 4.06Å; L1272-K1281 HydrophobicContact CD2-CG 3.82Å; K1281-L1380 HydrophobicContact CB-CB 4.39Å; K1281-L1380 PolarHBondContact N-O 3.06Å; K1281-L1380 PolarHBondContact O-N 3.05Å
1282	Y	84.8	Confident	69.2	Low	14.4 Å²	14.4	55 Å²	55	6%	0.056	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	117.8	173.8	-63.4	-83.9	0	0	0	108.6	L1126 Y1167 L1249 F1256 S1260 L1262 R1280 I1322 L1379	L1126-Y1282 HydrophobicContact CD1-CE1 4.32Å; L1126-Y1282 HydrophobicContact CD2-CE1 4.38Å; L1126-Y1282 HydrophobicContact CG-CE1 4.44Å; Y1167-Y1282 PolarHBondContact OH-OH 3.15Å; Y1167-Y1282 VanDerWaalsContact OH-OH 3.1Å; L1249-Y1282 HydrophobicContact CD1-CD1 4.26Å; L1249-Y1282 HydrophobicContact CD2-CD1 3.94Å; L1249-Y1282 HydrophobicContact CD2-CD2 4.46Å; L1249-Y1282 HydrophobicContact CD2-CE1 4.29Å; L1249-Y1282 HydrophobicContact CD2-CG 4.07Å; F1256-Y1282 HydrophobicContact CD1-CD2 4.48Å; F1256-Y1282 AromaticContact CE1-CD2 3.93Å; F1256-Y1282 HydrophobicContact CE1-CD2 4.15Å; F1256-Y1282 HydrophobicContact CE1-CE2 4.13Å; S1260-Y1282 PolarHBondContact O-N 3.02Å; L1262-Y1282 PolarHBondContact N-O 3.33Å; R1280-Y1282 PolarHBondContact NH1-OH 3.44Å; Y1282-I1322 HydrophobicContact CD1-CD1 3.44Å; Y1282-I1322 VanDerWaalsContact CD1-CD1 3.45Å; Y1282-I1322 HydrophobicContact CE1-CD1 3.73Å; Y1282-L1379 HydrophobicContact CD1-CD1 3.93Å; Y1282-L1379 HydrophobicContact CE1-CD1 3.67Å; Y1282-L1379 HydrophobicContact CE2-CD1 4.44Å; Y1282-L1379 HydrophobicContact CG-CD1 4.45Å
1283	L	86.7	Confident	67.7	Low	2 Å²	2	62.4 Å²	62.4	1%	0.01	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.8	178.9	-174.5	69	0	0	0	109.8	L1262 M1264 I1270 L1302 V1365 A1377 V1378 L1380	L1262-L1283 HydrophobicContact CB-CD1 3.99Å; L1262-L1283 CarbonylContact O-C 3.58Å; L1262-L1283 WeakPolarHBondContact O-CA 3.26Å; M1264-L1283 HydrophobicContact CE-CD2 4.27Å; M1264-L1283 HydrophobicContact CE-CG 3.96Å; M1264-L1283 HydrophobicContact CG-CD1 3.4Å; M1264-L1283 VanDerWaalsContact CG-CD1 3.43Å; M1264-L1283 HydrophobicContact CG-CD2 4.27Å; M1264-L1283 HydrophobicContact CG-CG 3.76Å; M1264-L1283 HydrophobicContact SD-CD1 3.97Å; M1264-L1283 HydrophobicContact SD-CD2 3.68Å; M1264-L1283 VanDerWaalsContact SD-CD2 3.59Å; M1264-L1283 HydrophobicContact SD-CG 3.7Å; I1270-L1283 HydrophobicContact CD1-CD1 4.27Å; L1283-L1302 HydrophobicContact CD1-CD2 4.17Å; L1283-L1302 HydrophobicContact CD2-CD2 3.84Å; L1283-V1365 HydrophobicContact CD2-CG1 4.46Å; L1283-A1377 CarbonylContact O-C 3.49Å; L1283-A1377 WeakPolarHBondContact O-CA 3.33Å; L1283-V1378 HydrophobicContact CB-CG2 3.79Å; L1283-V1378 HydrophobicContact CD2-CG2 4.09Å; L1283-V1378 HydrophobicContact CG-CG2 4.36Å; L1283-V1378 PolarHBondContact N-O 2.91Å; L1283-V1378 PolarHBondContact O-N 3.14Å; L1283-L1380 HydrophobicContact CB-CD1 4.26Å; L1283-L1380 HydrophobicContact CD2-CD1 4.28Å
1284	I	86.5	Confident	66.7	Low	7 Å²	7	63.9 Å²	63.9	4%	0.036	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.5	-171.4	-54.7	-174.4	0	0	0	111.2	L1249 R1250 L1261 L1262 I1263 M1264 A1377	L1249-I1284 HydrophobicContact CB-CD1 3.26Å; L1249-I1284 HydrophobicContact CD1-CD1 3.8Å; L1249-I1284 HydrophobicContact CD1-CG1 4.37Å; L1249-I1284 HydrophobicContact CD2-CD1 4.48Å; L1249-I1284 HydrophobicContact CG-CD1 4.09Å; R1250-I1284 HydrophobicContact CG-CG2 4.36Å; L1261-I1284 HydrophobicContact CD1-CD1 3.29Å; L1261-I1284 HydrophobicContact CD1-CG1 3.96Å; L1261-I1284 HydrophobicContact CD2-CD1 4.48Å; L1261-I1284 HydrophobicContact CG-CD1 4.15Å; L1262-I1284 PolarHBondContact O-N 3.14Å; I1263-I1284 CarbonylContact C-O 3.48Å; I1263-I1284 WeakPolarHBondContact CA-O 3.37Å; M1264-I1284 PolarHBondContact N-O 3.05Å; I1284-A1377 HydrophobicContact CD1-CB 4.46Å; I1284-A1377 HydrophobicContact CG1-CB 4.23Å
1285	A	83	Confident	66.2	Low	1.6 Å²	1.6	68 Å²	68	1%	0.013	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	132.6	171.7	0	0	0	0	0	111.4	R1250 M1264 E1331 Y1367 A1374 V1376	R1250-A1285 PolarHBondContact NH2-O 3.12Å; M1264-A1285 HydrophobicContact CE-CB 3.89Å; A1285-E1331 VanDerWaalsContact CB-OE1 3.25Å; A1285-E1331 WeakPolarHBondContact CB-OE1 3.16Å; A1285-Y1367 HydrophobicContact CB-CD2 4.46Å; A1285-Y1367 HydrophobicContact CB-CE2 3.76Å; A1285-A1374 HydrophobicContact CB-CB 3.9Å; A1285-V1376 HydrophobicContact CB-CB 4.25Å; A1285-V1376 PolarHBondContact N-O 3.08Å
1286	S	77.4	Confident	66.3	Low	31.2 Å²	31.2	71.8 Å²	71.8	22%	0.218	41%	0.41	C	S	.	.			trans	-113.4	144.3	172.9	-179.2	0	0	0	0	111.8	I1263 S1288	I1263-S1286 VanDerWaalsContact CG2-CB 3.45Å; S1286-S1288 PolarHBondContact OG-N 3.12Å; S1286-S1288 PolarHBondContact OG-OG 3.08Å
1287	S	69.6	Low	66.9	Low	58.6 Å²	58.6	68.8 Å²	68.8	41%	0.41	40%	0.395	S	S	.	.	S	Bend	trans	-76.2	-26.2	174.2	40.9	0	0	0	0	113	S1289 A1374	S1287-S1289 VanDerWaalsContact C-N 3.33Å; S1287-S1289 PolarHBondContact O-N 3.13Å; S1287-S1289 VanDerWaalsContact O-N 3.13Å; S1287-A1374 PolarHBondContact OG-N 3.35Å
1288	S	63.3	Low	68	Low	98.8 Å²	98.8	61.1 Å²	61.1	69%	0.691	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-21	-173.9	57.9	0	0	0	0	114	S1286	S1286-S1288 PolarHBondContact OG-N 3.12Å; S1286-S1288 PolarHBondContact OG-OG 3.08Å
1289	S	58.5	Low	69.1	Low	55.4 Å²	55.4	61.9 Å²	61.9	39%	0.387	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-17.9	-167.4	-44.3	0	0	0	0	114.5	M1264 S1287	M1264-S1289 PolarHBondContact O-OG 3.4Å; S1287-S1289 VanDerWaalsContact C-N 3.33Å; S1287-S1289 PolarHBondContact O-N 3.13Å; S1287-S1289 VanDerWaalsContact O-N 3.13Å
1290	C	61.9	Low	69.8	Low	28.4 Å²	28.4	61.9 Å²	61.9	19%	0.192	37%	0.368	C	S	.	.	S	Bend	trans	-110.8	113.6	173	-60.6	0	0	0	0	106.8	L1292 C1298 R1369	C1290-L1292 PolarHBondContact O-N 2.97Å; C1290-C1298 HydrophobicContact CB-CB 3.62Å; C1290-C1298 WeakPolarHBondContact CB-SG 3.42Å; C1290-C1298 WeakPolarHBondContact SG-CB 3.31Å; C1290-C1298 CovalentContact SG-SG 2.03Å; C1290-C1298 PolarHBondContact SG-SG 3.16Å; C1290-R1369 VanDerWaalsContact CB-NH2 3.34Å; C1290-R1369 PolarHBondContact O-NH2 2.52Å; C1290-R1369 PolarHBondContact SG-NH2 2.92Å
1291	G	53.2	Low	70.2	Confident	55.6 Å²	55.6	64.1 Å²	64.1	57%	0.573	39%	0.385	S	S	*	.			trans	-51.5	134.2	-171.2	0	0	0	0	0	112.8	N1293 S1294	G1291-N1293 PolarHBondContact O-N 3.07Å; G1291-S1294 PolarHBondContact O-N 3.11Å; G1291-S1294 VanDerWaalsContact O-N 3.12Å; G1291-S1294 PolarHBondContact O-OG 3.22Å; G1291-S1294 VanDerWaalsContact O-OG 3.12Å
1292	L	51.7	Low	70.5	Confident	139.8 Å²	139.8	62.4 Å²	62.4	73%	0.732	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-12.9	179.9	-80.8	133.5	0	0	0	114.3	F792 C1290 S1294	F792-L1292 HydrophobicContact CE1-CD1 4.29Å; F792-L1292 HydrophobicContact CE2-CD1 4.39Å; F792-L1292 HydrophobicContact CZ-CD1 4.13Å; C1290-L1292 PolarHBondContact O-N 2.97Å; L1292-S1294 PolarHBondContact O-N 3.17Å
1293	N	51.1	Low	70.7	Confident	155.2 Å²	155.2	64 Å²	64	83%	0.83	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	45.3	-178.4	-69	-12.5	0	0	0	112.5	G1291 V1295	G1291-N1293 PolarHBondContact O-N 3.07Å; N1293-V1295 PolarHBondContact O-N 3.01Å
1294	S	50	Low	70.7	Confident	79.4 Å²	79.4	63.9 Å²	63.9	56%	0.555	39%	0.39	S	S	*	.			trans	-75.7	114.5	178.4	57.9	0	0	0	0	112	G1291 L1292 D1296	G1291-S1294 PolarHBondContact O-N 3.11Å; G1291-S1294 VanDerWaalsContact O-N 3.12Å; G1291-S1294 PolarHBondContact O-OG 3.22Å; G1291-S1294 VanDerWaalsContact O-OG 3.12Å; L1292-S1294 PolarHBondContact O-N 3.17Å; S1294-D1296 PolarHBondContact O-N 3.19Å
1295	V	55.7	Low	70.8	Confident	137.6 Å²	137.6	69.2 Å²	69.2	83%	0.834	41%	0.409	S	S	*	.			trans	-94	-7.9	166.3	179.7	0	0	0	0	112.3	N1293	N1293-V1295 PolarHBondContact O-N 3.01Å
1296	D	61.7	Low	70.9	Confident	134.2 Å²	134.2	69.2 Å²	69.2	72%	0.718	41%	0.409	S	S	*	.	S	Bend	trans	-84.1	127.1	-178.7	-64.1	-34.2	0	0	0	112.2	S1294 C1298	S1294-D1296 PolarHBondContact O-N 3.19Å; D1296-C1298 PolarHBondContact O-N 2.94Å
1297	D	69.4	Low	70.9	Confident	81 Å²	81	69.9 Å²	69.9	43%	0.433	41%	0.412	S	S	.	.			trans	-56.6	122	170.2	-76.3	10.8	0	0	0	109.9	I1299 K1368 T1370	D1297-I1299 VanDerWaalsContact C-N 3.32Å; D1297-I1299 HydrophobicContact CB-CD1 3.85Å; D1297-I1299 HydrophobicContact CB-CG1 3.91Å; D1297-I1299 PolarHBondContact O-N 3.06Å; D1297-K1368 WeakPolarHBondContact OD2-CE 3.38Å; D1297-K1368 IonicContact OD2-NZ 3.37Å; D1297-K1368 PolarHBondContact OD2-NZ 3.06Å; D1297-T1370 HydrophobicContact CB-CG2 4.16Å; D1297-T1370 VanDerWaalsContact CG-CG2 3.46Å; D1297-T1370 WeakPolarHBondContact OD1-CG2 3.27Å
1298	C	76	Confident	70.8	Confident	17.8 Å²	17.8	69.4 Å²	69.4	12%	0.12	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	87.8	173.3	-168.9	0	0	0	0	109.1	C1290 D1296 K1368 R1369	C1290-C1298 HydrophobicContact CB-CB 3.62Å; C1290-C1298 WeakPolarHBondContact CB-SG 3.42Å; C1290-C1298 WeakPolarHBondContact SG-CB 3.31Å; C1290-C1298 CovalentContact SG-SG 2.03Å; C1290-C1298 PolarHBondContact SG-SG 3.16Å; D1296-C1298 PolarHBondContact O-N 2.94Å; C1298-K1368 CarbonylContact O-C 3.53Å; C1298-K1368 WeakPolarHBondContact O-CA 3.18Å; C1298-R1369 WeakPolarHBondContact CA-O 3.26Å; C1298-R1369 HydrophobicContact CB-CB 4.36Å; C1298-R1369 VanDerWaalsContact CB-O 3.24Å; C1298-R1369 WeakPolarHBondContact CB-O 3.37Å; C1298-R1369 PolarHBondContact N-O 2.97Å; C1298-R1369 PolarHBondContact O-N 3.32Å
1299	I	81.7	Confident	70.8	Confident	92 Å²	92	70.1 Å²	70.1	47%	0.472	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124	177.7	-59.8	169.1	0	0	0	108.7	D1297 R1366 Y1367 K1368	D1297-I1299 VanDerWaalsContact C-N 3.32Å; D1297-I1299 HydrophobicContact CB-CD1 3.85Å; D1297-I1299 HydrophobicContact CB-CG1 3.91Å; D1297-I1299 PolarHBondContact O-N 3.06Å; I1299-R1366 HydrophobicContact CG2-CG 4.4Å; I1299-Y1367 WeakPolarHBondContact CA-O 3.39Å; I1299-K1368 HydrophobicContact CG1-CG 4.21Å
1300	Y	83.4	Confident	71.1	Confident	31.2 Å²	31.2	70.5 Å²	70.5	12%	0.122	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	128.9	178.8	175.4	-110.3	0	0	0	110.3	M1264 P1265 H1266 G1267 L1302 R1366 Y1367	M1264-Y1300 HydrophobicContact CB-CD1 4.15Å; M1264-Y1300 HydrophobicContact CB-CE1 4.27Å; M1264-Y1300 HydrophobicContact CG-CD1 4.09Å; M1264-Y1300 HydrophobicContact CG-CE1 3.95Å; M1264-Y1300 HydrophobicContact SD-CD1 4.18Å; M1264-Y1300 HydrophobicContact SD-CE1 4.33Å; P1265-Y1300 HydrophobicContact CB-CD1 4.32Å; P1265-Y1300 HydrophobicContact CB-CD2 3.35Å; P1265-Y1300 VanDerWaalsContact CB-CD2 3.42Å; P1265-Y1300 HydrophobicContact CB-CE1 4.38Å; P1265-Y1300 HydrophobicContact CB-CE2 3.47Å; P1265-Y1300 VanDerWaalsContact CB-CE2 3.46Å; P1265-Y1300 HydrophobicContact CB-CG 3.81Å; H1266-Y1300 PolarHBondContact N-OH 3.07Å; H1266-Y1300 VanDerWaalsContact N-OH 3.12Å; H1266-Y1300 PolarHBondContact O-OH 3.3Å; H1266-Y1300 VanDerWaalsContact O-OH 3.1Å; G1267-Y1300 PolarHBondContact N-OH 2.84Å; G1267-Y1300 WeakPolarHBondContact O-CE2 3.26Å; G1267-Y1300 PolarHBondContact O-OH 2.94Å; Y1300-L1302 HydrophobicContact CD1-CD2 4.16Å; Y1300-L1302 HydrophobicContact CE1-CB 3.92Å; Y1300-L1302 HydrophobicContact CE1-CD2 3.95Å; Y1300-L1302 HydrophobicContact CE1-CG 4.4Å; Y1300-L1302 WeakPolarHBondContact OH-CD1 3.43Å; Y1300-R1366 CarbonylContact O-C 3.55Å; Y1300-R1366 VanDerWaalsContact O-CA 3.29Å; Y1300-R1366 WeakPolarHBondContact O-CA 3.27Å; Y1300-Y1367 PolarHBondContact N-O 2.87Å; Y1300-Y1367 PolarHBondContact O-N 2.98Å
1301	T	85.9	Confident	71	Confident	85.4 Å²	85.4	75.8 Å²	75.8	52%	0.524	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.5	179.2	51.7	0	0	0	0	110.4	V1365 R1366	T1301-V1365 CarbonylContact C-O 3.42Å; T1301-V1365 WeakPolarHBondContact CA-O 3.28Å; T1301-R1366 HydrophobicContact CG2-CB 4.11Å; T1301-R1366 HydrophobicContact CG2-CG 3.83Å
1302	L	88.1	Confident	71.6	Confident	3.2 Å²	3.2	77 Å²	77	2%	0.017	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	144.3	-178.1	135.3	78.4	0	0	0	109.6	M1264 T1268 I1270 L1283 Y1300 V1304 R1364 V1365	M1264-L1302 HydrophobicContact CG-CD2 4.47Å; M1264-L1302 HydrophobicContact SD-CD2 4.28Å; T1268-L1302 VanDerWaalsContact C-CD1 3.48Å; T1268-L1302 WeakPolarHBondContact O-CA 3.39Å; I1270-L1302 HydrophobicContact CD1-CD1 3.95Å; I1270-L1302 HydrophobicContact CD1-CD2 3.61Å; I1270-L1302 VanDerWaalsContact CD1-CD2 3.45Å; I1270-L1302 HydrophobicContact CD1-CG 4.13Å; I1270-L1302 HydrophobicContact CG1-CD1 4Å; I1270-L1302 HydrophobicContact CG1-CD2 4.1Å; I1270-L1302 HydrophobicContact CG1-CG 4.33Å; L1283-L1302 HydrophobicContact CD1-CD2 4.17Å; L1283-L1302 HydrophobicContact CD2-CD2 3.84Å; Y1300-L1302 HydrophobicContact CD1-CD2 4.16Å; Y1300-L1302 HydrophobicContact CE1-CB 3.92Å; Y1300-L1302 HydrophobicContact CE1-CD2 3.95Å; Y1300-L1302 HydrophobicContact CE1-CG 4.4Å; Y1300-L1302 WeakPolarHBondContact OH-CD1 3.43Å; L1302-V1304 HydrophobicContact CD1-CG2 3.36Å; L1302-V1304 HydrophobicContact CD2-CG2 4.25Å; L1302-V1304 HydrophobicContact CG-CG2 4.34Å; L1302-R1364 CarbonylContact O-C 3.55Å; L1302-R1364 WeakPolarHBondContact O-CA 3.36Å; L1302-V1365 HydrophobicContact CB-CB 4.36Å; L1302-V1365 HydrophobicContact CD1-CB 3.87Å; L1302-V1365 HydrophobicContact CD1-CG2 4.22Å; L1302-V1365 HydrophobicContact CD2-CB 4.22Å; L1302-V1365 HydrophobicContact CD2-CG1 4.27Å; L1302-V1365 HydrophobicContact CG-CB 3.89Å; L1302-V1365 HydrophobicContact CG-CG1 4.41Å; L1302-V1365 PolarHBondContact N-O 3.08Å; L1302-V1365 PolarHBondContact O-N 3.12Å
1303	T	89	Confident	72.3	Confident	49 Å²	49	72.6 Å²	72.6	30%	0.301	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.6	172.4	53.3	0	0	0	0	109.3	T1268 E1269 I1270 R1364	T1268-T1303 PolarHBondContact O-N 2.78Å; T1268-T1303 PolarHBondContact O-OG1 2.89Å; T1268-T1303 VanDerWaalsContact O-OG1 3.11Å; E1269-T1303 CarbonylContact C-O 3.56Å; E1269-T1303 VanDerWaalsContact CA-O 3.26Å; E1269-T1303 WeakPolarHBondContact CA-O 3.3Å; E1269-T1303 WeakPolarHBondContact CA-OG1 3.38Å; E1269-T1303 WeakPolarHBondContact CB-OG1 3.45Å; I1270-T1303 PolarHBondContact N-O 3.05Å; T1303-R1364 HydrophobicContact CG2-CG 4.02Å
1304	V	88.6	Confident	73.2	Confident	0.4 Å²	0.4	71.5 Å²	71.5	0%	0.002	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124	174.4	-173.3	0	0	0	0	107.7	I1270 L1272 L1302 V1317 T1362 I1363 V1365 L1380	I1270-V1304 HydrophobicContact CB-CG1 4.35Å; I1270-V1304 HydrophobicContact CB-CG2 4.35Å; I1270-V1304 HydrophobicContact CD1-CG2 4.37Å; I1270-V1304 HydrophobicContact CG2-CG1 4.37Å; I1270-V1304 CarbonylContact O-C 3.45Å; I1270-V1304 WeakPolarHBondContact O-CA 3.2Å; L1272-V1304 HydrophobicContact CD1-CG1 3.69Å; L1272-V1304 HydrophobicContact CG-CG1 3.98Å; L1302-V1304 HydrophobicContact CD1-CG2 3.36Å; L1302-V1304 HydrophobicContact CD2-CG2 4.25Å; L1302-V1304 HydrophobicContact CG-CG2 4.34Å; V1304-V1317 HydrophobicContact CG1-CG1 3.97Å; V1304-V1317 HydrophobicContact CG1-CG2 4.31Å; V1304-T1362 CarbonylContact O-C 3.53Å; V1304-T1362 WeakPolarHBondContact O-CA 3.34Å; V1304-I1363 HydrophobicContact CB-CD1 4.2Å; V1304-I1363 HydrophobicContact CB-CG1 3.68Å; V1304-I1363 HydrophobicContact CG1-CG1 4.48Å; V1304-I1363 HydrophobicContact CG2-CD1 4.38Å; V1304-I1363 HydrophobicContact CG2-CG1 4.2Å; V1304-I1363 PolarHBondContact N-O 3.09Å; V1304-I1363 PolarHBondContact O-N 2.91Å; V1304-V1365 HydrophobicContact CG2-CG2 4.03Å; V1304-L1380 HydrophobicContact CG1-CD1 4.31Å; V1304-L1380 HydrophobicContact CG2-CD1 3.9Å
1305	R	87.3	Confident	74.5	Confident	116.8 Å²	116.8	67.9 Å²	67.9	44%	0.441	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.1	-178.6	-175.2	169.6	-170.4	-173.2	1.7	110.8	I1270 V1271 L1272 T1307 D1361 T1362	I1270-R1305 PolarHBondContact O-N 2.99Å; V1271-R1305 CarbonylContact C-O 3.56Å; V1271-R1305 WeakPolarHBondContact CA-O 3.27Å; L1272-R1305 PolarHBondContact N-O 2.96Å; R1305-T1307 HydrophobicContact CG-CG2 4.36Å; R1305-D1361 CarbonylContact C-O 3.55Å; R1305-D1361 WeakPolarHBondContact CA-O 3.38Å; R1305-D1361 IonicContact NE-OD2 3.4Å; R1305-D1361 IonicContact NH2-OD2 3.59Å; R1305-T1362 HydrophobicContact CB-CG2 4.04Å; R1305-T1362 HydrophobicContact CG-CG2 3.71Å
1306	S	86	Confident	76	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.6	174.3	-161.9	0	0	0	0	110	G1315 R1316 D1361 H1382	S1306-G1315 WeakPolarHBondContact OG-CA 3.25Å; S1306-R1316 PolarHBondContact OG-O 2.85Å; S1306-R1316 VanDerWaalsContact OG-O 3.08Å; S1306-D1361 WeakPolarHBondContact CB-O 3.33Å; S1306-D1361 PolarHBondContact N-O 2.81Å; S1306-H1382 PolarHBondContact OG-CD2 3.24Å; S1306-H1382 PolarHBondContact OG-CE1 2.86Å; S1306-H1382 PolarHBondContact OG-ND1 2.78Å; S1306-H1382 PolarHBondContact OG-NE2 3.04Å
1307	T	78	Confident	77.2	Confident	46 Å²	46	58.1 Å²	58.1	28%	0.282	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.8	177.8	55.5	0	0	0	0	110.9	V1271 L1272 T1273 R1305 H1382	V1271-T1307 HydrophobicContact CG1-CG2 3.62Å; V1271-T1307 VanDerWaalsContact CG1-CG2 3.41Å; V1271-T1307 WeakPolarHBondContact CG1-OG1 3.44Å; L1272-T1307 PolarHBondContact O-N 3.1Å; L1272-T1307 PolarHBondContact O-OG1 3.06Å; T1273-T1307 WeakPolarHBondContact CA-OG1 3.43Å; T1273-T1307 HydrophobicContact CG2-CG2 4.28Å; T1273-T1307 WeakPolarHBondContact CG2-OG1 3.13Å; R1305-T1307 HydrophobicContact CG-CG2 4.36Å; T1307-H1382 PolarHBondContact O-NE2 3.15Å
1308	A	66.8	Low	78.1	Confident	47.8 Å²	47.8	54.2 Å²	54.2	40%	0.395	32%	0.317	S	S	.	.			trans	-76	145.9	175.2	0	0	0	0	0	112	S1310 V1313	A1308-S1310 VanDerWaalsContact C-N 3.31Å; A1308-S1310 PolarHBondContact O-N 3.14Å; A1308-V1313 HydrophobicContact CB-CB 4.36Å; A1308-V1313 WeakPolarHBondContact CB-O 3.45Å
1309	I	63.8	Low	78.8	Confident	112.6 Å²	112.6	53.4 Å²	53.4	58%	0.577	31%	0.311	S	S	*	.	S	Bend	trans	-68.8	-34.1	176.1	-64.7	166.2	0	0	0	111.2	T1274 S1384	T1274-I1309 HydrophobicContact CG2-CD1 4.03Å; T1274-I1309 HydrophobicContact CG2-CG1 3.53Å; T1274-I1309 WeakPolarHBondContact OG1-CD1 3.31Å; T1274-I1309 WeakPolarHBondContact OG1-CG1 3.36Å; I1309-S1384 WeakPolarHBondContact CD1-OG 3.49Å
1310	S	64.4	Low	79.1	Confident	64 Å²	64	49.8 Å²	49.8	45%	0.448	29%	0.292	S	S	.	.	S	Bend	trans	-134.6	142.1	-171.2	-62.4	0	0	0	0	110.6	A1308 G1312 V1313	A1308-S1310 VanDerWaalsContact C-N 3.31Å; A1308-S1310 PolarHBondContact O-N 3.14Å; S1310-G1312 PolarHBondContact O-N 2.97Å; S1310-G1312 VanDerWaalsContact O-N 3.12Å; S1310-V1313 PolarHBondContact O-N 3.01Å
1311	P	60.1	Low	79.3	Confident	139.6 Å²	139.6	49 Å²	49	91%	0.906	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	122.3	174.1	5	-5.1	0	0	0	110.4
1312	G	65.8	Low	79.3	Confident	82 Å²	82	45 Å²	45	85%	0.845	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.7	-3.4	179	0	0	0	0	0	116.4	S1310	S1310-G1312 PolarHBondContact O-N 2.97Å; S1310-G1312 VanDerWaalsContact O-N 3.12Å
1313	V	65.2	Low	79.3	Confident	46 Å²	46	45.3 Å²	45.3	28%	0.279	27%	0.267	S	S	.	.			trans	-105.9	120.6	167.8	-178.3	0	0	0	0	107.6	A1308 S1310 D1385 F1386	A1308-V1313 HydrophobicContact CB-CB 4.36Å; A1308-V1313 WeakPolarHBondContact CB-O 3.45Å; S1310-V1313 PolarHBondContact O-N 3.01Å; V1313-D1385 HydrophobicContact CG1-CB 4.29Å; V1313-D1385 WeakPolarHBondContact CG1-OD2 3.2Å; V1313-F1386 HydrophobicContact CG2-CE2 4.46Å
1314	E	71.3	Confident	79.1	Confident	133.2 Å²	133.2	43.8 Å²	43.8	62%	0.622	26%	0.256	S	S	*	.			trans	-85.6	137.1	176.5	-67.5	-178.1	179.1	0	0	108.8	D1385	E1314-D1385 WeakPolarHBondContact CA-OD2 3.17Å; E1314-D1385 WeakPolarHBondContact CB-OD2 3.14Å; E1314-D1385 PolarHBondContact N-OD2 3.11Å; E1314-D1385 VanDerWaalsContact O-CG 3.24Å; E1314-D1385 VanDerWaalsContact O-OD1 3.09Å
1315	G	77.5	Confident	78.7	Confident	2.4 Å²	2.4	44.3 Å²	44.3	3%	0.025	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	138.4	173.9	0	0	0	0	0	108.9	S1306 D1361 H1382	S1306-G1315 WeakPolarHBondContact OG-CA 3.25Å; G1315-D1361 WeakPolarHBondContact O-CA 3.3Å; G1315-D1361 VanDerWaalsContact O-CB 3.29Å; G1315-D1361 WeakPolarHBondContact O-CB 3.33Å; G1315-H1382 WeakPolarHBondContact CA-CE1 3.44Å
1316	R	86.1	Confident	78.2	Confident	66.4 Å²	66.4	39.1 Å²	39.1	25%	0.251	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	155.7	171.5	-68.2	176.5	-69.9	169.4	2.2	110.3	S1306 V1357 S1358 I1383 S1384 D1385 E1387	S1306-R1316 PolarHBondContact OG-O 2.85Å; S1306-R1316 VanDerWaalsContact OG-O 3.08Å; R1316-V1357 HydrophobicContact CB-CG1 3.99Å; R1316-S1358 VanDerWaalsContact CD-O 3.29Å; R1316-S1358 WeakPolarHBondContact CD-O 3.26Å; R1316-S1358 WeakPolarHBondContact CG-O 3.26Å; R1316-I1383 HydrophobicContact CB-CB 4.31Å; R1316-I1383 PolarHBondContact N-O 3.03Å; R1316-I1383 PolarHBondContact O-N 3.25Å; R1316-S1384 PolarHBondContact NH2-O 3.32Å; R1316-S1384 VanDerWaalsContact NH2-O 3.14Å; R1316-D1385 IonicContact NE-OD1 2.64Å; R1316-D1385 PolarHBondContact NH2-O 2.92Å; R1316-D1385 VanDerWaalsContact NH2-O 3.1Å; R1316-E1387 PolarHBondContact NH2-O 3.1Å; R1316-E1387 VanDerWaalsContact NH2-O 3.11Å
1317	V	87.7	Confident	77.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	119.7	176.6	-175.7	0	0	0	0	108.9	L1272 V1304 V1319 V1357 S1358 I1363	L1272-V1317 HydrophobicContact CD1-CB 4.45Å; L1272-V1317 HydrophobicContact CD1-CG1 3.84Å; L1272-V1317 HydrophobicContact CD1-CG2 4.28Å; V1304-V1317 HydrophobicContact CG1-CG1 3.97Å; V1304-V1317 HydrophobicContact CG1-CG2 4.31Å; V1317-V1319 HydrophobicContact CG1-CG2 4.31Å; V1317-V1357 WeakPolarHBondContact O-CA 3.27Å; V1317-S1358 PolarHBondContact N-OG 2.96Å; V1317-S1358 PolarHBondContact O-N 3.09Å; V1317-S1358 PolarHBondContact O-OG 3.04Å; V1317-I1363 HydrophobicContact CB-CD1 4.12Å; V1317-I1363 HydrophobicContact CB-CG1 4.32Å; V1317-I1363 HydrophobicContact CB-CG2 4.39Å; V1317-I1363 HydrophobicContact CG1-CD1 3.55Å; V1317-I1363 VanDerWaalsContact CG1-CD1 3.5Å; V1317-I1363 HydrophobicContact CG1-CG1 4.1Å; V1317-I1363 HydrophobicContact CG2-CG1 4.42Å
1318	G	88	Confident	77.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	139.3	168.8	0	0	0	0	0	111.5	W1356 L1380 F1381	G1318-W1356 CarbonylContact C-O 3.4Å; G1318-W1356 WeakPolarHBondContact CA-O 3.45Å; G1318-L1380 WeakPolarHBondContact O-CA 3.37Å; G1318-F1381 VanDerWaalsContact C-CE1 3.46Å; G1318-F1381 PolarHBondContact N-O 2.9Å; G1318-F1381 VanDerWaalsContact O-CD1 3.32Å; G1318-F1381 WeakPolarHBondContact O-CD1 3.36Å; G1318-F1381 PolarHBondContact O-N 3.2Å
1319	V	89.8	Confident	77.8	Confident	1.2 Å²	1.2	47.7 Å²	47.7	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123.4	178.1	-172.3	0	0	0	0	109.4	V1317 I1335 F1354 P1355 W1356 I1363 V1378 L1379 L1380	V1317-V1319 HydrophobicContact CG1-CG2 4.31Å; V1319-I1335 HydrophobicContact CB-CD1 4.28Å; V1319-I1335 HydrophobicContact CG1-CD1 3.88Å; V1319-I1335 HydrophobicContact CG2-CD1 4.24Å; V1319-F1354 HydrophobicContact CB-CE1 4.25Å; V1319-F1354 HydrophobicContact CG1-CD1 4.38Å; V1319-F1354 HydrophobicContact CG1-CE1 3.88Å; V1319-F1354 WeakPolarHBondContact O-CD1 3.34Å; V1319-P1355 CarbonylContact O-C 3.52Å; V1319-P1355 VanDerWaalsContact O-CA 3.28Å; V1319-P1355 WeakPolarHBondContact O-CA 3.23Å; V1319-W1356 HydrophobicContact CB-CE3 4.21Å; V1319-W1356 HydrophobicContact CG2-CE3 3.85Å; V1319-W1356 HydrophobicContact CG2-CZ3 4.15Å; V1319-W1356 PolarHBondContact N-O 3.03Å; V1319-W1356 PolarHBondContact O-N 2.98Å; V1319-I1363 HydrophobicContact CG2-CD1 3.88Å; V1319-V1378 HydrophobicContact CG1-CB 4.28Å; V1319-V1378 HydrophobicContact CG1-CG1 3.29Å; V1319-L1379 WeakPolarHBondContact CA-O 3.27Å; V1319-L1380 HydrophobicContact CB-CD2 4.49Å; V1319-L1380 HydrophobicContact CG1-CD2 4.2Å; V1319-L1380 HydrophobicContact CG2-CD2 3.87Å
1320	Q	88	Confident	78.8	Confident	16 Å²	16	44.4 Å²	44.4	8%	0.075	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.3	176.4	173.2	77.7	32.4	0	0	110.7	W1165 I1322 P1355 V1378 L1379 F1381	W1165-Q1320 HydrophobicContact CH2-CG 3.71Å; W1165-Q1320 HydrophobicContact CZ2-CG 4.04Å; Q1320-I1322 PolarHBondContact O-N 2.8Å; Q1320-P1355 HydrophobicContact CB-CB 4.26Å; Q1320-P1355 HydrophobicContact CG-CB 4.34Å; Q1320-P1355 VanDerWaalsContact OE1-CA 3.27Å; Q1320-P1355 VanDerWaalsContact OE1-CD 3.28Å; Q1320-V1378 CarbonylContact O-C 3.57Å; Q1320-V1378 WeakPolarHBondContact O-CA 3.38Å; Q1320-V1378 WeakPolarHBondContact O-CG1 3.28Å; Q1320-L1379 HydrophobicContact CB-CB 4.27Å; Q1320-L1379 PolarHBondContact N-O 2.98Å; Q1320-L1379 PolarHBondContact O-N 3.04Å; Q1320-F1381 HydrophobicContact CB-CE1 3.93Å
1321	I	88.2	Confident	79.8	Confident	13 Å²	13	41.3 Å²	41.3	7%	0.067	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127.9	177.4	-56.2	176.9	0	0	0	109.7	R1324 M1347 L1351 F1354	I1321-R1324 HydrophobicContact CG2-CG 3.88Å; I1321-M1347 HydrophobicContact CB-CE 4.07Å; I1321-M1347 HydrophobicContact CD1-CE 3.88Å; I1321-M1347 HydrophobicContact CD1-CG 3.79Å; I1321-M1347 HydrophobicContact CD1-SD 4.28Å; I1321-M1347 HydrophobicContact CG1-CE 3.87Å; I1321-M1347 HydrophobicContact CG1-CG 4.44Å; I1321-M1347 HydrophobicContact CG1-SD 4.4Å; I1321-M1347 HydrophobicContact CG2-CE 3.42Å; I1321-M1347 VanDerWaalsContact CG2-CE 3.42Å; I1321-L1351 HydrophobicContact CD1-CD2 3.62Å; I1321-F1354 HydrophobicContact CD1-CB 3.97Å; I1321-F1354 HydrophobicContact CD1-CD1 4.02Å; I1321-F1354 HydrophobicContact CD1-CD2 3.46Å; I1321-F1354 VanDerWaalsContact CD1-CD2 3.46Å; I1321-F1354 HydrophobicContact CD1-CE1 4.39Å; I1321-F1354 HydrophobicContact CD1-CE2 3.88Å; I1321-F1354 HydrophobicContact CD1-CG 3.53Å; I1321-F1354 VanDerWaalsContact CD1-CG 3.48Å; I1321-F1354 HydrophobicContact CD1-CZ 4.32Å; I1321-F1354 HydrophobicContact CG1-CB 4.04Å; I1321-F1354 HydrophobicContact CG1-CD1 3.72Å; I1321-F1354 HydrophobicContact CG1-CD2 4.12Å; I1321-F1354 HydrophobicContact CG1-CE1 4.17Å; I1321-F1354 HydrophobicContact CG1-CE2 4.46Å; I1321-F1354 HydrophobicContact CG1-CG 3.68Å; I1321-F1354 HydrophobicContact CG1-CZ 4.41Å
1322	I	85.4	Confident	81.2	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-53	170	-57	174.2	0	0	0	109.1	L1126 W1165 Y1187 Q1242 L1249 Y1282 Q1320 A1377 L1379	L1126-I1322 HydrophobicContact CD2-CD1 4.49Å; L1126-I1322 HydrophobicContact CD2-CG2 4.33Å; W1165-I1322 HydrophobicContact CH2-CG1 3.91Å; W1165-I1322 HydrophobicContact CZ3-CB 4.43Å; W1165-I1322 HydrophobicContact CZ3-CG1 3.87Å; W1165-I1322 HydrophobicContact CZ3-CG2 4.4Å; Y1187-I1322 PolarHBondContact OH-O 3.06Å; Q1242-I1322 PolarHBondContact NE2-O 3.12Å; L1249-I1322 HydrophobicContact CD1-CD1 3.94Å; L1249-I1322 HydrophobicContact CD1-CG2 4.21Å; Y1282-I1322 HydrophobicContact CD1-CD1 3.44Å; Y1282-I1322 VanDerWaalsContact CD1-CD1 3.45Å; Y1282-I1322 HydrophobicContact CE1-CD1 3.73Å; Q1320-I1322 PolarHBondContact O-N 2.8Å; I1322-A1377 WeakPolarHBondContact CA-O 3.36Å; I1322-A1377 HydrophobicContact CB-CB 4.15Å; I1322-A1377 WeakPolarHBondContact CB-O 3.28Å; I1322-A1377 HydrophobicContact CG2-CB 4.49Å; I1322-A1377 PolarHBondContact N-O 2.94Å; I1322-L1379 HydrophobicContact CD1-CB 4.02Å; I1322-L1379 HydrophobicContact CG1-CB 4.22Å
1323	N	87.7	Confident	82.3	Confident	9.6 Å²	9.6	31.2 Å²	31.2	5%	0.051	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	132.2	175.6	-159.8	31.7	0	0	0	110.9	Q1242 R1250 M1347 E1375 A1377	Q1242-N1323 WeakPolarHBondContact CG-OD1 3.41Å; Q1242-N1323 PolarHBondContact NE2-OD1 3.05Å; R1250-N1323 PolarHBondContact NH2-ND2 3.42Å; N1323-M1347 WeakPolarHBondContact O-CE 3.43Å; N1323-E1375 WeakPolarHBondContact CB-O 3.36Å; N1323-E1375 PolarHBondContact ND2-O 2.98Å; N1323-A1377 HydrophobicContact CB-CB 3.81Å; N1323-A1377 PolarHBondContact N-O 2.98Å; N1323-A1377 PolarHBondContact O-N 3.1Å; N1323-A1377 VanDerWaalsContact O-N 3.16Å
1324	R	85.5	Confident	83.5	Confident	17.6 Å²	17.6	31.4 Å²	31.4	7%	0.066	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-80.2	159.3	-177.2	-70.4	-176.6	-178.3	178	3.3	110.7	I1321 L1351 F1415 F1416 V1422 L1423	I1321-R1324 HydrophobicContact CG2-CG 3.88Å; R1324-L1351 HydrophobicContact CG-CD2 4.26Å; R1324-F1415 PolarHBondContact NH1-O 3.16Å; R1324-F1416 VanDerWaalsContact NH1-CE1 3.3Å; R1324-V1422 HydrophobicContact CG-CG1 4.45Å; R1324-V1422 VanDerWaalsContact CZ-CG1 3.45Å; R1324-V1422 VanDerWaalsContact NE-CG1 3.34Å; R1324-V1422 VanDerWaalsContact NH1-CG1 3.35Å; R1324-L1423 PolarHBondContact NH1-O 3.06Å; R1324-L1423 PolarHBondContact NH2-O 2.82Å
1325	P	81.1	Confident	84.4	Confident	11.8 Å²	11.8	25.1 Å²	25.1	8%	0.077	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-61.6	146.3	172.8	-13	25.4	0	0	0	111.7	E1331 M1347 R1348 V1376	P1325-E1331 HydrophobicContact CB-CB 4.36Å; P1325-E1331 HydrophobicContact CB-CG 4.37Å; P1325-E1331 WeakPolarHBondContact CB-O 3.34Å; P1325-M1347 HydrophobicContact CG-CE 4.38Å; P1325-M1347 HydrophobicContact CG-CG 4.33Å; P1325-M1347 HydrophobicContact CG-SD 3.87Å; P1325-R1348 HydrophobicContact CB-CG 4.18Å; P1325-R1348 HydrophobicContact CG-CG 3.93Å; P1325-V1376 HydrophobicContact CB-CG2 3.77Å; P1325-V1376 HydrophobicContact CG-CG2 3.69Å
1326	S	75.5	Confident	84.9	Confident	7.4 Å²	7.4	27 Å²	27	5%	0.052	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-63	142	-179.2	-169	0	0	0	0	112.4	E1328 E1331 R1348 E1375	S1326-E1328 VanDerWaalsContact C-N 3.32Å; S1326-E1328 PolarHBondContact OG-N 3.01Å; S1326-E1331 PolarHBondContact N-OE2 3.44Å; S1326-R1348 PolarHBondContact O-NH1 2.88Å; S1326-R1348 VanDerWaalsContact O-NH1 3.08Å; S1326-R1348 PolarHBondContact O-NH2 3.01Å; S1326-E1375 WeakPolarHBondContact CA-OE2 3.31Å; S1326-E1375 WeakPolarHBondContact CB-OE2 3.41Å; S1326-E1375 PolarHBondContact OG-OE2 2.94Å
1327	Q	71.8	Confident	85	Confident	119.2 Å²	119.2	23.9 Å²	23.9	56%	0.557	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.1	172	-70	-152.8	-19.3	0	0	112.5	G1329 F1416	Q1327-G1329 VanDerWaalsContact C-N 3.32Å; Q1327-G1329 PolarHBondContact O-N 2.88Å; Q1327-F1416 VanDerWaalsContact NE2-CD2 3.31Å; Q1327-F1416 VanDerWaalsContact NE2-CG 3.33Å
1328	E	75.2	Confident	84.7	Confident	155.8 Å²	155.8	28.5 Å²	28.5	73%	0.728	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.2	-177.6	-62.9	-178.9	177.3	0	0	113.4	S1326 Y1371	S1326-E1328 VanDerWaalsContact C-N 3.32Å; S1326-E1328 PolarHBondContact OG-N 3.01Å; E1328-Y1371 WeakPolarHBondContact O-CE2 3.21Å
1329	G	76.5	Confident	84.3	Confident	2.4 Å²	2.4	31.6 Å²	31.6	3%	0.025	16%	0.161	C	C	.	.	S	Bend	trans	-135.8	178.7	-179.7	0	0	0	0	0	112.9	Q1327 R1348 Y1371	Q1327-G1329 VanDerWaalsContact C-N 3.32Å; Q1327-G1329 PolarHBondContact O-N 2.88Å; G1329-R1348 PolarHBondContact O-NH1 3.01Å; G1329-R1348 VanDerWaalsContact O-NH1 3.08Å; G1329-R1348 PolarHBondContact O-NH2 3.26Å; G1329-R1348 VanDerWaalsContact O-NH2 3.15Å; G1329-Y1371 WeakPolarHBondContact CA-O 3.45Å
1330	D	83.9	Confident	83.8	Confident	41.8 Å²	41.8	33.4 Å²	33.4	22%	0.224	18%	0.176	C	C	.	.			trans	-100.5	12.8	177.7	76.1	-36.4	0	0	0	113.4	N1332 T1370 Y1371	D1330-N1332 PolarHBondContact O-N 2.92Å; D1330-T1370 PolarHBondContact OD1-N 3.03Å; D1330-T1370 PolarHBondContact OD1-OG1 3.11Å; D1330-T1370 VanDerWaalsContact OD2-CB 3.28Å; D1330-T1370 WeakPolarHBondContact OD2-CB 3.25Å; D1330-T1370 VanDerWaalsContact OD2-CG2 3.26Å; D1330-T1370 WeakPolarHBondContact OD2-CG2 3.33Å; D1330-T1370 PolarHBondContact OD2-N 3Å; D1330-T1370 VanDerWaalsContact OD2-N 3.16Å; D1330-T1370 PolarHBondContact OD2-OG1 3.18Å; D1330-Y1371 HydrophobicContact CB-CD1 4.24Å; D1330-Y1371 HydrophobicContact CB-CE1 3.72Å; D1330-Y1371 PolarHBondContact N-O 3.15Å; D1330-Y1371 PolarHBondContact OD1-N 2.99Å; D1330-Y1371 VanDerWaalsContact OD1-O 3.08Å
1331	E	86.4	Confident	83.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.21	C	C	.	.			trans	-51.7	131.1	176.3	-174.1	-178.1	-147.3	0	0	110.9	A1285 P1325 S1326 R1348 Y1367 K1368 R1369 A1374 E1375 V1376	A1285-E1331 VanDerWaalsContact CB-OE1 3.25Å; A1285-E1331 WeakPolarHBondContact CB-OE1 3.16Å; P1325-E1331 HydrophobicContact CB-CB 4.36Å; P1325-E1331 HydrophobicContact CB-CG 4.37Å; P1325-E1331 WeakPolarHBondContact CB-O 3.34Å; S1326-E1331 PolarHBondContact N-OE2 3.44Å; E1331-R1348 WeakPolarHBondContact O-CD 3.24Å; E1331-R1348 PolarHBondContact O-NH1 3.16Å; E1331-Y1367 HydrophobicContact CG-CE2 3.59Å; E1331-Y1367 WeakPolarHBondContact CG-OH 3.44Å; E1331-Y1367 VanDerWaalsContact OE1-CE2 3.25Å; E1331-Y1367 WeakPolarHBondContact OE1-CE2 3.4Å; E1331-Y1367 PolarHBondContact OE1-OH 3.01Å; E1331-K1368 WeakPolarHBondContact CA-O 3.31Å; E1331-R1369 HydrophobicContact CB-CB 4.43Å; E1331-R1369 HydrophobicContact CB-CG 4.15Å; E1331-R1369 HydrophobicContact CG-CB 4.43Å; E1331-R1369 HydrophobicContact CG-CG 4.42Å; E1331-A1374 VanDerWaalsContact OE1-CA 3.28Å; E1331-A1374 WeakPolarHBondContact OE1-CA 3.36Å; E1331-E1375 VanDerWaalsContact CD-N 3.3Å; E1331-E1375 PolarHBondContact OE1-N 3.19Å; E1331-E1375 VanDerWaalsContact OE1-N 3.11Å; E1331-E1375 WeakPolarHBondContact OE2-CA 3.26Å; E1331-E1375 PolarHBondContact OE2-N 3.12Å; E1331-V1376 VanDerWaalsContact CD-CG2 3.46Å; E1331-V1376 HydrophobicContact CG-CB 4.5Å; E1331-V1376 HydrophobicContact CG-CG2 3.78Å; E1331-V1376 VanDerWaalsContact OE1-CB 3.32Å; E1331-V1376 WeakPolarHBondContact OE1-CB 3.41Å; E1331-V1376 WeakPolarHBondContact OE1-CG2 3.39Å; E1331-V1376 PolarHBondContact OE1-N 3.13Å; E1331-V1376 PolarHBondContact OE2-N 3.12Å
1332	N	88.9	Confident	82.5	Confident	6 Å²	6	37.9 Å²	37.9	3%	0.032	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	155.4	176.8	-159.2	11.7	0	0	0	112.9	D1330 Y1334 N1346 R1348 K1368	D1330-N1332 PolarHBondContact O-N 2.92Å; N1332-Y1334 HydrophobicContact CB-CE2 4.02Å; N1332-Y1334 WeakPolarHBondContact ND2-CE1 3.31Å; N1332-Y1334 PolarHBondContact ND2-OH 3.1Å; N1332-Y1334 VanDerWaalsContact ND2-OH 3.14Å; N1332-N1346 PolarHBondContact ND2-OD1 3.25Å; N1332-N1346 PolarHBondContact OD1-OD1 3.29Å; N1332-N1346 VanDerWaalsContact OD1-OD1 3.11Å; N1332-R1348 HydrophobicContact CB-CG 4.34Å; N1332-R1348 VanDerWaalsContact OD1-CB 3.27Å; N1332-R1348 WeakPolarHBondContact OD1-CB 3.26Å; N1332-R1348 WeakPolarHBondContact OD1-CG 3.37Å; N1332-R1348 PolarHBondContact OD1-N 2.95Å; N1332-R1348 VanDerWaalsContact OD1-N 3.11Å; N1332-K1368 PolarHBondContact N-O 3.05Å; N1332-K1368 PolarHBondContact O-N 2.93Å
1333	L	88.9	Confident	82.3	Confident	2.6 Å²	2.6	41.9 Å²	41.9	1%	0.014	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.3	174.7	-163.8	77	0	0	0	109.4	M1264 M1347 V1365 Y1367 V1376 V1378	M1264-L1333 HydrophobicContact CE-CD1 4.46Å; M1264-L1333 HydrophobicContact SD-CD1 4.46Å; L1333-M1347 HydrophobicContact CB-CB 4.12Å; L1333-M1347 HydrophobicContact CB-CE 3.69Å; L1333-M1347 HydrophobicContact CB-SD 3.88Å; L1333-M1347 HydrophobicContact CD2-CE 3.38Å; L1333-M1347 VanDerWaalsContact CD2-CE 3.4Å; L1333-M1347 HydrophobicContact CD2-SD 4.24Å; L1333-M1347 HydrophobicContact CG-CE 4.14Å; L1333-M1347 WeakPolarHBondContact O-CB 3.25Å; L1333-M1347 PolarHBondContact O-N 3.09Å; L1333-M1347 VanDerWaalsContact O-N 3.09Å; L1333-V1365 HydrophobicContact CD1-CG1 3.44Å; L1333-V1365 VanDerWaalsContact CD1-CG1 3.48Å; L1333-V1365 HydrophobicContact CD2-CG1 3.97Å; L1333-V1365 HydrophobicContact CG-CG1 3.74Å; L1333-Y1367 HydrophobicContact CD1-CD2 4.11Å; L1333-Y1367 HydrophobicContact CD1-CG 4.43Å; L1333-V1376 HydrophobicContact CB-CG1 4.44Å; L1333-V1376 HydrophobicContact CD2-CG1 4.43Å; L1333-V1378 HydrophobicContact CD2-CG1 3.97Å; L1333-V1378 HydrophobicContact CD2-CG2 4.01Å
1334	Y	90.1	Very high	82.2	Confident	50.6 Å²	50.6	46.3 Å²	46.3	20%	0.198	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.4	176.3	-58.3	-90.2	0	0	0	109.3	N1332 E1344 V1345 N1346 V1365 R1366 K1368	N1332-Y1334 HydrophobicContact CB-CE2 4.02Å; N1332-Y1334 WeakPolarHBondContact ND2-CE1 3.31Å; N1332-Y1334 PolarHBondContact ND2-OH 3.1Å; N1332-Y1334 VanDerWaalsContact ND2-OH 3.14Å; Y1334-E1344 HydrophobicContact CD1-CG 4.39Å; Y1334-E1344 WeakPolarHBondContact CD1-OE1 3.28Å; Y1334-E1344 WeakPolarHBondContact CE1-OE1 3.42Å; Y1334-V1345 WeakPolarHBondContact CA-O 3.44Å; Y1334-N1346 HydrophobicContact CD1-CB 4.3Å; Y1334-N1346 HydrophobicContact CE1-CB 4.29Å; Y1334-V1365 CarbonylContact O-C 3.4Å; Y1334-V1365 WeakPolarHBondContact O-CA 3.33Å; Y1334-R1366 PolarHBondContact N-O 2.99Å; Y1334-R1366 PolarHBondContact O-N 2.91Å; Y1334-K1368 HydrophobicContact CE2-CB 4.25Å
1335	I	89.3	Confident	82.1	Confident	0.8 Å²	0.8	45.6 Å²	45.6	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.7	176.5	-53.6	167	0	0	0	107.8	V1319 E1344 V1345 F1354 W1356 I1363 R1364 V1365	V1319-I1335 HydrophobicContact CB-CD1 4.28Å; V1319-I1335 HydrophobicContact CG1-CD1 3.88Å; V1319-I1335 HydrophobicContact CG2-CD1 4.24Å; I1335-E1344 CarbonylContact O-C 3.55Å; I1335-E1344 WeakPolarHBondContact O-CA 3.33Å; I1335-V1345 HydrophobicContact CB-CB 4.3Å; I1335-V1345 PolarHBondContact N-O 3.01Å; I1335-V1345 PolarHBondContact O-N 2.97Å; I1335-F1354 HydrophobicContact CD1-CE1 3.85Å; I1335-F1354 HydrophobicContact CD1-CZ 3.89Å; I1335-W1356 HydrophobicContact CB-CZ3 4.4Å; I1335-W1356 HydrophobicContact CD1-CE3 4.37Å; I1335-W1356 HydrophobicContact CD1-CZ3 4.45Å; I1335-W1356 HydrophobicContact CG2-CE3 4.18Å; I1335-W1356 HydrophobicContact CG2-CH2 3.72Å; I1335-W1356 HydrophobicContact CG2-CZ3 3.46Å; I1335-W1356 VanDerWaalsContact CG2-CZ3 3.46Å; I1335-I1363 HydrophobicContact CG2-CB 4.26Å; I1335-I1363 HydrophobicContact CG2-CD1 3.99Å; I1335-R1364 CarbonylContact C-O 3.56Å; I1335-R1364 WeakPolarHBondContact CA-O 3.33Å; I1335-V1365 HydrophobicContact CG1-CG2 4.44Å; I1335-V1365 HydrophobicContact CG2-CG2 4.47Å
1336	F	89.7	Confident	82.4	Confident	42.4 Å²	42.4	47.4 Å²	47.4	19%	0.186	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	118.8	178	-58.6	-87.1	0	0	0	109.1	E1344 I1363 R1364 R1366	F1336-E1344 HydrophobicContact CD1-CB 4.01Å; F1336-E1344 HydrophobicContact CD1-CG 3.99Å; F1336-E1344 HydrophobicContact CE1-CB 3.91Å; F1336-E1344 VanDerWaalsContact CE1-CD 3.46Å; F1336-E1344 HydrophobicContact CE1-CG 3.5Å; F1336-E1344 VanDerWaalsContact CE1-CG 3.48Å; F1336-E1344 WeakPolarHBondContact CE1-OE2 3.33Å; F1336-E1344 HydrophobicContact CZ-CG 4.03Å; F1336-E1344 WeakPolarHBondContact CZ-OE1 3.38Å; F1336-I1363 WeakPolarHBondContact O-CA 3.34Å; F1336-R1364 HydrophobicContact CB-CB 4.19Å; F1336-R1364 HydrophobicContact CD2-CB 4.44Å; F1336-R1364 WeakPolarHBondContact CD2-O 3.41Å; F1336-R1364 PolarHBondContact N-O 2.94Å; F1336-R1364 PolarHBondContact O-N 3.13Å; F1336-R1366 HydrophobicContact CE2-CB 3.83Å; F1336-R1366 VanDerWaalsContact CZ-NH1 3.33Å
1337	D	87.2	Confident	82.9	Confident	1.6 Å²	1.6	47.1 Å²	47.1	1%	0.009	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	103.6	172.1	-171.5	-11.2	0	0	0	109.4	A1339 A1340 G1342 M1343 W1356 S1359	D1337-A1339 VanDerWaalsContact C-N 3.32Å; D1337-A1339 PolarHBondContact O-N 2.91Å; D1337-A1339 WeakPolarHBondContact OD1-CB 3.26Å; D1337-A1339 PolarHBondContact OD1-N 3.13Å; D1337-A1339 VanDerWaalsContact OD1-N 3.11Å; D1337-A1340 HydrophobicContact CB-CB 3.94Å; D1337-A1340 VanDerWaalsContact CG-CB 3.49Å; D1337-A1340 PolarHBondContact O-N 2.88Å; D1337-A1340 PolarHBondContact OD1-N 3.19Å; D1337-A1340 WeakPolarHBondContact OD2-CB 3.38Å; D1337-G1342 CarbonylContact O-C 3.59Å; D1337-G1342 VanDerWaalsContact O-CA 3.3Å; D1337-G1342 WeakPolarHBondContact O-CA 3.28Å; D1337-G1342 PolarHBondContact O-N 3.28Å; D1337-G1342 VanDerWaalsContact O-N 3.09Å; D1337-M1343 PolarHBondContact N-O 3.18Å; D1337-M1343 PolarHBondContact O-N 3.12Å; D1337-W1356 HydrophobicContact CB-CH2 3.86Å; D1337-W1356 HydrophobicContact CB-CZ2 3.84Å; D1337-S1359 PolarHBondContact OD1-OG 2.97Å; D1337-S1359 VanDerWaalsContact OD2-CB 3.27Å; D1337-S1359 WeakPolarHBondContact OD2-CB 3.4Å; D1337-S1359 PolarHBondContact OD2-N 2.99Å; D1337-S1359 PolarHBondContact OD2-OG 2.97Å
1338	E	81.5	Confident	83.4	Confident	95.8 Å²	95.8	46.1 Å²	46.1	45%	0.448	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-33.5	-179.7	-64.8	-155.4	164.6	0	0	111.9	A1340 G1341 R1364	E1338-A1340 VanDerWaalsContact C-N 3.31Å; E1338-A1340 PolarHBondContact O-N 3.12Å; E1338-G1341 PolarHBondContact O-N 3.11Å; E1338-R1364 VanDerWaalsContact CD-CZ 3.42Å; E1338-R1364 VanDerWaalsContact CD-NH1 3.33Å; E1338-R1364 WeakPolarHBondContact OE1-CD 3.22Å; E1338-R1364 WeakPolarHBondContact OE1-CG 3.26Å; E1338-R1364 IonicContact OE1-CZ 3.22Å; E1338-R1364 IonicContact OE1-NE 3.56Å; E1338-R1364 PolarHBondContact OE1-NE 2.86Å; E1338-R1364 VanDerWaalsContact OE1-NE 3.09Å; E1338-R1364 IonicContact OE1-NH1 3.43Å; E1338-R1364 PolarHBondContact OE1-NH1 2.87Å; E1338-R1364 IonicContact OE1-NH2 3.12Å; E1338-R1364 PolarHBondContact OE1-NH2 2.86Å; E1338-R1364 IonicContact OE2-CZ 3.38Å; E1338-R1364 VanDerWaalsContact OE2-CZ 3.29Å; E1338-R1364 IonicContact OE2-NE 3.97Å; E1338-R1364 IonicContact OE2-NH1 3.4Å; E1338-R1364 PolarHBondContact OE2-NH1 2.89Å; E1338-R1364 VanDerWaalsContact OE2-NH1 3.09Å; E1338-R1364 IonicContact OE2-NH2 3.01Å; E1338-R1364 PolarHBondContact OE2-NH2 3.16Å
1339	A	79.6	Confident	83.5	Confident	65.8 Å²	65.8	41 Å²	41	54%	0.544	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-28.3	-179.4	0	0	0	0	0	112.1	D1337 G1341 S1359	D1337-A1339 VanDerWaalsContact C-N 3.32Å; D1337-A1339 PolarHBondContact O-N 2.91Å; D1337-A1339 WeakPolarHBondContact OD1-CB 3.26Å; D1337-A1339 PolarHBondContact OD1-N 3.13Å; D1337-A1339 VanDerWaalsContact OD1-N 3.11Å; A1339-G1341 PolarHBondContact O-N 3.2Å; A1339-G1341 VanDerWaalsContact O-N 3.15Å; A1339-S1359 VanDerWaalsContact C-OG 3.28Å; A1339-S1359 VanDerWaalsContact CB-OG 3.27Å; A1339-S1359 WeakPolarHBondContact CB-OG 3.24Å
1340	A	78.8	Confident	83.7	Confident	40 Å²	40	43.2 Å²	43.2	33%	0.331	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	23.1	174.9	0	0	0	0	0	114	D1337 E1338 M1343 S1359	D1337-A1340 HydrophobicContact CB-CB 3.94Å; D1337-A1340 VanDerWaalsContact CG-CB 3.49Å; D1337-A1340 PolarHBondContact O-N 2.88Å; D1337-A1340 PolarHBondContact OD1-N 3.19Å; D1337-A1340 WeakPolarHBondContact OD2-CB 3.38Å; E1338-A1340 VanDerWaalsContact C-N 3.31Å; E1338-A1340 PolarHBondContact O-N 3.12Å; A1340-M1343 HydrophobicContact CB-CB 3.87Å; A1340-S1359 WeakPolarHBondContact CB-OG 3.36Å; A1340-S1359 PolarHBondContact N-OG 2.91Å
1341	G	76.9	Confident	83.7	Confident	77 Å²	77	41.5 Å²	41.5	79%	0.794	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	27.4	-177.8	0	0	0	0	0	114	E1338 A1339	E1338-G1341 PolarHBondContact O-N 3.11Å; A1339-G1341 PolarHBondContact O-N 3.2Å; A1339-G1341 VanDerWaalsContact O-N 3.15Å
1342	G	72.5	Confident	83.6	Confident	46.6 Å²	46.6	41.8 Å²	41.8	48%	0.48	26%	0.258	S	S	.	.	S	Bend	trans	78.9	30.1	-178.9	0	0	0	0	0	113.8	D1337 E1344	D1337-G1342 CarbonylContact O-C 3.59Å; D1337-G1342 VanDerWaalsContact O-CA 3.3Å; D1337-G1342 WeakPolarHBondContact O-CA 3.28Å; D1337-G1342 PolarHBondContact O-N 3.28Å; D1337-G1342 VanDerWaalsContact O-N 3.09Å; G1342-E1344 PolarHBondContact O-N 3.09Å
1343	M	82	Confident	83.4	Confident	85.4 Å²	85.4	43.6 Å²	43.6	42%	0.421	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	123.6	176.7	-175.4	178	178.1	0	0	110.2	D1337 A1340 V1345	D1337-M1343 PolarHBondContact N-O 3.18Å; D1337-M1343 PolarHBondContact O-N 3.12Å; A1340-M1343 HydrophobicContact CB-CB 3.87Å; M1343-V1345 HydrophobicContact CE-CG2 4.21Å; M1343-V1345 HydrophobicContact CG-CG2 4.46Å
1344	E	85.2	Confident	83.3	Confident	101.4 Å²	101.4	44.1 Å²	44.1	47%	0.474	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.2	174.7	-179.2	178.7	171.6	0	0	109.8	Y1334 I1335 F1336 G1342	Y1334-E1344 HydrophobicContact CD1-CG 4.39Å; Y1334-E1344 WeakPolarHBondContact CD1-OE1 3.28Å; Y1334-E1344 WeakPolarHBondContact CE1-OE1 3.42Å; I1335-E1344 CarbonylContact O-C 3.55Å; I1335-E1344 WeakPolarHBondContact O-CA 3.33Å; F1336-E1344 HydrophobicContact CD1-CB 4.01Å; F1336-E1344 HydrophobicContact CD1-CG 3.99Å; F1336-E1344 HydrophobicContact CE1-CB 3.91Å; F1336-E1344 VanDerWaalsContact CE1-CD 3.46Å; F1336-E1344 HydrophobicContact CE1-CG 3.5Å; F1336-E1344 VanDerWaalsContact CE1-CG 3.48Å; F1336-E1344 WeakPolarHBondContact CE1-OE2 3.33Å; F1336-E1344 HydrophobicContact CZ-CG 4.03Å; F1336-E1344 WeakPolarHBondContact CZ-OE1 3.38Å; G1342-E1344 PolarHBondContact O-N 3.09Å
1345	V	84.2	Confident	83.1	Confident	2.8 Å²	2.8	42.3 Å²	42.3	2%	0.017	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	111	173.1	-176.8	0	0	0	0	108.7	Y1334 I1335 M1343 N1350 F1354 W1356	Y1334-V1345 WeakPolarHBondContact CA-O 3.44Å; I1335-V1345 HydrophobicContact CB-CB 4.3Å; I1335-V1345 PolarHBondContact N-O 3.01Å; I1335-V1345 PolarHBondContact O-N 2.97Å; M1343-V1345 HydrophobicContact CE-CG2 4.21Å; M1343-V1345 HydrophobicContact CG-CG2 4.46Å; V1345-N1350 HydrophobicContact CG1-CB 4.15Å; V1345-F1354 HydrophobicContact CG1-CE2 4.05Å; V1345-F1354 HydrophobicContact CG1-CZ 3.97Å; V1345-W1356 HydrophobicContact CG2-CD2 4.42Å; V1345-W1356 HydrophobicContact CG2-CZ2 4.24Å
1346	N	86.8	Confident	83	Confident	49.6 Å²	49.6	43.1 Å²	43.1	27%	0.265	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.3	173.2	175.9	-6.8	0	0	0	109.7	N1332 Y1334 R1348 G1349 N1350	N1332-N1346 PolarHBondContact ND2-OD1 3.25Å; N1332-N1346 PolarHBondContact OD1-OD1 3.29Å; N1332-N1346 VanDerWaalsContact OD1-OD1 3.11Å; Y1334-N1346 HydrophobicContact CD1-CB 4.3Å; Y1334-N1346 HydrophobicContact CE1-CB 4.29Å; N1346-R1348 VanDerWaalsContact C-N 3.33Å; N1346-R1348 PolarHBondContact O-N 3.01Å; N1346-R1348 PolarHBondContact OD1-N 3.08Å; N1346-G1349 PolarHBondContact O-N 2.95Å; N1346-G1349 VanDerWaalsContact O-N 3.16Å; N1346-G1349 PolarHBondContact OD1-N 3.15Å; N1346-G1349 VanDerWaalsContact OD1-N 3.12Å; N1346-N1350 PolarHBondContact N-OD1 2.78Å; N1346-N1350 WeakPolarHBondContact O-CB 3.26Å; N1346-N1350 PolarHBondContact O-N 2.89Å; N1346-N1350 PolarHBondContact O-OD1 2.83Å
1347	M	85.3	Confident	82.9	Confident	0.6 Å²	0.6	42.9 Å²	42.9	0%	0.003	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-40.1	-179.1	-173	-172.9	-140.7	0	0	113	I1321 N1323 P1325 L1333 L1351 F1354 V1376 V1378	I1321-M1347 HydrophobicContact CB-CE 4.07Å; I1321-M1347 HydrophobicContact CD1-CE 3.88Å; I1321-M1347 HydrophobicContact CD1-CG 3.79Å; I1321-M1347 HydrophobicContact CD1-SD 4.28Å; I1321-M1347 HydrophobicContact CG1-CE 3.87Å; I1321-M1347 HydrophobicContact CG1-CG 4.44Å; I1321-M1347 HydrophobicContact CG1-SD 4.4Å; I1321-M1347 HydrophobicContact CG2-CE 3.42Å; I1321-M1347 VanDerWaalsContact CG2-CE 3.42Å; N1323-M1347 WeakPolarHBondContact O-CE 3.43Å; P1325-M1347 HydrophobicContact CG-CE 4.38Å; P1325-M1347 HydrophobicContact CG-CG 4.33Å; P1325-M1347 HydrophobicContact CG-SD 3.87Å; L1333-M1347 HydrophobicContact CB-CB 4.12Å; L1333-M1347 HydrophobicContact CB-CE 3.69Å; L1333-M1347 HydrophobicContact CB-SD 3.88Å; L1333-M1347 HydrophobicContact CD2-CE 3.38Å; L1333-M1347 VanDerWaalsContact CD2-CE 3.4Å; L1333-M1347 HydrophobicContact CD2-SD 4.24Å; L1333-M1347 HydrophobicContact CG-CE 4.14Å; L1333-M1347 WeakPolarHBondContact O-CB 3.25Å; L1333-M1347 PolarHBondContact O-N 3.09Å; L1333-M1347 VanDerWaalsContact O-N 3.09Å; M1347-L1351 HydrophobicContact CG-CD2 4.45Å; M1347-L1351 WeakPolarHBondContact O-CD2 3.31Å; M1347-L1351 VanDerWaalsContact O-CG 3.27Å; M1347-L1351 WeakPolarHBondContact O-CG 3.36Å; M1347-F1354 HydrophobicContact CB-CZ 4.43Å; M1347-F1354 HydrophobicContact CG-CE2 4.42Å; M1347-F1354 HydrophobicContact CG-CZ 4.39Å; M1347-V1376 HydrophobicContact CE-CG1 4.25Å; M1347-V1376 HydrophobicContact CE-CG2 4.48Å; M1347-V1376 HydrophobicContact SD-CG1 4.18Å; M1347-V1376 HydrophobicContact SD-CG2 4.37Å; M1347-V1378 HydrophobicContact CE-CG1 3.62Å; M1347-V1378 HydrophobicContact CE-CG2 3.83Å; M1347-V1378 VanDerWaalsContact CE-CG2 3.47Å; M1347-V1378 HydrophobicContact SD-CG1 4.4Å; M1347-V1378 HydrophobicContact SD-CG2 4.34Å
1348	R	82.5	Confident	82.9	Confident	99.4 Å²	99.4	42.9 Å²	42.9	38%	0.375	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-36.9	177.6	-110.3	-179.7	125.6	111	-2.9	112.7	P1325 S1326 G1329 E1331 N1332 N1346	P1325-R1348 HydrophobicContact CB-CG 4.18Å; P1325-R1348 HydrophobicContact CG-CG 3.93Å; S1326-R1348 PolarHBondContact O-NH1 2.88Å; S1326-R1348 VanDerWaalsContact O-NH1 3.08Å; S1326-R1348 PolarHBondContact O-NH2 3.01Å; G1329-R1348 PolarHBondContact O-NH1 3.01Å; G1329-R1348 VanDerWaalsContact O-NH1 3.08Å; G1329-R1348 PolarHBondContact O-NH2 3.26Å; G1329-R1348 VanDerWaalsContact O-NH2 3.15Å; E1331-R1348 WeakPolarHBondContact O-CD 3.24Å; E1331-R1348 PolarHBondContact O-NH1 3.16Å; N1332-R1348 HydrophobicContact CB-CG 4.34Å; N1332-R1348 VanDerWaalsContact OD1-CB 3.27Å; N1332-R1348 WeakPolarHBondContact OD1-CB 3.26Å; N1332-R1348 WeakPolarHBondContact OD1-CG 3.37Å; N1332-R1348 PolarHBondContact OD1-N 2.95Å; N1332-R1348 VanDerWaalsContact OD1-N 3.11Å; N1346-R1348 VanDerWaalsContact C-N 3.33Å; N1346-R1348 PolarHBondContact O-N 3.01Å; N1346-R1348 PolarHBondContact OD1-N 3.08Å
1349	G	77.6	Confident	83.1	Confident	47.6 Å²	47.6	41.7 Å²	41.7	49%	0.491	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-33.1	-175.2	0	0	0	0	0	114.2	N1346	N1346-G1349 PolarHBondContact O-N 2.95Å; N1346-G1349 VanDerWaalsContact O-N 3.16Å; N1346-G1349 PolarHBondContact OD1-N 3.15Å; N1346-G1349 VanDerWaalsContact OD1-N 3.12Å
1350	N	79.9	Confident	83.4	Confident	49.6 Å²	49.6	39 Å²	39	27%	0.265	25%	0.249	S	C	.	.			trans	-131	66.9	-171.2	-130.8	11.1	0	0	0	112.3	V1345 N1346 I1352 E1353	V1345-N1350 HydrophobicContact CG1-CB 4.15Å; N1346-N1350 PolarHBondContact N-OD1 2.78Å; N1346-N1350 WeakPolarHBondContact O-CB 3.26Å; N1346-N1350 PolarHBondContact O-N 2.89Å; N1346-N1350 PolarHBondContact O-OD1 2.83Å; N1350-I1352 VanDerWaalsContact C-N 3.32Å; N1350-I1352 PolarHBondContact O-N 3.04Å; N1350-I1352 VanDerWaalsContact O-N 3.1Å; N1350-I1352 WeakPolarHBondContact OD1-CG1 3.12Å; N1350-I1352 WeakPolarHBondContact OD1-CG2 3.3Å; N1350-I1352 PolarHBondContact OD1-N 2.76Å; N1350-E1353 HydrophobicContact CB-CG 4.39Å; N1350-E1353 WeakPolarHBondContact ND2-CG 3.3Å; N1350-E1353 PolarHBondContact ND2-OE1 3.4Å; N1350-E1353 PolarHBondContact O-N 3.13Å; N1350-E1353 VanDerWaalsContact O-N 3.13Å
1351	L	84.2	Confident	83.7	Confident	6.8 Å²	6.8	39.8 Å²	39.8	4%	0.036	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-71.1	-19.9	-178.5	-70.1	166.9	0	0	0	114	I1321 R1324 M1347 E1353 F1354 F1415 F1416	I1321-L1351 HydrophobicContact CD1-CD2 3.62Å; R1324-L1351 HydrophobicContact CG-CD2 4.26Å; M1347-L1351 HydrophobicContact CG-CD2 4.45Å; M1347-L1351 WeakPolarHBondContact O-CD2 3.31Å; M1347-L1351 VanDerWaalsContact O-CG 3.27Å; M1347-L1351 WeakPolarHBondContact O-CG 3.36Å; L1351-E1353 VanDerWaalsContact C-N 3.29Å; L1351-E1353 PolarHBondContact O-N 2.99Å; L1351-F1354 PolarHBondContact O-N 2.99Å; L1351-F1415 HydrophobicContact CB-CD1 3.81Å; L1351-F1415 HydrophobicContact CB-CE1 3.88Å; L1351-F1415 HydrophobicContact CB-CG 4.29Å; L1351-F1415 HydrophobicContact CB-CZ 4.36Å; L1351-F1415 HydrophobicContact CD1-CB 3.98Å; L1351-F1415 HydrophobicContact CD1-CD1 4.28Å; L1351-F1415 HydrophobicContact CD1-CD2 4.46Å; L1351-F1415 HydrophobicContact CD1-CG 4.03Å; L1351-F1416 HydrophobicContact CD1-CE2 3.75Å; L1351-F1416 HydrophobicContact CD1-CZ 3.58Å; L1351-F1416 VanDerWaalsContact CD1-CZ 3.47Å
1352	I	85.2	Confident	84.2	Confident	5.8 Å²	5.8	38.6 Å²	38.6	3%	0.03	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-72	-21.4	-176.5	153.3	161.6	0	0	0	113.9	N1350 F1354 F1415 R1425 R1427 P1460 A1462	N1350-I1352 VanDerWaalsContact C-N 3.32Å; N1350-I1352 PolarHBondContact O-N 3.04Å; N1350-I1352 VanDerWaalsContact O-N 3.1Å; N1350-I1352 WeakPolarHBondContact OD1-CG1 3.12Å; N1350-I1352 WeakPolarHBondContact OD1-CG2 3.3Å; N1350-I1352 PolarHBondContact OD1-N 2.76Å; I1352-F1354 VanDerWaalsContact C-N 3.29Å; I1352-F1354 PolarHBondContact O-N 2.64Å; I1352-F1415 HydrophobicContact CB-CE1 4.18Å; I1352-F1415 HydrophobicContact CB-CZ 3.78Å; I1352-F1415 HydrophobicContact CD1-CZ 4.39Å; I1352-F1415 HydrophobicContact CG1-CE1 4.46Å; I1352-F1415 HydrophobicContact CG1-CZ 4.33Å; I1352-F1415 HydrophobicContact CG2-CE1 3.43Å; I1352-F1415 VanDerWaalsContact CG2-CE1 3.43Å; I1352-F1415 HydrophobicContact CG2-CZ 3.75Å; I1352-R1425 HydrophobicContact CG2-CB 3.96Å; I1352-R1427 HydrophobicContact CB-CB 4.49Å; I1352-R1427 HydrophobicContact CD1-CB 4.06Å; I1352-R1427 HydrophobicContact CD1-CG 4.25Å; I1352-R1427 HydrophobicContact CG1-CB 4.26Å; I1352-R1427 VanDerWaalsContact CG1-N 3.27Å; I1352-R1427 PolarHBondContact O-N 3.1Å; I1352-R1427 VanDerWaalsContact O-N 3.09Å; I1352-P1460 HydrophobicContact CB-CG 4.16Å; I1352-P1460 HydrophobicContact CD1-CB 3.85Å; I1352-P1460 HydrophobicContact CD1-CG 3.71Å; I1352-P1460 VanDerWaalsContact CD1-CG 3.48Å; I1352-P1460 HydrophobicContact CG1-CB 4.16Å; I1352-P1460 HydrophobicContact CG1-CG 3.6Å; I1352-P1460 HydrophobicContact CG2-CB 4.22Å; I1352-P1460 HydrophobicContact CG2-CG 4.05Å; I1352-A1462 HydrophobicContact CD1-CB 4.05Å
1353	E	83.9	Confident	85.1	Confident	44.4 Å²	44.4	36.4 Å²	36.4	21%	0.207	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-78.1	-10.4	-178	-65.3	-79.5	168.2	0	0	112.6	N1350 L1351 P1355 W1356 R1427	N1350-E1353 HydrophobicContact CB-CG 4.39Å; N1350-E1353 WeakPolarHBondContact ND2-CG 3.3Å; N1350-E1353 PolarHBondContact ND2-OE1 3.4Å; N1350-E1353 PolarHBondContact O-N 3.13Å; N1350-E1353 VanDerWaalsContact O-N 3.13Å; L1351-E1353 VanDerWaalsContact C-N 3.29Å; L1351-E1353 PolarHBondContact O-N 2.99Å; E1353-P1355 CarbonylContact O-C 3.51Å; E1353-P1355 VanDerWaalsContact O-C 3.23Å; E1353-P1355 VanDerWaalsContact O-O 3.1Å; E1353-W1356 WeakPolarHBondContact O-CA 3.31Å; E1353-W1356 PolarHBondContact O-N 3.14Å; E1353-R1427 IonicContact OE1-CZ 3.62Å; E1353-R1427 IonicContact OE1-NE 3.36Å; E1353-R1427 IonicContact OE1-NH1 3.15Å; E1353-R1427 PolarHBondContact OE1-NH1 3.26Å; E1353-R1427 WeakPolarHBondContact OE2-CD 3.43Å; E1353-R1427 IonicContact OE2-NH1 3.82Å; E1353-R1427 PolarHBondContact OE2-NH1 3.05Å
1354	F	86.5	Confident	85.5	Confident	13 Å²	13	38.5 Å²	38.5	6%	0.057	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-90	136.2	-178.7	-67.5	-88.1	0	0	0	112.2	V1319 I1321 I1335 V1345 M1347 L1351 I1352 W1356	V1319-F1354 HydrophobicContact CB-CE1 4.25Å; V1319-F1354 HydrophobicContact CG1-CD1 4.38Å; V1319-F1354 HydrophobicContact CG1-CE1 3.88Å; V1319-F1354 WeakPolarHBondContact O-CD1 3.34Å; I1321-F1354 HydrophobicContact CD1-CB 3.97Å; I1321-F1354 HydrophobicContact CD1-CD1 4.02Å; I1321-F1354 HydrophobicContact CD1-CD2 3.46Å; I1321-F1354 VanDerWaalsContact CD1-CD2 3.46Å; I1321-F1354 HydrophobicContact CD1-CE1 4.39Å; I1321-F1354 HydrophobicContact CD1-CE2 3.88Å; I1321-F1354 HydrophobicContact CD1-CG 3.53Å; I1321-F1354 VanDerWaalsContact CD1-CG 3.48Å; I1321-F1354 HydrophobicContact CD1-CZ 4.32Å; I1321-F1354 HydrophobicContact CG1-CB 4.04Å; I1321-F1354 HydrophobicContact CG1-CD1 3.72Å; I1321-F1354 HydrophobicContact CG1-CD2 4.12Å; I1321-F1354 HydrophobicContact CG1-CE1 4.17Å; I1321-F1354 HydrophobicContact CG1-CE2 4.46Å; I1321-F1354 HydrophobicContact CG1-CG 3.68Å; I1321-F1354 HydrophobicContact CG1-CZ 4.41Å; I1335-F1354 HydrophobicContact CD1-CE1 3.85Å; I1335-F1354 HydrophobicContact CD1-CZ 3.89Å; V1345-F1354 HydrophobicContact CG1-CE2 4.05Å; V1345-F1354 HydrophobicContact CG1-CZ 3.97Å; M1347-F1354 HydrophobicContact CB-CZ 4.43Å; M1347-F1354 HydrophobicContact CG-CE2 4.42Å; M1347-F1354 HydrophobicContact CG-CZ 4.39Å; L1351-F1354 PolarHBondContact O-N 2.99Å; I1352-F1354 VanDerWaalsContact C-N 3.29Å; I1352-F1354 PolarHBondContact O-N 2.64Å; F1354-W1356 HydrophobicContact CD1-CB 3.94Å; F1354-W1356 HydrophobicContact CE1-CB 4.05Å; F1354-W1356 HydrophobicContact CG-CB 4.45Å
1355	P	86.5	Confident	85.7	Confident	11.6 Å²	11.6	33.8 Å²	33.8	8%	0.075	18%	0.184	C	C	.	.	S	Bend	cis	-65.5	130.4	0.3	22.4	-28.7	0	0	0	113	P1190 V1319 Q1320 E1353 L1389 R1426	P1190-P1355 HydrophobicContact CB-CB 4.38Å; P1190-P1355 HydrophobicContact CB-CG 4.27Å; P1190-P1355 HydrophobicContact CG-CB 4.46Å; V1319-P1355 CarbonylContact O-C 3.52Å; V1319-P1355 VanDerWaalsContact O-CA 3.28Å; V1319-P1355 WeakPolarHBondContact O-CA 3.23Å; Q1320-P1355 HydrophobicContact CB-CB 4.26Å; Q1320-P1355 HydrophobicContact CG-CB 4.34Å; Q1320-P1355 VanDerWaalsContact OE1-CA 3.27Å; Q1320-P1355 VanDerWaalsContact OE1-CD 3.28Å; E1353-P1355 CarbonylContact O-C 3.51Å; E1353-P1355 VanDerWaalsContact O-C 3.23Å; E1353-P1355 VanDerWaalsContact O-O 3.1Å; P1355-L1389 HydrophobicContact CB-CD1 4.16Å; P1355-L1389 HydrophobicContact CB-CD2 4.41Å; P1355-L1389 HydrophobicContact CG-CD1 4.07Å; P1355-L1389 HydrophobicContact CG-CD2 4.4Å; P1355-L1389 WeakPolarHBondContact O-CD1 3.44Å; P1355-R1426 VanDerWaalsContact CD-CZ 3.47Å; P1355-R1426 VanDerWaalsContact CG-CZ 3.48Å
1356	W	86.6	Confident	86	Confident	18.8 Å²	18.8	38.6 Å²	38.6	7%	0.071	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	146.4	-176.4	177.8	79	0	0	0	110.1	G1318 V1319 I1335 D1337 V1345 E1353 F1354 I1363	G1318-W1356 CarbonylContact C-O 3.4Å; G1318-W1356 WeakPolarHBondContact CA-O 3.45Å; V1319-W1356 HydrophobicContact CB-CE3 4.21Å; V1319-W1356 HydrophobicContact CG2-CE3 3.85Å; V1319-W1356 HydrophobicContact CG2-CZ3 4.15Å; V1319-W1356 PolarHBondContact N-O 3.03Å; V1319-W1356 PolarHBondContact O-N 2.98Å; I1335-W1356 HydrophobicContact CB-CZ3 4.4Å; I1335-W1356 HydrophobicContact CD1-CE3 4.37Å; I1335-W1356 HydrophobicContact CD1-CZ3 4.45Å; I1335-W1356 HydrophobicContact CG2-CE3 4.18Å; I1335-W1356 HydrophobicContact CG2-CH2 3.72Å; I1335-W1356 HydrophobicContact CG2-CZ3 3.46Å; I1335-W1356 VanDerWaalsContact CG2-CZ3 3.46Å; D1337-W1356 HydrophobicContact CB-CH2 3.86Å; D1337-W1356 HydrophobicContact CB-CZ2 3.84Å; V1345-W1356 HydrophobicContact CG2-CD2 4.42Å; V1345-W1356 HydrophobicContact CG2-CZ2 4.24Å; E1353-W1356 WeakPolarHBondContact O-CA 3.31Å; E1353-W1356 PolarHBondContact O-N 3.14Å; F1354-W1356 HydrophobicContact CD1-CB 3.94Å; F1354-W1356 HydrophobicContact CE1-CB 4.05Å; F1354-W1356 HydrophobicContact CG-CB 4.45Å; W1356-I1363 HydrophobicContact CH2-CG2 3.87Å; W1356-I1363 HydrophobicContact CZ3-CD1 4.22Å; W1356-I1363 HydrophobicContact CZ3-CG2 3.99Å
1357	V	87.3	Confident	86	Confident	37 Å²	37	36.6 Å²	36.6	22%	0.224	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.7	-179.6	-178	0	0	0	0	108.8	R1316 V1317 I1383 L1389	R1316-V1357 HydrophobicContact CB-CG1 3.99Å; V1317-V1357 WeakPolarHBondContact O-CA 3.27Å; V1357-I1383 HydrophobicContact CB-CD1 4.13Å; V1357-I1383 HydrophobicContact CG1-CD1 3.71Å; V1357-I1383 HydrophobicContact CG2-CD1 3.38Å; V1357-I1383 VanDerWaalsContact CG2-CD1 3.43Å; V1357-L1389 HydrophobicContact CG2-CD1 3.43Å; V1357-L1389 VanDerWaalsContact CG2-CD1 3.4Å; V1357-L1389 HydrophobicContact CG2-CD2 4.28Å; V1357-L1389 HydrophobicContact CG2-CG 3.9Å
1358	S	88.6	Confident	86.1	Confident	2.2 Å²	2.2	39.9 Å²	39.9	2%	0.015	20%	0.204	C	C	.	.			trans	-69.8	152.5	176.5	66.2	0	0	0	0	112.4	R1316 V1317 G1360 I1363	R1316-S1358 VanDerWaalsContact CD-O 3.29Å; R1316-S1358 WeakPolarHBondContact CD-O 3.26Å; R1316-S1358 WeakPolarHBondContact CG-O 3.26Å; V1317-S1358 PolarHBondContact N-OG 2.96Å; V1317-S1358 PolarHBondContact O-N 3.09Å; V1317-S1358 PolarHBondContact O-OG 3.04Å; S1358-G1360 WeakPolarHBondContact CB-O 3.26Å; S1358-G1360 PolarHBondContact OG-O 2.93Å; S1358-I1363 VanDerWaalsContact CB-CG2 3.42Å
1359	S	85.9	Confident	86.1	Confident	71.2 Å²	71.2	36.1 Å²	36.1	50%	0.498	19%	0.19	S	C	.	.	S	Bend	trans	-78.2	-31.2	174.4	-39.2	0	0	0	0	112.1	D1337 A1339 A1340	D1337-S1359 PolarHBondContact OD1-OG 2.97Å; D1337-S1359 VanDerWaalsContact OD2-CB 3.27Å; D1337-S1359 WeakPolarHBondContact OD2-CB 3.4Å; D1337-S1359 PolarHBondContact OD2-N 2.99Å; D1337-S1359 PolarHBondContact OD2-OG 2.97Å; A1339-S1359 VanDerWaalsContact C-OG 3.28Å; A1339-S1359 VanDerWaalsContact CB-OG 3.27Å; A1339-S1359 WeakPolarHBondContact CB-OG 3.24Å; A1340-S1359 WeakPolarHBondContact CB-OG 3.36Å; A1340-S1359 PolarHBondContact N-OG 2.91Å
1360	G	84.3	Confident	86.2	Confident	9 Å²	9	36.7 Å²	36.7	9%	0.093	18%	0.184	C	C	.	.	S	Bend	trans	-117.2	-171.1	176.7	0	0	0	0	0	114	S1358	S1358-G1360 WeakPolarHBondContact CB-O 3.26Å; S1358-G1360 PolarHBondContact OG-O 2.93Å
1361	D	86.1	Confident	86	Confident	55 Å²	55	41.2 Å²	41.2	29%	0.294	20%	0.198	S	C	.	.	S	Bend	trans	-82.9	-15.5	-178.2	73.1	-29.9	0	0	0	114.5	R1305 S1306 G1315	R1305-D1361 CarbonylContact C-O 3.55Å; R1305-D1361 WeakPolarHBondContact CA-O 3.38Å; R1305-D1361 IonicContact NE-OD2 3.4Å; R1305-D1361 IonicContact NH2-OD2 3.59Å; S1306-D1361 WeakPolarHBondContact CB-O 3.33Å; S1306-D1361 PolarHBondContact N-O 2.81Å; G1315-D1361 WeakPolarHBondContact O-CA 3.3Å; G1315-D1361 VanDerWaalsContact O-CB 3.29Å; G1315-D1361 WeakPolarHBondContact O-CB 3.33Å
1362	T	87.5	Confident	85.4	Confident	52 Å²	52	42.3 Å²	42.3	32%	0.319	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.9	-175.3	48.7	0	0	0	0	111.6	V1304 R1305	V1304-T1362 CarbonylContact O-C 3.53Å; V1304-T1362 WeakPolarHBondContact O-CA 3.34Å; R1305-T1362 HydrophobicContact CB-CG2 4.04Å; R1305-T1362 HydrophobicContact CG-CG2 3.71Å
1363	I	90.5	Very high	84.9	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.7	170.1	63.6	170.2	0	0	0	110.1	V1304 V1317 V1319 I1335 F1336 W1356 S1358 V1365	V1304-I1363 HydrophobicContact CB-CD1 4.2Å; V1304-I1363 HydrophobicContact CB-CG1 3.68Å; V1304-I1363 HydrophobicContact CG1-CG1 4.48Å; V1304-I1363 HydrophobicContact CG2-CD1 4.38Å; V1304-I1363 HydrophobicContact CG2-CG1 4.2Å; V1304-I1363 PolarHBondContact N-O 3.09Å; V1304-I1363 PolarHBondContact O-N 2.91Å; V1317-I1363 HydrophobicContact CB-CD1 4.12Å; V1317-I1363 HydrophobicContact CB-CG1 4.32Å; V1317-I1363 HydrophobicContact CB-CG2 4.39Å; V1317-I1363 HydrophobicContact CG1-CD1 3.55Å; V1317-I1363 VanDerWaalsContact CG1-CD1 3.5Å; V1317-I1363 HydrophobicContact CG1-CG1 4.1Å; V1317-I1363 HydrophobicContact CG2-CG1 4.42Å; V1319-I1363 HydrophobicContact CG2-CD1 3.88Å; I1335-I1363 HydrophobicContact CG2-CB 4.26Å; I1335-I1363 HydrophobicContact CG2-CD1 3.99Å; F1336-I1363 WeakPolarHBondContact O-CA 3.34Å; W1356-I1363 HydrophobicContact CH2-CG2 3.87Å; W1356-I1363 HydrophobicContact CZ3-CD1 4.22Å; W1356-I1363 HydrophobicContact CZ3-CG2 3.99Å; S1358-I1363 VanDerWaalsContact CB-CG2 3.42Å; I1363-V1365 HydrophobicContact CD1-CG2 4.01Å; I1363-V1365 HydrophobicContact CG1-CG2 4.33Å
1364	R	90.6	Very high	84.7	Confident	128 Å²	128	43.6 Å²	43.6	48%	0.483	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.8	169.1	-61.4	-171.3	172.4	128.9	7.6	109.3	L1302 T1303 I1335 F1336 E1338	L1302-R1364 CarbonylContact O-C 3.55Å; L1302-R1364 WeakPolarHBondContact O-CA 3.36Å; T1303-R1364 HydrophobicContact CG2-CG 4.02Å; I1335-R1364 CarbonylContact C-O 3.56Å; I1335-R1364 WeakPolarHBondContact CA-O 3.33Å; F1336-R1364 HydrophobicContact CB-CB 4.19Å; F1336-R1364 HydrophobicContact CD2-CB 4.44Å; F1336-R1364 WeakPolarHBondContact CD2-O 3.41Å; F1336-R1364 PolarHBondContact N-O 2.94Å; F1336-R1364 PolarHBondContact O-N 3.13Å; E1338-R1364 VanDerWaalsContact CD-CZ 3.42Å; E1338-R1364 VanDerWaalsContact CD-NH1 3.33Å; E1338-R1364 WeakPolarHBondContact OE1-CD 3.22Å; E1338-R1364 WeakPolarHBondContact OE1-CG 3.26Å; E1338-R1364 IonicContact OE1-CZ 3.22Å; E1338-R1364 IonicContact OE1-NE 3.56Å; E1338-R1364 PolarHBondContact OE1-NE 2.86Å; E1338-R1364 VanDerWaalsContact OE1-NE 3.09Å; E1338-R1364 IonicContact OE1-NH1 3.43Å; E1338-R1364 PolarHBondContact OE1-NH1 2.87Å; E1338-R1364 IonicContact OE1-NH2 3.12Å; E1338-R1364 PolarHBondContact OE1-NH2 2.86Å; E1338-R1364 IonicContact OE2-CZ 3.38Å; E1338-R1364 VanDerWaalsContact OE2-CZ 3.29Å; E1338-R1364 IonicContact OE2-NE 3.97Å; E1338-R1364 IonicContact OE2-NH1 3.4Å; E1338-R1364 PolarHBondContact OE2-NH1 2.89Å; E1338-R1364 VanDerWaalsContact OE2-NH1 3.09Å; E1338-R1364 IonicContact OE2-NH2 3.01Å; E1338-R1364 PolarHBondContact OE2-NH2 3.16Å
1365	V	89.9	Confident	84.5	Confident	4.2 Å²	4.2	44.7 Å²	44.7	3%	0.025	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.4	177.9	-179.7	0	0	0	0	108.3	L1283 T1301 L1302 V1304 L1333 Y1334 I1335 I1363	L1283-V1365 HydrophobicContact CD2-CG1 4.46Å; T1301-V1365 CarbonylContact C-O 3.42Å; T1301-V1365 WeakPolarHBondContact CA-O 3.28Å; L1302-V1365 HydrophobicContact CB-CB 4.36Å; L1302-V1365 HydrophobicContact CD1-CB 3.87Å; L1302-V1365 HydrophobicContact CD1-CG2 4.22Å; L1302-V1365 HydrophobicContact CD2-CB 4.22Å; L1302-V1365 HydrophobicContact CD2-CG1 4.27Å; L1302-V1365 HydrophobicContact CG-CB 3.89Å; L1302-V1365 HydrophobicContact CG-CG1 4.41Å; L1302-V1365 PolarHBondContact N-O 3.08Å; L1302-V1365 PolarHBondContact O-N 3.12Å; V1304-V1365 HydrophobicContact CG2-CG2 4.03Å; L1333-V1365 HydrophobicContact CD1-CG1 3.44Å; L1333-V1365 VanDerWaalsContact CD1-CG1 3.48Å; L1333-V1365 HydrophobicContact CD2-CG1 3.97Å; L1333-V1365 HydrophobicContact CG-CG1 3.74Å; Y1334-V1365 CarbonylContact O-C 3.4Å; Y1334-V1365 WeakPolarHBondContact O-CA 3.33Å; I1335-V1365 HydrophobicContact CG1-CG2 4.44Å; I1335-V1365 HydrophobicContact CG2-CG2 4.47Å; I1363-V1365 HydrophobicContact CD1-CG2 4.01Å; I1363-V1365 HydrophobicContact CG1-CG2 4.33Å
1366	R	89.4	Confident	84.5	Confident	103.2 Å²	103.2	44.1 Å²	44.1	39%	0.389	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	115.3	175.5	-177.8	-176.9	-83.4	163.8	1.7	109.4	I1299 Y1300 T1301 Y1334 F1336	I1299-R1366 HydrophobicContact CG2-CG 4.4Å; Y1300-R1366 CarbonylContact O-C 3.55Å; Y1300-R1366 VanDerWaalsContact O-CA 3.29Å; Y1300-R1366 WeakPolarHBondContact O-CA 3.27Å; T1301-R1366 HydrophobicContact CG2-CB 4.11Å; T1301-R1366 HydrophobicContact CG2-CG 3.83Å; Y1334-R1366 PolarHBondContact N-O 2.99Å; Y1334-R1366 PolarHBondContact O-N 2.91Å; F1336-R1366 HydrophobicContact CE2-CB 3.83Å; F1336-R1366 VanDerWaalsContact CZ-NH1 3.33Å
1367	Y	88.3	Confident	84.6	Confident	6.6 Å²	6.6	43.4 Å²	43.4	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	136	170.6	176.4	-101.6	0	0	0	110	M1264 A1285 I1299 Y1300 E1331 L1333 R1369 V1376	M1264-Y1367 HydrophobicContact CE-CD2 4.08Å; M1264-Y1367 HydrophobicContact CE-CE2 4.4Å; M1264-Y1367 HydrophobicContact CE-CG 4.38Å; M1264-Y1367 HydrophobicContact SD-CD2 4.41Å; M1264-Y1367 HydrophobicContact SD-CG 4.3Å; A1285-Y1367 HydrophobicContact CB-CD2 4.46Å; A1285-Y1367 HydrophobicContact CB-CE2 3.76Å; I1299-Y1367 WeakPolarHBondContact CA-O 3.39Å; Y1300-Y1367 PolarHBondContact N-O 2.87Å; Y1300-Y1367 PolarHBondContact O-N 2.98Å; E1331-Y1367 HydrophobicContact CG-CE2 3.59Å; E1331-Y1367 WeakPolarHBondContact CG-OH 3.44Å; E1331-Y1367 VanDerWaalsContact OE1-CE2 3.25Å; E1331-Y1367 WeakPolarHBondContact OE1-CE2 3.4Å; E1331-Y1367 PolarHBondContact OE1-OH 3.01Å; L1333-Y1367 HydrophobicContact CD1-CD2 4.11Å; L1333-Y1367 HydrophobicContact CD1-CG 4.43Å; Y1367-R1369 HydrophobicContact CE1-CB 4.06Å; Y1367-R1369 WeakPolarHBondContact OH-CD 3.41Å; Y1367-R1369 PolarHBondContact OH-NE 3.14Å; Y1367-V1376 HydrophobicContact CE2-CB 4.46Å
1368	K	86.5	Confident	84.7	Confident	69.8 Å²	69.8	41.7 Å²	41.7	30%	0.303	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.2	175.9	-176.9	177.1	-179.5	-179.9	0	110.1	D1297 C1298 I1299 E1331 N1332 Y1334	D1297-K1368 WeakPolarHBondContact OD2-CE 3.38Å; D1297-K1368 IonicContact OD2-NZ 3.37Å; D1297-K1368 PolarHBondContact OD2-NZ 3.06Å; C1298-K1368 CarbonylContact O-C 3.53Å; C1298-K1368 WeakPolarHBondContact O-CA 3.18Å; I1299-K1368 HydrophobicContact CG1-CG 4.21Å; E1331-K1368 WeakPolarHBondContact CA-O 3.31Å; N1332-K1368 PolarHBondContact N-O 3.05Å; N1332-K1368 PolarHBondContact O-N 2.93Å; Y1334-K1368 HydrophobicContact CE2-CB 4.25Å
1369	R	83	Confident	84.6	Confident	21 Å²	21	41.7 Å²	41.7	8%	0.079	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	135.7	170.5	-176.6	178.9	65	89.9	5.2	110.4	C1290 C1298 E1331 Y1367 G1372	C1290-R1369 VanDerWaalsContact CB-NH2 3.34Å; C1290-R1369 PolarHBondContact O-NH2 2.52Å; C1290-R1369 PolarHBondContact SG-NH2 2.92Å; C1298-R1369 WeakPolarHBondContact CA-O 3.26Å; C1298-R1369 HydrophobicContact CB-CB 4.36Å; C1298-R1369 VanDerWaalsContact CB-O 3.24Å; C1298-R1369 WeakPolarHBondContact CB-O 3.37Å; C1298-R1369 PolarHBondContact N-O 2.97Å; C1298-R1369 PolarHBondContact O-N 3.32Å; E1331-R1369 HydrophobicContact CB-CB 4.43Å; E1331-R1369 HydrophobicContact CB-CG 4.15Å; E1331-R1369 HydrophobicContact CG-CB 4.43Å; E1331-R1369 HydrophobicContact CG-CG 4.42Å; Y1367-R1369 HydrophobicContact CE1-CB 4.06Å; Y1367-R1369 WeakPolarHBondContact OH-CD 3.41Å; Y1367-R1369 PolarHBondContact OH-NE 3.14Å; R1369-G1372 PolarHBondContact NH1-O 3.03Å
1370	T	78.9	Confident	84.8	Confident	60 Å²	60	38.4 Å²	38.4	37%	0.368	19%	0.186	S	C	.	.	S	Bend	trans	-115.4	-36	174.2	70.4	0	0	0	0	112.3	D1297 D1330	D1297-T1370 HydrophobicContact CB-CG2 4.16Å; D1297-T1370 VanDerWaalsContact CG-CG2 3.46Å; D1297-T1370 WeakPolarHBondContact OD1-CG2 3.27Å; D1330-T1370 PolarHBondContact OD1-N 3.03Å; D1330-T1370 PolarHBondContact OD1-OG1 3.11Å; D1330-T1370 VanDerWaalsContact OD2-CB 3.28Å; D1330-T1370 WeakPolarHBondContact OD2-CB 3.25Å; D1330-T1370 VanDerWaalsContact OD2-CG2 3.26Å; D1330-T1370 WeakPolarHBondContact OD2-CG2 3.33Å; D1330-T1370 PolarHBondContact OD2-N 3Å; D1330-T1370 VanDerWaalsContact OD2-N 3.16Å; D1330-T1370 PolarHBondContact OD2-OG1 3.18Å
1371	Y	75.8	Confident	84.8	Confident	143 Å²	143	38.1 Å²	38.1	56%	0.561	18%	0.182	S	C	*	.	S	Bend	trans	-145.3	165.7	174.5	70.1	-85.5	0	0	0	112.2	E1328 G1329 D1330	E1328-Y1371 WeakPolarHBondContact O-CE2 3.21Å; G1329-Y1371 WeakPolarHBondContact CA-O 3.45Å; D1330-Y1371 HydrophobicContact CB-CD1 4.24Å; D1330-Y1371 HydrophobicContact CB-CE1 3.72Å; D1330-Y1371 PolarHBondContact N-O 3.15Å; D1330-Y1371 PolarHBondContact OD1-N 2.99Å; D1330-Y1371 VanDerWaalsContact OD1-O 3.08Å
1372	G	72.1	Confident	84.8	Confident	31 Å²	31	36 Å²	36	32%	0.32	17%	0.171	S	C	.	.	S	Bend	trans	86.9	176.1	-177.6	0	0	0	0	0	113.9	R1369	R1369-G1372 PolarHBondContact NH1-O 3.03Å
1373	L	74.8	Confident	84.5	Confident	72.6 Å²	72.6	33.7 Å²	33.7	38%	0.38	16%	0.157	S	C	.	.			trans	-76.8	143.2	-177	-63.5	175.2	0	0	0	111.1	P790 F792 E1375	P790-L1373 HydrophobicContact CG-CD1 4.27Å; F792-L1373 HydrophobicContact CE2-CD2 4Å; F792-L1373 HydrophobicContact CZ-CD2 4.05Å; L1373-E1375 HydrophobicContact CB-CG 4.27Å; L1373-E1375 PolarHBondContact O-N 3.17Å
1374	A	79.4	Confident	83.9	Confident	5.2 Å²	5.2	34.8 Å²	34.8	4%	0.043	16%	0.164	C	C	.	.			trans	-79.7	110.8	170.8	0	0	0	0	0	109	R1250 A1285 S1287 E1331	R1250-A1374 PolarHBondContact NH1-O 2.7Å; R1250-A1374 PolarHBondContact NH2-O 3.28Å; A1285-A1374 HydrophobicContact CB-CB 3.9Å; S1287-A1374 PolarHBondContact OG-N 3.35Å; E1331-A1374 VanDerWaalsContact OE1-CA 3.28Å; E1331-A1374 WeakPolarHBondContact OE1-CA 3.36Å
1375	E	81.9	Confident	82.9	Confident	34.8 Å²	34.8	31.8 Å²	31.8	16%	0.163	16%	0.158	C	C	.	.			trans	-120	-20.3	-176.2	-71.5	-169.6	154.9	0	0	113.4	R1243 R1250 N1323 S1326 E1331 L1373 A1377	R1243-E1375 IonicContact CZ-OE1 3.4Å; R1243-E1375 IonicContact NE-OE1 3.14Å; R1243-E1375 IonicContact NH2-OE1 3.17Å; R1243-E1375 PolarHBondContact NH2-OE1 3.04Å; R1250-E1375 VanDerWaalsContact NH2-CA 3.3Å; R1250-E1375 PolarHBondContact NH2-O 3.24Å; N1323-E1375 WeakPolarHBondContact CB-O 3.36Å; N1323-E1375 PolarHBondContact ND2-O 2.98Å; S1326-E1375 WeakPolarHBondContact CA-OE2 3.31Å; S1326-E1375 WeakPolarHBondContact CB-OE2 3.41Å; S1326-E1375 PolarHBondContact OG-OE2 2.94Å; E1331-E1375 VanDerWaalsContact CD-N 3.3Å; E1331-E1375 PolarHBondContact OE1-N 3.19Å; E1331-E1375 VanDerWaalsContact OE1-N 3.11Å; E1331-E1375 WeakPolarHBondContact OE2-CA 3.26Å; E1331-E1375 PolarHBondContact OE2-N 3.12Å; L1373-E1375 HydrophobicContact CB-CG 4.27Å; L1373-E1375 PolarHBondContact O-N 3.17Å; E1375-A1377 PolarHBondContact O-N 3.15Å
1376	V	87.5	Confident	81.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.194	C	C	.	.			trans	-58	129.2	-173.8	170.3	0	0	0	0	112.5	M1264 A1285 P1325 E1331 L1333 M1347 Y1367 V1378	M1264-V1376 HydrophobicContact CE-CG1 4.48Å; A1285-V1376 HydrophobicContact CB-CB 4.25Å; A1285-V1376 PolarHBondContact N-O 3.08Å; P1325-V1376 HydrophobicContact CB-CG2 3.77Å; P1325-V1376 HydrophobicContact CG-CG2 3.69Å; E1331-V1376 VanDerWaalsContact CD-CG2 3.46Å; E1331-V1376 HydrophobicContact CG-CB 4.5Å; E1331-V1376 HydrophobicContact CG-CG2 3.78Å; E1331-V1376 VanDerWaalsContact OE1-CB 3.32Å; E1331-V1376 WeakPolarHBondContact OE1-CB 3.41Å; E1331-V1376 WeakPolarHBondContact OE1-CG2 3.39Å; E1331-V1376 PolarHBondContact OE1-N 3.13Å; E1331-V1376 PolarHBondContact OE2-N 3.12Å; L1333-V1376 HydrophobicContact CB-CG1 4.44Å; L1333-V1376 HydrophobicContact CD2-CG1 4.43Å; M1347-V1376 HydrophobicContact CE-CG1 4.25Å; M1347-V1376 HydrophobicContact CE-CG2 4.48Å; M1347-V1376 HydrophobicContact SD-CG1 4.18Å; M1347-V1376 HydrophobicContact SD-CG2 4.37Å; Y1367-V1376 HydrophobicContact CE2-CB 4.46Å; V1376-V1378 HydrophobicContact CG1-CG1 4.31Å; V1376-V1378 HydrophobicContact CG1-CG2 3.93Å
1377	A	87.7	Confident	81.1	Confident	2.6 Å²	2.6	38.9 Å²	38.9	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	128.6	169.8	0	0	0	0	0	110.2	L1249 L1283 I1284 I1322 N1323 E1375	L1249-A1377 HydrophobicContact CD1-CB 4.3Å; L1283-A1377 CarbonylContact O-C 3.49Å; L1283-A1377 WeakPolarHBondContact O-CA 3.33Å; I1284-A1377 HydrophobicContact CD1-CB 4.46Å; I1284-A1377 HydrophobicContact CG1-CB 4.23Å; I1322-A1377 WeakPolarHBondContact CA-O 3.36Å; I1322-A1377 HydrophobicContact CB-CB 4.15Å; I1322-A1377 WeakPolarHBondContact CB-O 3.28Å; I1322-A1377 HydrophobicContact CG2-CB 4.49Å; I1322-A1377 PolarHBondContact N-O 2.94Å; N1323-A1377 HydrophobicContact CB-CB 3.81Å; N1323-A1377 PolarHBondContact N-O 2.98Å; N1323-A1377 PolarHBondContact O-N 3.1Å; N1323-A1377 VanDerWaalsContact O-N 3.16Å; E1375-A1377 PolarHBondContact O-N 3.15Å
1378	V	89.9	Confident	80.4	Confident	1.8 Å²	1.8	44.9 Å²	44.9	1%	0.011	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	141.8	-176.3	-139.5	0	0	0	0	110.8	L1283 V1319 Q1320 L1333 M1347 V1376 L1380	L1283-V1378 HydrophobicContact CB-CG2 3.79Å; L1283-V1378 HydrophobicContact CD2-CG2 4.09Å; L1283-V1378 HydrophobicContact CG-CG2 4.36Å; L1283-V1378 PolarHBondContact N-O 2.91Å; L1283-V1378 PolarHBondContact O-N 3.14Å; V1319-V1378 HydrophobicContact CG1-CB 4.28Å; V1319-V1378 HydrophobicContact CG1-CG1 3.29Å; Q1320-V1378 CarbonylContact O-C 3.57Å; Q1320-V1378 WeakPolarHBondContact O-CA 3.38Å; Q1320-V1378 WeakPolarHBondContact O-CG1 3.28Å; L1333-V1378 HydrophobicContact CD2-CG1 3.97Å; L1333-V1378 HydrophobicContact CD2-CG2 4.01Å; M1347-V1378 HydrophobicContact CE-CG1 3.62Å; M1347-V1378 HydrophobicContact CE-CG2 3.83Å; M1347-V1378 VanDerWaalsContact CE-CG2 3.47Å; M1347-V1378 HydrophobicContact SD-CG1 4.4Å; M1347-V1378 HydrophobicContact SD-CG2 4.34Å; V1376-V1378 HydrophobicContact CG1-CG1 4.31Å; V1376-V1378 HydrophobicContact CG1-CG2 3.93Å; V1378-L1380 HydrophobicContact CG1-CD2 4.35Å; V1378-L1380 HydrophobicContact CG2-CD2 4.39Å; V1378-L1380 HydrophobicContact CG2-CG 4.5Å
1379	L	87.4	Confident	80.1	Confident	2.2 Å²	2.2	43.2 Å²	43.2	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	122.2	169.4	178.9	63.9	0	0	0	109.2	W1165 R1280 Y1282 V1319 Q1320 I1322 F1381	W1165-L1379 HydrophobicContact CH2-CD2 4.24Å; W1165-L1379 HydrophobicContact CZ2-CD2 3.64Å; R1280-L1379 HydrophobicContact CB-CD1 4.12Å; R1280-L1379 HydrophobicContact CG-CD1 4.45Å; Y1282-L1379 HydrophobicContact CD1-CD1 3.93Å; Y1282-L1379 HydrophobicContact CE1-CD1 3.67Å; Y1282-L1379 HydrophobicContact CE2-CD1 4.44Å; Y1282-L1379 HydrophobicContact CG-CD1 4.45Å; V1319-L1379 WeakPolarHBondContact CA-O 3.27Å; Q1320-L1379 HydrophobicContact CB-CB 4.27Å; Q1320-L1379 PolarHBondContact N-O 2.98Å; Q1320-L1379 PolarHBondContact O-N 3.04Å; I1322-L1379 HydrophobicContact CD1-CB 4.02Å; I1322-L1379 HydrophobicContact CG1-CB 4.22Å; L1379-F1381 HydrophobicContact CD2-CD1 4.26Å; L1379-F1381 HydrophobicContact CG-CD1 4.08Å
1380	L	88.5	Confident	79.8	Confident	1.6 Å²	1.6	42.6 Å²	42.6	1%	0.008	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132	170.1	-58.3	174.6	0	0	0	108.9	I1270 L1272 R1280 K1281 L1283 V1304 G1318 V1319 V1378	I1270-L1380 HydrophobicContact CD1-CD1 3.87Å; I1270-L1380 HydrophobicContact CG2-CD1 4.47Å; L1272-L1380 HydrophobicContact CD1-CB 4.37Å; L1272-L1380 HydrophobicContact CD2-CB 4.29Å; R1280-L1380 CarbonylContact C-O 3.55Å; R1280-L1380 WeakPolarHBondContact CA-O 3.25Å; K1281-L1380 HydrophobicContact CB-CB 4.39Å; K1281-L1380 PolarHBondContact N-O 3.06Å; K1281-L1380 PolarHBondContact O-N 3.05Å; L1283-L1380 HydrophobicContact CB-CD1 4.26Å; L1283-L1380 HydrophobicContact CD2-CD1 4.28Å; V1304-L1380 HydrophobicContact CG1-CD1 4.31Å; V1304-L1380 HydrophobicContact CG2-CD1 3.9Å; G1318-L1380 WeakPolarHBondContact O-CA 3.37Å; V1319-L1380 HydrophobicContact CB-CD2 4.49Å; V1319-L1380 HydrophobicContact CG1-CD2 4.2Å; V1319-L1380 HydrophobicContact CG2-CD2 3.87Å; V1378-L1380 HydrophobicContact CG1-CD2 4.35Å; V1378-L1380 HydrophobicContact CG2-CD2 4.39Å; V1378-L1380 HydrophobicContact CG2-CG 4.5Å
1381	F	85.5	Confident	79.9	Confident	3.2 Å²	3.2	41.8 Å²	41.8	1%	0.014	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	149.4	-177.8	58.5	-91.1	0	0	0	112.7	P1190 I1191 S1279 R1280 G1318 Q1320 L1379 I1383 L1389	P1190-F1381 HydrophobicContact CB-CZ 4.09Å; P1190-F1381 HydrophobicContact CG-CE1 4.05Å; P1190-F1381 HydrophobicContact CG-CE2 4.21Å; P1190-F1381 HydrophobicContact CG-CZ 3.62Å; P1190-F1381 VanDerWaalsContact CG-CZ 3.47Å; I1191-F1381 HydrophobicContact CD1-CB 4.16Å; I1191-F1381 HydrophobicContact CD1-CD2 3.07Å; I1191-F1381 HydrophobicContact CD1-CE2 3.37Å; I1191-F1381 VanDerWaalsContact CD1-CE2 3.41Å; I1191-F1381 HydrophobicContact CD1-CG 3.93Å; I1191-F1381 HydrophobicContact CD1-CZ 4.31Å; I1191-F1381 HydrophobicContact CG1-CD2 3.95Å; I1191-F1381 HydrophobicContact CG1-CE2 3.72Å; S1279-F1381 CarbonylContact O-C 3.53Å; S1279-F1381 VanDerWaalsContact O-CA 3.26Å; S1279-F1381 WeakPolarHBondContact O-CA 3.41Å; R1280-F1381 HydrophobicContact CG-CB 4.4Å; G1318-F1381 VanDerWaalsContact C-CE1 3.46Å; G1318-F1381 PolarHBondContact N-O 2.9Å; G1318-F1381 VanDerWaalsContact O-CD1 3.32Å; G1318-F1381 WeakPolarHBondContact O-CD1 3.36Å; G1318-F1381 PolarHBondContact O-N 3.2Å; Q1320-F1381 HydrophobicContact CB-CE1 3.93Å; L1379-F1381 HydrophobicContact CD2-CD1 4.26Å; L1379-F1381 HydrophobicContact CG-CD1 4.08Å; F1381-I1383 HydrophobicContact CD2-CD1 4.1Å; F1381-I1383 HydrophobicContact CD2-CG1 3.64Å; F1381-I1383 HydrophobicContact CE2-CD1 3.45Å; F1381-I1383 VanDerWaalsContact CE2-CD1 3.46Å; F1381-I1383 HydrophobicContact CE2-CG1 3.47Å; F1381-I1383 VanDerWaalsContact CE2-CG1 3.48Å; F1381-I1383 HydrophobicContact CZ-CD1 4.26Å; F1381-L1389 HydrophobicContact CE2-CD2 4.32Å; F1381-L1389 HydrophobicContact CZ-CD2 4.26Å
1382	H	85	Confident	80.6	Confident	11.4 Å²	11.4	37 Å²	37	5%	0.053	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	134.8	173.9	175.3	-43.3	0	0	0	110.8	I1191 L1272 T1274 S1279 S1306 T1307 G1315 S1384	I1191-H1382 WeakPolarHBondContact CD1-O 3.35Å; L1272-H1382 HydrophobicContact CB-CB 4.39Å; T1274-H1382 VanDerWaalsContact CG2-CD2 3.5Å; T1274-H1382 WeakPolarHBondContact CG2-CD2 2.96Å; T1274-H1382 WeakPolarHBondContact CG2-CE1 3.24Å; T1274-H1382 VanDerWaalsContact CG2-NE2 3.27Å; T1274-H1382 WeakPolarHBondContact CG2-NE2 3.22Å; S1279-H1382 PolarHBondContact O-N 3.19Å; S1279-H1382 VanDerWaalsContact O-N 3.16Å; S1306-H1382 PolarHBondContact OG-CD2 3.24Å; S1306-H1382 PolarHBondContact OG-CE1 2.86Å; S1306-H1382 PolarHBondContact OG-ND1 2.78Å; S1306-H1382 PolarHBondContact OG-NE2 3.04Å; T1307-H1382 PolarHBondContact O-NE2 3.15Å; G1315-H1382 WeakPolarHBondContact CA-CE1 3.44Å; H1382-S1384 PolarHBondContact CE1-OG 2.77Å
1383	I	81.6	Confident	81.6	Confident	4.2 Å²	4.2	35.6 Å²	35.6	2%	0.022	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.8	170.2	-61.9	174.8	0	0	0	108.8	I1191 R1316 V1357 F1381 E1387 L1389	I1191-I1383 HydrophobicContact CD1-CG1 4.02Å; I1191-I1383 HydrophobicContact CG1-CG1 4.41Å; R1316-I1383 HydrophobicContact CB-CB 4.31Å; R1316-I1383 PolarHBondContact N-O 3.03Å; R1316-I1383 PolarHBondContact O-N 3.25Å; V1357-I1383 HydrophobicContact CB-CD1 4.13Å; V1357-I1383 HydrophobicContact CG1-CD1 3.71Å; V1357-I1383 HydrophobicContact CG2-CD1 3.38Å; V1357-I1383 VanDerWaalsContact CG2-CD1 3.43Å; F1381-I1383 HydrophobicContact CD2-CD1 4.1Å; F1381-I1383 HydrophobicContact CD2-CG1 3.64Å; F1381-I1383 HydrophobicContact CE2-CD1 3.45Å; F1381-I1383 VanDerWaalsContact CE2-CD1 3.46Å; F1381-I1383 HydrophobicContact CE2-CG1 3.47Å; F1381-I1383 VanDerWaalsContact CE2-CG1 3.48Å; F1381-I1383 HydrophobicContact CZ-CD1 4.26Å; I1383-E1387 HydrophobicContact CG2-CB 4.02Å; I1383-L1389 HydrophobicContact CD1-CD2 4.25Å
1384	S	77.5	Confident	82.6	Confident	23.4 Å²	23.4	33.1 Å²	33.1	16%	0.164	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	158	173.3	-5.9	0	0	0	0	111.7	I1309 R1316 H1382 F1386 E1387	I1309-S1384 WeakPolarHBondContact CD1-OG 3.49Å; R1316-S1384 PolarHBondContact NH2-O 3.32Å; R1316-S1384 VanDerWaalsContact NH2-O 3.14Å; H1382-S1384 PolarHBondContact CE1-OG 2.77Å; S1384-F1386 PolarHBondContact O-N 3.01Å; S1384-F1386 VanDerWaalsContact O-N 3.14Å; S1384-E1387 WeakPolarHBondContact CB-OE2 3.43Å; S1384-E1387 PolarHBondContact N-OE2 3.09Å; S1384-E1387 VanDerWaalsContact N-OE2 3.15Å; S1384-E1387 PolarHBondContact O-N 3.07Å; S1384-E1387 VanDerWaalsContact O-N 3.09Å; S1384-E1387 VanDerWaalsContact OG-CG 3.25Å; S1384-E1387 WeakPolarHBondContact OG-CG 3.29Å; S1384-E1387 PolarHBondContact OG-OE2 3.11Å; S1384-E1387 VanDerWaalsContact OG-OE2 3.1Å
1385	D	69.7	Low	83.4	Confident	66 Å²	66	32.9 Å²	32.9	35%	0.353	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.9	179.5	-74.8	-30.4	0	0	0	114.5	V1313 E1314 R1316 E1387	V1313-D1385 HydrophobicContact CG1-CB 4.29Å; V1313-D1385 WeakPolarHBondContact CG1-OD2 3.2Å; E1314-D1385 WeakPolarHBondContact CA-OD2 3.17Å; E1314-D1385 WeakPolarHBondContact CB-OD2 3.14Å; E1314-D1385 PolarHBondContact N-OD2 3.11Å; E1314-D1385 VanDerWaalsContact O-CG 3.24Å; E1314-D1385 VanDerWaalsContact O-OD1 3.09Å; R1316-D1385 IonicContact NE-OD1 2.64Å; R1316-D1385 PolarHBondContact NH2-O 2.92Å; R1316-D1385 VanDerWaalsContact NH2-O 3.1Å; D1385-E1387 VanDerWaalsContact C-N 3.34Å
1386	F	69.3	Low	84.1	Confident	180.4 Å²	180.4	35.8 Å²	35.8	79%	0.791	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-9.8	180	-55.4	-72.2	0	0	0	114.1	V1313 S1384	V1313-F1386 HydrophobicContact CG2-CE2 4.46Å; S1384-F1386 PolarHBondContact O-N 3.01Å; S1384-F1386 VanDerWaalsContact O-N 3.14Å
1387	E	71.8	Confident	84.5	Confident	75.2 Å²	75.2	37.8 Å²	37.8	35%	0.351	18%	0.178	S	C	.	.			trans	-89.8	143.9	178.8	-71.8	172.6	152.7	0	0	110.6	R1316 I1383 S1384 D1385	R1316-E1387 PolarHBondContact NH2-O 3.1Å; R1316-E1387 VanDerWaalsContact NH2-O 3.11Å; I1383-E1387 HydrophobicContact CG2-CB 4.02Å; S1384-E1387 WeakPolarHBondContact CB-OE2 3.43Å; S1384-E1387 PolarHBondContact N-OE2 3.09Å; S1384-E1387 VanDerWaalsContact N-OE2 3.15Å; S1384-E1387 PolarHBondContact O-N 3.07Å; S1384-E1387 VanDerWaalsContact O-N 3.09Å; S1384-E1387 VanDerWaalsContact OG-CG 3.25Å; S1384-E1387 WeakPolarHBondContact OG-CG 3.29Å; S1384-E1387 PolarHBondContact OG-OE2 3.11Å; S1384-E1387 VanDerWaalsContact OG-OE2 3.1Å; D1385-E1387 VanDerWaalsContact C-N 3.34Å
1388	Y	75	Confident	85	Confident	134.4 Å²	134.4	37.8 Å²	37.8	53%	0.527	18%	0.177	S	C	.	.			trans	-135.3	153.6	177.6	62.4	-88.6	0	0	0	109.2	K1193 D1390 F1392	K1193-Y1388 VanDerWaalsContact NZ-CZ 3.3Å; K1193-Y1388 PolarHBondContact NZ-OH 3.03Å; Y1388-D1390 WeakPolarHBondContact CD2-OD1 3.38Å; Y1388-D1390 WeakPolarHBondContact CE2-OD1 3.3Å; Y1388-D1390 PolarHBondContact O-N 3.03Å; Y1388-D1390 PolarHBondContact OH-OD1 2.93Å; Y1388-F1392 HydrophobicContact CE2-CE1 4.37Å
1389	L	79.2	Confident	85.3	Confident	34 Å²	34	38.2 Å²	38.2	18%	0.178	18%	0.181	C	C	.	.			trans	-74.7	128.3	176.2	-58.9	175.2	0	0	0	109.9	P1190 P1355 V1357 F1381 I1383 D1391	P1190-L1389 HydrophobicContact CB-CD2 3.61Å; P1190-L1389 VanDerWaalsContact CB-CD2 3.45Å; P1190-L1389 HydrophobicContact CG-CD2 4.39Å; P1355-L1389 HydrophobicContact CB-CD1 4.16Å; P1355-L1389 HydrophobicContact CB-CD2 4.41Å; P1355-L1389 HydrophobicContact CG-CD1 4.07Å; P1355-L1389 HydrophobicContact CG-CD2 4.4Å; P1355-L1389 WeakPolarHBondContact O-CD1 3.44Å; V1357-L1389 HydrophobicContact CG2-CD1 3.43Å; V1357-L1389 VanDerWaalsContact CG2-CD1 3.4Å; V1357-L1389 HydrophobicContact CG2-CD2 4.28Å; V1357-L1389 HydrophobicContact CG2-CG 3.9Å; F1381-L1389 HydrophobicContact CE2-CD2 4.32Å; F1381-L1389 HydrophobicContact CZ-CD2 4.26Å; I1383-L1389 HydrophobicContact CD1-CD2 4.25Å; L1389-D1391 PolarHBondContact O-N 3.21Å; L1389-D1391 VanDerWaalsContact O-N 3.15Å
1390	D	76.4	Confident	85.8	Confident	8.2 Å²	8.2	38.1 Å²	38.1	4%	0.044	18%	0.18	C	C	.	.			trans	-79.9	98	173.9	-74.9	-26.1	0	0	0	110	P1190 K1193 G1215 Y1388 F1392	P1190-D1390 PolarHBondContact O-N 2.97Å; K1193-D1390 VanDerWaalsContact CD-OD2 3.25Å; K1193-D1390 WeakPolarHBondContact CD-OD2 3.35Å; K1193-D1390 WeakPolarHBondContact CE-OD2 3.3Å; K1193-D1390 VanDerWaalsContact CG-OD2 3.29Å; K1193-D1390 WeakPolarHBondContact CG-OD2 3.29Å; K1193-D1390 IonicContact NZ-OD1 3.61Å; K1193-D1390 PolarHBondContact NZ-OD1 3.27Å; K1193-D1390 IonicContact NZ-OD2 3.22Å; K1193-D1390 PolarHBondContact NZ-OD2 2.74Å; G1215-D1390 VanDerWaalsContact CA-O 3.29Å; G1215-D1390 WeakPolarHBondContact CA-O 3.32Å; Y1388-D1390 WeakPolarHBondContact CD2-OD1 3.38Å; Y1388-D1390 WeakPolarHBondContact CE2-OD1 3.3Å; Y1388-D1390 PolarHBondContact O-N 3.03Å; Y1388-D1390 PolarHBondContact OH-OD1 2.93Å; D1390-F1392 HydrophobicContact CB-CD1 4.36Å; D1390-F1392 HydrophobicContact CB-CE1 4.05Å; D1390-F1392 HydrophobicContact CB-CZ 4.23Å; D1390-F1392 PolarHBondContact O-N 2.99Å; D1390-F1392 VanDerWaalsContact O-N 3.14Å; D1390-F1392 VanDerWaalsContact OD1-CE1 3.28Å; D1390-F1392 WeakPolarHBondContact OD1-CE1 3.37Å; D1390-F1392 VanDerWaalsContact OD1-CZ 3.25Å; D1390-F1392 WeakPolarHBondContact OD1-CZ 3.26Å
1391	D	81.9	Confident	86.1	Confident	42.8 Å²	42.8	43.4 Å²	43.4	23%	0.229	20%	0.2	C	C	.	.			trans	-80.9	17.3	176.9	-68.6	-20	0	0	0	113.5	V1214 L1389 R1426 R1428 K1430	V1214-D1391 WeakPolarHBondContact CG2-O 3.31Å; L1389-D1391 PolarHBondContact O-N 3.21Å; L1389-D1391 VanDerWaalsContact O-N 3.15Å; D1391-R1426 IonicContact OD1-CZ 3.48Å; D1391-R1426 IonicContact OD1-NE 3.3Å; D1391-R1426 PolarHBondContact OD1-NE 2.97Å; D1391-R1426 VanDerWaalsContact OD1-NE 3.17Å; D1391-R1426 IonicContact OD1-NH1 2.71Å; D1391-R1426 IonicContact OD1-NH2 3.37Å; D1391-R1426 PolarHBondContact OD1-NH2 3.39Å; D1391-R1428 HydrophobicContact CB-CB 4.47Å; D1391-K1430 PolarHBondContact O-N 3.01Å; D1391-K1430 VanDerWaalsContact O-N 3.14Å
1392	F	90.4	Very high	86.4	Confident	41.6 Å²	41.6	49.1 Å²	49.1	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150.8	-168.6	62.1	-97.9	0	0	0	114.4	G1215 L1216 Y1388 D1390 H1394 K1430	G1215-F1392 VanDerWaalsContact CA-O 3.3Å; G1215-F1392 WeakPolarHBondContact CA-O 3.35Å; G1215-F1392 PolarHBondContact N-O 3.02Å; L1216-F1392 PolarHBondContact N-O 3.1Å; Y1388-F1392 HydrophobicContact CE2-CE1 4.37Å; D1390-F1392 HydrophobicContact CB-CD1 4.36Å; D1390-F1392 HydrophobicContact CB-CE1 4.05Å; D1390-F1392 HydrophobicContact CB-CZ 4.23Å; D1390-F1392 PolarHBondContact O-N 2.99Å; D1390-F1392 VanDerWaalsContact O-N 3.14Å; D1390-F1392 VanDerWaalsContact OD1-CE1 3.28Å; D1390-F1392 WeakPolarHBondContact OD1-CE1 3.37Å; D1390-F1392 VanDerWaalsContact OD1-CZ 3.25Å; D1390-F1392 WeakPolarHBondContact OD1-CZ 3.26Å; F1392-H1394 HydrophobicContact CD2-CB 3.66Å; F1392-H1394 HydrophobicContact CE2-CB 3.72Å; F1392-K1430 CarbonylContact C-O 3.52Å; F1392-K1430 WeakPolarHBondContact CA-O 3.32Å; F1392-K1430 HydrophobicContact CB-CB 3.82Å; F1392-K1430 HydrophobicContact CB-CD 4.03Å; F1392-K1430 HydrophobicContact CB-CG 3.98Å; F1392-K1430 WeakPolarHBondContact CB-O 3.44Å
1393	V	93.8	Very high	86.8	Confident	2.8 Å²	2.8	48.5 Å²	48.5	2%	0.017	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	112.3	162.2	179.5	0	0	0	0	106.8	L1211 V1214 L1216 L1218 V1395 K1430 L1431 W1432	L1211-V1393 HydrophobicContact CD1-CB 4.47Å; L1211-V1393 HydrophobicContact CD1-CG1 3.7Å; L1211-V1393 HydrophobicContact CD1-CG2 4.07Å; V1214-V1393 HydrophobicContact CB-CG2 4.2Å; V1214-V1393 HydrophobicContact CG1-CG2 4.16Å; L1216-V1393 CarbonylContact O-C 3.55Å; L1216-V1393 WeakPolarHBondContact O-CA 3.31Å; L1218-V1393 HydrophobicContact CD1-CG1 4.06Å; V1393-V1395 HydrophobicContact CG1-CG2 4.36Å; V1393-K1430 PolarHBondContact N-O 3.04Å; V1393-L1431 HydrophobicContact CB-CD2 3.66Å; V1393-L1431 HydrophobicContact CB-CG 4.43Å; V1393-L1431 HydrophobicContact CG1-CD2 4.47Å; V1393-L1431 HydrophobicContact CG2-CD2 3.7Å; V1393-W1432 PolarHBondContact O-N 3.07Å
1394	H	95.1	Very high	87.1	Confident	18.6 Å²	18.6	49.6 Å²	49.6	9%	0.086	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115.2	-178.1	-176.2	-155.6	0	0	0	110.5	L1216 T1217 L1218 F1392 W1432 Q1434	L1216-H1394 PolarHBondContact O-N 3.21Å; T1217-H1394 CarbonylContact C-O 3.47Å; T1217-H1394 WeakPolarHBondContact CA-O 3.33Å; T1217-H1394 HydrophobicContact CG2-CB 4.29Å; L1218-H1394 PolarHBondContact N-O 2.93Å; F1392-H1394 HydrophobicContact CD2-CB 3.66Å; F1392-H1394 HydrophobicContact CE2-CB 3.72Å; H1394-W1432 CarbonylContact C-O 3.52Å; H1394-W1432 WeakPolarHBondContact CA-O 3.32Å; H1394-W1432 HydrophobicContact CB-CE3 4.39Å; H1394-W1432 AromaticContact CD2-CD2 3.55Å; H1394-W1432 VanDerWaalsContact CD2-CD2 3.44Å; H1394-W1432 AromaticContact CD2-CE3 3.5Å; H1394-W1432 VanDerWaalsContact CD2-CE3 3.43Å; H1394-W1432 AromaticContact CD2-CG 3.88Å; H1394-W1432 AromaticContact CD2-CZ3 3.99Å; H1394-W1432 AromaticContact CE1-CE3 3.99Å; H1394-W1432 AromaticContact CE1-CZ3 3.79Å; H1394-W1432 AromaticContact CG-CE3 3.82Å; H1394-W1432 AromaticContact NE2-CD2 3.74Å; H1394-W1432 AromaticContact NE2-CE2 3.84Å; H1394-W1432 AromaticContact NE2-CE3 3.67Å; H1394-W1432 AromaticContact NE2-CH2 3.91Å; H1394-W1432 AromaticContact NE2-CZ2 3.9Å; H1394-W1432 AromaticContact NE2-CZ3 3.82Å; H1394-Q1434 PolarHBondContact NE2-OE1 3.2Å; H1394-Q1434 VanDerWaalsContact NE2-OE1 3.15Å
1395	V	96.3	Very high	87.8	Confident	0.8 Å²	0.8	49 Å²	49	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	108.8	176.5	-175.6	0	0	0	0	108.1	L1218 I1231 V1393 W1432 F1433 Q1434 T1436	L1218-V1395 HydrophobicContact CB-CG1 4.39Å; L1218-V1395 HydrophobicContact CB-CG2 4.37Å; L1218-V1395 HydrophobicContact CD1-CG1 4.44Å; L1218-V1395 HydrophobicContact CD1-CG2 3.97Å; L1218-V1395 HydrophobicContact CD2-CG2 4.38Å; L1218-V1395 HydrophobicContact CG-CG2 4.4Å; I1231-V1395 HydrophobicContact CD1-CG2 3.94Å; V1393-V1395 HydrophobicContact CG1-CG2 4.36Å; V1395-W1432 PolarHBondContact N-O 3.21Å; V1395-F1433 HydrophobicContact CB-CD1 3.68Å; V1395-F1433 HydrophobicContact CB-CE1 3.98Å; V1395-F1433 HydrophobicContact CG1-CD1 4.08Å; V1395-F1433 HydrophobicContact CG1-CE1 4.38Å; V1395-F1433 HydrophobicContact CG2-CD1 3.96Å; V1395-F1433 HydrophobicContact CG2-CE1 3.71Å; V1395-F1433 HydrophobicContact CG2-CZ 4.48Å; V1395-F1433 CarbonylContact O-C 3.55Å; V1395-F1433 WeakPolarHBondContact O-CA 3.33Å; V1395-Q1434 PolarHBondContact O-N 3.26Å; V1395-T1436 HydrophobicContact CG1-CG2 4.39Å; V1395-T1436 PolarHBondContact O-OG1 2.99Å
1396	R	96	Very high	88.9	Confident	97 Å²	97	45.9 Å²	45.9	37%	0.366	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.2	-173.7	-176	174	168.1	149.8	-7.6	111.6	L1218 E1219 N1220 S1398 Q1434	L1218-R1396 PolarHBondContact O-N 3.11Å; E1219-R1396 WeakPolarHBondContact CA-O 3.42Å; N1220-R1396 PolarHBondContact N-O 3.17Å; N1220-R1396 VanDerWaalsContact N-O 3.17Å; R1396-S1398 PolarHBondContact O-N 3.08Å; R1396-S1398 VanDerWaalsContact O-N 3.07Å; R1396-S1398 PolarHBondContact O-OG 3.08Å; R1396-Q1434 CarbonylContact C-O 3.53Å; R1396-Q1434 VanDerWaalsContact CA-O 3.26Å; R1396-Q1434 WeakPolarHBondContact CA-O 3.24Å; R1396-Q1434 HydrophobicContact CG-CB 4.39Å; R1396-Q1434 HydrophobicContact CG-CG 4.5Å
1397	S	96.5	Very high	90.1	Very high	42.4 Å²	42.4	37.3 Å²	37.3	30%	0.297	17%	0.169	S	C	.	.	S	Bend	trans	51.1	35.5	173.2	-58.4	0	0	0	0	113.3	N1220 Q1434 K1435	N1220-S1397 WeakPolarHBondContact CA-O 3.4Å; N1220-S1397 VanDerWaalsContact OD1-CB 3.3Å; N1220-S1397 WeakPolarHBondContact OD1-CB 3.35Å; N1220-S1397 PolarHBondContact OD1-O 3.06Å; S1397-Q1434 PolarHBondContact N-O 3.05Å; S1397-K1435 VanDerWaalsContact CA-O 3.26Å; S1397-K1435 WeakPolarHBondContact CA-O 3.22Å; S1397-K1435 PolarHBondContact N-O 3.23Å
1398	S	97.4	Very high	91.1	Very high	1.8 Å²	1.8	33.8 Å²	33.8	1%	0.013	15%	0.153	C	C	.	.			trans	-111.1	161.5	-170.3	-67.8	0	0	0	0	111.4	V1221 R1396 T1436 Y1437	V1221-S1398 PolarHBondContact N-OG 2.8Å; V1221-S1398 VanDerWaalsContact N-OG 3.11Å; V1221-S1398 CarbonylContact O-C 3.56Å; V1221-S1398 VanDerWaalsContact O-CA 3.27Å; V1221-S1398 WeakPolarHBondContact O-CA 3.32Å; V1221-S1398 WeakPolarHBondContact O-CB 3.37Å; V1221-S1398 PolarHBondContact O-OG 2.89Å; R1396-S1398 PolarHBondContact O-N 3.08Å; R1396-S1398 VanDerWaalsContact O-N 3.07Å; R1396-S1398 PolarHBondContact O-OG 3.08Å; S1398-T1436 CarbonylContact O-C 3.59Å; S1398-T1436 VanDerWaalsContact O-CA 3.31Å; S1398-T1436 WeakPolarHBondContact O-CA 3.28Å; S1398-T1436 WeakPolarHBondContact O-CG2 3.31Å; S1398-Y1437 PolarHBondContact O-N 3.1Å
1399	A	96.9	Very high	91.9	Very high	10.4 Å²	10.4	27.4 Å²	27.4	9%	0.086	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.8	-179.4	0	0	0	0	0	110.9	V1221 T1222 L1223 R1401	V1221-A1399 PolarHBondContact O-N 3.1Å; T1222-A1399 CarbonylContact C-O 3.4Å; T1222-A1399 WeakPolarHBondContact CA-O 3.31Å; T1222-A1399 HydrophobicContact CG2-CB 4.42Å; L1223-A1399 PolarHBondContact N-O 3.06Å; A1399-R1401 HydrophobicContact CB-CG 4.22Å
1400	I	97	Very high	92.5	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	101.6	179.6	-58.8	178.9	0	0	0	108.1	L1223 I1231 N1403 G1406 F1433 T1436 Y1437 F1438 T1439 N1441	L1223-I1400 HydrophobicContact CB-CG1 4.38Å; L1223-I1400 HydrophobicContact CD1-CD1 4.29Å; L1223-I1400 HydrophobicContact CD1-CG1 3.93Å; L1223-I1400 CarbonylContact O-C 3.57Å; L1223-I1400 WeakPolarHBondContact O-CA 3.28Å; I1231-I1400 HydrophobicContact CD1-CD1 3.94Å; I1231-I1400 HydrophobicContact CG1-CD1 4.34Å; I1400-N1403 WeakPolarHBondContact CG2-ND2 3.35Å; I1400-G1406 WeakPolarHBondContact CG2-O 3.42Å; I1400-F1433 HydrophobicContact CD1-CE1 4.46Å; I1400-T1436 HydrophobicContact CD1-CG2 4.17Å; I1400-T1436 HydrophobicContact CG1-CG2 4.32Å; I1400-Y1437 PolarHBondContact N-O 3Å; I1400-F1438 HydrophobicContact CB-CD1 3.94Å; I1400-F1438 HydrophobicContact CB-CE1 4.16Å; I1400-F1438 HydrophobicContact CD1-CD1 4.27Å; I1400-F1438 HydrophobicContact CD1-CE1 3.59Å; I1400-F1438 HydrophobicContact CD1-CZ 4.07Å; I1400-F1438 HydrophobicContact CG1-CE1 4.38Å; I1400-F1438 HydrophobicContact CG2-CD1 4.14Å; I1400-F1438 HydrophobicContact CG2-CE1 4.33Å; I1400-F1438 WeakPolarHBondContact O-CA 3.39Å; I1400-T1439 PolarHBondContact O-N 2.97Å; I1400-T1439 VanDerWaalsContact O-N 3.13Å; I1400-N1441 PolarHBondContact O-ND2 3.05Å
1401	R	95.1	Very high	93.1	Very high	113.6 Å²	113.6	26.1 Å²	26.1	43%	0.429	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.4	-166.4	-32.9	-168.6	168.8	158.5	0.3	114.1	L1223 A1224 G1225 A1399 N1403 T1439	L1223-R1401 PolarHBondContact O-N 2.94Å; A1224-R1401 CarbonylContact C-O 3.54Å; A1224-R1401 VanDerWaalsContact CA-O 3.22Å; A1224-R1401 WeakPolarHBondContact CA-O 3.33Å; A1224-R1401 HydrophobicContact CB-CB 4.43Å; G1225-R1401 PolarHBondContact N-O 3.04Å; A1399-R1401 HydrophobicContact CB-CG 4.22Å; R1401-N1403 PolarHBondContact N-ND2 3.35Å; R1401-N1403 PolarHBondContact O-N 2.97Å; R1401-N1403 VanDerWaalsContact O-N 3.15Å; R1401-N1403 PolarHBondContact O-ND2 2.98Å; R1401-N1403 VanDerWaalsContact O-ND2 3.1Å; R1401-T1439 CarbonylContact C-O 3.54Å; R1401-T1439 WeakPolarHBondContact CA-O 3.42Å; R1401-T1439 WeakPolarHBondContact CB-O 3.38Å; R1401-T1439 WeakPolarHBondContact CB-OG1 3.42Å; R1401-T1439 VanDerWaalsContact CD-OG1 3.24Å; R1401-T1439 WeakPolarHBondContact CD-OG1 3.3Å; R1401-T1439 WeakPolarHBondContact CG-OG1 3.27Å; R1401-T1439 PolarHBondContact NE-OG1 2.88Å
1402	Q	93.4	Very high	93.4	Very high	121.6 Å²	121.6	25 Å²	25	57%	0.568	11%	0.113	S	C	*	.	S	Bend	trans	55.4	27	169.6	-60.7	178.4	-26.4	0	0	115.1	G1225 T1439 G1440	G1225-Q1402 WeakPolarHBondContact CA-O 3.35Å; Q1402-T1439 PolarHBondContact N-O 3.03Å; Q1402-G1440 VanDerWaalsContact CA-O 3.3Å; Q1402-G1440 WeakPolarHBondContact CA-O 3.34Å
1403	N	92.6	Very high	93.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.108	C	C	.	.			trans	-90.6	165.6	173.1	-51.3	-73	0	0	0	109.6	L1223 G1225 N1226 I1400 R1401 Y1405 N1441 R1442	L1223-N1403 PolarHBondContact O-ND2 3.12Å; G1225-N1403 PolarHBondContact N-OD1 3.13Å; N1226-N1403 VanDerWaalsContact CB-OD1 3.3Å; N1226-N1403 WeakPolarHBondContact CB-OD1 3.42Å; N1226-N1403 PolarHBondContact N-OD1 3.32Å; N1226-N1403 PolarHBondContact ND2-OD1 3Å; N1226-N1403 VanDerWaalsContact O-CA 3.32Å; N1226-N1403 WeakPolarHBondContact O-CA 3.33Å; I1400-N1403 WeakPolarHBondContact CG2-ND2 3.35Å; R1401-N1403 PolarHBondContact N-ND2 3.35Å; R1401-N1403 PolarHBondContact O-N 2.97Å; R1401-N1403 VanDerWaalsContact O-N 3.15Å; R1401-N1403 PolarHBondContact O-ND2 2.98Å; R1401-N1403 VanDerWaalsContact O-ND2 3.1Å; N1403-Y1405 VanDerWaalsContact CB-O 3.28Å; N1403-Y1405 WeakPolarHBondContact CB-O 3.39Å; N1403-N1441 WeakPolarHBondContact CB-OD1 3.32Å; N1403-N1441 PolarHBondContact N-OD1 3.17Å; N1403-N1441 VanDerWaalsContact N-OD1 3.13Å; N1403-N1441 PolarHBondContact ND2-OD1 2.87Å; N1403-N1441 CarbonylContact O-C 3.46Å; N1403-N1441 VanDerWaalsContact O-CA 3.24Å; N1403-N1441 WeakPolarHBondContact O-CA 3.33Å; N1403-N1441 WeakPolarHBondContact O-CB 3.29Å; N1403-R1442 PolarHBondContact O-N 3.11Å
1404	Q	88.8	Confident	92.6	Very high	26.2 Å²	26.2	23.6 Å²	23.6	12%	0.122	11%	0.109	C	C	.	.	S	Bend	trans	-64	-49.4	168.5	178.3	-175.5	5.9	0	0	110	E1227 N1228 R1442 Q1443 A1444 Y1862 P1866	E1227-Q1404 WeakPolarHBondContact O-CB 3.28Å; E1227-Q1404 PolarHBondContact O-OE1 3.06Å; E1227-Q1404 VanDerWaalsContact O-OE1 3.11Å; N1228-Q1404 WeakPolarHBondContact O-CA 3.27Å; N1228-Q1404 VanDerWaalsContact O-CB 3.25Å; N1228-Q1404 WeakPolarHBondContact O-CB 3.38Å; N1228-Q1404 PolarHBondContact O-N 3.15Å; Q1404-R1442 PolarHBondContact O-N 3.04Å; Q1404-Q1443 VanDerWaalsContact CD-OE1 3.27Å; Q1404-Q1443 HydrophobicContact CG-CB 4.2Å; Q1404-Q1443 VanDerWaalsContact CG-CD 3.42Å; Q1404-Q1443 HydrophobicContact CG-CG 4.05Å; Q1404-Q1443 VanDerWaalsContact CG-OE1 3.28Å; Q1404-Q1443 VanDerWaalsContact NE2-CD 3.26Å; Q1404-Q1443 VanDerWaalsContact NE2-NE2 3.17Å; Q1404-Q1443 WeakPolarHBondContact O-CB 3.43Å; Q1404-Q1443 PolarHBondContact O-N 3Å; Q1404-A1444 PolarHBondContact O-N 3.17Å; Q1404-Y1862 PolarHBondContact NE2-O 2.96Å; Q1404-Y1862 VanDerWaalsContact NE2-O 3.1Å; Q1404-P1866 VanDerWaalsContact NE2-CB 3.31Å
1405	Y	91.1	Very high	92	Very high	11.8 Å²	11.8	23.4 Å²	23.4	5%	0.046	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.1	172.6	-51.3	-68.3	0	0	0	110.3	N1228 A1229 G1230 N1403 Q1443 A1444 W1447 L1867 L1868 Q1871 Y1872	N1228-Y1405 PolarHBondContact O-N 3.02Å; N1228-Y1405 VanDerWaalsContact O-N 3.16Å; N1228-Y1405 WeakPolarHBondContact OD1-CD2 3.42Å; A1229-Y1405 CarbonylContact C-O 3.53Å; A1229-Y1405 VanDerWaalsContact CA-O 3.26Å; A1229-Y1405 WeakPolarHBondContact CA-O 3.46Å; A1229-Y1405 HydrophobicContact CB-CD2 4.44Å; G1230-Y1405 PolarHBondContact N-O 3.04Å; N1403-Y1405 VanDerWaalsContact CB-O 3.28Å; N1403-Y1405 WeakPolarHBondContact CB-O 3.39Å; Y1405-Q1443 HydrophobicContact CD1-CB 4.17Å; Y1405-Q1443 HydrophobicContact CE1-CB 3.77Å; Y1405-Q1443 VanDerWaalsContact CE1-OE1 3.28Å; Y1405-Q1443 PolarHBondContact OH-OE1 3.08Å; Y1405-Q1443 VanDerWaalsContact OH-OE1 3.12Å; Y1405-A1444 CarbonylContact C-O 3.54Å; Y1405-A1444 VanDerWaalsContact CA-O 3.27Å; Y1405-A1444 WeakPolarHBondContact CA-O 3.37Å; Y1405-A1444 HydrophobicContact CD1-CB 3.81Å; Y1405-A1444 HydrophobicContact CE1-CB 4.31Å; Y1405-W1447 HydrophobicContact CD1-CB 4.14Å; Y1405-W1447 HydrophobicContact CD1-CE3 4.3Å; Y1405-W1447 HydrophobicContact CD1-CG 4.34Å; Y1405-W1447 HydrophobicContact CD2-CE3 4.42Å; Y1405-W1447 HydrophobicContact CE1-CB 4.34Å; Y1405-W1447 HydrophobicContact CE1-CE3 4.17Å; Y1405-W1447 HydrophobicContact CE1-CG 4.23Å; Y1405-W1447 HydrophobicContact CE2-CE3 4.2Å; Y1405-W1447 HydrophobicContact CE2-CZ3 4.26Å; Y1405-W1447 HydrophobicContact CG-CB 4.46Å; Y1405-W1447 HydrophobicContact CG-CE3 4.35Å; Y1405-W1447 AromaticContact CZ-CE3 3.93Å; Y1405-L1867 PolarHBondContact OH-N 2.77Å; Y1405-L1868 HydrophobicContact CE1-CB 3.82Å; Y1405-L1868 HydrophobicContact CE1-CD2 4.29Å; Y1405-L1868 WeakPolarHBondContact OH-CB 3.46Å; Y1405-L1868 PolarHBondContact OH-N 2.93Å; Y1405-Q1871 PolarHBondContact OH-NE2 2.82Å; Y1405-Y1872 HydrophobicContact CE1-CE2 4.29Å
1406	G	92.2	Very high	91.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	-59	171.5	0	0	0	0	0	111	G1230 I1231 I1400 A1444 V1445	G1230-G1406 WeakPolarHBondContact CA-O 3.42Å; G1230-G1406 PolarHBondContact N-O 3.12Å; I1231-G1406 PolarHBondContact N-O 3.1Å; I1231-G1406 VanDerWaalsContact N-O 3.11Å; I1400-G1406 WeakPolarHBondContact CG2-O 3.42Å; G1406-A1444 PolarHBondContact N-O 3.02Å; G1406-V1445 CarbonylContact C-O 3.48Å; G1406-V1445 WeakPolarHBondContact CA-O 3.28Å; G1406-V1445 PolarHBondContact N-O 3.11Å; G1406-V1445 VanDerWaalsContact N-O 3.16Å
1407	L	94.3	Very high	90.5	Very high	0.4 Å²	0.4	26.2 Å²	26.2	0%	0.002	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.8	171.8	176.8	72.4	0	0	0	109.6	I1231 L1431 F1433 V1445 I1446 W1447 Y1466	I1231-L1407 HydrophobicContact CB-CD1 3.69Å; I1231-L1407 HydrophobicContact CG2-CD1 3.65Å; I1231-L1407 CarbonylContact O-C 3.54Å; I1231-L1407 WeakPolarHBondContact O-CA 3.4Å; L1407-L1431 HydrophobicContact CD1-CD2 4.16Å; L1407-L1431 HydrophobicContact CD2-CD1 4.29Å; L1407-L1431 HydrophobicContact CD2-CD2 4.16Å; L1407-F1433 HydrophobicContact CB-CZ 4.39Å; L1407-F1433 HydrophobicContact CD1-CZ 4Å; L1407-F1433 HydrophobicContact CD2-CE2 3.61Å; L1407-F1433 HydrophobicContact CD2-CZ 3.43Å; L1407-F1433 VanDerWaalsContact CD2-CZ 3.44Å; L1407-F1433 HydrophobicContact CG-CZ 4.16Å; L1407-V1445 PolarHBondContact N-O 3.27Å; L1407-I1446 HydrophobicContact CB-CB 4.45Å; L1407-I1446 HydrophobicContact CB-CG1 4.04Å; L1407-I1446 HydrophobicContact CB-CG2 4.44Å; L1407-I1446 HydrophobicContact CD2-CG1 4.18Å; L1407-I1446 HydrophobicContact CD2-CG2 3.92Å; L1407-I1446 HydrophobicContact CG-CG2 4.46Å; L1407-I1446 CarbonylContact O-C 3.43Å; L1407-I1446 WeakPolarHBondContact O-CA 3.31Å; L1407-W1447 PolarHBondContact O-N 3.12Å; L1407-Y1466 HydrophobicContact CD2-CD1 4.26Å; L1407-Y1466 HydrophobicContact CD2-CE1 3.79Å
1408	S	92.9	Very high	89.5	Confident	1.6 Å²	1.6	31.4 Å²	31.4	1%	0.011	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	114.1	167.9	177.5	0	0	0	0	109.8	I1231 R1232 Y1233 W1447	I1231-S1408 PolarHBondContact O-N 3.18Å; R1232-S1408 CarbonylContact C-O 3.56Å; R1232-S1408 VanDerWaalsContact CA-O 3.26Å; R1232-S1408 WeakPolarHBondContact CA-O 3.4Å; R1232-S1408 WeakPolarHBondContact CD-O 3.33Å; R1232-S1408 WeakPolarHBondContact CD-OG 3.47Å; R1232-S1408 PolarHBondContact NH1-O 3.09Å; R1232-S1408 PolarHBondContact NH1-OG 2.85Å; Y1233-S1408 PolarHBondContact N-O 3.03Å; S1408-W1447 CarbonylContact C-O 3.53Å; S1408-W1447 VanDerWaalsContact CA-O 3.29Å; S1408-W1447 WeakPolarHBondContact CA-O 3.29Å
1409	G	92.3	Very high	88.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.3	-179.4	0	0	0	0	0	112.3	Y1233 W1447 V1448 N1449	Y1233-G1409 CarbonylContact O-C 3.54Å; Y1233-G1409 WeakPolarHBondContact O-CA 3.37Å; G1409-W1447 PolarHBondContact N-O 3.25Å; G1409-V1448 CarbonylContact O-C 3.47Å; G1409-V1448 WeakPolarHBondContact O-CA 3.32Å; G1409-N1449 PolarHBondContact O-N 3.16Å
1410	V	91.4	Very high	87.4	Confident	4.6 Å²	4.6	36.3 Å²	36.3	3%	0.028	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.9	172.5	178.2	0	0	0	0	109.5	R1232 Y1233 N1234 P1235 Y1412 N1449 P1451	R1232-V1410 VanDerWaalsContact NH2-CG2 3.27Å; Y1233-V1410 PolarHBondContact O-N 3.05Å; N1234-V1410 HydrophobicContact CB-CG2 4.45Å; P1235-V1410 WeakPolarHBondContact CD-O 3.31Å; P1235-V1410 WeakPolarHBondContact CG-O 3.31Å; V1410-Y1412 HydrophobicContact CB-CE2 4.45Å; V1410-Y1412 HydrophobicContact CG1-CD1 4.39Å; V1410-Y1412 HydrophobicContact CG1-CD2 4.23Å; V1410-Y1412 HydrophobicContact CG1-CE1 3.87Å; V1410-Y1412 HydrophobicContact CG1-CE2 3.64Å; V1410-Y1412 HydrophobicContact CG1-CG 4.47Å; V1410-Y1412 VanDerWaalsContact CG1-CZ 3.45Å; V1410-N1449 VanDerWaalsContact CA-O 3.3Å; V1410-N1449 WeakPolarHBondContact CA-O 3.38Å; V1410-N1449 HydrophobicContact CG2-CB 4.21Å; V1410-P1451 HydrophobicContact CG1-CG 3.8Å
1411	H	90	Very high	86.8	Confident	10 Å²	10	36.4 Å²	36.4	5%	0.046	18%	0.175	C	C	.	.			trans	-125.3	125.1	176.4	-64.8	-71.7	0	0	0	109.6	Y1233 N1449 G1450 V1464 Y1466 F1494	Y1233-H1411 AromaticContact CD1-CE1 3.83Å; Y1233-H1411 AromaticContact CE1-CE1 3.5Å; Y1233-H1411 VanDerWaalsContact CE1-CE1 3.48Å; Y1233-H1411 WeakPolarHBondContact CE1-CE1 3.3Å; Y1233-H1411 AromaticContact CE1-ND1 3.93Å; H1411-N1449 PolarHBondContact N-O 3.24Å; H1411-N1449 VanDerWaalsContact N-O 3.07Å; H1411-G1450 WeakPolarHBondContact O-CA 3.33Å; H1411-V1464 WeakPolarHBondContact CE1-CG1 3.38Å; H1411-V1464 VanDerWaalsContact NE2-CG1 3.3Å; H1411-V1464 WeakPolarHBondContact NE2-CG1 3.4Å; H1411-Y1466 PolarHBondContact CD2-OH 2.79Å; H1411-Y1466 AromaticContact NE2-CE2 3.74Å; H1411-Y1466 AromaticContact NE2-CZ 3.63Å; H1411-Y1466 PolarHBondContact NE2-OH 2.98Å; H1411-F1494 HydrophobicContact CB-CZ 4.4Å; H1411-F1494 AromaticContact CD2-CE1 3.96Å
1412	Y	87.5	Confident	86.3	Confident	20 Å²	20	31.6 Å²	31.6	8%	0.078	16%	0.158	C	C	.	.			trans	-100.2	153	-178.5	-60.2	-79.4	0	0	0	110.6	N1234 P1235 Q1236 V1410 L1423 R1425 P1451 L1452 N1492	N1234-Y1412 WeakPolarHBondContact OD1-CE2 3.28Å; N1234-Y1412 PolarHBondContact OD1-OH 2.96Å; N1234-Y1412 VanDerWaalsContact OD1-OH 3.05Å; P1235-Y1412 HydrophobicContact CG-CD2 4.08Å; P1235-Y1412 HydrophobicContact CG-CE2 4.27Å; Q1236-Y1412 HydrophobicContact CB-CE2 4.07Å; Q1236-Y1412 PolarHBondContact OE1-OH 2.94Å; Q1236-Y1412 VanDerWaalsContact OE1-OH 3.14Å; V1410-Y1412 HydrophobicContact CB-CE2 4.45Å; V1410-Y1412 HydrophobicContact CG1-CD1 4.39Å; V1410-Y1412 HydrophobicContact CG1-CD2 4.23Å; V1410-Y1412 HydrophobicContact CG1-CE1 3.87Å; V1410-Y1412 HydrophobicContact CG1-CE2 3.64Å; V1410-Y1412 HydrophobicContact CG1-CG 4.47Å; V1410-Y1412 VanDerWaalsContact CG1-CZ 3.45Å; Y1412-L1423 HydrophobicContact CD1-CD1 4.04Å; Y1412-L1423 HydrophobicContact CD1-CD2 4.21Å; Y1412-L1423 HydrophobicContact CD2-CB 4.27Å; Y1412-L1423 HydrophobicContact CD2-CD1 4.4Å; Y1412-L1423 HydrophobicContact CD2-CD2 3.77Å; Y1412-L1423 HydrophobicContact CD2-CG 4.36Å; Y1412-L1423 HydrophobicContact CE1-CD2 4.21Å; Y1412-L1423 HydrophobicContact CE2-CD2 3.8Å; Y1412-L1423 HydrophobicContact CG-CB 4.39Å; Y1412-L1423 HydrophobicContact CG-CD1 3.85Å; Y1412-L1423 HydrophobicContact CG-CD2 3.99Å; Y1412-L1423 HydrophobicContact CG-CG 4.3Å; Y1412-R1425 VanDerWaalsContact O-CD 3.32Å; Y1412-R1425 WeakPolarHBondContact O-CD 3.32Å; Y1412-R1425 PolarHBondContact O-NE 2.9Å; Y1412-P1451 HydrophobicContact CD1-CG 3.88Å; Y1412-P1451 HydrophobicContact CE1-CG 3.5Å; Y1412-P1451 VanDerWaalsContact CE1-CG 3.44Å; Y1412-L1452 HydrophobicContact CD1-CD1 3.61Å; Y1412-L1452 HydrophobicContact CD1-CG 3.89Å; Y1412-L1452 HydrophobicContact CE1-CD1 4.18Å; Y1412-L1452 HydrophobicContact CE1-CG 4.24Å; Y1412-L1452 HydrophobicContact CG-CD1 4.38Å; Y1412-N1492 PolarHBondContact O-ND2 3Å
1413	S	84.7	Confident	86	Confident	8.4 Å²	8.4	25.8 Å²	25.8	6%	0.059	13%	0.131	C	C	.	.	S	Bend	trans	-96.4	-24.5	174.5	-63.6	0	0	0	0	112.7	R1425 S1459 D1486 S1490 A1491 N1492	S1413-R1425 VanDerWaalsContact O-CZ 3.28Å; S1413-R1425 PolarHBondContact O-NH1 3.05Å; S1413-S1459 PolarHBondContact O-OG 2.87Å; S1413-D1486 PolarHBondContact OG-OD2 2.86Å; S1413-S1490 PolarHBondContact OG-OG 2.41Å; S1413-S1490 VanDerWaalsContact OG-OG 3.14Å; S1413-A1491 PolarHBondContact OG-N 3Å; S1413-A1491 VanDerWaalsContact OG-N 3.14Å; S1413-N1492 PolarHBondContact OG-ND2 3.16Å
1414	S	83.9	Confident	85.7	Confident	6.4 Å²	6.4	27.6 Å²	27.6	5%	0.045	14%	0.14	C	C	.	.	S	Bend	trans	-96.5	163.2	176.7	52.3	0	0	0	0	112.8	F1416 L1423 R1425 L1452 E1454	S1414-F1416 WeakPolarHBondContact CB-O 3.43Å; S1414-F1416 PolarHBondContact OG-O 3.03Å; S1414-L1423 WeakPolarHBondContact O-CB 3.29Å; S1414-L1423 WeakPolarHBondContact O-CD1 3.37Å; S1414-L1423 VanDerWaalsContact OG-CD1 3.27Å; S1414-L1423 WeakPolarHBondContact OG-CD1 3.35Å; S1414-R1425 WeakPolarHBondContact O-CD 3.31Å; S1414-L1452 VanDerWaalsContact OG-CD1 3.29Å; S1414-L1452 WeakPolarHBondContact OG-CD1 3.48Å; S1414-E1454 PolarHBondContact OG-O 3.26Å; S1414-E1454 VanDerWaalsContact OG-O 3.12Å
1415	F	82.3	Confident	85.6	Confident	13.4 Å²	13.4	27.1 Å²	27.1	6%	0.059	14%	0.137	C	C	.	.	S	Bend	trans	-89.1	-21.6	174.7	-66.1	-69.7	0	0	0	113.5	R1324 L1351 I1352 L1423 R1425 E1456 P1460	R1324-F1415 PolarHBondContact NH1-O 3.16Å; L1351-F1415 HydrophobicContact CB-CD1 3.81Å; L1351-F1415 HydrophobicContact CB-CE1 3.88Å; L1351-F1415 HydrophobicContact CB-CG 4.29Å; L1351-F1415 HydrophobicContact CB-CZ 4.36Å; L1351-F1415 HydrophobicContact CD1-CB 3.98Å; L1351-F1415 HydrophobicContact CD1-CD1 4.28Å; L1351-F1415 HydrophobicContact CD1-CD2 4.46Å; L1351-F1415 HydrophobicContact CD1-CG 4.03Å; I1352-F1415 HydrophobicContact CB-CE1 4.18Å; I1352-F1415 HydrophobicContact CB-CZ 3.78Å; I1352-F1415 HydrophobicContact CD1-CZ 4.39Å; I1352-F1415 HydrophobicContact CG1-CE1 4.46Å; I1352-F1415 HydrophobicContact CG1-CZ 4.33Å; I1352-F1415 HydrophobicContact CG2-CE1 3.43Å; I1352-F1415 VanDerWaalsContact CG2-CE1 3.43Å; I1352-F1415 HydrophobicContact CG2-CZ 3.75Å; F1415-L1423 WeakPolarHBondContact O-CB 3.36Å; F1415-L1423 PolarHBondContact O-N 3.13Å; F1415-R1425 HydrophobicContact CD1-CB 4.2Å; F1415-R1425 HydrophobicContact CE1-CB 4.06Å; F1415-R1425 HydrophobicContact CE1-CG 4.28Å; F1415-E1456 WeakPolarHBondContact CD2-OE2 3.23Å; F1415-E1456 PolarHBondContact N-OE1 2.8Å; F1415-P1460 HydrophobicContact CE2-CG 4.18Å; F1415-P1460 HydrophobicContact CZ-CG 3.99Å
1416	F	81.5	Confident	85.3	Confident	46.2 Å²	46.2	28.1 Å²	28.1	20%	0.203	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-136.8	162.8	-176.4	-39.6	-83.7	0	0	0	110.7	R1324 Q1327 L1351 S1414 S1421 V1422 E1456	R1324-F1416 VanDerWaalsContact NH1-CE1 3.3Å; Q1327-F1416 VanDerWaalsContact NE2-CD2 3.31Å; Q1327-F1416 VanDerWaalsContact NE2-CG 3.33Å; L1351-F1416 HydrophobicContact CD1-CE2 3.75Å; L1351-F1416 HydrophobicContact CD1-CZ 3.58Å; L1351-F1416 VanDerWaalsContact CD1-CZ 3.47Å; S1414-F1416 WeakPolarHBondContact CB-O 3.43Å; S1414-F1416 PolarHBondContact OG-O 3.03Å; F1416-S1421 WeakPolarHBondContact CA-O 3.31Å; F1416-V1422 HydrophobicContact CD1-CG2 4.12Å; F1416-V1422 HydrophobicContact CE1-CG2 4.12Å; F1416-E1456 WeakPolarHBondContact CE1-OE1 3.19Å; F1416-E1456 WeakPolarHBondContact CE1-OE2 3.43Å; F1416-E1456 WeakPolarHBondContact CE2-OE1 3.35Å; F1416-E1456 HydrophobicContact CZ-CG 4.36Å; F1416-E1456 WeakPolarHBondContact CZ-OE1 3.31Å; F1416-E1456 VanDerWaalsContact CZ-OE2 3.26Å; F1416-E1456 WeakPolarHBondContact CZ-OE2 3.45Å
1417	R	79.1	Confident	85.1	Confident	112 Å²	112	34.1 Å²	34.1	42%	0.423	16%	0.163	S	C	.	.			trans	-120.5	154.4	170.4	-172.5	175.7	144.8	143.7	2.1	108.9	D1419 G1420 S1421 M1453	R1417-D1419 VanDerWaalsContact CB-OD1 3.28Å; R1417-D1419 WeakPolarHBondContact CB-OD1 3.26Å; R1417-D1419 WeakPolarHBondContact CG-OD1 3.43Å; R1417-D1419 IonicContact CZ-OD2 3.62Å; R1417-D1419 IonicContact NE-OD1 3.33Å; R1417-D1419 PolarHBondContact NE-OD1 3.23Å; R1417-D1419 IonicContact NE-OD2 3.22Å; R1417-D1419 PolarHBondContact NE-OD2 3.04Å; R1417-D1419 IonicContact NH2-OD2 3.19Å; R1417-D1419 PolarHBondContact NH2-OD2 3.29Å; R1417-D1419 PolarHBondContact O-N 3.07Å; R1417-G1420 PolarHBondContact O-N 3.03Å; R1417-S1421 WeakPolarHBondContact CB-OG 3.34Å; R1417-S1421 PolarHBondContact N-O 3.09Å; R1417-M1453 HydrophobicContact CB-CE 4.49Å; R1417-M1453 HydrophobicContact CG-CE 4.24Å; R1417-M1453 HydrophobicContact CG-SD 4.35Å
1418	N	75.3	Confident	84.7	Confident	150.6 Å²	150.6	40.1 Å²	40.1	81%	0.805	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-22.8	179.7	-62.3	-7.1	0	0	0	114.2	G1420 E1454	N1418-G1420 VanDerWaalsContact C-N 3.27Å; N1418-G1420 PolarHBondContact O-N 3.13Å; N1418-G1420 VanDerWaalsContact O-N 3.14Å; N1418-E1454 PolarHBondContact ND2-OE1 3.48Å
1419	D	75.1	Confident	84.6	Confident	93 Å²	93	40.3 Å²	40.3	50%	0.497	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	10.4	175.9	9	-10.9	0	0	0	113.7	R1417 S1421	R1417-D1419 VanDerWaalsContact CB-OD1 3.28Å; R1417-D1419 WeakPolarHBondContact CB-OD1 3.26Å; R1417-D1419 WeakPolarHBondContact CG-OD1 3.43Å; R1417-D1419 IonicContact CZ-OD2 3.62Å; R1417-D1419 IonicContact NE-OD1 3.33Å; R1417-D1419 PolarHBondContact NE-OD1 3.23Å; R1417-D1419 IonicContact NE-OD2 3.22Å; R1417-D1419 PolarHBondContact NE-OD2 3.04Å; R1417-D1419 IonicContact NH2-OD2 3.19Å; R1417-D1419 PolarHBondContact NH2-OD2 3.29Å; R1417-D1419 PolarHBondContact O-N 3.07Å; D1419-S1421 VanDerWaalsContact C-N 3.28Å; D1419-S1421 VanDerWaalsContact CG-OG 3.24Å; D1419-S1421 PolarHBondContact O-N 3.04Å; D1419-S1421 VanDerWaalsContact OD1-CB 3.3Å; D1419-S1421 WeakPolarHBondContact OD1-CB 3.36Å; D1419-S1421 PolarHBondContact OD1-N 3.06Å; D1419-S1421 PolarHBondContact OD1-OG 3.22Å; D1419-S1421 PolarHBondContact OD2-OG 2.96Å
1420	G	75.8	Confident	84.7	Confident	22.6 Å²	22.6	43.6 Å²	43.6	23%	0.233	20%	0.202	C	C	.	.	S	Bend	trans	74.5	4.9	-175.8	0	0	0	0	0	114.6	R1417 N1418	R1417-G1420 PolarHBondContact O-N 3.03Å; N1418-G1420 VanDerWaalsContact C-N 3.27Å; N1418-G1420 PolarHBondContact O-N 3.13Å; N1418-G1420 VanDerWaalsContact O-N 3.14Å
1421	S	83.9	Confident	84.8	Confident	2.2 Å²	2.2	43.5 Å²	43.5	2%	0.015	20%	0.201	C	C	.	.			trans	-70.4	138.2	177	30.7	0	0	0	0	111.6	Q1236 I1237 F1416 R1417 D1419	Q1236-S1421 PolarHBondContact NE2-OG 2.91Å; I1237-S1421 CarbonylContact O-C 3.54Å; I1237-S1421 WeakPolarHBondContact O-CA 3.32Å; I1237-S1421 WeakPolarHBondContact O-CB 3.42Å; F1416-S1421 WeakPolarHBondContact CA-O 3.31Å; R1417-S1421 WeakPolarHBondContact CB-OG 3.34Å; R1417-S1421 PolarHBondContact N-O 3.09Å; D1419-S1421 VanDerWaalsContact C-N 3.28Å; D1419-S1421 VanDerWaalsContact CG-OG 3.24Å; D1419-S1421 PolarHBondContact O-N 3.04Å; D1419-S1421 VanDerWaalsContact OD1-CB 3.3Å; D1419-S1421 WeakPolarHBondContact OD1-CB 3.36Å; D1419-S1421 PolarHBondContact OD1-N 3.06Å; D1419-S1421 PolarHBondContact OD1-OG 3.22Å; D1419-S1421 PolarHBondContact OD2-OG 2.96Å
1422	V	84.3	Confident	85.1	Confident	12.2 Å²	12.2	46.4 Å²	46.4	7%	0.074	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.9	179.4	165.8	0	0	0	0	110.2	Q1236 I1237 Q1242 R1324 F1416 L1424	Q1236-V1422 WeakPolarHBondContact CA-O 3.47Å; I1237-V1422 HydrophobicContact CB-CB 4.45Å; I1237-V1422 PolarHBondContact N-O 3.11Å; I1237-V1422 PolarHBondContact O-N 3.14Å; Q1242-V1422 HydrophobicContact CG-CG2 4.44Å; R1324-V1422 HydrophobicContact CG-CG1 4.45Å; R1324-V1422 VanDerWaalsContact CZ-CG1 3.45Å; R1324-V1422 VanDerWaalsContact NE-CG1 3.34Å; R1324-V1422 VanDerWaalsContact NH1-CG1 3.35Å; F1416-V1422 HydrophobicContact CD1-CG2 4.12Å; F1416-V1422 HydrophobicContact CE1-CG2 4.12Å; V1422-L1424 HydrophobicContact CG1-CD2 4.11Å
1423	L	86.9	Confident	85.5	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.3	179.3	-51.5	174.4	0	0	0	108.9	P1235 Q1236 R1324 Y1412 S1414 F1415 R1425 L1452	P1235-L1423 CarbonylContact O-C 3.54Å; P1235-L1423 VanDerWaalsContact O-CA 3.3Å; P1235-L1423 WeakPolarHBondContact O-CA 3.27Å; Q1236-L1423 HydrophobicContact CB-CD2 4Å; Q1236-L1423 HydrophobicContact CG-CD2 3.85Å; R1324-L1423 PolarHBondContact NH1-O 3.06Å; R1324-L1423 PolarHBondContact NH2-O 2.82Å; Y1412-L1423 HydrophobicContact CD1-CD1 4.04Å; Y1412-L1423 HydrophobicContact CD1-CD2 4.21Å; Y1412-L1423 HydrophobicContact CD2-CB 4.27Å; Y1412-L1423 HydrophobicContact CD2-CD1 4.4Å; Y1412-L1423 HydrophobicContact CD2-CD2 3.77Å; Y1412-L1423 HydrophobicContact CD2-CG 4.36Å; Y1412-L1423 HydrophobicContact CE1-CD2 4.21Å; Y1412-L1423 HydrophobicContact CE2-CD2 3.8Å; Y1412-L1423 HydrophobicContact CG-CB 4.39Å; Y1412-L1423 HydrophobicContact CG-CD1 3.85Å; Y1412-L1423 HydrophobicContact CG-CD2 3.99Å; Y1412-L1423 HydrophobicContact CG-CG 4.3Å; S1414-L1423 WeakPolarHBondContact O-CB 3.29Å; S1414-L1423 WeakPolarHBondContact O-CD1 3.37Å; S1414-L1423 VanDerWaalsContact OG-CD1 3.27Å; S1414-L1423 WeakPolarHBondContact OG-CD1 3.35Å; F1415-L1423 WeakPolarHBondContact O-CB 3.36Å; F1415-L1423 PolarHBondContact O-N 3.13Å; L1423-R1425 PolarHBondContact O-N 2.92Å; L1423-L1452 HydrophobicContact CD1-CD1 4.09Å
1424	L	85.6	Confident	86.1	Confident	36 Å²	36	46.7 Å²	46.7	19%	0.188	21%	0.213	C	C	.	.			trans	-80.2	65.4	-175.8	-65	-176.8	0	0	0	111.6	Y1187 R1212 P1235 I1237 V1422	Y1187-L1424 HydrophobicContact CD1-CD1 4.22Å; Y1187-L1424 HydrophobicContact CE1-CD1 3.89Å; Y1187-L1424 HydrophobicContact CE1-CD2 3.98Å; R1212-L1424 HydrophobicContact CB-CD1 4.43Å; R1212-L1424 VanDerWaalsContact O-CD1 3.26Å; R1212-L1424 WeakPolarHBondContact O-CD1 3.39Å; P1235-L1424 HydrophobicContact CB-CB 3.98Å; P1235-L1424 PolarHBondContact O-N 3.17Å; I1237-L1424 HydrophobicContact CD1-CD1 3.48Å; I1237-L1424 VanDerWaalsContact CD1-CD1 3.48Å; I1237-L1424 HydrophobicContact CD1-CD2 4.2Å; I1237-L1424 HydrophobicContact CD1-CG 3.91Å; I1237-L1424 HydrophobicContact CG1-CD1 4.15Å; I1237-L1424 HydrophobicContact CG1-CG 4.36Å; V1422-L1424 HydrophobicContact CG1-CD2 4.11Å
1425	R	87.1	Confident	86.7	Confident	16.6 Å²	16.6	50.8 Å²	50.8	6%	0.063	23%	0.23	C	C	.	.			trans	-78.4	135.1	174.6	-134.4	175.6	140	-124.9	-20.6	110.3	I1352 Y1412 S1413 S1414 F1415 L1423 S1459 P1460 A1462 A1491 N1492	I1352-R1425 HydrophobicContact CG2-CB 3.96Å; Y1412-R1425 VanDerWaalsContact O-CD 3.32Å; Y1412-R1425 WeakPolarHBondContact O-CD 3.32Å; Y1412-R1425 PolarHBondContact O-NE 2.9Å; S1413-R1425 VanDerWaalsContact O-CZ 3.28Å; S1413-R1425 PolarHBondContact O-NH1 3.05Å; S1414-R1425 WeakPolarHBondContact O-CD 3.31Å; F1415-R1425 HydrophobicContact CD1-CB 4.2Å; F1415-R1425 HydrophobicContact CE1-CB 4.06Å; F1415-R1425 HydrophobicContact CE1-CG 4.28Å; L1423-R1425 PolarHBondContact O-N 2.92Å; R1425-S1459 PolarHBondContact NH1-OG 2.81Å; R1425-P1460 VanDerWaalsContact CZ-O 3.27Å; R1425-P1460 PolarHBondContact NH1-O 3.26Å; R1425-P1460 VanDerWaalsContact NH1-O 3.11Å; R1425-P1460 PolarHBondContact NH2-O 2.89Å; R1425-P1460 VanDerWaalsContact NH2-O 3.09Å; R1425-A1462 HydrophobicContact CG-CB 4.28Å; R1425-A1462 VanDerWaalsContact NH2-CB 3.33Å; R1425-A1462 VanDerWaalsContact NH2-N 3.16Å; R1425-A1491 VanDerWaalsContact CZ-CB 3.49Å; R1425-A1491 VanDerWaalsContact NH2-C 3.34Å; R1425-A1491 VanDerWaalsContact NH2-CB 3.31Å; R1425-A1491 PolarHBondContact NH2-O 3.14Å; R1425-N1492 PolarHBondContact NE-OD1 3.24Å; R1425-N1492 PolarHBondContact NH2-OD1 3.05Å
1426	R	86.3	Confident	87.3	Confident	32.4 Å²	32.4	50.2 Å²	50.2	12%	0.122	23%	0.227	C	C	.	.			trans	-125.4	150.1	178.8	-133.1	-177.6	-178.1	162.1	1.7	110.2	P1355 D1391 R1428 A1462	P1355-R1426 VanDerWaalsContact CD-CZ 3.47Å; P1355-R1426 VanDerWaalsContact CG-CZ 3.48Å; D1391-R1426 IonicContact OD1-CZ 3.48Å; D1391-R1426 IonicContact OD1-NE 3.3Å; D1391-R1426 PolarHBondContact OD1-NE 2.97Å; D1391-R1426 VanDerWaalsContact OD1-NE 3.17Å; D1391-R1426 IonicContact OD1-NH1 2.71Å; D1391-R1426 IonicContact OD1-NH2 3.37Å; D1391-R1426 PolarHBondContact OD1-NH2 3.39Å; R1426-R1428 WeakPolarHBondContact CB-O 3.34Å; R1426-R1428 VanDerWaalsContact CD-O 3.26Å; R1426-R1428 WeakPolarHBondContact CD-O 3.44Å; R1426-R1428 WeakPolarHBondContact CG-O 3.41Å; R1426-R1428 PolarHBondContact O-N 3.01Å; R1426-R1428 VanDerWaalsContact O-N 3.15Å; R1426-A1462 VanDerWaalsContact O-CB 3.3Å; R1426-A1462 WeakPolarHBondContact O-CB 3.37Å
1427	R	86.2	Confident	88	Confident	125.6 Å²	125.6	53.6 Å²	53.6	47%	0.474	24%	0.24	S	C	.	.	S	Bend	trans	-54.7	-38.2	179	-173.7	172.7	-178.7	167.6	-0.3	113.2	I1352 E1353 A1462 E1463	I1352-R1427 HydrophobicContact CB-CB 4.49Å; I1352-R1427 HydrophobicContact CD1-CB 4.06Å; I1352-R1427 HydrophobicContact CD1-CG 4.25Å; I1352-R1427 HydrophobicContact CG1-CB 4.26Å; I1352-R1427 VanDerWaalsContact CG1-N 3.27Å; I1352-R1427 PolarHBondContact O-N 3.1Å; I1352-R1427 VanDerWaalsContact O-N 3.09Å; E1353-R1427 IonicContact OE1-CZ 3.62Å; E1353-R1427 IonicContact OE1-NE 3.36Å; E1353-R1427 IonicContact OE1-NH1 3.15Å; E1353-R1427 PolarHBondContact OE1-NH1 3.26Å; E1353-R1427 WeakPolarHBondContact OE2-CD 3.43Å; E1353-R1427 IonicContact OE2-NH1 3.82Å; E1353-R1427 PolarHBondContact OE2-NH1 3.05Å; R1427-A1462 WeakPolarHBondContact O-CA 3.44Å; R1427-E1463 PolarHBondContact O-N 2.96Å
1428	R	87.7	Confident	88.8	Confident	127.4 Å²	127.4	48.4 Å²	48.4	48%	0.481	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134	174.6	-68.3	-179	175.3	144.4	2	109.8	D1391 R1426 E1463	D1391-R1428 HydrophobicContact CB-CB 4.47Å; R1426-R1428 WeakPolarHBondContact CB-O 3.34Å; R1426-R1428 VanDerWaalsContact CD-O 3.26Å; R1426-R1428 WeakPolarHBondContact CD-O 3.44Å; R1426-R1428 WeakPolarHBondContact CG-O 3.41Å; R1426-R1428 PolarHBondContact O-N 3.01Å; R1426-R1428 VanDerWaalsContact O-N 3.15Å; R1428-E1463 CarbonylContact C-O 3.56Å; R1428-E1463 WeakPolarHBondContact CA-O 3.32Å; R1428-E1463 HydrophobicContact CG-CB 4.41Å; R1428-E1463 IonicContact NE-OE2 3.18Å; R1428-E1463 PolarHBondContact NE-OE2 2.97Å
1429	S	90	Very high	89.8	Confident	6.4 Å²	6.4	42.6 Å²	42.6	5%	0.045	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	126.5	174.2	-49.2	0	0	0	0	109.3	E1463 V1464 A1465	S1429-E1463 PolarHBondContact N-O 2.94Å; S1429-V1464 CarbonylContact O-C 3.56Å; S1429-V1464 WeakPolarHBondContact O-CA 3.39Å; S1429-A1465 PolarHBondContact O-N 3.06Å
1430	K	93.3	Very high	90.6	Very high	68.2 Å²	68.2	39.5 Å²	39.5	30%	0.297	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.7	-178.7	-61.5	-178.7	177.4	173.9	0	111.1	D1391 F1392 V1393 A1465 L1467	D1391-K1430 PolarHBondContact O-N 3.01Å; D1391-K1430 VanDerWaalsContact O-N 3.14Å; F1392-K1430 CarbonylContact C-O 3.52Å; F1392-K1430 WeakPolarHBondContact CA-O 3.32Å; F1392-K1430 HydrophobicContact CB-CB 3.82Å; F1392-K1430 HydrophobicContact CB-CD 4.03Å; F1392-K1430 HydrophobicContact CB-CG 3.98Å; F1392-K1430 WeakPolarHBondContact CB-O 3.44Å; V1393-K1430 PolarHBondContact N-O 3.04Å; K1430-A1465 CarbonylContact C-O 3.46Å; K1430-A1465 WeakPolarHBondContact CA-O 3.36Å; K1430-A1465 HydrophobicContact CB-CB 4.28Å; K1430-A1465 HydrophobicContact CG-CB 4.04Å; K1430-L1467 HydrophobicContact CB-CD1 4.25Å; K1430-L1467 HydrophobicContact CD-CD1 4.15Å; K1430-L1467 HydrophobicContact CG-CD1 3.41Å; K1430-L1467 VanDerWaalsContact CG-CD1 3.41Å
1431	L	94.9	Very high	91.3	Very high	3.2 Å²	3.2	38.5 Å²	38.5	2%	0.017	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	111.5	169.8	-70.3	101.9	0	0	0	107.8	Y1233 V1393 L1407 F1433 A1465 Y1466 L1467	Y1233-L1431 HydrophobicContact CD1-CD1 4.36Å; Y1233-L1431 HydrophobicContact CD2-CD2 4.21Å; Y1233-L1431 HydrophobicContact CG-CD1 4.33Å; Y1233-L1431 HydrophobicContact CG-CD2 4.36Å; V1393-L1431 HydrophobicContact CB-CD2 3.66Å; V1393-L1431 HydrophobicContact CB-CG 4.43Å; V1393-L1431 HydrophobicContact CG1-CD2 4.47Å; V1393-L1431 HydrophobicContact CG2-CD2 3.7Å; L1407-L1431 HydrophobicContact CD1-CD2 4.16Å; L1407-L1431 HydrophobicContact CD2-CD1 4.29Å; L1407-L1431 HydrophobicContact CD2-CD2 4.16Å; L1431-F1433 HydrophobicContact CB-CE2 4.12Å; L1431-F1433 HydrophobicContact CB-CZ 4.5Å; L1431-A1465 PolarHBondContact N-O 3.09Å; L1431-Y1466 HydrophobicContact CB-CD1 4.05Å; L1431-Y1466 HydrophobicContact CB-CE1 4.17Å; L1431-Y1466 HydrophobicContact CD1-CD1 4.17Å; L1431-Y1466 HydrophobicContact CD1-CE1 4.09Å; L1431-Y1466 HydrophobicContact CD2-CE1 4.04Å; L1431-Y1466 HydrophobicContact CG-CE1 4.39Å; L1431-Y1466 WeakPolarHBondContact O-CA 3.41Å; L1431-L1467 PolarHBondContact O-N 3.02Å
1432	W	95.7	Very high	91.5	Very high	71.6 Å²	71.6	44.6 Å²	44.6	27%	0.271	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.6	-172.7	-176.4	16.5	0	0	0	111.4	V1393 H1394 V1395 L1467	V1393-W1432 PolarHBondContact O-N 3.07Å; H1394-W1432 CarbonylContact C-O 3.52Å; H1394-W1432 WeakPolarHBondContact CA-O 3.32Å; H1394-W1432 HydrophobicContact CB-CE3 4.39Å; H1394-W1432 AromaticContact CD2-CD2 3.55Å; H1394-W1432 VanDerWaalsContact CD2-CD2 3.44Å; H1394-W1432 AromaticContact CD2-CE3 3.5Å; H1394-W1432 VanDerWaalsContact CD2-CE3 3.43Å; H1394-W1432 AromaticContact CD2-CG 3.88Å; H1394-W1432 AromaticContact CD2-CZ3 3.99Å; H1394-W1432 AromaticContact CE1-CE3 3.99Å; H1394-W1432 AromaticContact CE1-CZ3 3.79Å; H1394-W1432 AromaticContact CG-CE3 3.82Å; H1394-W1432 AromaticContact NE2-CD2 3.74Å; H1394-W1432 AromaticContact NE2-CE2 3.84Å; H1394-W1432 AromaticContact NE2-CE3 3.67Å; H1394-W1432 AromaticContact NE2-CH2 3.91Å; H1394-W1432 AromaticContact NE2-CZ2 3.9Å; H1394-W1432 AromaticContact NE2-CZ3 3.82Å; V1395-W1432 PolarHBondContact N-O 3.21Å; W1432-L1467 CarbonylContact C-O 3.57Å; W1432-L1467 WeakPolarHBondContact CA-O 3.35Å; W1432-L1467 HydrophobicContact CB-CB 4.21Å; W1432-L1467 HydrophobicContact CB-CD1 4.07Å; W1432-L1467 HydrophobicContact CG-CB 4.07Å; W1432-L1467 HydrophobicContact CG-CD1 4.11Å
1433	F	96.4	Very high	91.5	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.009	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.6	173.2	-58.2	-84.2	0	0	0	108.9	I1231 V1395 I1400 L1407 L1431 T1436 F1438 L1467 D1469 C1471	I1231-F1433 HydrophobicContact CD1-CE1 4.34Å; V1395-F1433 HydrophobicContact CB-CD1 3.68Å; V1395-F1433 HydrophobicContact CB-CE1 3.98Å; V1395-F1433 HydrophobicContact CG1-CD1 4.08Å; V1395-F1433 HydrophobicContact CG1-CE1 4.38Å; V1395-F1433 HydrophobicContact CG2-CD1 3.96Å; V1395-F1433 HydrophobicContact CG2-CE1 3.71Å; V1395-F1433 HydrophobicContact CG2-CZ 4.48Å; V1395-F1433 CarbonylContact O-C 3.55Å; V1395-F1433 WeakPolarHBondContact O-CA 3.33Å; I1400-F1433 HydrophobicContact CD1-CE1 4.46Å; L1407-F1433 HydrophobicContact CB-CZ 4.39Å; L1407-F1433 HydrophobicContact CD1-CZ 4Å; L1407-F1433 HydrophobicContact CD2-CE2 3.61Å; L1407-F1433 HydrophobicContact CD2-CZ 3.43Å; L1407-F1433 VanDerWaalsContact CD2-CZ 3.44Å; L1407-F1433 HydrophobicContact CG-CZ 4.16Å; L1431-F1433 HydrophobicContact CB-CE2 4.12Å; L1431-F1433 HydrophobicContact CB-CZ 4.5Å; F1433-T1436 HydrophobicContact CB-CG2 4.22Å; F1433-T1436 HydrophobicContact CD1-CG2 4.39Å; F1433-F1438 HydrophobicContact CB-CE2 4.48Å; F1433-F1438 HydrophobicContact CD1-CE2 4.41Å; F1433-F1438 AromaticContact CD1-CZ 3.84Å; F1433-F1438 HydrophobicContact CD1-CZ 3.84Å; F1433-F1438 HydrophobicContact CE1-CZ 4.19Å; F1433-F1438 HydrophobicContact CG-CE2 4.45Å; F1433-F1438 HydrophobicContact CG-CZ 4.17Å; F1433-L1467 PolarHBondContact N-O 3.11Å; F1433-D1469 PolarHBondContact O-N 3Å; F1433-C1471 PolarHBondContact O-SG 3.11Å
1434	Q	96.3	Very high	91.6	Very high	31.4 Å²	31.4	46.2 Å²	46.2	15%	0.147	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	126	179.8	-172.7	174.2	42.2	0	0	110.1	H1394 V1395 R1396 S1397 T1436 D1469	H1394-Q1434 PolarHBondContact NE2-OE1 3.2Å; H1394-Q1434 VanDerWaalsContact NE2-OE1 3.15Å; V1395-Q1434 PolarHBondContact O-N 3.26Å; R1396-Q1434 CarbonylContact C-O 3.53Å; R1396-Q1434 VanDerWaalsContact CA-O 3.26Å; R1396-Q1434 WeakPolarHBondContact CA-O 3.24Å; R1396-Q1434 HydrophobicContact CG-CB 4.39Å; R1396-Q1434 HydrophobicContact CG-CG 4.5Å; S1397-Q1434 PolarHBondContact N-O 3.05Å; Q1434-T1436 PolarHBondContact O-N 3.23Å; Q1434-T1436 VanDerWaalsContact O-N 3.13Å; Q1434-T1436 PolarHBondContact O-OG1 3.37Å; Q1434-D1469 CarbonylContact C-O 3.55Å; Q1434-D1469 VanDerWaalsContact CA-O 3.28Å; Q1434-D1469 WeakPolarHBondContact CA-O 3.33Å; Q1434-D1469 HydrophobicContact CG-CB 4.42Å; Q1434-D1469 WeakPolarHBondContact CG-OD2 3.34Å; Q1434-D1469 PolarHBondContact NE2-OD2 3.28Å; Q1434-D1469 VanDerWaalsContact NE2-OD2 3.08Å
1435	K	96.6	Very high	91.9	Very high	92.6 Å²	92.6	44.6 Å²	44.6	40%	0.403	19%	0.191	S	C	.	.	S	Bend	trans	53	37.5	179.7	-61.1	179.2	-179.4	-176.8	0	112.7	S1397 D1469 N1470	S1397-K1435 VanDerWaalsContact CA-O 3.26Å; S1397-K1435 WeakPolarHBondContact CA-O 3.22Å; S1397-K1435 PolarHBondContact N-O 3.23Å; K1435-D1469 PolarHBondContact N-O 3Å; K1435-N1470 VanDerWaalsContact CA-O 3.24Å; K1435-N1470 WeakPolarHBondContact CA-O 3.39Å; K1435-N1470 HydrophobicContact CG-CB 4.26Å; K1435-N1470 PolarHBondContact N-O 3.16Å
1436	T	96.3	Very high	92.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	19%	0.188	C	C	.	.			trans	-99.7	140.4	-177.5	-49.8	0	0	0	0	110.8	V1395 S1398 I1400 F1433 Q1434 F1438 C1471 S1472	V1395-T1436 HydrophobicContact CG1-CG2 4.39Å; V1395-T1436 PolarHBondContact O-OG1 2.99Å; S1398-T1436 CarbonylContact O-C 3.59Å; S1398-T1436 VanDerWaalsContact O-CA 3.31Å; S1398-T1436 WeakPolarHBondContact O-CA 3.28Å; S1398-T1436 WeakPolarHBondContact O-CG2 3.31Å; I1400-T1436 HydrophobicContact CD1-CG2 4.17Å; I1400-T1436 HydrophobicContact CG1-CG2 4.32Å; F1433-T1436 HydrophobicContact CB-CG2 4.22Å; F1433-T1436 HydrophobicContact CD1-CG2 4.39Å; Q1434-T1436 PolarHBondContact O-N 3.23Å; Q1434-T1436 VanDerWaalsContact O-N 3.13Å; Q1434-T1436 PolarHBondContact O-OG1 3.37Å; T1436-F1438 HydrophobicContact CG2-CD2 4.25Å; T1436-F1438 HydrophobicContact CG2-CE1 4.48Å; T1436-F1438 HydrophobicContact CG2-CE2 3.8Å; T1436-F1438 HydrophobicContact CG2-CZ 4.03Å; T1436-F1438 VanDerWaalsContact OG1-CE2 3.29Å; T1436-F1438 WeakPolarHBondContact OG1-CE2 3.12Å; T1436-C1471 PolarHBondContact N-SG 2.95Å; T1436-C1471 VanDerWaalsContact N-SG 3.44Å; T1436-C1471 WeakPolarHBondContact O-CA 3.41Å; T1436-C1471 WeakPolarHBondContact O-CB 3.38Å; T1436-C1471 PolarHBondContact OG1-SG 3.06Å; T1436-S1472 PolarHBondContact O-N 3.02Å
1437	Y	96.1	Very high	92.5	Very high	119.2 Å²	119.2	43.4 Å²	43.4	47%	0.467	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	114.1	179.1	-57.7	-87.1	0	0	0	110.3	S1398 I1400 S1472	S1398-Y1437 PolarHBondContact O-N 3.1Å; I1400-Y1437 PolarHBondContact N-O 3Å; Y1437-S1472 CarbonylContact C-O 3.57Å; Y1437-S1472 WeakPolarHBondContact CA-O 3.41Å
1438	F	95.5	Very high	92.7	Very high	1.2 Å²	1.2	37.4 Å²	37.4	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	109.6	171.2	-65.7	-87.7	0	0	0	109.3	I1400 F1433 T1436 V1445 S1472 V1473 S1474 N1476	I1400-F1438 HydrophobicContact CB-CD1 3.94Å; I1400-F1438 HydrophobicContact CB-CE1 4.16Å; I1400-F1438 HydrophobicContact CD1-CD1 4.27Å; I1400-F1438 HydrophobicContact CD1-CE1 3.59Å; I1400-F1438 HydrophobicContact CD1-CZ 4.07Å; I1400-F1438 HydrophobicContact CG1-CE1 4.38Å; I1400-F1438 HydrophobicContact CG2-CD1 4.14Å; I1400-F1438 HydrophobicContact CG2-CE1 4.33Å; I1400-F1438 WeakPolarHBondContact O-CA 3.39Å; F1433-F1438 HydrophobicContact CB-CE2 4.48Å; F1433-F1438 HydrophobicContact CD1-CE2 4.41Å; F1433-F1438 AromaticContact CD1-CZ 3.84Å; F1433-F1438 HydrophobicContact CD1-CZ 3.84Å; F1433-F1438 HydrophobicContact CE1-CZ 4.19Å; F1433-F1438 HydrophobicContact CG-CE2 4.45Å; F1433-F1438 HydrophobicContact CG-CZ 4.17Å; T1436-F1438 HydrophobicContact CG2-CD2 4.25Å; T1436-F1438 HydrophobicContact CG2-CE1 4.48Å; T1436-F1438 HydrophobicContact CG2-CE2 3.8Å; T1436-F1438 HydrophobicContact CG2-CZ 4.03Å; T1436-F1438 VanDerWaalsContact OG1-CE2 3.29Å; T1436-F1438 WeakPolarHBondContact OG1-CE2 3.12Å; F1438-V1445 HydrophobicContact CB-CG1 3.79Å; F1438-V1445 HydrophobicContact CD1-CG1 3.69Å; F1438-V1445 VanDerWaalsContact CD1-CG1 3.43Å; F1438-V1445 HydrophobicContact CD2-CG1 4.22Å; F1438-V1445 HydrophobicContact CE1-CG1 4.28Å; F1438-V1445 HydrophobicContact CG-CG1 3.65Å; F1438-V1445 VanDerWaalsContact CG-CG1 3.46Å; F1438-S1472 PolarHBondContact N-O 3.09Å; F1438-V1473 HydrophobicContact CB-CG1 4.4Å; F1438-V1473 HydrophobicContact CB-CG2 4.23Å; F1438-V1473 HydrophobicContact CD2-CG2 4.03Å; F1438-V1473 HydrophobicContact CG-CG2 4.49Å; F1438-V1473 WeakPolarHBondContact O-CA 3.24Å; F1438-S1474 PolarHBondContact O-N 2.99Å; F1438-N1476 PolarHBondContact O-ND2 2.99Å
1439	T	94.9	Very high	92.6	Very high	30.2 Å²	30.2	32.3 Å²	32.3	19%	0.185	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	130.9	-174.2	68.9	0	0	0	0	114.4	I1400 R1401 Q1402 N1441 S1474 N1476	I1400-T1439 PolarHBondContact O-N 2.97Å; I1400-T1439 VanDerWaalsContact O-N 3.13Å; R1401-T1439 CarbonylContact C-O 3.54Å; R1401-T1439 WeakPolarHBondContact CA-O 3.42Å; R1401-T1439 WeakPolarHBondContact CB-O 3.38Å; R1401-T1439 WeakPolarHBondContact CB-OG1 3.42Å; R1401-T1439 VanDerWaalsContact CD-OG1 3.24Å; R1401-T1439 WeakPolarHBondContact CD-OG1 3.3Å; R1401-T1439 WeakPolarHBondContact CG-OG1 3.27Å; R1401-T1439 PolarHBondContact NE-OG1 2.88Å; Q1402-T1439 PolarHBondContact N-O 3.03Å; T1439-N1441 VanDerWaalsContact C-N 3.27Å; T1439-N1441 PolarHBondContact O-N 2.9Å; T1439-S1474 VanDerWaalsContact CA-O 3.26Å; T1439-S1474 WeakPolarHBondContact CA-O 3.32Å; T1439-S1474 WeakPolarHBondContact CG2-OG 3.41Å; T1439-N1476 PolarHBondContact N-OD1 2.81Å
1440	G	92	Very high	92.3	Very high	28 Å²	28	32.3 Å²	32.3	29%	0.289	15%	0.147	S	C	.	.	S	Bend	trans	67.9	18.9	172.1	0	0	0	0	0	115.4	Q1402 S1474 F1475 N1476	Q1402-G1440 VanDerWaalsContact CA-O 3.3Å; Q1402-G1440 WeakPolarHBondContact CA-O 3.34Å; G1440-S1474 PolarHBondContact N-O 2.89Å; G1440-F1475 WeakPolarHBondContact CA-O 3.33Å; G1440-F1475 PolarHBondContact N-O 3.07Å; G1440-N1476 PolarHBondContact N-OD1 3.2Å
1441	N	92.3	Very high	91.4	Very high	0.6 Å²	0.6	30.8 Å²	30.8	0%	0.003	14%	0.144	C	C	.	.			trans	-70.9	143.3	175.2	-58.9	-73.2	0	0	0	109.9	I1400 N1403 T1439 N1476 N1477	I1400-N1441 PolarHBondContact O-ND2 3.05Å; N1403-N1441 WeakPolarHBondContact CB-OD1 3.32Å; N1403-N1441 PolarHBondContact N-OD1 3.17Å; N1403-N1441 VanDerWaalsContact N-OD1 3.13Å; N1403-N1441 PolarHBondContact ND2-OD1 2.87Å; N1403-N1441 CarbonylContact O-C 3.46Å; N1403-N1441 VanDerWaalsContact O-CA 3.24Å; N1403-N1441 WeakPolarHBondContact O-CA 3.33Å; N1403-N1441 WeakPolarHBondContact O-CB 3.29Å; T1439-N1441 VanDerWaalsContact C-N 3.27Å; T1439-N1441 PolarHBondContact O-N 2.9Å; N1441-N1476 WeakPolarHBondContact CB-OD1 3.42Å; N1441-N1476 PolarHBondContact N-OD1 2.89Å; N1441-N1476 PolarHBondContact ND2-OD1 2.95Å; N1441-N1477 PolarHBondContact O-N 2.94Å
1442	R	86.8	Confident	90.3	Very high	130.4 Å²	130.4	33.5 Å²	33.5	49%	0.492	16%	0.158	S	C	.	.	S	Bend	trans	-89.6	-27.7	-162.3	-62.3	-178.7	-160.4	169.2	-0.3	115.9	E1227 N1403 Q1404 N1477 E1863	E1227-R1442 PolarHBondContact O-NH2 3.11Å; E1227-R1442 VanDerWaalsContact O-NH2 3.12Å; N1403-R1442 PolarHBondContact O-N 3.11Å; Q1404-R1442 PolarHBondContact O-N 3.04Å; R1442-N1477 CarbonylContact C-O 3.42Å; R1442-N1477 VanDerWaalsContact O-CB 3.28Å; R1442-N1477 WeakPolarHBondContact O-CB 3.43Å; R1442-N1477 VanDerWaalsContact O-CG 3.29Å; R1442-N1477 PolarHBondContact O-ND2 3.02Å; R1442-N1477 VanDerWaalsContact O-O 3.06Å; R1442-E1863 IonicContact CZ-OE2 3.78Å; R1442-E1863 IonicContact NH1-OE2 3.75Å; R1442-E1863 PolarHBondContact NH1-OE2 3.09Å
1443	Q	84.5	Confident	88.9	Confident	46.4 Å²	46.4	33 Å²	33	22%	0.217	16%	0.16	C	C	.	.	S	Bend	trans	-129.6	-38.4	-174.4	-73.6	-178.1	-6	0	0	115	Q1404 Y1405 N1477 G1478 S1479 H1869 Y1875	Q1404-Q1443 VanDerWaalsContact CD-OE1 3.27Å; Q1404-Q1443 HydrophobicContact CG-CB 4.2Å; Q1404-Q1443 VanDerWaalsContact CG-CD 3.42Å; Q1404-Q1443 HydrophobicContact CG-CG 4.05Å; Q1404-Q1443 VanDerWaalsContact CG-OE1 3.28Å; Q1404-Q1443 VanDerWaalsContact NE2-CD 3.26Å; Q1404-Q1443 VanDerWaalsContact NE2-NE2 3.17Å; Q1404-Q1443 WeakPolarHBondContact O-CB 3.43Å; Q1404-Q1443 PolarHBondContact O-N 3Å; Y1405-Q1443 HydrophobicContact CD1-CB 4.17Å; Y1405-Q1443 HydrophobicContact CE1-CB 3.77Å; Y1405-Q1443 VanDerWaalsContact CE1-OE1 3.28Å; Y1405-Q1443 PolarHBondContact OH-OE1 3.08Å; Y1405-Q1443 VanDerWaalsContact OH-OE1 3.12Å; Q1443-N1477 CarbonylContact C-O 3.53Å; Q1443-N1477 VanDerWaalsContact C-O 3.31Å; Q1443-N1477 VanDerWaalsContact CA-O 3.28Å; Q1443-N1477 WeakPolarHBondContact CA-O 3.25Å; Q1443-N1477 PolarHBondContact N-O 3.07Å; Q1443-N1477 VanDerWaalsContact N-O 3.11Å; Q1443-G1478 CarbonylContact O-C 3.57Å; Q1443-G1478 VanDerWaalsContact O-CA 3.3Å; Q1443-G1478 WeakPolarHBondContact O-CA 3.38Å; Q1443-S1479 PolarHBondContact O-N 3.09Å; Q1443-H1869 PolarHBondContact NE2-CE1 3.35Å; Q1443-H1869 VanDerWaalsContact NE2-CE1 3.27Å; Q1443-Y1875 PolarHBondContact O-OH 3.06Å
1444	A	88.4	Confident	87.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	150	172.2	0	0	0	0	0	111	Q1404 Y1405 G1406 W1447 S1479 I1481	Q1404-A1444 PolarHBondContact O-N 3.17Å; Y1405-A1444 CarbonylContact C-O 3.54Å; Y1405-A1444 VanDerWaalsContact CA-O 3.27Å; Y1405-A1444 WeakPolarHBondContact CA-O 3.37Å; Y1405-A1444 HydrophobicContact CD1-CB 3.81Å; Y1405-A1444 HydrophobicContact CE1-CB 4.31Å; G1406-A1444 PolarHBondContact N-O 3.02Å; A1444-W1447 HydrophobicContact CB-CB 4.27Å; A1444-S1479 CarbonylContact C-O 3.55Å; A1444-S1479 WeakPolarHBondContact CA-O 3.34Å; A1444-S1479 VanDerWaalsContact CB-O 3.28Å; A1444-S1479 WeakPolarHBondContact CB-O 3.33Å; A1444-I1481 HydrophobicContact CB-CD1 4.21Å
1445	V	92.5	Very high	86	Confident	3.6 Å²	3.6	39 Å²	39	2%	0.022	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-53.7	173.1	-179.4	0	0	0	0	109.3	G1406 L1407 F1438 V1473 N1476 S1479 V1480	G1406-V1445 CarbonylContact C-O 3.48Å; G1406-V1445 WeakPolarHBondContact CA-O 3.28Å; G1406-V1445 PolarHBondContact N-O 3.11Å; G1406-V1445 VanDerWaalsContact N-O 3.16Å; L1407-V1445 PolarHBondContact N-O 3.27Å; F1438-V1445 HydrophobicContact CB-CG1 3.79Å; F1438-V1445 HydrophobicContact CD1-CG1 3.69Å; F1438-V1445 VanDerWaalsContact CD1-CG1 3.43Å; F1438-V1445 HydrophobicContact CD2-CG1 4.22Å; F1438-V1445 HydrophobicContact CE1-CG1 4.28Å; F1438-V1445 HydrophobicContact CG-CG1 3.65Å; F1438-V1445 VanDerWaalsContact CG-CG1 3.46Å; V1445-V1473 HydrophobicContact CB-CG1 4.44Å; V1445-V1473 HydrophobicContact CG1-CG1 4.04Å; V1445-V1473 HydrophobicContact CG1-CG2 4.37Å; V1445-V1473 HydrophobicContact CG2-CG1 3.73Å; V1445-N1476 HydrophobicContact CG2-CB 3.74Å; V1445-N1476 VanDerWaalsContact CG2-CG 3.45Å; V1445-S1479 PolarHBondContact N-O 2.82Å; V1445-V1480 HydrophobicContact CB-CG1 4.46Å; V1445-V1480 HydrophobicContact CB-CG2 4.29Å; V1445-V1480 WeakPolarHBondContact CB-O 3.43Å; V1445-V1480 HydrophobicContact CG1-CG2 4.43Å
1446	I	93.6	Very high	84.7	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	125.6	174.8	-66.5	164.6	0	0	0	107.5	L1407 V1448 Y1466 I1468 V1480 I1481 E1482 W1496	L1407-I1446 HydrophobicContact CB-CB 4.45Å; L1407-I1446 HydrophobicContact CB-CG1 4.04Å; L1407-I1446 HydrophobicContact CB-CG2 4.44Å; L1407-I1446 HydrophobicContact CD2-CG1 4.18Å; L1407-I1446 HydrophobicContact CD2-CG2 3.92Å; L1407-I1446 HydrophobicContact CG-CG2 4.46Å; L1407-I1446 CarbonylContact O-C 3.43Å; L1407-I1446 WeakPolarHBondContact O-CA 3.31Å; I1446-V1448 HydrophobicContact CG2-CG2 3.94Å; I1446-Y1466 HydrophobicContact CG2-CE1 4.29Å; I1446-I1468 HydrophobicContact CD1-CD1 3.49Å; I1446-I1468 VanDerWaalsContact CD1-CD1 3.47Å; I1446-I1468 HydrophobicContact CD1-CG1 4.22Å; I1446-V1480 HydrophobicContact CB-CG1 4.08Å; I1446-V1480 HydrophobicContact CB-CG2 4.28Å; I1446-V1480 HydrophobicContact CD1-CG2 4.44Å; I1446-V1480 HydrophobicContact CG2-CG1 4.34Å; I1446-V1480 PolarHBondContact N-O 3.43Å; I1446-V1480 CarbonylContact O-C 3.58Å; I1446-V1480 WeakPolarHBondContact O-CA 3.41Å; I1446-I1481 HydrophobicContact CB-CG1 4.36Å; I1446-I1481 WeakPolarHBondContact O-CA 3.44Å; I1446-I1481 PolarHBondContact O-N 3.05Å; I1446-E1482 PolarHBondContact O-N 2.88Å; I1446-W1496 HydrophobicContact CG2-CH2 4.02Å; I1446-W1496 HydrophobicContact CG2-CZ3 4.38Å
1447	W	91.8	Very high	83.1	Confident	21.6 Å²	21.6	46.8 Å²	46.8	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.1	172.5	175.4	45.9	0	0	0	110.4	Y1405 L1407 S1408 G1409 A1444 N1449 I1481 T1483 H1484 L1867 L1868 Q1871 Y1872	Y1405-W1447 HydrophobicContact CD1-CB 4.14Å; Y1405-W1447 HydrophobicContact CD1-CE3 4.3Å; Y1405-W1447 HydrophobicContact CD1-CG 4.34Å; Y1405-W1447 HydrophobicContact CD2-CE3 4.42Å; Y1405-W1447 HydrophobicContact CE1-CB 4.34Å; Y1405-W1447 HydrophobicContact CE1-CE3 4.17Å; Y1405-W1447 HydrophobicContact CE1-CG 4.23Å; Y1405-W1447 HydrophobicContact CE2-CE3 4.2Å; Y1405-W1447 HydrophobicContact CE2-CZ3 4.26Å; Y1405-W1447 HydrophobicContact CG-CB 4.46Å; Y1405-W1447 HydrophobicContact CG-CE3 4.35Å; Y1405-W1447 AromaticContact CZ-CE3 3.93Å; L1407-W1447 PolarHBondContact O-N 3.12Å; S1408-W1447 CarbonylContact C-O 3.53Å; S1408-W1447 VanDerWaalsContact CA-O 3.29Å; S1408-W1447 WeakPolarHBondContact CA-O 3.29Å; G1409-W1447 PolarHBondContact N-O 3.25Å; A1444-W1447 HydrophobicContact CB-CB 4.27Å; W1447-N1449 HydrophobicContact CE3-CB 3.98Å; W1447-N1449 HydrophobicContact CH2-CB 3.88Å; W1447-N1449 WeakPolarHBondContact CH2-ND2 3.45Å; W1447-N1449 HydrophobicContact CZ2-CB 3.86Å; W1447-N1449 VanDerWaalsContact CZ2-ND2 3.35Å; W1447-N1449 WeakPolarHBondContact CZ2-ND2 3.4Å; W1447-N1449 HydrophobicContact CZ3-CB 3.34Å; W1447-I1481 CarbonylContact C-O 3.32Å; W1447-I1481 WeakPolarHBondContact CA-O 3.23Å; W1447-T1483 PolarHBondContact NE1-OG1 2.98Å; W1447-T1483 VanDerWaalsContact NE1-OG1 3.15Å; W1447-H1484 AromaticContact CD1-CD2 3.91Å; W1447-H1484 AromaticContact CD1-NE2 3.91Å; W1447-H1484 AromaticContact CE2-CD2 3.72Å; W1447-H1484 AromaticContact NE1-CD2 3.07Å; W1447-H1484 PolarHBondContact NE1-CD2 2.84Å; W1447-H1484 AromaticContact NE1-NE2 3.15Å; W1447-H1484 PolarHBondContact NE1-NE2 3.17Å; W1447-H1484 VanDerWaalsContact NE1-NE2 3.15Å; W1447-L1867 HydrophobicContact CH2-CB 4.1Å; W1447-L1867 HydrophobicContact CZ3-CB 4.16Å; W1447-L1868 HydrophobicContact CD2-CD1 4.02Å; W1447-L1868 HydrophobicContact CG-CD1 4.09Å; W1447-L1868 HydrophobicContact CZ2-CD1 4.07Å; W1447-Q1871 HydrophobicContact CH2-CB 3.67Å; W1447-Q1871 HydrophobicContact CH2-CG 3.3Å; W1447-Q1871 HydrophobicContact CZ2-CB 4.27Å; W1447-Q1871 HydrophobicContact CZ2-CG 3.85Å; W1447-Q1871 HydrophobicContact CZ3-CG 4.07Å; W1447-Y1872 VanDerWaalsContact CB-OH 3.27Å; W1447-Y1872 WeakPolarHBondContact CB-OH 3.49Å; W1447-Y1872 AromaticContact CD1-CE1 3.46Å; W1447-Y1872 VanDerWaalsContact CD1-CE1 3.46Å; W1447-Y1872 AromaticContact CD1-CZ 3.54Å; W1447-Y1872 AromaticContact CD2-CE1 3.93Å; W1447-Y1872 HydrophobicContact CD2-CE1 3.93Å; W1447-Y1872 AromaticContact CD2-CE2 3.56Å; W1447-Y1872 HydrophobicContact CD2-CE2 3.79Å; W1447-Y1872 AromaticContact CD2-CZ 3.13Å; W1447-Y1872 AromaticContact CE2-CE1 3.23Å; W1447-Y1872 AromaticContact CE2-CE2 3.37Å; W1447-Y1872 AromaticContact CE2-CZ 3.14Å; W1447-Y1872 VanDerWaalsContact CE2-CZ 3.4Å; W1447-Y1872 AromaticContact CE3-CE2 3.64Å; W1447-Y1872 HydrophobicContact CE3-CE2 3.64Å; W1447-Y1872 AromaticContact CE3-CZ 3.73Å; W1447-Y1872 HydrophobicContact CG-CE1 4.07Å; W1447-Y1872 HydrophobicContact CG-CE2 4.27Å; W1447-Y1872 AromaticContact CG-CZ 3.43Å; W1447-Y1872 VanDerWaalsContact CG-CZ 3.43Å; W1447-Y1872 HydrophobicContact CH2-CD2 4.15Å; W1447-Y1872 AromaticContact CH2-CE2 3.71Å; W1447-Y1872 HydrophobicContact CH2-CE2 3.71Å; W1447-Y1872 HydrophobicContact CZ2-CD1 4.1Å; W1447-Y1872 AromaticContact CZ2-CD2 3.92Å; W1447-Y1872 HydrophobicContact CZ2-CD2 4.01Å; W1447-Y1872 AromaticContact CZ2-CE1 3.66Å; W1447-Y1872 HydrophobicContact CZ2-CE1 3.66Å; W1447-Y1872 AromaticContact CZ2-CE2 3.3Å; W1447-Y1872 HydrophobicContact CZ2-CE2 3.3Å; W1447-Y1872 HydrophobicContact CZ2-CG 4.28Å; W1447-Y1872 AromaticContact CZ2-CZ 3.56Å; W1447-Y1872 AromaticContact CZ3-CE2 3.69Å; W1447-Y1872 HydrophobicContact CZ3-CE2 4.06Å; W1447-Y1872 AromaticContact NE1-CD1 3.98Å; W1447-Y1872 AromaticContact NE1-CE1 2.93Å; W1447-Y1872 AromaticContact NE1-CE2 3.87Å; W1447-Y1872 AromaticContact NE1-CZ 3.14Å; W1447-Y1872 VanDerWaalsContact NE1-CZ 3.25Å; W1447-Y1872 PolarHBondContact NE1-OH 3.07Å; W1447-Y1872 VanDerWaalsContact NE1-OH 3.12Å
1448	V	91	Very high	81.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.8	176.8	-173.6	0	0	0	0	109.4	G1409 I1446 Y1466 I1481 E1482 T1483 H1484 F1494 W1496	G1409-V1448 CarbonylContact O-C 3.47Å; G1409-V1448 WeakPolarHBondContact O-CA 3.32Å; I1446-V1448 HydrophobicContact CG2-CG2 3.94Å; V1448-Y1466 HydrophobicContact CB-CE2 4.43Å; V1448-Y1466 HydrophobicContact CG1-CE2 3.99Å; V1448-Y1466 WeakPolarHBondContact CG1-OH 3.35Å; V1448-Y1466 HydrophobicContact CG2-CD2 4.34Å; V1448-Y1466 HydrophobicContact CG2-CE1 3.95Å; V1448-Y1466 HydrophobicContact CG2-CE2 3.79Å; V1448-Y1466 VanDerWaalsContact CG2-CZ 3.42Å; V1448-Y1466 VanDerWaalsContact CG2-OH 3.28Å; V1448-Y1466 WeakPolarHBondContact CG2-OH 3.3Å; V1448-I1481 PolarHBondContact N-O 3.19Å; V1448-E1482 HydrophobicContact CB-CB 4.3Å; V1448-E1482 HydrophobicContact CB-CG 4.19Å; V1448-E1482 HydrophobicContact CG1-CG 4.36Å; V1448-E1482 PolarHBondContact N-O 3.13Å; V1448-E1482 CarbonylContact O-C 3.58Å; V1448-E1482 WeakPolarHBondContact O-CA 3.34Å; V1448-T1483 HydrophobicContact CB-CG2 4.28Å; V1448-T1483 WeakPolarHBondContact O-CA 3.32Å; V1448-T1483 PolarHBondContact O-N 3.24Å; V1448-T1483 PolarHBondContact O-OG1 2.92Å; V1448-H1484 PolarHBondContact O-N 2.96Å; V1448-F1494 HydrophobicContact CG1-CE1 4.23Å; V1448-W1496 HydrophobicContact CB-CZ2 4.47Å; V1448-W1496 HydrophobicContact CG2-CH2 3.78Å; V1448-W1496 HydrophobicContact CG2-CZ2 3.84Å
1449	N	86.3	Confident	80.8	Confident	20.8 Å²	20.8	48.7 Å²	48.7	11%	0.111	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132.5	-177.8	-169.9	18.2	0	0	0	113.3	G1409 V1410 H1411 W1447 P1451 T1483 Q1871	G1409-N1449 PolarHBondContact O-N 3.16Å; V1410-N1449 VanDerWaalsContact CA-O 3.3Å; V1410-N1449 WeakPolarHBondContact CA-O 3.38Å; V1410-N1449 HydrophobicContact CG2-CB 4.21Å; H1411-N1449 PolarHBondContact N-O 3.24Å; H1411-N1449 VanDerWaalsContact N-O 3.07Å; W1447-N1449 HydrophobicContact CE3-CB 3.98Å; W1447-N1449 HydrophobicContact CH2-CB 3.88Å; W1447-N1449 WeakPolarHBondContact CH2-ND2 3.45Å; W1447-N1449 HydrophobicContact CZ2-CB 3.86Å; W1447-N1449 VanDerWaalsContact CZ2-ND2 3.35Å; W1447-N1449 WeakPolarHBondContact CZ2-ND2 3.4Å; W1447-N1449 HydrophobicContact CZ3-CB 3.34Å; N1449-P1451 WeakPolarHBondContact O-CD 3.31Å; N1449-T1483 CarbonylContact C-O 3.57Å; N1449-T1483 VanDerWaalsContact CA-O 3.23Å; N1449-T1483 WeakPolarHBondContact CA-O 3.39Å; N1449-T1483 PolarHBondContact OD1-O 3Å; N1449-T1483 VanDerWaalsContact OD1-O 3.13Å; N1449-T1483 PolarHBondContact OD1-OG1 2.98Å; N1449-T1483 VanDerWaalsContact OD1-OG1 3.09Å; N1449-Q1871 PolarHBondContact ND2-NE2 2.75Å; N1449-Q1871 PolarHBondContact ND2-OE1 3.12Å
1450	G	82.3	Confident	80.1	Confident	5.8 Å²	5.8	49.3 Å²	49.3	6%	0.06	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	98.3	164.3	0	0	0	0	0	110.9	H1411 T1483 H1484 R1485	H1411-G1450 WeakPolarHBondContact O-CA 3.33Å; G1450-T1483 PolarHBondContact N-O 2.91Å; G1450-H1484 PolarHBondContact N-ND1 2.77Å; G1450-H1484 PolarHBondContact N-O 2.91Å; G1450-R1485 VanDerWaalsContact O-CB 3.31Å; G1450-R1485 WeakPolarHBondContact O-CB 3.43Å; G1450-R1485 PolarHBondContact O-N 3.1Å
1451	P	76.1	Confident	79.7	Confident	37.2 Å²	37.2	48.9 Å²	48.9	24%	0.242	24%	0.244	C	C	.	.			trans	-82.8	-3.6	-169.7	31.3	-36.5	0	0	0	114.8	V1410 Y1412 N1449 M1453 R1485	V1410-P1451 HydrophobicContact CG1-CG 3.8Å; Y1412-P1451 HydrophobicContact CD1-CG 3.88Å; Y1412-P1451 HydrophobicContact CE1-CG 3.5Å; Y1412-P1451 VanDerWaalsContact CE1-CG 3.44Å; N1449-P1451 WeakPolarHBondContact O-CD 3.31Å; P1451-M1453 PolarHBondContact O-N 2.97Å; P1451-M1453 VanDerWaalsContact O-N 3.17Å; P1451-R1485 VanDerWaalsContact O-CD 3.32Å; P1451-R1485 WeakPolarHBondContact O-CD 3.36Å
1452	L	71.7	Confident	79.5	Confident	60.4 Å²	60.4	48.9 Å²	48.9	32%	0.316	24%	0.244	S	C	.	.			trans	-87.5	138.4	179.7	-64.9	170.9	0	0	0	110	Y1412 S1414 L1423 D1486	Y1412-L1452 HydrophobicContact CD1-CD1 3.61Å; Y1412-L1452 HydrophobicContact CD1-CG 3.89Å; Y1412-L1452 HydrophobicContact CE1-CD1 4.18Å; Y1412-L1452 HydrophobicContact CE1-CG 4.24Å; Y1412-L1452 HydrophobicContact CG-CD1 4.38Å; S1414-L1452 VanDerWaalsContact OG-CD1 3.29Å; S1414-L1452 WeakPolarHBondContact OG-CD1 3.48Å; L1423-L1452 HydrophobicContact CD1-CD1 4.09Å; L1452-D1486 VanDerWaalsContact C-OD2 3.27Å; L1452-D1486 WeakPolarHBondContact O-CB 3.41Å
1453	M	65.8	Low	79.6	Confident	60.6 Å²	60.6	43.9 Å²	43.9	30%	0.299	23%	0.226	S	C	.	.			trans	-107.4	-18.6	171.8	-108.7	-176.3	27.3	0	0	111.6	R1417 P1451 V1455 R1485 D1486 L1970 N1972 I2178	R1417-M1453 HydrophobicContact CB-CE 4.49Å; R1417-M1453 HydrophobicContact CG-CE 4.24Å; R1417-M1453 HydrophobicContact CG-SD 4.35Å; P1451-M1453 PolarHBondContact O-N 2.97Å; P1451-M1453 VanDerWaalsContact O-N 3.17Å; M1453-V1455 PolarHBondContact O-N 2.77Å; M1453-V1455 VanDerWaalsContact O-N 3.15Å; M1453-R1485 HydrophobicContact CB-CB 4.48Å; M1453-R1485 HydrophobicContact CG-CB 4.12Å; M1453-D1486 WeakPolarHBondContact CA-OD1 3.49Å; M1453-L1970 HydrophobicContact SD-CD2 4.19Å; M1453-N1972 HydrophobicContact CE-CB 3.74Å; M1453-N1972 WeakPolarHBondContact CE-OD1 3.41Å; M1453-N1972 WeakPolarHBondContact CG-OD1 3.15Å; M1453-N1972 HydrophobicContact SD-CB 4.47Å; M1453-N1972 PolarHBondContact SD-OD1 3.04Å; M1453-I2178 HydrophobicContact CG-CD1 3.66Å; M1453-I2178 WeakPolarHBondContact O-CD1 3.45Å
1454	E	64.1	Low	79.9	Confident	134.8 Å²	134.8	41.8 Å²	41.8	63%	0.63	22%	0.217	S	C	*	.			trans	-82.4	121.2	179.7	-68.7	174.2	-174.6	0	0	109.5	S1414 N1418 E1456	S1414-E1454 PolarHBondContact OG-O 3.26Å; S1414-E1454 VanDerWaalsContact OG-O 3.12Å; N1418-E1454 PolarHBondContact ND2-OE1 3.48Å; E1454-E1456 PolarHBondContact O-N 3.4Å
1455	V	67.3	Low	80.2	Confident	23.8 Å²	23.8	41.9 Å²	41.9	14%	0.144	22%	0.218	C	C	.	.			trans	-109.2	124.9	171	-171.8	0	0	0	0	108.1	M1453 M1457 D1486 S1489 A1491 Q1519	M1453-V1455 PolarHBondContact O-N 2.77Å; M1453-V1455 VanDerWaalsContact O-N 3.15Å; V1455-M1457 PolarHBondContact O-N 3.03Å; V1455-D1486 HydrophobicContact CG2-CB 4.15Å; V1455-S1489 WeakPolarHBondContact CG2-O 3.18Å; V1455-S1489 WeakPolarHBondContact CG2-OG 3.25Å; V1455-A1491 HydrophobicContact CG1-CB 4.27Å; V1455-Q1519 VanDerWaalsContact CB-NE2 3.26Å; V1455-Q1519 VanDerWaalsContact CG1-CD 3.4Å; V1455-Q1519 HydrophobicContact CG1-CG 4.41Å
1456	E	68.6	Low	80.4	Confident	86.8 Å²	86.8	41.8 Å²	41.8	41%	0.406	22%	0.217	S	C	.	.			trans	-61.3	131	173.9	-70.8	170.2	-172.5	0	0	109.3	F1415 F1416 E1454 D1458 S1459 Q1519	F1415-E1456 WeakPolarHBondContact CD2-OE2 3.23Å; F1415-E1456 PolarHBondContact N-OE1 2.8Å; F1416-E1456 WeakPolarHBondContact CE1-OE1 3.19Å; F1416-E1456 WeakPolarHBondContact CE1-OE2 3.43Å; F1416-E1456 WeakPolarHBondContact CE2-OE1 3.35Å; F1416-E1456 HydrophobicContact CZ-CG 4.36Å; F1416-E1456 WeakPolarHBondContact CZ-OE1 3.31Å; F1416-E1456 VanDerWaalsContact CZ-OE2 3.26Å; F1416-E1456 WeakPolarHBondContact CZ-OE2 3.45Å; E1454-E1456 PolarHBondContact O-N 3.4Å; E1456-D1458 PolarHBondContact O-N 3.1Å; E1456-D1458 VanDerWaalsContact O-N 3.16Å; E1456-S1459 WeakPolarHBondContact CB-OG 3.36Å; E1456-S1459 WeakPolarHBondContact O-CB 3.3Å; E1456-S1459 PolarHBondContact O-N 3.1Å; E1456-S1459 VanDerWaalsContact O-N 3.15Å; E1456-S1459 PolarHBondContact O-OG 3.04Å; E1456-Q1519 PolarHBondContact O-NE2 3.05Å; E1456-Q1519 PolarHBondContact O-OE1 3.02Å
1457	M	63.4	Low	80.5	Confident	171.4 Å²	171.4	42.9 Å²	42.9	84%	0.844	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	133.6	176.1	-72.3	-169.8	178.8	0	0	110.5	V1455 S1459	V1455-M1457 PolarHBondContact O-N 3.03Å; M1457-S1459 VanDerWaalsContact C-N 3.33Å; M1457-S1459 PolarHBondContact O-N 3.14Å
1458	D	68.6	Low	80.6	Confident	149.6 Å²	149.6	42 Å²	42	80%	0.8	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.8	18.3	-177.9	-54.6	-38.9	0	0	0	115.6	E1456 P1460	E1456-D1458 PolarHBondContact O-N 3.1Å; E1456-D1458 VanDerWaalsContact O-N 3.16Å; D1458-P1460 WeakPolarHBondContact O-CD 3.28Å
1459	S	75.8	Confident	80.8	Confident	10.2 Å²	10.2	43 Å²	43	7%	0.071	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-62.5	126.1	173.7	-77.5	0	0	0	0	111.3	S1413 R1425 E1456 M1457 A1491	S1413-S1459 PolarHBondContact O-OG 2.87Å; R1425-S1459 PolarHBondContact NH1-OG 2.81Å; E1456-S1459 WeakPolarHBondContact CB-OG 3.36Å; E1456-S1459 WeakPolarHBondContact O-CB 3.3Å; E1456-S1459 PolarHBondContact O-N 3.1Å; E1456-S1459 VanDerWaalsContact O-N 3.15Å; E1456-S1459 PolarHBondContact O-OG 3.04Å; M1457-S1459 VanDerWaalsContact C-N 3.33Å; M1457-S1459 PolarHBondContact O-N 3.14Å; S1459-A1491 WeakPolarHBondContact OG-CB 3.48Å
1460	P	80.1	Confident	81.3	Confident	41.4 Å²	41.4	45.4 Å²	45.4	27%	0.269	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-67.2	146.4	-179.3	27.8	-35.4	0	0	0	111.1	I1352 F1415 R1425 D1458	I1352-P1460 HydrophobicContact CB-CG 4.16Å; I1352-P1460 HydrophobicContact CD1-CB 3.85Å; I1352-P1460 HydrophobicContact CD1-CG 3.71Å; I1352-P1460 VanDerWaalsContact CD1-CG 3.48Å; I1352-P1460 HydrophobicContact CG1-CB 4.16Å; I1352-P1460 HydrophobicContact CG1-CG 3.6Å; I1352-P1460 HydrophobicContact CG2-CB 4.22Å; I1352-P1460 HydrophobicContact CG2-CG 4.05Å; F1415-P1460 HydrophobicContact CE2-CG 4.18Å; F1415-P1460 HydrophobicContact CZ-CG 3.99Å; R1425-P1460 VanDerWaalsContact CZ-O 3.27Å; R1425-P1460 PolarHBondContact NH1-O 3.26Å; R1425-P1460 VanDerWaalsContact NH1-O 3.11Å; R1425-P1460 PolarHBondContact NH2-O 2.89Å; R1425-P1460 VanDerWaalsContact NH2-O 3.09Å; D1458-P1460 WeakPolarHBondContact O-CD 3.28Å
1461	L	83.1	Confident	82	Confident	19.6 Å²	19.6	45.2 Å²	45.2	10%	0.103	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-76.1	135	-177	-150.4	92.5	0	0	0	112	A1491 P1518 L1523 L1525	L1461-A1491 CarbonylContact C-O 3.57Å; L1461-A1491 VanDerWaalsContact CA-O 3.28Å; L1461-A1491 WeakPolarHBondContact CA-O 3.33Å; L1461-A1491 VanDerWaalsContact CD1-C 3.48Å; L1461-A1491 VanDerWaalsContact CD1-O 3.3Å; L1461-A1491 WeakPolarHBondContact CD1-O 3.42Å; L1461-A1491 WeakPolarHBondContact CD2-O 2.82Å; L1461-P1518 HydrophobicContact CD1-CB 3.99Å; L1461-P1518 HydrophobicContact CD2-CB 4.15Å; L1461-L1523 HydrophobicContact CB-CD1 3.92Å; L1461-L1523 HydrophobicContact CD1-CB 3.62Å; L1461-L1523 HydrophobicContact CD1-CD1 3.53Å; L1461-L1523 HydrophobicContact CD1-CG 4.19Å; L1461-L1523 HydrophobicContact CD2-CB 4.29Å; L1461-L1523 HydrophobicContact CG-CD1 3.86Å; L1461-L1525 HydrophobicContact CB-CD1 4.35Å; L1461-L1525 HydrophobicContact CD1-CB 4.43Å; L1461-L1525 HydrophobicContact CD2-CB 3.5Å; L1461-L1525 VanDerWaalsContact CD2-CB 3.44Å; L1461-L1525 HydrophobicContact CD2-CD1 3.95Å; L1461-L1525 HydrophobicContact CD2-CG 4.37Å; L1461-L1525 HydrophobicContact CG-CD1 4.29Å
1462	A	86.7	Confident	82.9	Confident	1.4 Å²	1.4	44.5 Å²	44.5	1%	0.012	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	146.6	174.8	0	0	0	0	0	111.3	I1352 R1425 R1426 R1427 A1491 N1492 S1493	I1352-A1462 HydrophobicContact CD1-CB 4.05Å; R1425-A1462 HydrophobicContact CG-CB 4.28Å; R1425-A1462 VanDerWaalsContact NH2-CB 3.33Å; R1425-A1462 VanDerWaalsContact NH2-N 3.16Å; R1426-A1462 VanDerWaalsContact O-CB 3.3Å; R1426-A1462 WeakPolarHBondContact O-CB 3.37Å; R1427-A1462 WeakPolarHBondContact O-CA 3.44Å; A1462-A1491 PolarHBondContact N-O 3.17Å; A1462-N1492 CarbonylContact O-C 3.45Å; A1462-N1492 WeakPolarHBondContact O-CA 3.36Å; A1462-S1493 PolarHBondContact O-N 2.99Å
1463	E	89.4	Confident	84	Confident	25.4 Å²	25.4	41.7 Å²	41.7	12%	0.119	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.3	175	-174.2	-176.5	-170.8	0	0	110.7	R1427 R1428 S1429 S1493 R1528	R1427-E1463 PolarHBondContact O-N 2.96Å; R1428-E1463 CarbonylContact C-O 3.56Å; R1428-E1463 WeakPolarHBondContact CA-O 3.32Å; R1428-E1463 HydrophobicContact CG-CB 4.41Å; R1428-E1463 IonicContact NE-OE2 3.18Å; R1428-E1463 PolarHBondContact NE-OE2 2.97Å; S1429-E1463 PolarHBondContact N-O 2.94Å; E1463-S1493 CarbonylContact C-O 3.59Å; E1463-S1493 WeakPolarHBondContact CA-O 3.36Å; E1463-R1528 IonicContact OE1-CZ 3.5Å; E1463-R1528 IonicContact OE1-NH2 2.69Å; E1463-R1528 PolarHBondContact OE1-NH2 3.14Å
1464	V	91.9	Very high	85.4	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.018	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	116.2	179.4	179.2	0	0	0	0	109.4	H1411 S1429 Y1466 N1492 S1493 F1494 W1495	H1411-V1464 WeakPolarHBondContact CE1-CG1 3.38Å; H1411-V1464 VanDerWaalsContact NE2-CG1 3.3Å; H1411-V1464 WeakPolarHBondContact NE2-CG1 3.4Å; S1429-V1464 CarbonylContact O-C 3.56Å; S1429-V1464 WeakPolarHBondContact O-CA 3.39Å; V1464-Y1466 HydrophobicContact CG1-CD2 4.3Å; V1464-Y1466 HydrophobicContact CG1-CE2 3.79Å; V1464-N1492 HydrophobicContact CG2-CB 4.43Å; V1464-S1493 PolarHBondContact N-O 3.06Å; V1464-F1494 HydrophobicContact CB-CD1 3.91Å; V1464-F1494 HydrophobicContact CB-CE1 3.86Å; V1464-F1494 HydrophobicContact CB-CZ 4.34Å; V1464-F1494 HydrophobicContact CG1-CD1 4.04Å; V1464-F1494 HydrophobicContact CG1-CE1 3.86Å; V1464-F1494 HydrophobicContact CG2-CE1 4.35Å; V1464-F1494 HydrophobicContact CG2-CZ 4.36Å; V1464-F1494 CarbonylContact O-C 3.56Å; V1464-F1494 WeakPolarHBondContact O-CA 3.41Å; V1464-W1495 PolarHBondContact O-N 3.01Å
1465	A	94.5	Very high	86.8	Confident	2 Å²	2	38.9 Å²	38.9	2%	0.017	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.6	-178.2	0	0	0	0	0	112.9	S1429 K1430 L1431 L1467 W1495	S1429-A1465 PolarHBondContact O-N 3.06Å; K1430-A1465 CarbonylContact C-O 3.46Å; K1430-A1465 WeakPolarHBondContact CA-O 3.36Å; K1430-A1465 HydrophobicContact CB-CB 4.28Å; K1430-A1465 HydrophobicContact CG-CB 4.04Å; L1431-A1465 PolarHBondContact N-O 3.09Å; A1465-L1467 HydrophobicContact CB-CD1 3.79Å; A1465-L1467 HydrophobicContact CB-CD2 4.34Å; A1465-W1495 CarbonylContact C-O 3.56Å; A1465-W1495 VanDerWaalsContact CA-O 3.22Å; A1465-W1495 WeakPolarHBondContact CA-O 3.34Å; A1465-W1495 HydrophobicContact CB-CB 4.12Å; A1465-W1495 HydrophobicContact CB-CD2 4.32Å; A1465-W1495 HydrophobicContact CB-CE3 3.84Å; A1465-W1495 HydrophobicContact CB-CG 4.46Å; A1465-W1495 HydrophobicContact CB-CZ3 4.47Å
1466	Y	95.4	Very high	88.1	Confident	0.4 Å²	0.4	37.8 Å²	37.8	0%	0.002	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	113.7	169.9	-74.8	-89.9	0	0	0	109.4	L1407 H1411 L1431 I1446 V1448 V1464 W1495 W1496 K1497	L1407-Y1466 HydrophobicContact CD2-CD1 4.26Å; L1407-Y1466 HydrophobicContact CD2-CE1 3.79Å; H1411-Y1466 PolarHBondContact CD2-OH 2.79Å; H1411-Y1466 AromaticContact NE2-CE2 3.74Å; H1411-Y1466 AromaticContact NE2-CZ 3.63Å; H1411-Y1466 PolarHBondContact NE2-OH 2.98Å; L1431-Y1466 HydrophobicContact CB-CD1 4.05Å; L1431-Y1466 HydrophobicContact CB-CE1 4.17Å; L1431-Y1466 HydrophobicContact CD1-CD1 4.17Å; L1431-Y1466 HydrophobicContact CD1-CE1 4.09Å; L1431-Y1466 HydrophobicContact CD2-CE1 4.04Å; L1431-Y1466 HydrophobicContact CG-CE1 4.39Å; L1431-Y1466 WeakPolarHBondContact O-CA 3.41Å; I1446-Y1466 HydrophobicContact CG2-CE1 4.29Å; V1448-Y1466 HydrophobicContact CB-CE2 4.43Å; V1448-Y1466 HydrophobicContact CG1-CE2 3.99Å; V1448-Y1466 WeakPolarHBondContact CG1-OH 3.35Å; V1448-Y1466 HydrophobicContact CG2-CD2 4.34Å; V1448-Y1466 HydrophobicContact CG2-CE1 3.95Å; V1448-Y1466 HydrophobicContact CG2-CE2 3.79Å; V1448-Y1466 VanDerWaalsContact CG2-CZ 3.42Å; V1448-Y1466 VanDerWaalsContact CG2-OH 3.28Å; V1448-Y1466 WeakPolarHBondContact CG2-OH 3.3Å; V1464-Y1466 HydrophobicContact CG1-CD2 4.3Å; V1464-Y1466 HydrophobicContact CG1-CE2 3.79Å; Y1466-W1495 PolarHBondContact N-O 3.06Å; Y1466-W1496 VanDerWaalsContact CB-CE3 3.46Å; Y1466-W1496 VanDerWaalsContact CB-CZ3 3.43Å; Y1466-W1496 AromaticContact CD1-CH2 3.9Å; Y1466-W1496 HydrophobicContact CD1-CH2 4.14Å; Y1466-W1496 AromaticContact CD1-CZ3 3.85Å; Y1466-W1496 HydrophobicContact CD1-CZ3 4.22Å; Y1466-W1496 HydrophobicContact CD2-CD2 4.39Å; Y1466-W1496 AromaticContact CD2-CE2 3.97Å; Y1466-W1496 HydrophobicContact CD2-CE3 4.26Å; Y1466-W1496 AromaticContact CD2-CH2 3.89Å; Y1466-W1496 HydrophobicContact CD2-CH2 3.93Å; Y1466-W1496 AromaticContact CD2-CZ2 3.81Å; Y1466-W1496 HydrophobicContact CD2-CZ2 3.81Å; Y1466-W1496 AromaticContact CD2-CZ3 3.96Å; Y1466-W1496 HydrophobicContact CD2-CZ3 4.3Å; Y1466-W1496 HydrophobicContact CE1-CH2 4.19Å; Y1466-W1496 AromaticContact CE2-CH2 3.97Å; Y1466-W1496 HydrophobicContact CE2-CH2 4.23Å; Y1466-W1496 AromaticContact CE2-CZ2 3.92Å; Y1466-W1496 HydrophobicContact CE2-CZ2 4.24Å; Y1466-W1496 HydrophobicContact CG-CD2 4.43Å; Y1466-W1496 AromaticContact CG-CE3 3.88Å; Y1466-W1496 HydrophobicContact CG-CE3 4.13Å; Y1466-W1496 AromaticContact CG-CH2 3.77Å; Y1466-W1496 HydrophobicContact CG-CH2 3.77Å; Y1466-W1496 HydrophobicContact CG-CZ2 4.12Å; Y1466-W1496 AromaticContact CG-CZ3 3.77Å; Y1466-W1496 HydrophobicContact CG-CZ3 3.77Å; Y1466-W1496 VanDerWaalsContact CG-CZ3 3.49Å; Y1466-K1497 PolarHBondContact O-N 2.96Å
1467	L	95.8	Very high	89	Confident	25.2 Å²	25.2	36.6 Å²	36.6	13%	0.132	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.3	-176.6	-55.1	148.5	0	0	0	108.8	K1430 L1431 W1432 F1433 A1465 K1497	K1430-L1467 HydrophobicContact CB-CD1 4.25Å; K1430-L1467 HydrophobicContact CD-CD1 4.15Å; K1430-L1467 HydrophobicContact CG-CD1 3.41Å; K1430-L1467 VanDerWaalsContact CG-CD1 3.41Å; L1431-L1467 PolarHBondContact O-N 3.02Å; W1432-L1467 CarbonylContact C-O 3.57Å; W1432-L1467 WeakPolarHBondContact CA-O 3.35Å; W1432-L1467 HydrophobicContact CB-CB 4.21Å; W1432-L1467 HydrophobicContact CB-CD1 4.07Å; W1432-L1467 HydrophobicContact CG-CB 4.07Å; W1432-L1467 HydrophobicContact CG-CD1 4.11Å; F1433-L1467 PolarHBondContact N-O 3.11Å; A1465-L1467 HydrophobicContact CB-CD1 3.79Å; A1465-L1467 HydrophobicContact CB-CD2 4.34Å; L1467-K1497 CarbonylContact C-O 3.5Å; L1467-K1497 WeakPolarHBondContact CA-O 3.36Å; L1467-K1497 HydrophobicContact CD2-CB 3.75Å; L1467-K1497 HydrophobicContact CD2-CD 4.08Å; L1467-K1497 HydrophobicContact CD2-CG 4.39Å; L1467-K1497 HydrophobicContact CG-CB 4.19Å
1468	I	95.5	Very high	90	Very high	3.2 Å²	3.2	28.7 Å²	28.7	2%	0.016	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	101	176.8	-54.1	178.6	0	0	0	107.1	I1446 C1471 I1481 K1497 I1498 W1499 S1501	I1446-I1468 HydrophobicContact CD1-CD1 3.49Å; I1446-I1468 VanDerWaalsContact CD1-CD1 3.47Å; I1446-I1468 HydrophobicContact CD1-CG1 4.22Å; I1468-C1471 HydrophobicContact CG2-CB 3.61Å; I1468-I1481 HydrophobicContact CD1-CD1 4.24Å; I1468-K1497 PolarHBondContact N-O 3.08Å; I1468-I1498 HydrophobicContact CB-CG1 4.34Å; I1468-I1498 HydrophobicContact CD1-CD1 4.41Å; I1468-I1498 HydrophobicContact CD1-CG1 4.2Å; I1468-I1498 HydrophobicContact CG1-CG1 4.48Å; I1468-I1498 WeakPolarHBondContact O-CA 3.34Å; I1468-W1499 PolarHBondContact O-N 2.97Å; I1468-S1501 PolarHBondContact O-OG 3.13Å
1469	D	95.4	Very high	90.8	Very high	19.2 Å²	19.2	22.5 Å²	22.5	10%	0.103	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	120.3	-172.7	174.3	21.9	0	0	0	110.4	F1433 Q1434 K1435 C1471 W1499	F1433-D1469 PolarHBondContact O-N 3Å; Q1434-D1469 CarbonylContact C-O 3.55Å; Q1434-D1469 VanDerWaalsContact CA-O 3.28Å; Q1434-D1469 WeakPolarHBondContact CA-O 3.33Å; Q1434-D1469 HydrophobicContact CG-CB 4.42Å; Q1434-D1469 WeakPolarHBondContact CG-OD2 3.34Å; Q1434-D1469 PolarHBondContact NE2-OD2 3.28Å; Q1434-D1469 VanDerWaalsContact NE2-OD2 3.08Å; K1435-D1469 PolarHBondContact N-O 3Å; D1469-C1471 PolarHBondContact O-N 3.03Å; D1469-C1471 VanDerWaalsContact O-N 3.13Å; D1469-C1471 PolarHBondContact O-SG 3.05Å; D1469-W1499 HydrophobicContact CB-CE3 4.47Å; D1469-W1499 VanDerWaalsContact OD1-CE3 3.22Å; D1469-W1499 WeakPolarHBondContact OD1-CZ3 3.34Å
1470	N	96.6	Very high	91.6	Very high	71 Å²	71	22.1 Å²	22.1	38%	0.38	12%	0.119	S	C	.	.	S	Bend	trans	52.3	40.3	176.3	-163.8	-7.8	0	0	0	112.7	K1435 W1499 Q1500 S1501	K1435-N1470 VanDerWaalsContact CA-O 3.24Å; K1435-N1470 WeakPolarHBondContact CA-O 3.39Å; K1435-N1470 HydrophobicContact CG-CB 4.26Å; K1435-N1470 PolarHBondContact N-O 3.16Å; N1470-W1499 PolarHBondContact N-O 3.01Å; N1470-Q1500 WeakPolarHBondContact CA-O 3.35Å; N1470-S1501 PolarHBondContact N-OG 3.3Å
1471	C	96.3	Very high	92	Very high	2.6 Å²	2.6	20.6 Å²	20.6	2%	0.018	11%	0.109	C	C	.	.			trans	-97.3	154.2	-177.9	-68.3	0	0	0	0	111.1	F1433 T1436 I1468 D1469 S1501 N1502	F1433-C1471 PolarHBondContact O-SG 3.11Å; T1436-C1471 PolarHBondContact N-SG 2.95Å; T1436-C1471 VanDerWaalsContact N-SG 3.44Å; T1436-C1471 WeakPolarHBondContact O-CA 3.41Å; T1436-C1471 WeakPolarHBondContact O-CB 3.38Å; T1436-C1471 PolarHBondContact OG1-SG 3.06Å; I1468-C1471 HydrophobicContact CG2-CB 3.61Å; D1469-C1471 PolarHBondContact O-N 3.03Å; D1469-C1471 VanDerWaalsContact O-N 3.13Å; D1469-C1471 PolarHBondContact O-SG 3.05Å; C1471-S1501 PolarHBondContact N-OG 2.8Å; C1471-S1501 VanDerWaalsContact N-OG 3.1Å; C1471-S1501 CarbonylContact O-C 3.48Å; C1471-S1501 VanDerWaalsContact O-CA 3.29Å; C1471-S1501 WeakPolarHBondContact O-CA 3.38Å; C1471-S1501 WeakPolarHBondContact O-CB 3.41Å; C1471-N1502 PolarHBondContact O-N 3.1Å
1472	S	95.4	Very high	92.2	Very high	21.6 Å²	21.6	20.2 Å²	20.2	15%	0.151	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.6	175.2	179.8	0	0	0	0	109.5	T1436 Y1437 F1438 N1502 F1504	T1436-S1472 PolarHBondContact O-N 3.02Å; Y1437-S1472 CarbonylContact C-O 3.57Å; Y1437-S1472 WeakPolarHBondContact CA-O 3.41Å; F1438-S1472 PolarHBondContact N-O 3.09Å; S1472-N1502 WeakPolarHBondContact CA-O 3.4Å; S1472-F1504 WeakPolarHBondContact OG-CE1 3.27Å
1473	V	95	Very high	92.1	Very high	3.2 Å²	3.2	21.1 Å²	21.1	2%	0.019	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	104.9	-179.9	-177.3	0	0	0	0	108.1	F1438 V1445 N1476 V1480 N1502 F1503 F1504 N1506	F1438-V1473 HydrophobicContact CB-CG1 4.4Å; F1438-V1473 HydrophobicContact CB-CG2 4.23Å; F1438-V1473 HydrophobicContact CD2-CG2 4.03Å; F1438-V1473 HydrophobicContact CG-CG2 4.49Å; F1438-V1473 WeakPolarHBondContact O-CA 3.24Å; V1445-V1473 HydrophobicContact CB-CG1 4.44Å; V1445-V1473 HydrophobicContact CG1-CG1 4.04Å; V1445-V1473 HydrophobicContact CG1-CG2 4.37Å; V1445-V1473 HydrophobicContact CG2-CG1 3.73Å; V1473-N1476 VanDerWaalsContact CG1-ND2 3.33Å; V1473-N1476 WeakPolarHBondContact CG1-ND2 3.36Å; V1473-V1480 HydrophobicContact CG1-CG1 4.09Å; V1473-N1502 PolarHBondContact N-O 2.98Å; V1473-F1503 HydrophobicContact CB-CD1 3.57Å; V1473-F1503 HydrophobicContact CB-CE1 3.79Å; V1473-F1503 HydrophobicContact CB-CG 4.19Å; V1473-F1503 HydrophobicContact CB-CZ 4.45Å; V1473-F1503 HydrophobicContact CG1-CD1 3.78Å; V1473-F1503 HydrophobicContact CG1-CE1 3.99Å; V1473-F1503 HydrophobicContact CG2-CD1 3.93Å; V1473-F1503 HydrophobicContact CG2-CE1 3.61Å; V1473-F1503 HydrophobicContact CG2-CE2 4.47Å; V1473-F1503 HydrophobicContact CG2-CZ 4.04Å; V1473-F1503 VanDerWaalsContact O-CA 3.31Å; V1473-F1503 WeakPolarHBondContact O-CA 3.32Å; V1473-F1504 PolarHBondContact O-N 3.25Å; V1473-N1506 PolarHBondContact O-ND2 2.94Å; V1473-N1506 PolarHBondContact O-OD1 3.3Å
1474	S	94.3	Very high	91.6	Very high	6.4 Å²	6.4	21.5 Å²	21.5	5%	0.045	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	145.5	-172.2	61.8	0	0	0	0	115.3	F1438 T1439 G1440 N1476 F1504 N1506	F1438-S1474 PolarHBondContact O-N 2.99Å; T1439-S1474 VanDerWaalsContact CA-O 3.26Å; T1439-S1474 WeakPolarHBondContact CA-O 3.32Å; T1439-S1474 WeakPolarHBondContact CG2-OG 3.41Å; G1440-S1474 PolarHBondContact N-O 2.89Å; S1474-N1476 PolarHBondContact N-ND2 3.2Å; S1474-N1476 VanDerWaalsContact N-ND2 3.13Å; S1474-N1476 PolarHBondContact O-N 2.89Å; S1474-N1476 VanDerWaalsContact O-N 3.13Å; S1474-N1476 PolarHBondContact O-ND2 2.97Å; S1474-N1476 VanDerWaalsContact O-ND2 3.1Å; S1474-F1504 VanDerWaalsContact CA-O 3.28Å; S1474-F1504 WeakPolarHBondContact CA-O 3.39Å; S1474-F1504 VanDerWaalsContact CB-CE2 3.46Å; S1474-F1504 WeakPolarHBondContact CB-O 3.5Å; S1474-F1504 VanDerWaalsContact OG-CZ 3.3Å; S1474-F1504 WeakPolarHBondContact OG-CZ 3.37Å; S1474-N1506 VanDerWaalsContact C-OD1 3.27Å; S1474-N1506 WeakPolarHBondContact CA-OD1 3.32Å; S1474-N1506 PolarHBondContact N-OD1 2.79Å
1475	F	94.5	Very high	90.8	Very high	128.8 Å²	128.8	24.6 Å²	24.6	57%	0.565	13%	0.125	S	C	*	.	S	Bend	trans	54.2	27.7	177.8	-50.9	-71.1	0	0	0	113.6	G1440 F1504 S1505 N1506	G1440-F1475 WeakPolarHBondContact CA-O 3.33Å; G1440-F1475 PolarHBondContact N-O 3.07Å; F1475-F1504 HydrophobicContact CD2-CE2 4.22Å; F1475-F1504 HydrophobicContact CE1-CE2 4.46Å; F1475-F1504 HydrophobicContact CE2-CD2 4.47Å; F1475-F1504 AromaticContact CE2-CE2 3.63Å; F1475-F1504 HydrophobicContact CE2-CE2 3.63Å; F1475-F1504 VanDerWaalsContact CE2-CE2 3.48Å; F1475-F1504 AromaticContact CE2-CZ 3.94Å; F1475-F1504 HydrophobicContact CE2-CZ 4.17Å; F1475-F1504 HydrophobicContact CZ-CD2 4.43Å; F1475-F1504 AromaticContact CZ-CE2 3.78Å; F1475-F1504 HydrophobicContact CZ-CE2 3.88Å; F1475-F1504 HydrophobicContact CZ-CZ 4.47Å; F1475-F1504 PolarHBondContact N-O 3.12Å; F1475-S1505 VanDerWaalsContact CA-O 3.31Å; F1475-S1505 WeakPolarHBondContact CA-O 3.37Å; F1475-S1505 PolarHBondContact N-O 3.22Å; F1475-N1506 PolarHBondContact N-OD1 3Å
1476	N	92.8	Very high	89.7	Confident	1.4 Å²	1.4	25.4 Å²	25.4	1%	0.007	13%	0.129	C	C	.	.			trans	-85.9	151.8	174.4	-57.9	-79.9	0	0	0	109.8	F1438 T1439 G1440 N1441 V1445 V1473 S1474 N1506 Y1507	F1438-N1476 PolarHBondContact O-ND2 2.99Å; T1439-N1476 PolarHBondContact N-OD1 2.81Å; G1440-N1476 PolarHBondContact N-OD1 3.2Å; N1441-N1476 WeakPolarHBondContact CB-OD1 3.42Å; N1441-N1476 PolarHBondContact N-OD1 2.89Å; N1441-N1476 PolarHBondContact ND2-OD1 2.95Å; V1445-N1476 HydrophobicContact CG2-CB 3.74Å; V1445-N1476 VanDerWaalsContact CG2-CG 3.45Å; V1473-N1476 VanDerWaalsContact CG1-ND2 3.33Å; V1473-N1476 WeakPolarHBondContact CG1-ND2 3.36Å; S1474-N1476 PolarHBondContact N-ND2 3.2Å; S1474-N1476 VanDerWaalsContact N-ND2 3.13Å; S1474-N1476 PolarHBondContact O-N 2.89Å; S1474-N1476 VanDerWaalsContact O-N 3.13Å; S1474-N1476 PolarHBondContact O-ND2 2.97Å; S1474-N1476 VanDerWaalsContact O-ND2 3.1Å; N1476-N1506 WeakPolarHBondContact CB-OD1 3.28Å; N1476-N1506 PolarHBondContact N-OD1 3.01Å; N1476-N1506 VanDerWaalsContact N-OD1 3.1Å; N1476-N1506 PolarHBondContact ND2-OD1 3.01Å; N1476-N1506 VanDerWaalsContact ND2-OD1 3.11Å; N1476-N1506 CarbonylContact O-C 3.45Å; N1476-N1506 WeakPolarHBondContact O-CA 3.25Å; N1476-Y1507 PolarHBondContact O-N 2.92Å
1477	N	88.8	Confident	88.7	Confident	62.2 Å²	62.2	28.3 Å²	28.3	33%	0.333	14%	0.144	S	C	.	.	B	Isolated β-bridge	trans	-106	119.8	168.3	-171.1	21.5	0	0	0	107.8	N1441 R1442 Q1443 Y1507	N1441-N1477 PolarHBondContact O-N 2.94Å; R1442-N1477 CarbonylContact C-O 3.42Å; R1442-N1477 VanDerWaalsContact O-CB 3.28Å; R1442-N1477 WeakPolarHBondContact O-CB 3.43Å; R1442-N1477 VanDerWaalsContact O-CG 3.29Å; R1442-N1477 PolarHBondContact O-ND2 3.02Å; R1442-N1477 VanDerWaalsContact O-O 3.06Å; Q1443-N1477 CarbonylContact C-O 3.53Å; Q1443-N1477 VanDerWaalsContact C-O 3.31Å; Q1443-N1477 VanDerWaalsContact CA-O 3.28Å; Q1443-N1477 WeakPolarHBondContact CA-O 3.25Å; Q1443-N1477 PolarHBondContact N-O 3.07Å; Q1443-N1477 VanDerWaalsContact N-O 3.11Å; N1477-Y1507 CarbonylContact C-O 3.58Å; N1477-Y1507 WeakPolarHBondContact CA-O 3.3Å; N1477-Y1507 VanDerWaalsContact OD1-CD1 3.31Å; N1477-Y1507 WeakPolarHBondContact OD1-CD1 3.38Å
1478	G	83.6	Confident	87.6	Confident	4.8 Å²	4.8	31.2 Å²	31.2	5%	0.049	16%	0.157	C	C	.	.	S	Bend	trans	99.1	170.3	-175	0	0	0	0	0	115	Q1443 V1480 Y1507 E1508	Q1443-G1478 CarbonylContact O-C 3.57Å; Q1443-G1478 VanDerWaalsContact O-CA 3.3Å; Q1443-G1478 WeakPolarHBondContact O-CA 3.38Å; G1478-V1480 PolarHBondContact O-N 3.15Å; G1478-Y1507 PolarHBondContact N-O 2.82Å; G1478-E1508 CarbonylContact C-O 3.56Å; G1478-E1508 VanDerWaalsContact C-O 3.27Å; G1478-E1508 VanDerWaalsContact CA-O 3.22Å; G1478-E1508 WeakPolarHBondContact CA-O 3.34Å
1479	S	86.4	Confident	86.6	Confident	19.2 Å²	19.2	32.1 Å²	32.1	13%	0.134	16%	0.163	C	C	.	.			trans	-96	172.8	-167.8	14	0	0	0	0	113.5	Q1443 A1444 V1445 I1481 E1482 E1508 S1509 G1510	Q1443-S1479 PolarHBondContact O-N 3.09Å; A1444-S1479 CarbonylContact C-O 3.55Å; A1444-S1479 WeakPolarHBondContact CA-O 3.34Å; A1444-S1479 VanDerWaalsContact CB-O 3.28Å; A1444-S1479 WeakPolarHBondContact CB-O 3.33Å; V1445-S1479 PolarHBondContact N-O 2.82Å; S1479-I1481 WeakPolarHBondContact OG-CD1 3.4Å; S1479-I1481 WeakPolarHBondContact OG-CG1 3.39Å; S1479-E1482 WeakPolarHBondContact CB-OE2 3.39Å; S1479-E1482 PolarHBondContact OG-OE2 2.89Å; S1479-E1508 PolarHBondContact N-O 2.97Å; S1479-E1508 PolarHBondContact OG-O 3.3Å; S1479-S1509 WeakPolarHBondContact OG-CA 3.25Å; S1479-G1510 CarbonylContact C-O 3.57Å; S1479-G1510 WeakPolarHBondContact CA-O 3.33Å; S1479-G1510 WeakPolarHBondContact CB-O 3.27Å; S1479-G1510 PolarHBondContact OG-N 2.78Å; S1479-G1510 VanDerWaalsContact OG-N 3.08Å
1480	V	91.1	Very high	86	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.012	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	120	162	175.4	0	0	0	0	108.2	V1445 I1446 V1473 G1478 W1496 F1503 G1510 L1511 S1512	V1445-V1480 HydrophobicContact CB-CG1 4.46Å; V1445-V1480 HydrophobicContact CB-CG2 4.29Å; V1445-V1480 WeakPolarHBondContact CB-O 3.43Å; V1445-V1480 HydrophobicContact CG1-CG2 4.43Å; I1446-V1480 HydrophobicContact CB-CG1 4.08Å; I1446-V1480 HydrophobicContact CB-CG2 4.28Å; I1446-V1480 HydrophobicContact CD1-CG2 4.44Å; I1446-V1480 HydrophobicContact CG2-CG1 4.34Å; I1446-V1480 PolarHBondContact N-O 3.43Å; I1446-V1480 CarbonylContact O-C 3.58Å; I1446-V1480 WeakPolarHBondContact O-CA 3.41Å; V1473-V1480 HydrophobicContact CG1-CG1 4.09Å; G1478-V1480 PolarHBondContact O-N 3.15Å; V1480-W1496 HydrophobicContact CG1-CH2 3.8Å; V1480-W1496 HydrophobicContact CG1-CZ3 3.79Å; V1480-F1503 HydrophobicContact CG1-CD1 3.91Å; V1480-F1503 HydrophobicContact CG1-CE1 3.69Å; V1480-G1510 PolarHBondContact N-O 3.05Å; V1480-L1511 HydrophobicContact CB-CD1 3.63Å; V1480-L1511 HydrophobicContact CB-CD2 3.57Å; V1480-L1511 VanDerWaalsContact CB-CD2 3.47Å; V1480-L1511 HydrophobicContact CB-CG 4.21Å; V1480-L1511 HydrophobicContact CG1-CD1 4.14Å; V1480-L1511 HydrophobicContact CG1-CD2 3.97Å; V1480-L1511 HydrophobicContact CG1-CG 4.39Å; V1480-L1511 HydrophobicContact CG2-CD1 3.95Å; V1480-L1511 HydrophobicContact CG2-CD2 3.91Å; V1480-L1511 CarbonylContact O-C 3.58Å; V1480-L1511 WeakPolarHBondContact O-CA 3.2Å; V1480-S1512 PolarHBondContact O-N 3.08Å
1481	I	89.1	Confident	85.5	Confident	10.8 Å²	10.8	27.9 Å²	27.9	6%	0.055	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	129.3	-172.7	-56	172.8	0	0	0	109.4	A1444 I1446 W1447 V1448 I1468 S1479 T1483 W1496 I1498 G1510 L1511 S1512 I1513 L1868 Y1872 Y1875	A1444-I1481 HydrophobicContact CB-CD1 4.21Å; I1446-I1481 HydrophobicContact CB-CG1 4.36Å; I1446-I1481 WeakPolarHBondContact O-CA 3.44Å; I1446-I1481 PolarHBondContact O-N 3.05Å; W1447-I1481 CarbonylContact C-O 3.32Å; W1447-I1481 WeakPolarHBondContact CA-O 3.23Å; V1448-I1481 PolarHBondContact N-O 3.19Å; I1468-I1481 HydrophobicContact CD1-CD1 4.24Å; S1479-I1481 WeakPolarHBondContact OG-CD1 3.4Å; S1479-I1481 WeakPolarHBondContact OG-CG1 3.39Å; I1481-T1483 HydrophobicContact CG2-CG2 3.72Å; I1481-W1496 HydrophobicContact CD1-CE3 4.16Å; I1481-W1496 HydrophobicContact CD1-CZ3 3.99Å; I1481-W1496 HydrophobicContact CG2-CH2 3.76Å; I1481-W1496 HydrophobicContact CG2-CZ2 4.36Å; I1481-W1496 HydrophobicContact CG2-CZ3 3.9Å; I1481-I1498 HydrophobicContact CD1-CD1 3.94Å; I1481-G1510 PolarHBondContact N-O 3.4Å; I1481-L1511 HydrophobicContact CB-CG 4.46Å; I1481-L1511 HydrophobicContact CD1-CD2 4.24Å; I1481-L1511 HydrophobicContact CG1-CG 4.43Å; I1481-S1512 CarbonylContact C-O 3.53Å; I1481-S1512 VanDerWaalsContact CA-O 3.28Å; I1481-S1512 WeakPolarHBondContact CA-O 3.29Å; I1481-S1512 PolarHBondContact O-N 2.88Å; I1481-I1513 HydrophobicContact CD1-CD1 4.46Å; I1481-I1513 HydrophobicContact CG2-CD1 4.2Å; I1481-I1513 HydrophobicContact CG2-CG1 3.84Å; I1481-L1868 HydrophobicContact CD1-CD1 4.39Å; I1481-L1868 HydrophobicContact CD1-CD2 3.73Å; I1481-Y1872 HydrophobicContact CG2-CE1 4.18Å; I1481-Y1875 HydrophobicContact CD1-CE2 4.36Å
1482	E	88.4	Confident	85	Confident	10.6 Å²	10.6	28 Å²	28	5%	0.05	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.3	169.5	-176.8	175.1	166.7	0	0	110	I1446 V1448 S1479 H1484 F1494 W1496 S1512 I1513 S1514	I1446-E1482 PolarHBondContact O-N 2.88Å; V1448-E1482 HydrophobicContact CB-CB 4.3Å; V1448-E1482 HydrophobicContact CB-CG 4.19Å; V1448-E1482 HydrophobicContact CG1-CG 4.36Å; V1448-E1482 PolarHBondContact N-O 3.13Å; V1448-E1482 CarbonylContact O-C 3.58Å; V1448-E1482 WeakPolarHBondContact O-CA 3.34Å; S1479-E1482 WeakPolarHBondContact CB-OE2 3.39Å; S1479-E1482 PolarHBondContact OG-OE2 2.89Å; E1482-H1484 VanDerWaalsContact CD-NE2 3.31Å; E1482-H1484 VanDerWaalsContact CG-NE2 3.29Å; E1482-H1484 WeakPolarHBondContact CG-NE2 3.31Å; E1482-H1484 IonicContact OE1-CD2 3.15Å; E1482-H1484 PolarHBondContact OE1-CD2 3.3Å; E1482-H1484 IonicContact OE1-CE1 3.25Å; E1482-H1484 PolarHBondContact OE1-CE1 2.79Å; E1482-H1484 IonicContact OE1-NE2 3.23Å; E1482-H1484 PolarHBondContact OE1-NE2 3.05Å; E1482-H1484 VanDerWaalsContact OE1-NE2 3.12Å; E1482-F1494 WeakPolarHBondContact OE1-CD1 3.23Å; E1482-F1494 VanDerWaalsContact OE1-CD2 3.24Å; E1482-F1494 WeakPolarHBondContact OE1-CD2 3.24Å; E1482-F1494 WeakPolarHBondContact OE1-CG 3.2Å; E1482-W1496 HydrophobicContact CB-CZ2 4.37Å; E1482-W1496 WeakPolarHBondContact OE2-CZ2 3.43Å; E1482-W1496 PolarHBondContact OE2-NE1 3.02Å; E1482-S1512 PolarHBondContact N-O 2.98Å; E1482-I1513 HydrophobicContact CB-CB 4.37Å; E1482-I1513 HydrophobicContact CB-CG1 4.38Å; E1482-I1513 HydrophobicContact CB-CG2 4.26Å; E1482-I1513 VanDerWaalsContact OE2-CG2 3.3Å; E1482-I1513 WeakPolarHBondContact OE2-CG2 3.32Å; E1482-S1514 PolarHBondContact O-N 3.31Å
1483	T	82.8	Confident	84.7	Confident	21 Å²	21	27.1 Å²	27.1	13%	0.129	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.9	-179.5	57.5	0	0	0	0	110.5	W1447 V1448 N1449 G1450 I1481 W1496 S1512 I1513 S1514 Y1872	W1447-T1483 PolarHBondContact NE1-OG1 2.98Å; W1447-T1483 VanDerWaalsContact NE1-OG1 3.15Å; V1448-T1483 HydrophobicContact CB-CG2 4.28Å; V1448-T1483 WeakPolarHBondContact O-CA 3.32Å; V1448-T1483 PolarHBondContact O-N 3.24Å; V1448-T1483 PolarHBondContact O-OG1 2.92Å; N1449-T1483 CarbonylContact C-O 3.57Å; N1449-T1483 VanDerWaalsContact CA-O 3.23Å; N1449-T1483 WeakPolarHBondContact CA-O 3.39Å; N1449-T1483 PolarHBondContact OD1-O 3Å; N1449-T1483 VanDerWaalsContact OD1-O 3.13Å; N1449-T1483 PolarHBondContact OD1-OG1 2.98Å; N1449-T1483 VanDerWaalsContact OD1-OG1 3.09Å; G1450-T1483 PolarHBondContact N-O 2.91Å; I1481-T1483 HydrophobicContact CG2-CG2 3.72Å; T1483-W1496 HydrophobicContact CG2-CZ2 4.17Å; T1483-S1512 PolarHBondContact N-O 3.27Å; T1483-S1512 VanDerWaalsContact N-O 3.15Å; T1483-S1512 PolarHBondContact OG1-O 3.46Å; T1483-I1513 HydrophobicContact CG2-CG1 4.48Å; T1483-I1513 HydrophobicContact CG2-CG2 4.47Å; T1483-S1514 PolarHBondContact OG1-N 2.92Å; T1483-Y1872 HydrophobicContact CG2-CD1 3.99Å; T1483-Y1872 HydrophobicContact CG2-CD2 3.34Å; T1483-Y1872 HydrophobicContact CG2-CE1 3.66Å; T1483-Y1872 HydrophobicContact CG2-CE2 3.96Å; T1483-Y1872 HydrophobicContact CG2-CG 3.91Å
1484	H	79.5	Confident	84.6	Confident	33.6 Å²	33.6	27 Å²	27	16%	0.156	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.9	174.4	-61.7	-70.6	0	0	0	110	W1447 V1448 G1450 E1482 D1486 L1487 F1494 S1514 P1516	W1447-H1484 AromaticContact CD1-CD2 3.91Å; W1447-H1484 AromaticContact CD1-NE2 3.91Å; W1447-H1484 AromaticContact CE2-CD2 3.72Å; W1447-H1484 AromaticContact NE1-CD2 3.07Å; W1447-H1484 PolarHBondContact NE1-CD2 2.84Å; W1447-H1484 AromaticContact NE1-NE2 3.15Å; W1447-H1484 PolarHBondContact NE1-NE2 3.17Å; W1447-H1484 VanDerWaalsContact NE1-NE2 3.15Å; V1448-H1484 PolarHBondContact O-N 2.96Å; G1450-H1484 PolarHBondContact N-ND1 2.77Å; G1450-H1484 PolarHBondContact N-O 2.91Å; E1482-H1484 VanDerWaalsContact CD-NE2 3.31Å; E1482-H1484 VanDerWaalsContact CG-NE2 3.29Å; E1482-H1484 WeakPolarHBondContact CG-NE2 3.31Å; E1482-H1484 IonicContact OE1-CD2 3.15Å; E1482-H1484 PolarHBondContact OE1-CD2 3.3Å; E1482-H1484 IonicContact OE1-CE1 3.25Å; E1482-H1484 PolarHBondContact OE1-CE1 2.79Å; E1482-H1484 IonicContact OE1-NE2 3.23Å; E1482-H1484 PolarHBondContact OE1-NE2 3.05Å; E1482-H1484 VanDerWaalsContact OE1-NE2 3.12Å; H1484-D1486 VanDerWaalsContact C-N 3.32Å; H1484-D1486 WeakPolarHBondContact CB-O 3.27Å; H1484-D1486 WeakPolarHBondContact CB-OD1 3.38Å; H1484-D1486 IonicContact CG-OD1 3.16Å; H1484-D1486 IonicContact ND1-OD1 3.38Å; H1484-L1487 HydrophobicContact CB-CB 4.41Å; H1484-L1487 HydrophobicContact CB-CD1 4.38Å; H1484-L1487 HydrophobicContact CB-CD2 4.12Å; H1484-L1487 HydrophobicContact CB-CG 4.24Å; H1484-F1494 AromaticContact CE1-CE2 3.45Å; H1484-F1494 VanDerWaalsContact CE1-CE2 3.45Å; H1484-F1494 WeakPolarHBondContact CE1-CE2 3.35Å; H1484-F1494 AromaticContact CE1-CZ 3.3Å; H1484-F1494 WeakPolarHBondContact CE1-CZ 3.41Å; H1484-F1494 AromaticContact NE2-CD2 3.96Å; H1484-F1494 AromaticContact NE2-CE2 3.53Å; H1484-F1494 WeakPolarHBondContact NE2-CE2 3.28Å; H1484-F1494 AromaticContact NE2-CZ 3.66Å; H1484-S1514 PolarHBondContact CD2-O 3.03Å; H1484-S1514 VanDerWaalsContact CD2-O 3.27Å; H1484-S1514 PolarHBondContact NE2-O 2.61Å; H1484-P1516 HydrophobicContact CB-CB 4.43Å; H1484-P1516 VanDerWaalsContact CD2-CD 3.49Å; H1484-P1516 WeakPolarHBondContact CD2-CD 3.28Å; H1484-P1516 WeakPolarHBondContact NE2-CD 3.43Å
1485	R	74.4	Confident	84.6	Confident	68 Å²	68	28.9 Å²	28.9	26%	0.257	14%	0.141	S	C	.	.	S	Bend	trans	-91.1	-17.5	169.8	-83.3	-174.6	175.4	-142.2	-6.8	111.6	G1450 P1451 M1453 L1487 R1870 E1952 L1970	G1450-R1485 VanDerWaalsContact O-CB 3.31Å; G1450-R1485 WeakPolarHBondContact O-CB 3.43Å; G1450-R1485 PolarHBondContact O-N 3.1Å; P1451-R1485 VanDerWaalsContact O-CD 3.32Å; P1451-R1485 WeakPolarHBondContact O-CD 3.36Å; M1453-R1485 HydrophobicContact CB-CB 4.48Å; M1453-R1485 HydrophobicContact CG-CB 4.12Å; R1485-L1487 VanDerWaalsContact C-N 3.29Å; R1485-L1487 PolarHBondContact O-N 3.13Å; R1485-R1870 PolarHBondContact NH2-O 3.22Å; R1485-R1870 VanDerWaalsContact NH2-O 3.13Å; R1485-E1952 IonicContact CZ-OE1 3.5Å; R1485-E1952 VanDerWaalsContact CZ-OE1 3.29Å; R1485-E1952 IonicContact CZ-OE2 2.77Å; R1485-E1952 IonicContact NH1-OE1 3.22Å; R1485-E1952 PolarHBondContact NH1-OE1 2.96Å; R1485-E1952 IonicContact NH1-OE2 2.74Å; R1485-E1952 VanDerWaalsContact NH2-CD 3.34Å; R1485-E1952 IonicContact NH2-OE1 3Å; R1485-E1952 PolarHBondContact NH2-OE1 3.18Å; R1485-E1952 IonicContact NH2-OE2 3.63Å; R1485-E1952 PolarHBondContact NH2-OE2 2.89Å; R1485-L1970 HydrophobicContact CB-CD2 4.35Å; R1485-L1970 HydrophobicContact CG-CD2 4.41Å; R1485-L1970 VanDerWaalsContact O-CD1 3.3Å; R1485-L1970 WeakPolarHBondContact O-CD1 3.29Å; R1485-L1970 WeakPolarHBondContact O-CD2 3.44Å
1486	D	72	Confident	84.7	Confident	18.4 Å²	18.4	22.8 Å²	22.8	10%	0.098	11%	0.114	C	C	.	.			trans	-99.7	66.2	172.3	158.1	-17.5	0	0	0	111.1	S1413 L1452 M1453 V1455 H1484 Q1488 S1489 S1490	S1413-D1486 PolarHBondContact OG-OD2 2.86Å; L1452-D1486 VanDerWaalsContact C-OD2 3.27Å; L1452-D1486 WeakPolarHBondContact O-CB 3.41Å; M1453-D1486 WeakPolarHBondContact CA-OD1 3.49Å; V1455-D1486 HydrophobicContact CG2-CB 4.15Å; H1484-D1486 VanDerWaalsContact C-N 3.32Å; H1484-D1486 WeakPolarHBondContact CB-O 3.27Å; H1484-D1486 WeakPolarHBondContact CB-OD1 3.38Å; H1484-D1486 IonicContact CG-OD1 3.16Å; H1484-D1486 IonicContact ND1-OD1 3.38Å; D1486-Q1488 VanDerWaalsContact C-N 3.33Å; D1486-Q1488 PolarHBondContact O-N 3.06Å; D1486-Q1488 VanDerWaalsContact O-N 3.12Å; D1486-Q1488 WeakPolarHBondContact OD1-CB 3.44Å; D1486-Q1488 WeakPolarHBondContact OD1-CG 3.28Å; D1486-Q1488 PolarHBondContact OD1-N 3.33Å; D1486-S1489 VanDerWaalsContact CB-O 3.26Å; D1486-S1489 WeakPolarHBondContact CB-O 3.35Å; D1486-S1489 VanDerWaalsContact CG-O 3.31Å; D1486-S1489 CarbonylContact O-C 3.53Å; D1486-S1489 PolarHBondContact O-N 2.97Å; D1486-S1489 VanDerWaalsContact O-N 3.09Å; D1486-S1489 VanDerWaalsContact O-O 3.11Å; D1486-S1489 WeakPolarHBondContact OD2-CB 3.41Å; D1486-S1489 PolarHBondContact OD2-N 2.85Å; D1486-S1489 PolarHBondContact OD2-OG 3.44Å; D1486-S1490 PolarHBondContact O-N 2.78Å; D1486-S1490 VanDerWaalsContact OD2-CB 3.25Å; D1486-S1490 WeakPolarHBondContact OD2-CB 3.4Å; D1486-S1490 PolarHBondContact OD2-OG 3.01Å
1487	L	73.9	Confident	84.8	Confident	61.4 Å²	61.4	25.9 Å²	25.9	32%	0.321	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.2	-178.2	-108.5	133.2	0	0	0	112.9	H1484 R1485 L1515 P1516 D1517 L1970	H1484-L1487 HydrophobicContact CB-CB 4.41Å; H1484-L1487 HydrophobicContact CB-CD1 4.38Å; H1484-L1487 HydrophobicContact CB-CD2 4.12Å; H1484-L1487 HydrophobicContact CB-CG 4.24Å; R1485-L1487 VanDerWaalsContact C-N 3.29Å; R1485-L1487 PolarHBondContact O-N 3.13Å; L1487-L1515 WeakPolarHBondContact CD2-O 3.38Å; L1487-P1516 HydrophobicContact CD1-CB 4.35Å; L1487-P1516 HydrophobicContact CD2-CB 4.32Å; L1487-P1516 CarbonylContact O-C 3.56Å; L1487-P1516 WeakPolarHBondContact O-CA 3.3Å; L1487-D1517 WeakPolarHBondContact O-CB 3.34Å; L1487-D1517 PolarHBondContact O-N 3Å; L1487-L1970 HydrophobicContact CB-CD1 3.92Å; L1487-L1970 HydrophobicContact CD2-CD1 4.47Å
1488	Q	73.6	Confident	85.2	Confident	85.4 Å²	85.4	23 Å²	23	40%	0.399	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-17.1	-175.9	-65.7	-174.4	-10.7	0	0	114.1	D1486 L1970 I2178 R2179	D1486-Q1488 VanDerWaalsContact C-N 3.33Å; D1486-Q1488 PolarHBondContact O-N 3.06Å; D1486-Q1488 VanDerWaalsContact O-N 3.12Å; D1486-Q1488 WeakPolarHBondContact OD1-CB 3.44Å; D1486-Q1488 WeakPolarHBondContact OD1-CG 3.28Å; D1486-Q1488 PolarHBondContact OD1-N 3.33Å; Q1488-L1970 HydrophobicContact CG-CD1 4.21Å; Q1488-I2178 HydrophobicContact CB-CG2 4.18Å; Q1488-R2179 VanDerWaalsContact C-NH2 3.34Å; Q1488-R2179 VanDerWaalsContact CA-NH2 3.35Å; Q1488-R2179 PolarHBondContact O-NE 3.26Å; Q1488-R2179 PolarHBondContact O-NH2 2.87Å
1489	S	75.2	Confident	85.8	Confident	21.8 Å²	21.8	26.9 Å²	26.9	15%	0.152	13%	0.125	C	C	.	.			trans	-158	110.9	179.9	142.9	0	0	0	0	109.8	V1455 D1486 D1517 Q1519	V1455-S1489 WeakPolarHBondContact CG2-O 3.18Å; V1455-S1489 WeakPolarHBondContact CG2-OG 3.25Å; D1486-S1489 VanDerWaalsContact CB-O 3.26Å; D1486-S1489 WeakPolarHBondContact CB-O 3.35Å; D1486-S1489 VanDerWaalsContact CG-O 3.31Å; D1486-S1489 CarbonylContact O-C 3.53Å; D1486-S1489 PolarHBondContact O-N 2.97Å; D1486-S1489 VanDerWaalsContact O-N 3.09Å; D1486-S1489 VanDerWaalsContact O-O 3.11Å; D1486-S1489 WeakPolarHBondContact OD2-CB 3.41Å; D1486-S1489 PolarHBondContact OD2-N 2.85Å; D1486-S1489 PolarHBondContact OD2-OG 3.44Å; S1489-D1517 CarbonylContact C-O 3.54Å; S1489-D1517 WeakPolarHBondContact CA-O 3.47Å; S1489-Q1519 WeakPolarHBondContact OG-CG 3.42Å; S1489-Q1519 PolarHBondContact OG-NE2 3.08Å
1490	S	82.7	Confident	86.2	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.014	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-132	146.1	174.6	-173.2	0	0	0	0	110.2	S1413 D1486 N1492 P1516 D1517 P1518 Q1519	S1413-S1490 PolarHBondContact OG-OG 2.41Å; S1413-S1490 VanDerWaalsContact OG-OG 3.14Å; D1486-S1490 PolarHBondContact O-N 2.78Å; D1486-S1490 VanDerWaalsContact OD2-CB 3.25Å; D1486-S1490 WeakPolarHBondContact OD2-CB 3.4Å; D1486-S1490 PolarHBondContact OD2-OG 3.01Å; S1490-N1492 VanDerWaalsContact C-N 3.3Å; S1490-N1492 PolarHBondContact O-N 3.02Å; S1490-N1492 PolarHBondContact OG-N 3.16Å; S1490-N1492 PolarHBondContact OG-O 3.4Å; S1490-N1492 VanDerWaalsContact OG-O 3.13Å; S1490-P1516 VanDerWaalsContact CB-CG 3.49Å; S1490-D1517 PolarHBondContact N-O 2.95Å; S1490-P1518 VanDerWaalsContact O-CA 3.31Å; S1490-P1518 WeakPolarHBondContact O-CA 3.35Å; S1490-Q1519 PolarHBondContact O-N 3.25Å; S1490-Q1519 VanDerWaalsContact O-N 3.1Å
1491	A	84.9	Confident	86.5	Confident	0.8 Å²	0.8	29.3 Å²	29.3	1%	0.007	13%	0.134	C	C	.	.	S	Bend	trans	-92.8	13.3	169.3	0	0	0	0	0	111.5	S1413 R1425 V1455 S1459 L1461 A1462	S1413-A1491 PolarHBondContact OG-N 3Å; S1413-A1491 VanDerWaalsContact OG-N 3.14Å; R1425-A1491 VanDerWaalsContact CZ-CB 3.49Å; R1425-A1491 VanDerWaalsContact NH2-C 3.34Å; R1425-A1491 VanDerWaalsContact NH2-CB 3.31Å; R1425-A1491 PolarHBondContact NH2-O 3.14Å; V1455-A1491 HydrophobicContact CG1-CB 4.27Å; S1459-A1491 WeakPolarHBondContact OG-CB 3.48Å; L1461-A1491 CarbonylContact C-O 3.57Å; L1461-A1491 VanDerWaalsContact CA-O 3.28Å; L1461-A1491 WeakPolarHBondContact CA-O 3.33Å; L1461-A1491 VanDerWaalsContact CD1-C 3.48Å; L1461-A1491 VanDerWaalsContact CD1-O 3.3Å; L1461-A1491 WeakPolarHBondContact CD1-O 3.42Å; L1461-A1491 WeakPolarHBondContact CD2-O 2.82Å; A1462-A1491 PolarHBondContact N-O 3.17Å
1492	N	87.2	Confident	86.8	Confident	4.2 Å²	4.2	32.3 Å²	32.3	2%	0.022	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129	-176.2	-58.8	-45.5	0	0	0	111.8	Y1412 S1413 R1425 A1462 V1464 S1490 F1494	Y1412-N1492 PolarHBondContact O-ND2 3Å; S1413-N1492 PolarHBondContact OG-ND2 3.16Å; R1425-N1492 PolarHBondContact NE-OD1 3.24Å; R1425-N1492 PolarHBondContact NH2-OD1 3.05Å; A1462-N1492 CarbonylContact O-C 3.45Å; A1462-N1492 WeakPolarHBondContact O-CA 3.36Å; V1464-N1492 HydrophobicContact CG2-CB 4.43Å; S1490-N1492 VanDerWaalsContact C-N 3.3Å; S1490-N1492 PolarHBondContact O-N 3.02Å; S1490-N1492 PolarHBondContact OG-N 3.16Å; S1490-N1492 PolarHBondContact OG-O 3.4Å; S1490-N1492 VanDerWaalsContact OG-O 3.13Å; N1492-F1494 HydrophobicContact CB-CE2 3.88Å; N1492-F1494 HydrophobicContact CB-CZ 3.98Å; N1492-F1494 WeakPolarHBondContact O-CE2 3.24Å
1493	S	89.2	Confident	87.1	Confident	2.4 Å²	2.4	32.2 Å²	32.2	2%	0.017	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	139.2	166.6	179.5	0	0	0	0	110	A1462 E1463 V1464 S1526	A1462-S1493 PolarHBondContact O-N 2.99Å; E1463-S1493 CarbonylContact C-O 3.59Å; E1463-S1493 WeakPolarHBondContact CA-O 3.36Å; V1464-S1493 PolarHBondContact N-O 3.06Å; S1493-S1526 PolarHBondContact OG-O 3.12Å; S1493-S1526 VanDerWaalsContact OG-O 3.14Å
1494	F	92.3	Very high	87.7	Confident	1.4 Å²	1.4	34.5 Å²	34.5	1%	0.006	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.4	-174	-70.7	-84	0	0	0	111.6	H1411 V1448 V1464 E1482 H1484 N1492 L1515 P1516 H1527 R1528	H1411-F1494 HydrophobicContact CB-CZ 4.4Å; H1411-F1494 AromaticContact CD2-CE1 3.96Å; V1448-F1494 HydrophobicContact CG1-CE1 4.23Å; V1464-F1494 HydrophobicContact CB-CD1 3.91Å; V1464-F1494 HydrophobicContact CB-CE1 3.86Å; V1464-F1494 HydrophobicContact CB-CZ 4.34Å; V1464-F1494 HydrophobicContact CG1-CD1 4.04Å; V1464-F1494 HydrophobicContact CG1-CE1 3.86Å; V1464-F1494 HydrophobicContact CG2-CE1 4.35Å; V1464-F1494 HydrophobicContact CG2-CZ 4.36Å; V1464-F1494 CarbonylContact O-C 3.56Å; V1464-F1494 WeakPolarHBondContact O-CA 3.41Å; E1482-F1494 WeakPolarHBondContact OE1-CD1 3.23Å; E1482-F1494 VanDerWaalsContact OE1-CD2 3.24Å; E1482-F1494 WeakPolarHBondContact OE1-CD2 3.24Å; E1482-F1494 WeakPolarHBondContact OE1-CG 3.2Å; H1484-F1494 AromaticContact CE1-CE2 3.45Å; H1484-F1494 VanDerWaalsContact CE1-CE2 3.45Å; H1484-F1494 WeakPolarHBondContact CE1-CE2 3.35Å; H1484-F1494 AromaticContact CE1-CZ 3.3Å; H1484-F1494 WeakPolarHBondContact CE1-CZ 3.41Å; H1484-F1494 AromaticContact NE2-CD2 3.96Å; H1484-F1494 AromaticContact NE2-CE2 3.53Å; H1484-F1494 WeakPolarHBondContact NE2-CE2 3.28Å; H1484-F1494 AromaticContact NE2-CZ 3.66Å; N1492-F1494 HydrophobicContact CB-CE2 3.88Å; N1492-F1494 HydrophobicContact CB-CZ 3.98Å; N1492-F1494 WeakPolarHBondContact O-CE2 3.24Å; F1494-L1515 HydrophobicContact CB-CD2 4.1Å; F1494-P1516 HydrophobicContact CD2-CG 4.04Å; F1494-P1516 HydrophobicContact CE2-CG 3.8Å; F1494-H1527 AromaticContact CD2-CE1 3.9Å; F1494-H1527 AromaticContact CD2-ND1 3.92Å; F1494-H1527 PolarHBondContact N-ND1 3.21Å; F1494-H1527 WeakPolarHBondContact O-CA 3.35Å; F1494-R1528 PolarHBondContact O-N 3.01Å
1495	W	94.1	Very high	88.4	Confident	46 Å²	46	34.4 Å²	34.4	17%	0.174	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	110	173.2	179.6	21.7	0	0	0	110.9	V1464 A1465 Y1466 K1497 R1528 E1530	V1464-W1495 PolarHBondContact O-N 3.01Å; A1465-W1495 CarbonylContact C-O 3.56Å; A1465-W1495 VanDerWaalsContact CA-O 3.22Å; A1465-W1495 WeakPolarHBondContact CA-O 3.34Å; A1465-W1495 HydrophobicContact CB-CB 4.12Å; A1465-W1495 HydrophobicContact CB-CD2 4.32Å; A1465-W1495 HydrophobicContact CB-CE3 3.84Å; A1465-W1495 HydrophobicContact CB-CG 4.46Å; A1465-W1495 HydrophobicContact CB-CZ3 4.47Å; Y1466-W1495 PolarHBondContact N-O 3.06Å; W1495-K1497 HydrophobicContact CZ2-CD 4.17Å; W1495-R1528 CarbonylContact C-O 3.46Å; W1495-R1528 VanDerWaalsContact CA-O 3.29Å; W1495-R1528 WeakPolarHBondContact CA-O 3.42Å; W1495-R1528 HydrophobicContact CB-CB 4.29Å; W1495-R1528 VanDerWaalsContact CD1-CB 3.42Å; W1495-R1528 HydrophobicContact CG-CB 3.97Å; W1495-E1530 PolarHBondContact NE1-OE1 2.96Å
1496	W	95.8	Very high	89.3	Confident	0.8 Å²	0.8	31.3 Å²	31.3	0%	0.003	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.3	173.5	-71.8	90	0	0	0	110.3	I1446 V1448 Y1466 V1480 I1481 E1482 T1483 I1513 R1528 F1529 E1530	I1446-W1496 HydrophobicContact CG2-CH2 4.02Å; I1446-W1496 HydrophobicContact CG2-CZ3 4.38Å; V1448-W1496 HydrophobicContact CB-CZ2 4.47Å; V1448-W1496 HydrophobicContact CG2-CH2 3.78Å; V1448-W1496 HydrophobicContact CG2-CZ2 3.84Å; Y1466-W1496 VanDerWaalsContact CB-CE3 3.46Å; Y1466-W1496 VanDerWaalsContact CB-CZ3 3.43Å; Y1466-W1496 AromaticContact CD1-CH2 3.9Å; Y1466-W1496 HydrophobicContact CD1-CH2 4.14Å; Y1466-W1496 AromaticContact CD1-CZ3 3.85Å; Y1466-W1496 HydrophobicContact CD1-CZ3 4.22Å; Y1466-W1496 HydrophobicContact CD2-CD2 4.39Å; Y1466-W1496 AromaticContact CD2-CE2 3.97Å; Y1466-W1496 HydrophobicContact CD2-CE3 4.26Å; Y1466-W1496 AromaticContact CD2-CH2 3.89Å; Y1466-W1496 HydrophobicContact CD2-CH2 3.93Å; Y1466-W1496 AromaticContact CD2-CZ2 3.81Å; Y1466-W1496 HydrophobicContact CD2-CZ2 3.81Å; Y1466-W1496 AromaticContact CD2-CZ3 3.96Å; Y1466-W1496 HydrophobicContact CD2-CZ3 4.3Å; Y1466-W1496 HydrophobicContact CE1-CH2 4.19Å; Y1466-W1496 AromaticContact CE2-CH2 3.97Å; Y1466-W1496 HydrophobicContact CE2-CH2 4.23Å; Y1466-W1496 AromaticContact CE2-CZ2 3.92Å; Y1466-W1496 HydrophobicContact CE2-CZ2 4.24Å; Y1466-W1496 HydrophobicContact CG-CD2 4.43Å; Y1466-W1496 AromaticContact CG-CE3 3.88Å; Y1466-W1496 HydrophobicContact CG-CE3 4.13Å; Y1466-W1496 AromaticContact CG-CH2 3.77Å; Y1466-W1496 HydrophobicContact CG-CH2 3.77Å; Y1466-W1496 HydrophobicContact CG-CZ2 4.12Å; Y1466-W1496 AromaticContact CG-CZ3 3.77Å; Y1466-W1496 HydrophobicContact CG-CZ3 3.77Å; Y1466-W1496 VanDerWaalsContact CG-CZ3 3.49Å; V1480-W1496 HydrophobicContact CG1-CH2 3.8Å; V1480-W1496 HydrophobicContact CG1-CZ3 3.79Å; I1481-W1496 HydrophobicContact CD1-CE3 4.16Å; I1481-W1496 HydrophobicContact CD1-CZ3 3.99Å; I1481-W1496 HydrophobicContact CG2-CH2 3.76Å; I1481-W1496 HydrophobicContact CG2-CZ2 4.36Å; I1481-W1496 HydrophobicContact CG2-CZ3 3.9Å; E1482-W1496 HydrophobicContact CB-CZ2 4.37Å; E1482-W1496 WeakPolarHBondContact OE2-CZ2 3.43Å; E1482-W1496 PolarHBondContact OE2-NE1 3.02Å; T1483-W1496 HydrophobicContact CG2-CZ2 4.17Å; W1496-I1513 HydrophobicContact CD2-CD1 4.1Å; W1496-I1513 HydrophobicContact CE3-CD1 4.5Å; W1496-I1513 HydrophobicContact CG-CD1 4.14Å; W1496-R1528 PolarHBondContact N-O 2.78Å; W1496-F1529 HydrophobicContact CB-CD2 3.52Å; W1496-F1529 VanDerWaalsContact CB-CD2 3.5Å; W1496-F1529 HydrophobicContact CB-CE2 3.94Å; W1496-F1529 HydrophobicContact CB-CG 4.41Å; W1496-F1529 HydrophobicContact CG-CD2 4.16Å; W1496-F1529 HydrophobicContact CG-CE2 4.44Å; W1496-F1529 CarbonylContact O-C 3.49Å; W1496-F1529 WeakPolarHBondContact O-CA 3.29Å; W1496-E1530 PolarHBondContact O-N 3.2Å
1497	K	96	Very high	90.2	Very high	67.4 Å²	67.4	36.1 Å²	36.1	29%	0.293	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	112.5	174.5	-175.7	171.9	-174.7	169.3	0	110.2	Y1466 L1467 I1468 W1495 E1530	Y1466-K1497 PolarHBondContact O-N 2.96Å; L1467-K1497 CarbonylContact C-O 3.5Å; L1467-K1497 WeakPolarHBondContact CA-O 3.36Å; L1467-K1497 HydrophobicContact CD2-CB 3.75Å; L1467-K1497 HydrophobicContact CD2-CD 4.08Å; L1467-K1497 HydrophobicContact CD2-CG 4.39Å; L1467-K1497 HydrophobicContact CG-CB 4.19Å; I1468-K1497 PolarHBondContact N-O 3.08Å; W1495-K1497 HydrophobicContact CZ2-CD 4.17Å; K1497-E1530 CarbonylContact C-O 3.54Å; K1497-E1530 WeakPolarHBondContact CA-O 3.28Å; K1497-E1530 HydrophobicContact CB-CB 4.4Å; K1497-E1530 WeakPolarHBondContact CD-OE2 3.23Å; K1497-E1530 VanDerWaalsContact CE-OE2 3.29Å; K1497-E1530 WeakPolarHBondContact CE-OE2 3.31Å; K1497-E1530 HydrophobicContact CG-CB 4.13Å; K1497-E1530 IonicContact NZ-OE2 3.69Å; K1497-E1530 PolarHBondContact NZ-OE2 3.36Å
1498	I	96.2	Very high	90.8	Very high	0.4 Å²	0.4	37.5 Å²	37.5	0%	0.002	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.9	176.9	-55.1	177.5	0	0	0	107.4	I1468 I1481 F1503 L1511 F1529 E1530 L1531 R1532	I1468-I1498 HydrophobicContact CB-CG1 4.34Å; I1468-I1498 HydrophobicContact CD1-CD1 4.41Å; I1468-I1498 HydrophobicContact CD1-CG1 4.2Å; I1468-I1498 HydrophobicContact CG1-CG1 4.48Å; I1468-I1498 WeakPolarHBondContact O-CA 3.34Å; I1481-I1498 HydrophobicContact CD1-CD1 3.94Å; I1498-F1503 HydrophobicContact CG2-CE2 4Å; I1498-F1503 HydrophobicContact CG2-CZ 4.21Å; I1498-L1511 HydrophobicContact CD1-CD1 3.83Å; I1498-L1511 HydrophobicContact CD1-CD2 3.76Å; I1498-L1511 HydrophobicContact CD1-CG 4.47Å; I1498-F1529 HydrophobicContact CD1-CE2 4.46Å; I1498-F1529 HydrophobicContact CD1-CZ 4.36Å; I1498-E1530 PolarHBondContact N-O 3.16Å; I1498-L1531 HydrophobicContact CB-CD1 3.63Å; I1498-L1531 HydrophobicContact CD1-CD1 4.37Å; I1498-L1531 HydrophobicContact CG2-CD1 3.57Å; I1498-L1531 WeakPolarHBondContact O-CA 3.38Å; I1498-R1532 PolarHBondContact O-N 3.28Å
1499	W	96.3	Very high	91.1	Very high	87 Å²	87	33.6 Å²	33.6	33%	0.33	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137.4	-173.5	-175.3	45.5	0	0	0	111.3	I1468 D1469 N1470 S1501 R1532 E1533	I1468-W1499 PolarHBondContact O-N 2.97Å; D1469-W1499 HydrophobicContact CB-CE3 4.47Å; D1469-W1499 VanDerWaalsContact OD1-CE3 3.22Å; D1469-W1499 WeakPolarHBondContact OD1-CZ3 3.34Å; N1470-W1499 PolarHBondContact N-O 3.01Å; W1499-S1501 PolarHBondContact O-N 3.17Å; W1499-S1501 PolarHBondContact O-OG 3.12Å; W1499-R1532 WeakPolarHBondContact CA-O 3.37Å; W1499-E1533 PolarHBondContact NE1-OE2 2.99Å
1500	Q	96.3	Very high	91.6	Very high	72.4 Å²	72.4	33 Å²	33	34%	0.338	15%	0.151	S	C	.	.	S	Bend	trans	50.1	31.6	176.1	-71.3	179.8	-3.9	0	0	114.3	N1470 R1532 E1533 S1534	N1470-Q1500 WeakPolarHBondContact CA-O 3.35Å; Q1500-R1532 PolarHBondContact N-O 2.96Å; Q1500-R1532 VanDerWaalsContact N-O 3.13Å; Q1500-E1533 WeakPolarHBondContact CA-O 3.41Å; Q1500-E1533 HydrophobicContact CG-CB 3.96Å; Q1500-E1533 WeakPolarHBondContact CG-OE2 3.43Å; Q1500-E1533 PolarHBondContact NE2-OE2 2.97Å; Q1500-S1534 PolarHBondContact N-OG 3.2Å
1501	S	96.4	Very high	92	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.151	C	C	.	.			trans	-105.7	147.4	-171.5	-66.6	0	0	0	0	112	I1468 N1470 C1471 W1499 S1534 N1535	I1468-S1501 PolarHBondContact O-OG 3.13Å; N1470-S1501 PolarHBondContact N-OG 3.3Å; C1471-S1501 PolarHBondContact N-OG 2.8Å; C1471-S1501 VanDerWaalsContact N-OG 3.1Å; C1471-S1501 CarbonylContact O-C 3.48Å; C1471-S1501 VanDerWaalsContact O-CA 3.29Å; C1471-S1501 WeakPolarHBondContact O-CA 3.38Å; C1471-S1501 WeakPolarHBondContact O-CB 3.41Å; W1499-S1501 PolarHBondContact O-N 3.17Å; W1499-S1501 PolarHBondContact O-OG 3.12Å; S1501-S1534 PolarHBondContact N-OG 3.1Å; S1501-S1534 CarbonylContact O-C 3.51Å; S1501-S1534 VanDerWaalsContact O-CA 3.27Å; S1501-S1534 WeakPolarHBondContact O-CA 3.28Å; S1501-S1534 VanDerWaalsContact O-CB 3.27Å; S1501-S1534 WeakPolarHBondContact O-CB 3.36Å; S1501-N1535 PolarHBondContact O-N 3.09Å
1502	N	95.7	Very high	92.2	Very high	73.6 Å²	73.6	34.1 Å²	34.1	39%	0.394	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121	-177.4	-68.9	-35.3	0	0	0	110.7	C1471 S1472 V1473 F1504 N1535	C1471-N1502 PolarHBondContact O-N 3.1Å; S1472-N1502 WeakPolarHBondContact CA-O 3.4Å; V1473-N1502 PolarHBondContact N-O 2.98Å; N1502-F1504 HydrophobicContact CB-CD1 4.4Å; N1502-N1535 CarbonylContact C-O 3.59Å; N1502-N1535 WeakPolarHBondContact CA-O 3.42Å; N1502-N1535 WeakPolarHBondContact OD1-CB 3.39Å
1503	F	95.2	Very high	92.4	Very high	9 Å²	9	34 Å²	34	4%	0.039	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	103.9	175.9	-67.6	-100.3	0	0	0	108.9	V1473 V1480 I1498 N1535 F1536 Q1537 N1539	V1473-F1503 HydrophobicContact CB-CD1 3.57Å; V1473-F1503 HydrophobicContact CB-CE1 3.79Å; V1473-F1503 HydrophobicContact CB-CG 4.19Å; V1473-F1503 HydrophobicContact CB-CZ 4.45Å; V1473-F1503 HydrophobicContact CG1-CD1 3.78Å; V1473-F1503 HydrophobicContact CG1-CE1 3.99Å; V1473-F1503 HydrophobicContact CG2-CD1 3.93Å; V1473-F1503 HydrophobicContact CG2-CE1 3.61Å; V1473-F1503 HydrophobicContact CG2-CE2 4.47Å; V1473-F1503 HydrophobicContact CG2-CZ 4.04Å; V1473-F1503 VanDerWaalsContact O-CA 3.31Å; V1473-F1503 WeakPolarHBondContact O-CA 3.32Å; V1480-F1503 HydrophobicContact CG1-CD1 3.91Å; V1480-F1503 HydrophobicContact CG1-CE1 3.69Å; I1498-F1503 HydrophobicContact CG2-CE2 4Å; I1498-F1503 HydrophobicContact CG2-CZ 4.21Å; F1503-N1535 PolarHBondContact N-O 2.97Å; F1503-F1536 HydrophobicContact CB-CD1 3.48Å; F1503-F1536 VanDerWaalsContact CB-CD1 3.47Å; F1503-F1536 HydrophobicContact CB-CE1 3.75Å; F1503-F1536 HydrophobicContact CB-CG 4.18Å; F1503-F1536 HydrophobicContact CD1-CD1 4.46Å; F1503-F1536 AromaticContact CD1-CE1 3.95Å; F1503-F1536 HydrophobicContact CD1-CE1 3.96Å; F1503-F1536 AromaticContact CD2-CD1 3.96Å; F1503-F1536 HydrophobicContact CD2-CD1 3.99Å; F1503-F1536 HydrophobicContact CD2-CD2 4.37Å; F1503-F1536 AromaticContact CD2-CE1 3.46Å; F1503-F1536 HydrophobicContact CD2-CE1 3.46Å; F1503-F1536 VanDerWaalsContact CD2-CE1 3.44Å; F1503-F1536 AromaticContact CD2-CE2 3.95Å; F1503-F1536 HydrophobicContact CD2-CE2 4.28Å; F1503-F1536 HydrophobicContact CD2-CG 4.34Å; F1503-F1536 AromaticContact CD2-CZ 3.62Å; F1503-F1536 HydrophobicContact CD2-CZ 3.62Å; F1503-F1536 VanDerWaalsContact CD2-CZ 3.45Å; F1503-F1536 HydrophobicContact CE1-CE1 4.43Å; F1503-F1536 AromaticContact CE2-CE1 3.97Å; F1503-F1536 HydrophobicContact CE2-CE1 4Å; F1503-F1536 HydrophobicContact CE2-CE2 4.27Å; F1503-F1536 AromaticContact CE2-CZ 3.87Å; F1503-F1536 HydrophobicContact CE2-CZ 3.87Å; F1503-F1536 AromaticContact CG-CD1 3.76Å; F1503-F1536 HydrophobicContact CG-CD1 3.76Å; F1503-F1536 AromaticContact CG-CE1 3.45Å; F1503-F1536 HydrophobicContact CG-CE1 3.45Å; F1503-F1536 VanDerWaalsContact CG-CE1 3.45Å; F1503-F1536 HydrophobicContact CG-CZ 4.12Å; F1503-F1536 HydrophobicContact CZ-CE1 4.44Å; F1503-F1536 HydrophobicContact CZ-CZ 4.34Å; F1503-F1536 CarbonylContact O-C 3.58Å; F1503-F1536 WeakPolarHBondContact O-CA 3.41Å; F1503-Q1537 PolarHBondContact O-N 3.18Å; F1503-N1539 PolarHBondContact O-ND2 3.04Å; F1503-N1539 VanDerWaalsContact O-ND2 3.1Å
1504	F	93.9	Very high	92.4	Very high	67.8 Å²	67.8	35 Å²	35	30%	0.297	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140	-175.4	72.6	-93.8	0	0	0	114.7	S1472 V1473 S1474 F1475 N1502 N1506 Q1537	S1472-F1504 WeakPolarHBondContact OG-CE1 3.27Å; V1473-F1504 PolarHBondContact O-N 3.25Å; S1474-F1504 VanDerWaalsContact CA-O 3.28Å; S1474-F1504 WeakPolarHBondContact CA-O 3.39Å; S1474-F1504 VanDerWaalsContact CB-CE2 3.46Å; S1474-F1504 WeakPolarHBondContact CB-O 3.5Å; S1474-F1504 VanDerWaalsContact OG-CZ 3.3Å; S1474-F1504 WeakPolarHBondContact OG-CZ 3.37Å; F1475-F1504 HydrophobicContact CD2-CE2 4.22Å; F1475-F1504 HydrophobicContact CE1-CE2 4.46Å; F1475-F1504 HydrophobicContact CE2-CD2 4.47Å; F1475-F1504 AromaticContact CE2-CE2 3.63Å; F1475-F1504 HydrophobicContact CE2-CE2 3.63Å; F1475-F1504 VanDerWaalsContact CE2-CE2 3.48Å; F1475-F1504 AromaticContact CE2-CZ 3.94Å; F1475-F1504 HydrophobicContact CE2-CZ 4.17Å; F1475-F1504 HydrophobicContact CZ-CD2 4.43Å; F1475-F1504 AromaticContact CZ-CE2 3.78Å; F1475-F1504 HydrophobicContact CZ-CE2 3.88Å; F1475-F1504 HydrophobicContact CZ-CZ 4.47Å; F1475-F1504 PolarHBondContact N-O 3.12Å; N1502-F1504 HydrophobicContact CB-CD1 4.4Å; F1504-N1506 VanDerWaalsContact C-N 3.26Å; F1504-N1506 PolarHBondContact N-ND2 3.27Å; F1504-N1506 PolarHBondContact O-N 2.98Å; F1504-N1506 PolarHBondContact O-ND2 3.13Å; F1504-Q1537 VanDerWaalsContact CA-O 3.25Å; F1504-Q1537 WeakPolarHBondContact CA-O 3.33Å; F1504-Q1537 HydrophobicContact CB-CB 4.45Å
1505	S	94.3	Very high	92.3	Very high	31.6 Å²	31.6	35 Å²	35	22%	0.221	17%	0.166	C	C	.	.	S	Bend	trans	50	42.2	174.9	-52.7	0	0	0	0	113.9	F1475 Q1537 D1538 N1539	F1475-S1505 VanDerWaalsContact CA-O 3.31Å; F1475-S1505 WeakPolarHBondContact CA-O 3.37Å; F1475-S1505 PolarHBondContact N-O 3.22Å; S1505-Q1537 PolarHBondContact N-O 3.1Å; S1505-Q1537 VanDerWaalsContact N-O 3.12Å; S1505-D1538 VanDerWaalsContact CA-O 3.3Å; S1505-D1538 WeakPolarHBondContact CA-O 3.39Å; S1505-D1538 PolarHBondContact OG-OD2 3.11Å; S1505-D1538 VanDerWaalsContact OG-OD2 3.04Å; S1505-N1539 PolarHBondContact N-OD1 3.18Å
1506	N	93.6	Very high	92	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.016	16%	0.157	C	C	.	.			trans	-92.5	147.4	173.1	-57.3	-76.1	0	0	0	110.6	V1473 S1474 F1475 N1476 F1504 S1509 N1539 V1540	V1473-N1506 PolarHBondContact O-ND2 2.94Å; V1473-N1506 PolarHBondContact O-OD1 3.3Å; S1474-N1506 VanDerWaalsContact C-OD1 3.27Å; S1474-N1506 WeakPolarHBondContact CA-OD1 3.32Å; S1474-N1506 PolarHBondContact N-OD1 2.79Å; F1475-N1506 PolarHBondContact N-OD1 3Å; N1476-N1506 WeakPolarHBondContact CB-OD1 3.28Å; N1476-N1506 PolarHBondContact N-OD1 3.01Å; N1476-N1506 VanDerWaalsContact N-OD1 3.1Å; N1476-N1506 PolarHBondContact ND2-OD1 3.01Å; N1476-N1506 VanDerWaalsContact ND2-OD1 3.11Å; N1476-N1506 CarbonylContact O-C 3.45Å; N1476-N1506 WeakPolarHBondContact O-CA 3.25Å; F1504-N1506 VanDerWaalsContact C-N 3.26Å; F1504-N1506 PolarHBondContact N-ND2 3.27Å; F1504-N1506 PolarHBondContact O-N 2.98Å; F1504-N1506 PolarHBondContact O-ND2 3.13Å; N1506-S1509 PolarHBondContact O-OG 3.04Å; N1506-N1539 WeakPolarHBondContact CB-OD1 3.23Å; N1506-N1539 PolarHBondContact N-OD1 3.19Å; N1506-N1539 VanDerWaalsContact N-OD1 3.09Å; N1506-N1539 PolarHBondContact ND2-OD1 3.03Å; N1506-N1539 VanDerWaalsContact ND2-OD1 3.08Å; N1506-N1539 WeakPolarHBondContact O-CA 3.39Å; N1506-V1540 PolarHBondContact O-N 3.14Å
1507	Y	91.5	Very high	91.4	Very high	119.4 Å²	119.4	34 Å²	34	47%	0.468	16%	0.164	S	C	.	.	B	Isolated β-bridge	trans	-105.7	144.1	178	-134.6	-91.8	0	0	0	110.1	N1476 N1477 G1478 S1509 V1540	N1476-Y1507 PolarHBondContact O-N 2.92Å; N1477-Y1507 CarbonylContact C-O 3.58Å; N1477-Y1507 WeakPolarHBondContact CA-O 3.3Å; N1477-Y1507 VanDerWaalsContact OD1-CD1 3.31Å; N1477-Y1507 WeakPolarHBondContact OD1-CD1 3.38Å; G1478-Y1507 PolarHBondContact N-O 2.82Å; Y1507-S1509 VanDerWaalsContact C-N 3.25Å; Y1507-S1509 PolarHBondContact O-N 2.91Å; Y1507-S1509 VanDerWaalsContact O-N 3.11Å; Y1507-V1540 HydrophobicContact CD1-CB 4.03Å; Y1507-V1540 HydrophobicContact CD1-CG1 4.41Å; Y1507-V1540 HydrophobicContact CD1-CG2 4.25Å; Y1507-V1540 HydrophobicContact CD2-CB 4.03Å; Y1507-V1540 HydrophobicContact CD2-CG1 3.84Å; Y1507-V1540 HydrophobicContact CE1-CB 4.46Å; Y1507-V1540 HydrophobicContact CE1-CG2 4.25Å; Y1507-V1540 HydrophobicContact CE2-CG1 3.95Å
1508	E	85.6	Confident	90.5	Very high	90.4 Å²	90.4	31.3 Å²	31.3	42%	0.422	15%	0.153	S	C	.	.	S	Bend	trans	47.4	43.7	-171.6	-69.9	-176.5	179.8	0	0	111.9	G1478 S1479 G1510 V1540 D1541	G1478-E1508 CarbonylContact C-O 3.56Å; G1478-E1508 VanDerWaalsContact C-O 3.27Å; G1478-E1508 VanDerWaalsContact CA-O 3.22Å; G1478-E1508 WeakPolarHBondContact CA-O 3.34Å; S1479-E1508 PolarHBondContact N-O 2.97Å; S1479-E1508 PolarHBondContact OG-O 3.3Å; E1508-G1510 VanDerWaalsContact C-N 3.27Å; E1508-G1510 PolarHBondContact O-N 2.83Å; E1508-V1540 PolarHBondContact N-O 3.05Å; E1508-V1540 VanDerWaalsContact N-O 3.12Å; E1508-D1541 HydrophobicContact CG-CB 4.41Å
1509	S	81.1	Confident	89.1	Confident	4.8 Å²	4.8	34.3 Å²	34.3	3%	0.034	17%	0.167	C	C	.	.			trans	-90.7	150.4	-166.2	65.4	0	0	0	0	113	S1479 N1506 Y1507 N1539 V1540 D1541 F1542 Q1543	S1479-S1509 WeakPolarHBondContact OG-CA 3.25Å; N1506-S1509 PolarHBondContact O-OG 3.04Å; Y1507-S1509 VanDerWaalsContact C-N 3.25Å; Y1507-S1509 PolarHBondContact O-N 2.91Å; Y1507-S1509 VanDerWaalsContact O-N 3.11Å; S1509-N1539 WeakPolarHBondContact OG-CB 3.35Å; S1509-V1540 PolarHBondContact N-O 2.95Å; S1509-V1540 PolarHBondContact OG-O 3.05Å; S1509-D1541 PolarHBondContact N-O 2.74Å; S1509-F1542 CarbonylContact O-C 3.55Å; S1509-F1542 VanDerWaalsContact O-CA 3.28Å; S1509-F1542 WeakPolarHBondContact O-CA 3.32Å; S1509-F1542 WeakPolarHBondContact OG-CA 3.45Å; S1509-F1542 WeakPolarHBondContact OG-CB 3.33Å; S1509-F1542 WeakPolarHBondContact OG-CD2 3.37Å; S1509-F1542 PolarHBondContact OG-N 3.4Å; S1509-Q1543 PolarHBondContact O-N 2.82Å
1510	G	84.4	Confident	87.5	Confident	8 Å²	8	33.5 Å²	33.5	8%	0.082	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155	-174.3	177.3	0	0	0	0	0	113.7	S1479 V1480 I1481 E1508 Q1543	S1479-G1510 CarbonylContact C-O 3.57Å; S1479-G1510 WeakPolarHBondContact CA-O 3.33Å; S1479-G1510 WeakPolarHBondContact CB-O 3.27Å; S1479-G1510 PolarHBondContact OG-N 2.78Å; S1479-G1510 VanDerWaalsContact OG-N 3.08Å; V1480-G1510 PolarHBondContact N-O 3.05Å; I1481-G1510 PolarHBondContact N-O 3.4Å; E1508-G1510 VanDerWaalsContact C-N 3.27Å; E1508-G1510 PolarHBondContact O-N 2.83Å; G1510-Q1543 CarbonylContact C-O 3.4Å; G1510-Q1543 VanDerWaalsContact CA-O 3.27Å; G1510-Q1543 WeakPolarHBondContact CA-O 3.28Å
1511	L	91.4	Very high	85.5	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	108.5	174.5	-74.4	112.6	0	0	0	107.6	V1480 I1481 I1498 I1513 F1529 F1536 F1542 Q1543 F1544 L1545	V1480-L1511 HydrophobicContact CB-CD1 3.63Å; V1480-L1511 HydrophobicContact CB-CD2 3.57Å; V1480-L1511 VanDerWaalsContact CB-CD2 3.47Å; V1480-L1511 HydrophobicContact CB-CG 4.21Å; V1480-L1511 HydrophobicContact CG1-CD1 4.14Å; V1480-L1511 HydrophobicContact CG1-CD2 3.97Å; V1480-L1511 HydrophobicContact CG1-CG 4.39Å; V1480-L1511 HydrophobicContact CG2-CD1 3.95Å; V1480-L1511 HydrophobicContact CG2-CD2 3.91Å; V1480-L1511 CarbonylContact O-C 3.58Å; V1480-L1511 WeakPolarHBondContact O-CA 3.2Å; I1481-L1511 HydrophobicContact CB-CG 4.46Å; I1481-L1511 HydrophobicContact CD1-CD2 4.24Å; I1481-L1511 HydrophobicContact CG1-CG 4.43Å; I1498-L1511 HydrophobicContact CD1-CD1 3.83Å; I1498-L1511 HydrophobicContact CD1-CD2 3.76Å; I1498-L1511 HydrophobicContact CD1-CG 4.47Å; L1511-I1513 HydrophobicContact CD2-CD1 4.26Å; L1511-F1529 HydrophobicContact CD1-CZ 4.38Å; L1511-F1529 HydrophobicContact CD2-CE2 4.33Å; L1511-F1529 HydrophobicContact CD2-CZ 4.21Å; L1511-F1536 HydrophobicContact CD1-CE1 3.94Å; L1511-F1536 HydrophobicContact CD1-CZ 4.02Å; L1511-F1536 HydrophobicContact CD2-CE1 4.23Å; L1511-F1536 HydrophobicContact CD2-CZ 4.39Å; L1511-F1542 HydrophobicContact CD1-CE2 4.26Å; L1511-Q1543 PolarHBondContact N-O 2.97Å; L1511-F1544 HydrophobicContact CB-CD2 3.84Å; L1511-F1544 HydrophobicContact CB-CE2 4.04Å; L1511-F1544 HydrophobicContact CB-CG 4.35Å; L1511-F1544 HydrophobicContact CB-CZ 4.49Å; L1511-F1544 HydrophobicContact CD1-CD2 3.78Å; L1511-F1544 HydrophobicContact CD1-CE2 3.77Å; L1511-F1544 HydrophobicContact CD1-CZ 4.44Å; L1511-F1544 HydrophobicContact CD2-CD2 4.13Å; L1511-F1544 HydrophobicContact CD2-CE2 3.9Å; L1511-F1544 HydrophobicContact CD2-CZ 4.45Å; L1511-F1544 HydrophobicContact CG-CD2 4.29Å; L1511-F1544 HydrophobicContact CG-CE2 4.25Å; L1511-F1544 CarbonylContact O-C 3.57Å; L1511-F1544 WeakPolarHBondContact O-CA 3.41Å; L1511-L1545 PolarHBondContact O-N 3.32Å; L1511-L1545 VanDerWaalsContact O-O 3.14Å
1512	S	90.2	Very high	83.5	Confident	26.2 Å²	26.2	40.8 Å²	40.8	18%	0.183	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	99.2	177.1	-175.7	0	0	0	0	109.3	V1480 I1481 E1482 T1483 L1545 Y1872	V1480-S1512 PolarHBondContact O-N 3.08Å; I1481-S1512 CarbonylContact C-O 3.53Å; I1481-S1512 VanDerWaalsContact CA-O 3.28Å; I1481-S1512 WeakPolarHBondContact CA-O 3.29Å; I1481-S1512 PolarHBondContact O-N 2.88Å; E1482-S1512 PolarHBondContact N-O 2.98Å; T1483-S1512 PolarHBondContact N-O 3.27Å; T1483-S1512 VanDerWaalsContact N-O 3.15Å; T1483-S1512 PolarHBondContact OG1-O 3.46Å; S1512-L1545 CarbonylContact C-O 3.41Å; S1512-L1545 WeakPolarHBondContact CA-O 3.37Å; S1512-Y1872 PolarHBondContact OG-OH 2.88Å
1513	I	91.8	Very high	81.5	Confident	1.6 Å²	1.6	41.8 Å²	41.8	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.9	-175.8	-64	169.1	0	0	0	109.1	I1481 E1482 T1483 W1496 L1511 L1515 F1529 L1545 L1546 S1547	I1481-I1513 HydrophobicContact CD1-CD1 4.46Å; I1481-I1513 HydrophobicContact CG2-CD1 4.2Å; I1481-I1513 HydrophobicContact CG2-CG1 3.84Å; E1482-I1513 HydrophobicContact CB-CB 4.37Å; E1482-I1513 HydrophobicContact CB-CG1 4.38Å; E1482-I1513 HydrophobicContact CB-CG2 4.26Å; E1482-I1513 VanDerWaalsContact OE2-CG2 3.3Å; E1482-I1513 WeakPolarHBondContact OE2-CG2 3.32Å; T1483-I1513 HydrophobicContact CG2-CG1 4.48Å; T1483-I1513 HydrophobicContact CG2-CG2 4.47Å; W1496-I1513 HydrophobicContact CD2-CD1 4.1Å; W1496-I1513 HydrophobicContact CE3-CD1 4.5Å; W1496-I1513 HydrophobicContact CG-CD1 4.14Å; L1511-I1513 HydrophobicContact CD2-CD1 4.26Å; I1513-L1515 HydrophobicContact CG2-CD2 3.81Å; I1513-L1515 HydrophobicContact CG2-CG 4.13Å; I1513-F1529 HydrophobicContact CD1-CD2 3.88Å; I1513-F1529 HydrophobicContact CD1-CE2 3.45Å; I1513-F1529 VanDerWaalsContact CD1-CE2 3.44Å; I1513-F1529 HydrophobicContact CD1-CZ 4.48Å; I1513-L1545 PolarHBondContact N-O 3.15Å; I1513-L1546 HydrophobicContact CB-CD1 3.69Å; I1513-L1546 HydrophobicContact CG2-CD1 3.54Å; I1513-L1546 CarbonylContact O-C 3.49Å; I1513-L1546 WeakPolarHBondContact O-CA 3.34Å; I1513-S1547 PolarHBondContact O-N 3.06Å
1514	S	89	Confident	79.9	Confident	22.4 Å²	22.4	49.2 Å²	49.2	16%	0.157	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	105.1	176.5	-62.7	0	0	0	0	109.3	E1482 T1483 H1484 S1547	E1482-S1514 PolarHBondContact O-N 3.31Å; T1483-S1514 PolarHBondContact OG1-N 2.92Å; H1484-S1514 PolarHBondContact CD2-O 3.03Å; H1484-S1514 VanDerWaalsContact CD2-O 3.27Å; H1484-S1514 PolarHBondContact NE2-O 2.61Å; S1514-S1547 WeakPolarHBondContact CA-OG 3.23Å; S1514-S1547 WeakPolarHBondContact CB-OG 3.4Å; S1514-S1547 PolarHBondContact OG-OG 3.02Å; S1514-S1547 VanDerWaalsContact OG-OG 3.12Å
1515	L	90.4	Very high	78.8	Confident	1.8 Å²	1.8	48.8 Å²	48.8	1%	0.009	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.5	-175.4	-60.6	171.4	0	0	0	110.9	L1487 F1494 I1513 H1527 L1546 S1547 G1548 Y1549 A1551	L1487-L1515 WeakPolarHBondContact CD2-O 3.38Å; F1494-L1515 HydrophobicContact CB-CD2 4.1Å; I1513-L1515 HydrophobicContact CG2-CD2 3.81Å; I1513-L1515 HydrophobicContact CG2-CG 4.13Å; L1515-H1527 HydrophobicContact CD1-CB 3.86Å; L1515-H1527 HydrophobicContact CD2-CB 4.27Å; L1515-H1527 HydrophobicContact CG-CB 4.47Å; L1515-L1546 HydrophobicContact CD1-CD1 4.09Å; L1515-L1546 HydrophobicContact CG-CD1 4.27Å; L1515-S1547 PolarHBondContact N-O 3.17Å; L1515-G1548 CarbonylContact O-C 3.53Å; L1515-G1548 WeakPolarHBondContact O-CA 3.25Å; L1515-Y1549 PolarHBondContact O-N 3.07Å; L1515-A1551 HydrophobicContact CD1-CB 3.51Å; L1515-A1551 VanDerWaalsContact CD1-CB 3.48Å
1516	P	87.5	Confident	78.1	Confident	0.2 Å²	0.2	49.4 Å²	49.4	0%	0.001	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-76.1	162.3	-177.9	32.8	-34.8	0	0	0	112.4	H1484 L1487 S1490 F1494 P1518 H1527 Y1549	H1484-P1516 HydrophobicContact CB-CB 4.43Å; H1484-P1516 VanDerWaalsContact CD2-CD 3.49Å; H1484-P1516 WeakPolarHBondContact CD2-CD 3.28Å; H1484-P1516 WeakPolarHBondContact NE2-CD 3.43Å; L1487-P1516 HydrophobicContact CD1-CB 4.35Å; L1487-P1516 HydrophobicContact CD2-CB 4.32Å; L1487-P1516 CarbonylContact O-C 3.56Å; L1487-P1516 WeakPolarHBondContact O-CA 3.3Å; S1490-P1516 VanDerWaalsContact CB-CG 3.49Å; F1494-P1516 HydrophobicContact CD2-CG 4.04Å; F1494-P1516 HydrophobicContact CE2-CG 3.8Å; P1516-P1518 WeakPolarHBondContact O-CD 3.45Å; P1516-H1527 PolarHBondContact O-CE1 2.94Å; P1516-H1527 PolarHBondContact O-NE2 3.17Å; P1516-H1527 VanDerWaalsContact O-NE2 3.13Å; P1516-Y1549 VanDerWaalsContact O-CB 3.29Å; P1516-Y1549 WeakPolarHBondContact O-CB 3.38Å
1517	D	82.5	Confident	78	Confident	25 Å²	25	49.3 Å²	49.3	13%	0.134	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-79.7	122.8	175.3	-157.2	-9.7	0	0	0	111	L1487 S1489 S1490 Q1519 Y1549 R2179	L1487-D1517 WeakPolarHBondContact O-CB 3.34Å; L1487-D1517 PolarHBondContact O-N 3Å; S1489-D1517 CarbonylContact C-O 3.54Å; S1489-D1517 WeakPolarHBondContact CA-O 3.47Å; S1490-D1517 PolarHBondContact N-O 2.95Å; D1517-Q1519 PolarHBondContact O-N 3.04Å; D1517-Y1549 HydrophobicContact CB-CD2 3.82Å; D1517-Y1549 VanDerWaalsContact CB-CD2 3.49Å; D1517-Y1549 HydrophobicContact CB-CE2 4.13Å; D1517-Y1549 VanDerWaalsContact CB-CE2 3.47Å; D1517-Y1549 HydrophobicContact CB-CG 4.19Å; D1517-Y1549 VanDerWaalsContact CG-OH 3.31Å; D1517-Y1549 VanDerWaalsContact OD1-CD2 3.31Å; D1517-Y1549 WeakPolarHBondContact OD1-CD2 3.4Å; D1517-Y1549 WeakPolarHBondContact OD1-CE1 3.48Å; D1517-Y1549 WeakPolarHBondContact OD1-CE2 3.29Å; D1517-Y1549 PolarHBondContact OD1-OH 3.21Å; D1517-Y1549 WeakPolarHBondContact OD2-CD2 3.4Å; D1517-Y1549 WeakPolarHBondContact OD2-CE2 3.4Å; D1517-Y1549 PolarHBondContact OD2-OH 2.95Å; D1517-R2179 IonicContact OD1-NH2 3.17Å; D1517-R2179 IonicContact OD2-CZ 2.74Å; D1517-R2179 IonicContact OD2-NH1 3.33Å; D1517-R2179 PolarHBondContact OD2-NH1 2.86Å; D1517-R2179 IonicContact OD2-NH2 3.97Å; D1517-R2179 PolarHBondContact OD2-NH2 3.4Å
1518	P	76.5	Confident	78.1	Confident	11.6 Å²	11.6	48.1 Å²	48.1	8%	0.075	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-70.1	127.9	174.4	28.4	-32.3	0	0	0	111.2	L1461 S1490 P1516 N1520 Y1549	L1461-P1518 HydrophobicContact CD1-CB 3.99Å; L1461-P1518 HydrophobicContact CD2-CB 4.15Å; S1490-P1518 VanDerWaalsContact O-CA 3.31Å; S1490-P1518 WeakPolarHBondContact O-CA 3.35Å; P1516-P1518 WeakPolarHBondContact O-CD 3.45Å; P1518-N1520 VanDerWaalsContact C-N 3.27Å; P1518-N1520 PolarHBondContact O-N 2.98Å; P1518-Y1549 VanDerWaalsContact CD-CD1 3.49Å; P1518-Y1549 VanDerWaalsContact CD-CG 3.49Å; P1518-Y1549 HydrophobicContact CG-CD1 4.05Å; P1518-Y1549 HydrophobicContact CG-CE1 3.92Å; P1518-Y1549 HydrophobicContact CG-CE2 4.39Å; P1518-Y1549 HydrophobicContact CG-CG 4.42Å
1519	Q	67.5	Low	78.6	Confident	62.6 Å²	62.6	43.8 Å²	43.8	29%	0.293	24%	0.236	S	C	.	.	S	Bend	trans	-52.7	-28.9	-178.1	-119.7	-174	-6.3	0	0	114.9	V1455 E1456 S1489 S1490 D1517	V1455-Q1519 VanDerWaalsContact CB-NE2 3.26Å; V1455-Q1519 VanDerWaalsContact CG1-CD 3.4Å; V1455-Q1519 HydrophobicContact CG1-CG 4.41Å; E1456-Q1519 PolarHBondContact O-NE2 3.05Å; E1456-Q1519 PolarHBondContact O-OE1 3.02Å; S1489-Q1519 WeakPolarHBondContact OG-CG 3.42Å; S1489-Q1519 PolarHBondContact OG-NE2 3.08Å; S1490-Q1519 PolarHBondContact O-N 3.25Å; S1490-Q1519 VanDerWaalsContact O-N 3.1Å; D1517-Q1519 PolarHBondContact O-N 3.04Å
1520	N	62.1	Low	79.3	Confident	70.8 Å²	70.8	44.6 Å²	44.6	38%	0.379	24%	0.239	S	C	.	.			trans	-119.7	97.2	-178.9	-126.4	-23.7	0	0	0	110.5	P1518 L1522 L1523	P1518-N1520 VanDerWaalsContact C-N 3.27Å; P1518-N1520 PolarHBondContact O-N 2.98Å; N1520-L1522 PolarHBondContact O-N 2.83Å; N1520-L1522 VanDerWaalsContact O-N 3.12Å; N1520-L1522 WeakPolarHBondContact OD1-CB 3.33Å; N1520-L1522 PolarHBondContact OD1-N 3.17Å; N1520-L1523 HydrophobicContact CB-CD1 3.87Å; N1520-L1523 HydrophobicContact CB-CG 4.27Å; N1520-L1523 PolarHBondContact O-N 3.05Å; N1520-L1523 VanDerWaalsContact O-N 3.13Å
1521	V	54.9	Low	79.9	Confident	75 Å²	75	44.2 Å²	44.2	46%	0.455	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.2	179.3	-174.2	0	0	0	0	112.5	L1523 Y1549 L1606	V1521-L1523 VanDerWaalsContact C-N 3.31Å; V1521-L1523 PolarHBondContact O-N 2.94Å; V1521-Y1549 WeakPolarHBondContact CG1-OH 3.34Å; V1521-Y1549 WeakPolarHBondContact CG2-OH 3.19Å; V1521-L1606 HydrophobicContact CG1-CB 4.15Å; V1521-L1606 HydrophobicContact CG1-CD1 4.31Å; V1521-L1606 HydrophobicContact CG2-CD1 3.94Å
1522	L	53.6	Low	80.1	Confident	150.4 Å²	150.4	48.6 Å²	48.6	79%	0.787	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	4.6	-177.9	-66.4	167.8	0	0	0	113.1	N1520 N1524	N1520-L1522 PolarHBondContact O-N 2.83Å; N1520-L1522 VanDerWaalsContact O-N 3.12Å; N1520-L1522 WeakPolarHBondContact OD1-CB 3.33Å; N1520-L1522 PolarHBondContact OD1-N 3.17Å; L1522-N1524 PolarHBondContact O-N 3.45Å
1523	L	54.7	Low	80.4	Confident	96.2 Å²	96.2	51.3 Å²	51.3	50%	0.504	26%	0.261	S	S	.	.	S	Bend	trans	-82.5	123.1	-176	-70.3	167.1	0	0	0	112.9	L1461 N1520 V1521 L1525 V1607	L1461-L1523 HydrophobicContact CB-CD1 3.92Å; L1461-L1523 HydrophobicContact CD1-CB 3.62Å; L1461-L1523 HydrophobicContact CD1-CD1 3.53Å; L1461-L1523 HydrophobicContact CD1-CG 4.19Å; L1461-L1523 HydrophobicContact CD2-CB 4.29Å; L1461-L1523 HydrophobicContact CG-CD1 3.86Å; N1520-L1523 HydrophobicContact CB-CD1 3.87Å; N1520-L1523 HydrophobicContact CB-CG 4.27Å; N1520-L1523 PolarHBondContact O-N 3.05Å; N1520-L1523 VanDerWaalsContact O-N 3.13Å; V1521-L1523 VanDerWaalsContact C-N 3.31Å; V1521-L1523 PolarHBondContact O-N 2.94Å; L1523-L1525 PolarHBondContact O-N 2.77Å; L1523-V1607 HydrophobicContact CD2-CG1 4.43Å
1524	N	62.4	Low	80.6	Confident	163.8 Å²	163.8	51.4 Å²	51.4	88%	0.876	26%	0.262	S	S	*	.	S	Bend	trans	-66	4.9	-174	-92.1	-4.9	0	0	0	116.2	L1522	L1522-N1524 PolarHBondContact O-N 3.45Å
1525	L	69.3	Low	81	Confident	60 Å²	60	52 Å²	52	31%	0.314	26%	0.264	S	S	.	.			trans	-111	97.7	-176.8	-74.7	168.4	0	0	0	109.9	L1461 L1523	L1461-L1525 HydrophobicContact CB-CD1 4.35Å; L1461-L1525 HydrophobicContact CD1-CB 4.43Å; L1461-L1525 HydrophobicContact CD2-CB 3.5Å; L1461-L1525 VanDerWaalsContact CD2-CB 3.44Å; L1461-L1525 HydrophobicContact CD2-CD1 3.95Å; L1461-L1525 HydrophobicContact CD2-CG 4.37Å; L1461-L1525 HydrophobicContact CG-CD1 4.29Å; L1523-L1525 PolarHBondContact O-N 2.77Å
1526	S	80	Confident	81.2	Confident	42.2 Å²	42.2	51.9 Å²	51.9	30%	0.295	26%	0.263	S	S	.	.			trans	-96	157.5	173.3	59.8	0	0	0	0	111.9	S1493	S1493-S1526 PolarHBondContact OG-O 3.12Å; S1493-S1526 VanDerWaalsContact OG-O 3.14Å
1527	H	91.5	Very high	81.5	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	148.1	172.7	-63	-87	0	0	0	111	F1494 L1515 P1516 A1551 W1552	F1494-H1527 AromaticContact CD2-CE1 3.9Å; F1494-H1527 AromaticContact CD2-ND1 3.92Å; F1494-H1527 PolarHBondContact N-ND1 3.21Å; F1494-H1527 WeakPolarHBondContact O-CA 3.35Å; L1515-H1527 HydrophobicContact CD1-CB 3.86Å; L1515-H1527 HydrophobicContact CD2-CB 4.27Å; L1515-H1527 HydrophobicContact CG-CB 4.47Å; P1516-H1527 PolarHBondContact O-CE1 2.94Å; P1516-H1527 PolarHBondContact O-NE2 3.17Å; P1516-H1527 VanDerWaalsContact O-NE2 3.13Å; H1527-A1551 HydrophobicContact CB-CB 3.78Å; H1527-A1551 CarbonylContact O-C 3.51Å; H1527-A1551 VanDerWaalsContact O-CA 3.27Å; H1527-A1551 WeakPolarHBondContact O-CA 3.3Å; H1527-W1552 PolarHBondContact O-N 3.34Å
1528	R	93.7	Very high	82.1	Confident	94.8 Å²	94.8	57.9 Å²	57.9	36%	0.358	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.2	-178.6	-64.2	-177.4	-159.2	-178.4	0.2	111.2	E1463 F1494 W1495 W1496 W1552	E1463-R1528 IonicContact OE1-CZ 3.5Å; E1463-R1528 IonicContact OE1-NH2 2.69Å; E1463-R1528 PolarHBondContact OE1-NH2 3.14Å; F1494-R1528 PolarHBondContact O-N 3.01Å; W1495-R1528 CarbonylContact C-O 3.46Å; W1495-R1528 VanDerWaalsContact CA-O 3.29Å; W1495-R1528 WeakPolarHBondContact CA-O 3.42Å; W1495-R1528 HydrophobicContact CB-CB 4.29Å; W1495-R1528 VanDerWaalsContact CD1-CB 3.42Å; W1495-R1528 HydrophobicContact CG-CB 3.97Å; W1496-R1528 PolarHBondContact N-O 2.78Å; R1528-W1552 CarbonylContact C-O 3.54Å; R1528-W1552 WeakPolarHBondContact CA-O 3.4Å; R1528-W1552 HydrophobicContact CB-CE3 4.3Å; R1528-W1552 HydrophobicContact CG-CB 4.46Å; R1528-W1552 HydrophobicContact CG-CE3 4.35Å
1529	F	95.8	Very high	83	Confident	0.6 Å²	0.6	57.4 Å²	57.4	0%	0.003	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	118.2	174.4	-178.7	-84.2	0	0	0	110.3	W1496 I1498 L1511 I1513 L1531 F1544 L1546 W1552 L1553 N1554 I1555	W1496-F1529 HydrophobicContact CB-CD2 3.52Å; W1496-F1529 VanDerWaalsContact CB-CD2 3.5Å; W1496-F1529 HydrophobicContact CB-CE2 3.94Å; W1496-F1529 HydrophobicContact CB-CG 4.41Å; W1496-F1529 HydrophobicContact CG-CD2 4.16Å; W1496-F1529 HydrophobicContact CG-CE2 4.44Å; W1496-F1529 CarbonylContact O-C 3.49Å; W1496-F1529 WeakPolarHBondContact O-CA 3.29Å; I1498-F1529 HydrophobicContact CD1-CE2 4.46Å; I1498-F1529 HydrophobicContact CD1-CZ 4.36Å; L1511-F1529 HydrophobicContact CD1-CZ 4.38Å; L1511-F1529 HydrophobicContact CD2-CE2 4.33Å; L1511-F1529 HydrophobicContact CD2-CZ 4.21Å; I1513-F1529 HydrophobicContact CD1-CD2 3.88Å; I1513-F1529 HydrophobicContact CD1-CE2 3.45Å; I1513-F1529 VanDerWaalsContact CD1-CE2 3.44Å; I1513-F1529 HydrophobicContact CD1-CZ 4.48Å; F1529-L1531 HydrophobicContact CE1-CB 3.68Å; F1529-L1531 HydrophobicContact CZ-CB 4.15Å; F1529-F1544 HydrophobicContact CE1-CE2 4.29Å; F1529-F1544 AromaticContact CE1-CZ 3.62Å; F1529-F1544 HydrophobicContact CE1-CZ 3.62Å; F1529-F1544 HydrophobicContact CE2-CZ 4.32Å; F1529-F1544 HydrophobicContact CZ-CE1 4.49Å; F1529-F1544 AromaticContact CZ-CE2 3.79Å; F1529-F1544 HydrophobicContact CZ-CE2 3.88Å; F1529-F1544 AromaticContact CZ-CZ 3.45Å; F1529-F1544 HydrophobicContact CZ-CZ 3.45Å; F1529-F1544 VanDerWaalsContact CZ-CZ 3.46Å; F1529-L1546 HydrophobicContact CB-CD2 4.43Å; F1529-L1546 HydrophobicContact CD1-CD2 4.4Å; F1529-L1546 HydrophobicContact CD2-CD1 4.39Å; F1529-L1546 HydrophobicContact CG-CD2 4.28Å; F1529-W1552 PolarHBondContact N-O 3.1Å; F1529-L1553 HydrophobicContact CB-CD2 3.57Å; F1529-L1553 HydrophobicContact CD1-CD2 4.49Å; F1529-L1553 HydrophobicContact CG-CD2 4.38Å; F1529-L1553 CarbonylContact O-C 3.57Å; F1529-L1553 VanDerWaalsContact O-CA 3.31Å; F1529-L1553 WeakPolarHBondContact O-CA 3.26Å; F1529-N1554 PolarHBondContact O-N 3.08Å; F1529-I1555 HydrophobicContact CD1-CG1 4.47Å; F1529-I1555 HydrophobicContact CE1-CD1 4.44Å; F1529-I1555 HydrophobicContact CE1-CG1 4.36Å
1530	E	96.1	Very high	84.2	Confident	20.8 Å²	20.8	56.7 Å²	56.7	10%	0.097	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	122.3	178.4	-69	171.9	-138.5	0	0	109.5	W1495 W1496 K1497 I1498 W1552 N1554	W1495-E1530 PolarHBondContact NE1-OE1 2.96Å; W1496-E1530 PolarHBondContact O-N 3.2Å; K1497-E1530 CarbonylContact C-O 3.54Å; K1497-E1530 WeakPolarHBondContact CA-O 3.28Å; K1497-E1530 HydrophobicContact CB-CB 4.4Å; K1497-E1530 WeakPolarHBondContact CD-OE2 3.23Å; K1497-E1530 VanDerWaalsContact CE-OE2 3.29Å; K1497-E1530 WeakPolarHBondContact CE-OE2 3.31Å; K1497-E1530 HydrophobicContact CG-CB 4.13Å; K1497-E1530 IonicContact NZ-OE2 3.69Å; K1497-E1530 PolarHBondContact NZ-OE2 3.36Å; I1498-E1530 PolarHBondContact N-O 3.16Å; E1530-W1552 HydrophobicContact CG-CE3 4.46Å; E1530-W1552 HydrophobicContact CG-CH2 4.36Å; E1530-W1552 HydrophobicContact CG-CZ3 3.65Å; E1530-N1554 CarbonylContact C-O 3.46Å; E1530-N1554 WeakPolarHBondContact CA-O 3.31Å; E1530-N1554 HydrophobicContact CG-CB 4.37Å
1531	L	96.4	Very high	85.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	107.8	170.7	177.3	63.5	0	0	0	108.8	I1498 F1529 F1536 F1544 N1554 I1555 S1556 N1558 F1560	I1498-L1531 HydrophobicContact CB-CD1 3.63Å; I1498-L1531 HydrophobicContact CD1-CD1 4.37Å; I1498-L1531 HydrophobicContact CG2-CD1 3.57Å; I1498-L1531 WeakPolarHBondContact O-CA 3.38Å; F1529-L1531 HydrophobicContact CE1-CB 3.68Å; F1529-L1531 HydrophobicContact CZ-CB 4.15Å; L1531-F1536 HydrophobicContact CD1-CE2 4.02Å; L1531-F1536 HydrophobicContact CD1-CZ 4.18Å; L1531-F1536 HydrophobicContact CD2-CE2 4.03Å; L1531-F1536 HydrophobicContact CD2-CZ 4.37Å; L1531-F1536 HydrophobicContact CG-CE2 4.49Å; L1531-F1544 HydrophobicContact CD2-CE2 4.04Å; L1531-F1544 HydrophobicContact CD2-CZ 4.49Å; L1531-N1554 PolarHBondContact N-O 3.17Å; L1531-I1555 HydrophobicContact CB-CG1 4.4Å; L1531-I1555 HydrophobicContact CD2-CG2 4.32Å; L1531-I1555 CarbonylContact O-C 3.35Å; L1531-I1555 VanDerWaalsContact O-CA 3.29Å; L1531-I1555 WeakPolarHBondContact O-CA 3.37Å; L1531-S1556 PolarHBondContact O-N 3.06Å; L1531-N1558 PolarHBondContact O-ND2 2.93Å; L1531-F1560 HydrophobicContact CD2-CZ 4.16Å
1532	R	96.6	Very high	87.3	Confident	93.2 Å²	93.2	52.3 Å²	52.3	35%	0.352	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	141.3	-172	-59	-173.7	63.9	-168.5	-6.6	112.5	I1498 W1499 Q1500 S1534 S1556 N1558	I1498-R1532 PolarHBondContact O-N 3.28Å; W1499-R1532 WeakPolarHBondContact CA-O 3.37Å; Q1500-R1532 PolarHBondContact N-O 2.96Å; Q1500-R1532 VanDerWaalsContact N-O 3.13Å; R1532-S1534 PolarHBondContact O-N 3.03Å; R1532-S1534 PolarHBondContact O-OG 3.06Å; R1532-S1556 VanDerWaalsContact CA-O 3.28Å; R1532-S1556 WeakPolarHBondContact CA-O 3.27Å; R1532-S1556 WeakPolarHBondContact CG-OG 3.4Å; R1532-S1556 PolarHBondContact NE-OG 2.97Å; R1532-N1558 VanDerWaalsContact C-OD1 3.26Å; R1532-N1558 WeakPolarHBondContact CA-OD1 3.29Å; R1532-N1558 PolarHBondContact N-OD1 2.92Å
1533	E	96.2	Very high	89.1	Confident	83.4 Å²	83.4	47.8 Å²	47.8	39%	0.39	24%	0.238	S	C	.	.	S	Bend	trans	52.2	29.9	170.1	-62.8	170.3	-166.1	0	0	113.9	W1499 Q1500 S1556 S1557 N1558	W1499-E1533 PolarHBondContact NE1-OE2 2.99Å; Q1500-E1533 WeakPolarHBondContact CA-O 3.41Å; Q1500-E1533 HydrophobicContact CG-CB 3.96Å; Q1500-E1533 WeakPolarHBondContact CG-OE2 3.43Å; Q1500-E1533 PolarHBondContact NE2-OE2 2.97Å; E1533-S1556 PolarHBondContact N-O 3.24Å; E1533-S1556 VanDerWaalsContact N-O 3.11Å; E1533-S1557 VanDerWaalsContact CA-O 3.3Å; E1533-S1557 WeakPolarHBondContact CA-O 3.29Å; E1533-N1558 PolarHBondContact N-OD1 2.91Å
1534	S	96.6	Very high	90.9	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.021	21%	0.214	C	C	.	.			trans	-106.7	151.5	-174.5	-61.9	0	0	0	0	111.6	Q1500 S1501 R1532 N1558 N1559	Q1500-S1534 PolarHBondContact N-OG 3.2Å; S1501-S1534 PolarHBondContact N-OG 3.1Å; S1501-S1534 CarbonylContact O-C 3.51Å; S1501-S1534 VanDerWaalsContact O-CA 3.27Å; S1501-S1534 WeakPolarHBondContact O-CA 3.28Å; S1501-S1534 VanDerWaalsContact O-CB 3.27Å; S1501-S1534 WeakPolarHBondContact O-CB 3.36Å; R1532-S1534 PolarHBondContact O-N 3.03Å; R1532-S1534 PolarHBondContact O-OG 3.06Å; S1534-N1558 WeakPolarHBondContact CB-OD1 3.34Å; S1534-N1558 PolarHBondContact N-OD1 3.14Å; S1534-N1558 CarbonylContact O-C 3.52Å; S1534-N1558 VanDerWaalsContact O-CA 3.26Å; S1534-N1558 WeakPolarHBondContact O-CA 3.34Å; S1534-N1558 WeakPolarHBondContact O-CB 3.39Å; S1534-N1559 PolarHBondContact O-N 2.94Å
1535	N	95.9	Very high	92.4	Very high	35.2 Å²	35.2	37.1 Å²	37.1	19%	0.188	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.3	-178.2	-172.5	35.7	0	0	0	110.8	S1501 N1502 F1503 Q1537 N1559	S1501-N1535 PolarHBondContact O-N 3.09Å; N1502-N1535 CarbonylContact C-O 3.59Å; N1502-N1535 WeakPolarHBondContact CA-O 3.42Å; N1502-N1535 WeakPolarHBondContact OD1-CB 3.39Å; F1503-N1535 PolarHBondContact N-O 2.97Å; N1535-Q1537 PolarHBondContact ND2-OE1 3.1Å; N1535-N1559 CarbonylContact C-O 3.57Å; N1535-N1559 WeakPolarHBondContact CA-O 3.41Å; N1535-N1559 WeakPolarHBondContact OD1-CB 3.42Å; N1535-N1559 PolarHBondContact OD1-ND2 2.96Å; N1535-N1559 PolarHBondContact OD1-O 3.14Å
1536	F	95.5	Very high	93.5	Very high	0.8 Å²	0.8	34.3 Å²	34.3	0%	0.004	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	111.4	173.4	-66.6	-95.5	0	0	0	108.6	F1503 L1511 L1531 F1542 N1559 F1560 T1561 N1563	F1503-F1536 HydrophobicContact CB-CD1 3.48Å; F1503-F1536 VanDerWaalsContact CB-CD1 3.47Å; F1503-F1536 HydrophobicContact CB-CE1 3.75Å; F1503-F1536 HydrophobicContact CB-CG 4.18Å; F1503-F1536 HydrophobicContact CD1-CD1 4.46Å; F1503-F1536 AromaticContact CD1-CE1 3.95Å; F1503-F1536 HydrophobicContact CD1-CE1 3.96Å; F1503-F1536 AromaticContact CD2-CD1 3.96Å; F1503-F1536 HydrophobicContact CD2-CD1 3.99Å; F1503-F1536 HydrophobicContact CD2-CD2 4.37Å; F1503-F1536 AromaticContact CD2-CE1 3.46Å; F1503-F1536 HydrophobicContact CD2-CE1 3.46Å; F1503-F1536 VanDerWaalsContact CD2-CE1 3.44Å; F1503-F1536 AromaticContact CD2-CE2 3.95Å; F1503-F1536 HydrophobicContact CD2-CE2 4.28Å; F1503-F1536 HydrophobicContact CD2-CG 4.34Å; F1503-F1536 AromaticContact CD2-CZ 3.62Å; F1503-F1536 HydrophobicContact CD2-CZ 3.62Å; F1503-F1536 VanDerWaalsContact CD2-CZ 3.45Å; F1503-F1536 HydrophobicContact CE1-CE1 4.43Å; F1503-F1536 AromaticContact CE2-CE1 3.97Å; F1503-F1536 HydrophobicContact CE2-CE1 4Å; F1503-F1536 HydrophobicContact CE2-CE2 4.27Å; F1503-F1536 AromaticContact CE2-CZ 3.87Å; F1503-F1536 HydrophobicContact CE2-CZ 3.87Å; F1503-F1536 AromaticContact CG-CD1 3.76Å; F1503-F1536 HydrophobicContact CG-CD1 3.76Å; F1503-F1536 AromaticContact CG-CE1 3.45Å; F1503-F1536 HydrophobicContact CG-CE1 3.45Å; F1503-F1536 VanDerWaalsContact CG-CE1 3.45Å; F1503-F1536 HydrophobicContact CG-CZ 4.12Å; F1503-F1536 HydrophobicContact CZ-CE1 4.44Å; F1503-F1536 HydrophobicContact CZ-CZ 4.34Å; F1503-F1536 CarbonylContact O-C 3.58Å; F1503-F1536 WeakPolarHBondContact O-CA 3.41Å; L1511-F1536 HydrophobicContact CD1-CE1 3.94Å; L1511-F1536 HydrophobicContact CD1-CZ 4.02Å; L1511-F1536 HydrophobicContact CD2-CE1 4.23Å; L1511-F1536 HydrophobicContact CD2-CZ 4.39Å; L1531-F1536 HydrophobicContact CD1-CE2 4.02Å; L1531-F1536 HydrophobicContact CD1-CZ 4.18Å; L1531-F1536 HydrophobicContact CD2-CE2 4.03Å; L1531-F1536 HydrophobicContact CD2-CZ 4.37Å; L1531-F1536 HydrophobicContact CG-CE2 4.49Å; F1536-F1542 AromaticContact CD1-CE2 3.65Å; F1536-F1542 HydrophobicContact CD1-CE2 3.65Å; F1536-F1542 AromaticContact CD1-CZ 3.93Å; F1536-F1542 HydrophobicContact CD1-CZ 4.03Å; F1536-F1542 HydrophobicContact CE1-CE2 4.18Å; F1536-F1542 HydrophobicContact CE1-CZ 4.36Å; F1536-F1542 HydrophobicContact CG-CE2 4.4Å; F1536-F1542 HydrophobicContact CG-CZ 4.43Å; F1536-N1559 PolarHBondContact N-O 3.27Å; F1536-F1560 HydrophobicContact CB-CD1 3.6Å; F1536-F1560 HydrophobicContact CB-CE1 3.99Å; F1536-F1560 HydrophobicContact CB-CG 4.42Å; F1536-F1560 HydrophobicContact CD1-CE1 4.41Å; F1536-F1560 AromaticContact CD2-CD1 3.76Å; F1536-F1560 HydrophobicContact CD2-CD1 3.76Å; F1536-F1560 AromaticContact CD2-CE1 3.28Å; F1536-F1560 HydrophobicContact CD2-CE1 3.28Å; F1536-F1560 AromaticContact CD2-CZ 3.81Å; F1536-F1560 HydrophobicContact CD2-CZ 3.81Å; F1536-F1560 AromaticContact CE2-CE1 3.8Å; F1536-F1560 HydrophobicContact CE2-CE1 3.8Å; F1536-F1560 HydrophobicContact CE2-CZ 4.04Å; F1536-F1560 AromaticContact CG-CD1 3.82Å; F1536-F1560 HydrophobicContact CG-CD1 3.82Å; F1536-F1560 AromaticContact CG-CE1 3.65Å; F1536-F1560 HydrophobicContact CG-CE1 3.65Å; F1536-F1560 HydrophobicContact CZ-CE1 4.5Å; F1536-F1560 CarbonylContact O-C 3.53Å; F1536-F1560 WeakPolarHBondContact O-CA 3.38Å; F1536-T1561 PolarHBondContact O-N 3Å; F1536-N1563 PolarHBondContact O-ND2 3.09Å; F1536-N1563 PolarHBondContact O-OD1 3.03Å
1537	Q	94.9	Very high	94	Very high	84.4 Å²	84.4	33.3 Å²	33.3	39%	0.394	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.9	-171.9	-175.8	173.6	-11	0	0	113	F1503 F1504 S1505 N1535 N1539 T1561	F1503-Q1537 PolarHBondContact O-N 3.18Å; F1504-Q1537 VanDerWaalsContact CA-O 3.25Å; F1504-Q1537 WeakPolarHBondContact CA-O 3.33Å; F1504-Q1537 HydrophobicContact CB-CB 4.45Å; S1505-Q1537 PolarHBondContact N-O 3.1Å; S1505-Q1537 VanDerWaalsContact N-O 3.12Å; N1535-Q1537 PolarHBondContact ND2-OE1 3.1Å; Q1537-N1539 PolarHBondContact N-ND2 3.22Å; Q1537-N1539 PolarHBondContact O-N 2.94Å; Q1537-N1539 VanDerWaalsContact O-N 3.11Å; Q1537-N1539 PolarHBondContact O-ND2 3.31Å; Q1537-T1561 VanDerWaalsContact CA-O 3.27Å; Q1537-T1561 WeakPolarHBondContact CA-O 3.29Å; Q1537-T1561 WeakPolarHBondContact CG-OG1 3.29Å
1538	D	94.9	Very high	93.8	Very high	66.8 Å²	66.8	34 Å²	34	36%	0.357	17%	0.167	S	C	.	.	S	Bend	trans	55.2	32.2	170.2	-169.8	47.7	0	0	0	113.8	S1505 T1561 M1562	S1505-D1538 VanDerWaalsContact CA-O 3.3Å; S1505-D1538 WeakPolarHBondContact CA-O 3.39Å; S1505-D1538 PolarHBondContact OG-OD2 3.11Å; S1505-D1538 VanDerWaalsContact OG-OD2 3.04Å; D1538-T1561 PolarHBondContact N-O 3.08Å; D1538-T1561 VanDerWaalsContact N-O 3.11Å; D1538-M1562 WeakPolarHBondContact CA-O 3.26Å
1539	N	94.3	Very high	93.5	Very high	1.4 Å²	1.4	31 Å²	31	1%	0.007	16%	0.156	C	C	.	.			trans	-85.9	139.4	178.2	-60.9	-69.3	0	0	0	111	F1503 S1505 N1506 S1509 Q1537 F1542 N1563 R1564	F1503-N1539 PolarHBondContact O-ND2 3.04Å; F1503-N1539 VanDerWaalsContact O-ND2 3.1Å; S1505-N1539 PolarHBondContact N-OD1 3.18Å; N1506-N1539 WeakPolarHBondContact CB-OD1 3.23Å; N1506-N1539 PolarHBondContact N-OD1 3.19Å; N1506-N1539 VanDerWaalsContact N-OD1 3.09Å; N1506-N1539 PolarHBondContact ND2-OD1 3.03Å; N1506-N1539 VanDerWaalsContact ND2-OD1 3.08Å; N1506-N1539 WeakPolarHBondContact O-CA 3.39Å; S1509-N1539 WeakPolarHBondContact OG-CB 3.35Å; Q1537-N1539 PolarHBondContact N-ND2 3.22Å; Q1537-N1539 PolarHBondContact O-N 2.94Å; Q1537-N1539 VanDerWaalsContact O-N 3.11Å; Q1537-N1539 PolarHBondContact O-ND2 3.31Å; N1539-F1542 HydrophobicContact CB-CB 4.15Å; N1539-F1542 HydrophobicContact CB-CD2 4.02Å; N1539-F1542 HydrophobicContact CB-CG 4.36Å; N1539-N1563 VanDerWaalsContact CB-OD1 3.29Å; N1539-N1563 WeakPolarHBondContact CB-OD1 3.41Å; N1539-N1563 PolarHBondContact N-OD1 2.92Å; N1539-N1563 PolarHBondContact ND2-OD1 2.84Å; N1539-N1563 WeakPolarHBondContact O-CA 3.4Å; N1539-R1564 PolarHBondContact O-N 2.89Å
1540	V	92.8	Very high	93.1	Very high	47.6 Å²	47.6	32.3 Å²	32.3	29%	0.288	16%	0.161	S	C	.	.	B	Isolated β-bridge	trans	-104.1	141.9	-178.2	-177.6	0	0	0	0	110	N1506 Y1507 E1508 S1509 F1542 R1564	N1506-V1540 PolarHBondContact O-N 3.14Å; Y1507-V1540 HydrophobicContact CD1-CB 4.03Å; Y1507-V1540 HydrophobicContact CD1-CG1 4.41Å; Y1507-V1540 HydrophobicContact CD1-CG2 4.25Å; Y1507-V1540 HydrophobicContact CD2-CB 4.03Å; Y1507-V1540 HydrophobicContact CD2-CG1 3.84Å; Y1507-V1540 HydrophobicContact CE1-CB 4.46Å; Y1507-V1540 HydrophobicContact CE1-CG2 4.25Å; Y1507-V1540 HydrophobicContact CE2-CG1 3.95Å; E1508-V1540 PolarHBondContact N-O 3.05Å; E1508-V1540 VanDerWaalsContact N-O 3.12Å; S1509-V1540 PolarHBondContact N-O 2.95Å; S1509-V1540 PolarHBondContact OG-O 3.05Å; V1540-F1542 PolarHBondContact O-N 3.18Å; V1540-R1564 CarbonylContact C-O 3.54Å
1541	D	90.1	Very high	92.9	Very high	51 Å²	51	31.3 Å²	31.3	27%	0.273	16%	0.156	S	C	.	.	S	Bend	trans	48.6	42.9	-170.6	-67.1	-38.8	0	0	0	112.3	E1508 S1509 Q1543 R1564	E1508-D1541 HydrophobicContact CG-CB 4.41Å; S1509-D1541 PolarHBondContact N-O 2.74Å; D1541-Q1543 PolarHBondContact O-N 2.78Å; D1541-R1564 CarbonylContact C-O 3.52Å; D1541-R1564 VanDerWaalsContact CA-O 3.27Å; D1541-R1564 WeakPolarHBondContact CA-O 3.36Å; D1541-R1564 PolarHBondContact N-O 3.07Å
1542	F	92.4	Very high	92.7	Very high	1.4 Å²	1.4	34.8 Å²	34.8	1%	0.006	17%	0.17	C	C	.	.			trans	-70.1	126.7	-177.1	179.4	-97.6	0	0	0	111.9	S1509 L1511 F1536 N1539 V1540 F1544 F1560 N1563 R1564 A1565 L1571	S1509-F1542 CarbonylContact O-C 3.55Å; S1509-F1542 VanDerWaalsContact O-CA 3.28Å; S1509-F1542 WeakPolarHBondContact O-CA 3.32Å; S1509-F1542 WeakPolarHBondContact OG-CA 3.45Å; S1509-F1542 WeakPolarHBondContact OG-CB 3.33Å; S1509-F1542 WeakPolarHBondContact OG-CD2 3.37Å; S1509-F1542 PolarHBondContact OG-N 3.4Å; L1511-F1542 HydrophobicContact CD1-CE2 4.26Å; F1536-F1542 AromaticContact CD1-CE2 3.65Å; F1536-F1542 HydrophobicContact CD1-CE2 3.65Å; F1536-F1542 AromaticContact CD1-CZ 3.93Å; F1536-F1542 HydrophobicContact CD1-CZ 4.03Å; F1536-F1542 HydrophobicContact CE1-CE2 4.18Å; F1536-F1542 HydrophobicContact CE1-CZ 4.36Å; F1536-F1542 HydrophobicContact CG-CE2 4.4Å; F1536-F1542 HydrophobicContact CG-CZ 4.43Å; N1539-F1542 HydrophobicContact CB-CB 4.15Å; N1539-F1542 HydrophobicContact CB-CD2 4.02Å; N1539-F1542 HydrophobicContact CB-CG 4.36Å; V1540-F1542 PolarHBondContact O-N 3.18Å; F1542-F1544 HydrophobicContact CE1-CB 4.34Å; F1542-F1544 HydrophobicContact CZ-CB 4.28Å; F1542-F1560 HydrophobicContact CE1-CD1 4.42Å; F1542-F1560 HydrophobicContact CE1-CE1 4.45Å; F1542-F1560 HydrophobicContact CZ-CD1 4.28Å; F1542-F1560 HydrophobicContact CZ-CE1 4.09Å; F1542-N1563 HydrophobicContact CB-CB 4.12Å; F1542-N1563 HydrophobicContact CD1-CB 4.19Å; F1542-N1563 HydrophobicContact CG-CB 4.14Å; F1542-R1564 PolarHBondContact N-O 3.03Å; F1542-A1565 WeakPolarHBondContact O-CA 3.31Å; F1542-A1565 WeakPolarHBondContact O-CB 3.36Å; F1542-L1571 HydrophobicContact CD1-CB 4.37Å; F1542-L1571 HydrophobicContact CD1-CD2 3.8Å; F1542-L1571 HydrophobicContact CE1-CB 4.42Å
1543	Q	90.5	Very high	92.7	Very high	55.4 Å²	55.4	30.4 Å²	30.4	26%	0.259	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	123.7	174.4	-175.4	-178.3	6.9	0	0	111.8	S1509 G1510 L1511 D1541 I1569	S1509-Q1543 PolarHBondContact O-N 2.82Å; G1510-Q1543 CarbonylContact C-O 3.4Å; G1510-Q1543 VanDerWaalsContact CA-O 3.27Å; G1510-Q1543 WeakPolarHBondContact CA-O 3.28Å; L1511-Q1543 PolarHBondContact N-O 2.97Å; D1541-Q1543 PolarHBondContact O-N 2.78Å; Q1543-I1569 HydrophobicContact CB-CD1 3.86Å; Q1543-I1569 HydrophobicContact CG-CD1 3.91Å; Q1543-I1569 HydrophobicContact CG-CG2 4.1Å
1544	F	93.7	Very high	92.7	Very high	1.4 Å²	1.4	27.5 Å²	27.5	1%	0.006	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	111	167.4	-170.4	-67.3	0	0	0	109	L1511 F1529 L1531 F1542 L1546 L1571 M1572 K1573 L1574	L1511-F1544 HydrophobicContact CB-CD2 3.84Å; L1511-F1544 HydrophobicContact CB-CE2 4.04Å; L1511-F1544 HydrophobicContact CB-CG 4.35Å; L1511-F1544 HydrophobicContact CB-CZ 4.49Å; L1511-F1544 HydrophobicContact CD1-CD2 3.78Å; L1511-F1544 HydrophobicContact CD1-CE2 3.77Å; L1511-F1544 HydrophobicContact CD1-CZ 4.44Å; L1511-F1544 HydrophobicContact CD2-CD2 4.13Å; L1511-F1544 HydrophobicContact CD2-CE2 3.9Å; L1511-F1544 HydrophobicContact CD2-CZ 4.45Å; L1511-F1544 HydrophobicContact CG-CD2 4.29Å; L1511-F1544 HydrophobicContact CG-CE2 4.25Å; L1511-F1544 CarbonylContact O-C 3.57Å; L1511-F1544 WeakPolarHBondContact O-CA 3.41Å; F1529-F1544 HydrophobicContact CE1-CE2 4.29Å; F1529-F1544 AromaticContact CE1-CZ 3.62Å; F1529-F1544 HydrophobicContact CE1-CZ 3.62Å; F1529-F1544 HydrophobicContact CE2-CZ 4.32Å; F1529-F1544 HydrophobicContact CZ-CE1 4.49Å; F1529-F1544 AromaticContact CZ-CE2 3.79Å; F1529-F1544 HydrophobicContact CZ-CE2 3.88Å; F1529-F1544 AromaticContact CZ-CZ 3.45Å; F1529-F1544 HydrophobicContact CZ-CZ 3.45Å; F1529-F1544 VanDerWaalsContact CZ-CZ 3.46Å; L1531-F1544 HydrophobicContact CD2-CE2 4.04Å; L1531-F1544 HydrophobicContact CD2-CZ 4.49Å; F1542-F1544 HydrophobicContact CE1-CB 4.34Å; F1542-F1544 HydrophobicContact CZ-CB 4.28Å; F1544-L1546 HydrophobicContact CE1-CB 3.92Å; F1544-L1571 WeakPolarHBondContact CB-O 3.36Å; F1544-L1571 PolarHBondContact N-O 3.24Å; F1544-M1572 HydrophobicContact CB-CB 4.15Å; F1544-M1572 HydrophobicContact CB-CG 4.04Å; F1544-M1572 HydrophobicContact CD1-CE 4.01Å; F1544-M1572 HydrophobicContact CD1-CG 3.65Å; F1544-M1572 HydrophobicContact CD1-SD 4.12Å; F1544-M1572 HydrophobicContact CD2-SD 4.47Å; F1544-M1572 HydrophobicContact CE1-CE 3.81Å; F1544-M1572 HydrophobicContact CE1-CG 4.35Å; F1544-M1572 HydrophobicContact CE1-SD 4.27Å; F1544-M1572 HydrophobicContact CG-CG 4.02Å; F1544-M1572 HydrophobicContact CG-SD 4.3Å; F1544-M1572 HydrophobicContact CZ-CE 4.19Å; F1544-M1572 HydrophobicContact CZ-SD 4.46Å; F1544-M1572 CarbonylContact O-C 3.56Å; F1544-M1572 VanDerWaalsContact O-CA 3.28Å; F1544-M1572 WeakPolarHBondContact O-CA 3.29Å; F1544-K1573 PolarHBondContact O-N 3.2Å; F1544-L1574 HydrophobicContact CE1-CD2 4.3Å
1545	L	92.5	Very high	92.6	Very high	34.6 Å²	34.6	27.4 Å²	27.4	18%	0.181	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117.6	176	177	65.3	0	0	0	109.2	L1511 S1512 I1513 K1573	L1511-L1545 PolarHBondContact O-N 3.32Å; L1511-L1545 VanDerWaalsContact O-O 3.14Å; S1512-L1545 CarbonylContact C-O 3.41Å; S1512-L1545 WeakPolarHBondContact CA-O 3.37Å; I1513-L1545 PolarHBondContact N-O 3.15Å; L1545-K1573 WeakPolarHBondContact CA-O 3.37Å; L1545-K1573 HydrophobicContact CD1-CB 4.02Å; L1545-K1573 HydrophobicContact CD1-CD 4.22Å; L1545-K1573 HydrophobicContact CD1-CG 4.15Å
1546	L	93.8	Very high	92.6	Very high	0.4 Å²	0.4	25.8 Å²	25.8	0%	0.002	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	111.5	169.5	-179.1	68.6	0	0	0	109.1	I1513 L1515 F1529 F1544 L1553 K1573 L1574 A1575	I1513-L1546 HydrophobicContact CB-CD1 3.69Å; I1513-L1546 HydrophobicContact CG2-CD1 3.54Å; I1513-L1546 CarbonylContact O-C 3.49Å; I1513-L1546 WeakPolarHBondContact O-CA 3.34Å; L1515-L1546 HydrophobicContact CD1-CD1 4.09Å; L1515-L1546 HydrophobicContact CG-CD1 4.27Å; F1529-L1546 HydrophobicContact CB-CD2 4.43Å; F1529-L1546 HydrophobicContact CD1-CD2 4.4Å; F1529-L1546 HydrophobicContact CD2-CD1 4.39Å; F1529-L1546 HydrophobicContact CG-CD2 4.28Å; F1544-L1546 HydrophobicContact CE1-CB 3.92Å; L1546-L1553 HydrophobicContact CD2-CD1 3.64Å; L1546-L1553 HydrophobicContact CD2-CD2 3.42Å; L1546-L1553 VanDerWaalsContact CD2-CD2 3.44Å; L1546-L1553 HydrophobicContact CD2-CG 4.21Å; L1546-K1573 PolarHBondContact N-O 3.09Å; L1546-L1574 HydrophobicContact CB-CD2 3.68Å; L1546-L1574 HydrophobicContact CD2-CD2 3.97Å; L1546-L1574 HydrophobicContact CG-CD2 4.33Å; L1546-L1574 CarbonylContact O-C 3.52Å; L1546-L1574 WeakPolarHBondContact O-CA 3.32Å; L1546-A1575 PolarHBondContact O-N 3.14Å
1547	S	90.2	Very high	92.6	Very high	22.2 Å²	22.2	28.2 Å²	28.2	16%	0.155	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	176.3	-176.5	81.1	0	0	0	0	111.9	I1513 S1514 L1515 A1575 K1579	I1513-S1547 PolarHBondContact O-N 3.06Å; S1514-S1547 WeakPolarHBondContact CA-OG 3.23Å; S1514-S1547 WeakPolarHBondContact CB-OG 3.4Å; S1514-S1547 PolarHBondContact OG-OG 3.02Å; S1514-S1547 VanDerWaalsContact OG-OG 3.12Å; L1515-S1547 PolarHBondContact N-O 3.17Å; S1547-A1575 VanDerWaalsContact CA-O 3.3Å; S1547-A1575 WeakPolarHBondContact CA-O 3.41Å; S1547-K1579 PolarHBondContact O-NZ 3.49Å
1548	G	86.9	Confident	92.7	Very high	16.4 Å²	16.4	24.2 Å²	24.2	17%	0.169	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	101.4	-153.4	173.9	0	0	0	0	0	114.9	L1515 M1577 K1579	L1515-G1548 CarbonylContact O-C 3.53Å; L1515-G1548 WeakPolarHBondContact O-CA 3.25Å; G1548-M1577 PolarHBondContact O-N 3.1Å; G1548-K1579 PolarHBondContact O-NZ 3.11Å
1549	Y	87.4	Confident	92.8	Very high	30.8 Å²	30.8	23.4 Å²	23.4	12%	0.121	13%	0.125	C	C	.	.	S	Bend	trans	-69.4	176.7	-170.8	-154.1	-106.3	0	0	0	114.5	L1515 P1516 D1517 P1518 V1521 A1551 M1577 K1579 L1606	L1515-Y1549 PolarHBondContact O-N 3.07Å; P1516-Y1549 VanDerWaalsContact O-CB 3.29Å; P1516-Y1549 WeakPolarHBondContact O-CB 3.38Å; D1517-Y1549 HydrophobicContact CB-CD2 3.82Å; D1517-Y1549 VanDerWaalsContact CB-CD2 3.49Å; D1517-Y1549 HydrophobicContact CB-CE2 4.13Å; D1517-Y1549 VanDerWaalsContact CB-CE2 3.47Å; D1517-Y1549 HydrophobicContact CB-CG 4.19Å; D1517-Y1549 VanDerWaalsContact CG-OH 3.31Å; D1517-Y1549 VanDerWaalsContact OD1-CD2 3.31Å; D1517-Y1549 WeakPolarHBondContact OD1-CD2 3.4Å; D1517-Y1549 WeakPolarHBondContact OD1-CE1 3.48Å; D1517-Y1549 WeakPolarHBondContact OD1-CE2 3.29Å; D1517-Y1549 PolarHBondContact OD1-OH 3.21Å; D1517-Y1549 WeakPolarHBondContact OD2-CD2 3.4Å; D1517-Y1549 WeakPolarHBondContact OD2-CE2 3.4Å; D1517-Y1549 PolarHBondContact OD2-OH 2.95Å; P1518-Y1549 VanDerWaalsContact CD-CD1 3.49Å; P1518-Y1549 VanDerWaalsContact CD-CG 3.49Å; P1518-Y1549 HydrophobicContact CG-CD1 4.05Å; P1518-Y1549 HydrophobicContact CG-CE1 3.92Å; P1518-Y1549 HydrophobicContact CG-CE2 4.39Å; P1518-Y1549 HydrophobicContact CG-CG 4.42Å; V1521-Y1549 WeakPolarHBondContact CG1-OH 3.34Å; V1521-Y1549 WeakPolarHBondContact CG2-OH 3.19Å; Y1549-A1551 PolarHBondContact O-N 3.31Å; Y1549-M1577 HydrophobicContact CD1-SD 4.17Å; Y1549-M1577 HydrophobicContact CD2-CE 4.05Å; Y1549-M1577 HydrophobicContact CD2-CG 4.5Å; Y1549-M1577 HydrophobicContact CD2-SD 3.48Å; Y1549-M1577 WeakPolarHBondContact CD2-SD 3.27Å; Y1549-M1577 HydrophobicContact CE1-CE 4.43Å; Y1549-M1577 HydrophobicContact CE1-SD 4.02Å; Y1549-M1577 HydrophobicContact CE2-CE 3.59Å; Y1549-M1577 VanDerWaalsContact CE2-CE 3.43Å; Y1549-M1577 HydrophobicContact CE2-SD 3.41Å; Y1549-M1577 VanDerWaalsContact CE2-SD 3.56Å; Y1549-M1577 WeakPolarHBondContact CE2-SD 3.27Å; Y1549-M1577 HydrophobicContact CG-SD 4.1Å; Y1549-M1577 VanDerWaalsContact CZ-SD 3.57Å; Y1549-M1577 WeakPolarHBondContact OH-CE 3.39Å; Y1549-K1579 WeakPolarHBondContact O-CE 3.33Å; Y1549-K1579 PolarHBondContact O-NZ 3.02Å; Y1549-L1606 WeakPolarHBondContact OH-CD1 2.94Å
1550	Y	88.3	Confident	92.8	Very high	28 Å²	28	23.3 Å²	23.3	11%	0.11	12%	0.124	C	C	.	.			trans	-54.5	132.8	176.5	174.1	-96.5	0	0	0	112.1	E1578 E1580 A1605 V1611	Y1550-E1578 WeakPolarHBondContact CA-O 3.17Å; Y1550-E1578 HydrophobicContact CD2-CB 4.44Å; Y1550-E1578 VanDerWaalsContact CD2-O 3.31Å; Y1550-E1578 WeakPolarHBondContact CD2-O 3.3Å; Y1550-E1580 HydrophobicContact CE2-CB 4.19Å; Y1550-E1580 PolarHBondContact OH-OE2 3.09Å; Y1550-A1605 HydrophobicContact CD2-CB 3.61Å; Y1550-A1605 HydrophobicContact CE2-CB 4.2Å; Y1550-A1605 HydrophobicContact CG-CB 4.35Å; Y1550-V1611 HydrophobicContact CD2-CG1 4.48Å; Y1550-V1611 HydrophobicContact CD2-CG2 4.48Å; Y1550-V1611 HydrophobicContact CE2-CG1 3.82Å; Y1550-V1611 HydrophobicContact CE2-CG2 3.99Å
1551	A	90.7	Very high	93	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	148.3	-179.3	0	0	0	0	0	111.9	L1515 H1527 Y1549 L1553 K1579 E1580	L1515-A1551 HydrophobicContact CD1-CB 3.51Å; L1515-A1551 VanDerWaalsContact CD1-CB 3.48Å; H1527-A1551 HydrophobicContact CB-CB 3.78Å; H1527-A1551 CarbonylContact O-C 3.51Å; H1527-A1551 VanDerWaalsContact O-CA 3.27Å; H1527-A1551 WeakPolarHBondContact O-CA 3.3Å; Y1549-A1551 PolarHBondContact O-N 3.31Å; A1551-L1553 HydrophobicContact CB-CD2 3.92Å; A1551-K1579 HydrophobicContact CB-CD 4.06Å; A1551-E1580 PolarHBondContact O-N 3.03Å
1552	W	92.9	Very high	93.2	Very high	74 Å²	74	24.4 Å²	24.4	28%	0.28	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	123.8	169	-178	83.4	0	0	0	110.4	H1527 R1528 F1529 E1530 N1554 E1580	H1527-W1552 PolarHBondContact O-N 3.34Å; R1528-W1552 CarbonylContact C-O 3.54Å; R1528-W1552 WeakPolarHBondContact CA-O 3.4Å; R1528-W1552 HydrophobicContact CB-CE3 4.3Å; R1528-W1552 HydrophobicContact CG-CB 4.46Å; R1528-W1552 HydrophobicContact CG-CE3 4.35Å; F1529-W1552 PolarHBondContact N-O 3.1Å; E1530-W1552 HydrophobicContact CG-CE3 4.46Å; E1530-W1552 HydrophobicContact CG-CH2 4.36Å; E1530-W1552 HydrophobicContact CG-CZ3 3.65Å; W1552-N1554 HydrophobicContact CH2-CB 3.77Å; W1552-N1554 HydrophobicContact CZ2-CB 4.18Å; W1552-N1554 HydrophobicContact CZ3-CB 4.09Å; W1552-E1580 CarbonylContact C-O 3.3Å; W1552-E1580 VanDerWaalsContact CD1-CD 3.49Å
1553	L	95.5	Very high	93.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.2	-171.8	-50.7	-173.4	0	0	0	111.2	F1529 L1546 A1551 L1574 K1579 E1580 L1581 V1582	F1529-L1553 HydrophobicContact CB-CD2 3.57Å; F1529-L1553 HydrophobicContact CD1-CD2 4.49Å; F1529-L1553 HydrophobicContact CG-CD2 4.38Å; F1529-L1553 CarbonylContact O-C 3.57Å; F1529-L1553 VanDerWaalsContact O-CA 3.31Å; F1529-L1553 WeakPolarHBondContact O-CA 3.26Å; L1546-L1553 HydrophobicContact CD2-CD1 3.64Å; L1546-L1553 HydrophobicContact CD2-CD2 3.42Å; L1546-L1553 VanDerWaalsContact CD2-CD2 3.44Å; L1546-L1553 HydrophobicContact CD2-CG 4.21Å; A1551-L1553 HydrophobicContact CB-CD2 3.92Å; L1553-L1574 HydrophobicContact CD1-CD1 4.33Å; L1553-L1574 HydrophobicContact CD1-CD2 4.33Å; L1553-K1579 HydrophobicContact CD1-CB 3.6Å; L1553-K1579 HydrophobicContact CD1-CD 4.02Å; L1553-K1579 HydrophobicContact CD1-CG 3.82Å; L1553-K1579 HydrophobicContact CG-CB 4.11Å; L1553-K1579 HydrophobicContact CG-CD 4.39Å; L1553-K1579 HydrophobicContact CG-CG 4.38Å; L1553-E1580 PolarHBondContact N-O 3.15Å; L1553-L1581 HydrophobicContact CB-CB 4.25Å; L1553-L1581 HydrophobicContact CB-CD1 3.47Å; L1553-L1581 VanDerWaalsContact CB-CD1 3.44Å; L1553-L1581 HydrophobicContact CB-CG 4.43Å; L1553-L1581 HydrophobicContact CD1-CB 4.44Å; L1553-L1581 HydrophobicContact CD1-CD1 4.08Å; L1553-L1581 HydrophobicContact CG-CD1 4.42Å; L1553-L1581 WeakPolarHBondContact O-CA 3.25Å; L1553-V1582 PolarHBondContact O-N 3.05Å
1554	N	96	Very high	93.4	Very high	22.6 Å²	22.6	27.4 Å²	27.4	12%	0.121	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	109.1	171.2	-176.8	-17.3	0	0	0	109.9	F1529 E1530 L1531 W1552 S1556 V1582	F1529-N1554 PolarHBondContact O-N 3.08Å; E1530-N1554 CarbonylContact C-O 3.46Å; E1530-N1554 WeakPolarHBondContact CA-O 3.31Å; E1530-N1554 HydrophobicContact CG-CB 4.37Å; L1531-N1554 PolarHBondContact N-O 3.17Å; W1552-N1554 HydrophobicContact CH2-CB 3.77Å; W1552-N1554 HydrophobicContact CZ2-CB 4.18Å; W1552-N1554 HydrophobicContact CZ3-CB 4.09Å; N1554-S1556 WeakPolarHBondContact OD1-CB 3.41Å; N1554-S1556 PolarHBondContact OD1-OG 3.15Å; N1554-V1582 WeakPolarHBondContact CA-O 3.47Å
1555	I	96.1	Very high	93.3	Very high	0.2 Å²	0.2	27.7 Å²	27.7	0%	0.001	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	94.2	178.6	-57.7	176.9	0	0	0	107.4	F1529 L1531 N1558 M1572 L1581 V1582 M1583 E1584 N1586	F1529-I1555 HydrophobicContact CD1-CG1 4.47Å; F1529-I1555 HydrophobicContact CE1-CD1 4.44Å; F1529-I1555 HydrophobicContact CE1-CG1 4.36Å; L1531-I1555 HydrophobicContact CB-CG1 4.4Å; L1531-I1555 HydrophobicContact CD2-CG2 4.32Å; L1531-I1555 CarbonylContact O-C 3.35Å; L1531-I1555 VanDerWaalsContact O-CA 3.29Å; L1531-I1555 WeakPolarHBondContact O-CA 3.37Å; I1555-N1558 WeakPolarHBondContact CG2-ND2 3.22Å; I1555-M1572 HydrophobicContact CD1-CE 3.41Å; I1555-M1572 HydrophobicContact CD1-SD 4.33Å; I1555-L1581 HydrophobicContact CD1-CD1 4.21Å; I1555-L1581 HydrophobicContact CG1-CD1 4.32Å; I1555-V1582 PolarHBondContact N-O 3Å; I1555-M1583 HydrophobicContact CB-CE 4.17Å; I1555-M1583 HydrophobicContact CB-CG 4.23Å; I1555-M1583 HydrophobicContact CD1-CE 3.96Å; I1555-M1583 HydrophobicContact CG2-CE 4.11Å; I1555-M1583 HydrophobicContact CG2-CG 4.35Å; I1555-M1583 VanDerWaalsContact O-CA 3.3Å; I1555-M1583 WeakPolarHBondContact O-CA 3.34Å; I1555-E1584 PolarHBondContact O-N 3.05Å; I1555-E1584 VanDerWaalsContact O-N 3.08Å; I1555-N1586 PolarHBondContact O-ND2 3.22Å
1556	S	95.7	Very high	92.9	Very high	2.8 Å²	2.8	31 Å²	31	2%	0.02	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.4	-172	52.1	0	0	0	0	115	L1531 R1532 E1533 N1554 N1558 E1584	L1531-S1556 PolarHBondContact O-N 3.06Å; R1532-S1556 VanDerWaalsContact CA-O 3.28Å; R1532-S1556 WeakPolarHBondContact CA-O 3.27Å; R1532-S1556 WeakPolarHBondContact CG-OG 3.4Å; R1532-S1556 PolarHBondContact NE-OG 2.97Å; E1533-S1556 PolarHBondContact N-O 3.24Å; E1533-S1556 VanDerWaalsContact N-O 3.11Å; N1554-S1556 WeakPolarHBondContact OD1-CB 3.41Å; N1554-S1556 PolarHBondContact OD1-OG 3.15Å; S1556-N1558 VanDerWaalsContact C-N 3.28Å; S1556-N1558 PolarHBondContact N-ND2 3.1Å; S1556-N1558 PolarHBondContact O-N 3Å; S1556-N1558 PolarHBondContact O-ND2 3.03Å; S1556-E1584 CarbonylContact C-O 3.41Å; S1556-E1584 VanDerWaalsContact CA-O 3.23Å; S1556-E1584 WeakPolarHBondContact CA-O 3.33Å
1557	S	95.7	Very high	92.2	Very high	50.6 Å²	50.6	36.9 Å²	36.9	35%	0.354	18%	0.177	S	C	.	.	S	Bend	trans	58.2	33.6	173.3	-52.3	0	0	0	0	114.7	E1533 E1584 R1585 N1586	E1533-S1557 VanDerWaalsContact CA-O 3.3Å; E1533-S1557 WeakPolarHBondContact CA-O 3.29Å; S1557-E1584 PolarHBondContact N-O 3.19Å; S1557-R1585 WeakPolarHBondContact CA-O 3.31Å; S1557-N1586 PolarHBondContact N-OD1 3.12Å
1558	N	96.4	Very high	91.6	Very high	1.6 Å²	1.6	38.8 Å²	38.8	1%	0.009	19%	0.185	C	C	.	.			trans	-94.4	156.1	177.2	-54.7	-72.2	0	0	0	112	L1531 R1532 E1533 S1534 I1555 S1556 F1560 N1586 R1587	L1531-N1558 PolarHBondContact O-ND2 2.93Å; R1532-N1558 VanDerWaalsContact C-OD1 3.26Å; R1532-N1558 WeakPolarHBondContact CA-OD1 3.29Å; R1532-N1558 PolarHBondContact N-OD1 2.92Å; E1533-N1558 PolarHBondContact N-OD1 2.91Å; S1534-N1558 WeakPolarHBondContact CB-OD1 3.34Å; S1534-N1558 PolarHBondContact N-OD1 3.14Å; S1534-N1558 CarbonylContact O-C 3.52Å; S1534-N1558 VanDerWaalsContact O-CA 3.26Å; S1534-N1558 WeakPolarHBondContact O-CA 3.34Å; S1534-N1558 WeakPolarHBondContact O-CB 3.39Å; I1555-N1558 WeakPolarHBondContact CG2-ND2 3.22Å; S1556-N1558 VanDerWaalsContact C-N 3.28Å; S1556-N1558 PolarHBondContact N-ND2 3.1Å; S1556-N1558 PolarHBondContact O-N 3Å; S1556-N1558 PolarHBondContact O-ND2 3.03Å; N1558-F1560 HydrophobicContact CB-CD2 4.41Å; N1558-F1560 HydrophobicContact CB-CE2 3.73Å; N1558-F1560 HydrophobicContact CB-CZ 4.29Å; N1558-N1586 VanDerWaalsContact CB-OD1 3.32Å; N1558-N1586 WeakPolarHBondContact CB-OD1 3.33Å; N1558-N1586 PolarHBondContact N-OD1 2.91Å; N1558-N1586 VanDerWaalsContact N-OD1 3.08Å; N1558-N1586 PolarHBondContact ND2-OD1 3Å; N1558-N1586 CarbonylContact O-C 3.51Å; N1558-N1586 VanDerWaalsContact O-CA 3.29Å; N1558-N1586 WeakPolarHBondContact O-CA 3.43Å; N1558-R1587 PolarHBondContact O-N 3.02Å
1559	N	96	Very high	91.5	Very high	48.2 Å²	48.2	39.3 Å²	39.3	26%	0.258	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123	177.7	-172.6	47.4	0	0	0	110.3	S1534 N1535 F1536 T1561	S1534-N1559 PolarHBondContact O-N 2.94Å; N1535-N1559 CarbonylContact C-O 3.57Å; N1535-N1559 WeakPolarHBondContact CA-O 3.41Å; N1535-N1559 WeakPolarHBondContact OD1-CB 3.42Å; N1535-N1559 PolarHBondContact OD1-ND2 2.96Å; N1535-N1559 PolarHBondContact OD1-O 3.14Å; F1536-N1559 PolarHBondContact N-O 3.27Å; N1559-T1561 WeakPolarHBondContact ND2-CG2 3.19Å; N1559-T1561 PolarHBondContact ND2-OG1 2.89Å; N1559-T1561 WeakPolarHBondContact OD1-CG2 3.35Å
1560	F	95.8	Very high	91.5	Very high	0.2 Å²	0.2	37.9 Å²	37.9	0%	0.001	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	105.7	176.9	-63.5	-89.8	0	0	0	108.3	L1531 F1536 F1542 N1558 R1587 W1588 R1589 N1591	L1531-F1560 HydrophobicContact CD2-CZ 4.16Å; F1536-F1560 HydrophobicContact CB-CD1 3.6Å; F1536-F1560 HydrophobicContact CB-CE1 3.99Å; F1536-F1560 HydrophobicContact CB-CG 4.42Å; F1536-F1560 HydrophobicContact CD1-CE1 4.41Å; F1536-F1560 AromaticContact CD2-CD1 3.76Å; F1536-F1560 HydrophobicContact CD2-CD1 3.76Å; F1536-F1560 AromaticContact CD2-CE1 3.28Å; F1536-F1560 HydrophobicContact CD2-CE1 3.28Å; F1536-F1560 AromaticContact CD2-CZ 3.81Å; F1536-F1560 HydrophobicContact CD2-CZ 3.81Å; F1536-F1560 AromaticContact CE2-CE1 3.8Å; F1536-F1560 HydrophobicContact CE2-CE1 3.8Å; F1536-F1560 HydrophobicContact CE2-CZ 4.04Å; F1536-F1560 AromaticContact CG-CD1 3.82Å; F1536-F1560 HydrophobicContact CG-CD1 3.82Å; F1536-F1560 AromaticContact CG-CE1 3.65Å; F1536-F1560 HydrophobicContact CG-CE1 3.65Å; F1536-F1560 HydrophobicContact CZ-CE1 4.5Å; F1536-F1560 CarbonylContact O-C 3.53Å; F1536-F1560 WeakPolarHBondContact O-CA 3.38Å; F1542-F1560 HydrophobicContact CE1-CD1 4.42Å; F1542-F1560 HydrophobicContact CE1-CE1 4.45Å; F1542-F1560 HydrophobicContact CZ-CD1 4.28Å; F1542-F1560 HydrophobicContact CZ-CE1 4.09Å; N1558-F1560 HydrophobicContact CB-CD2 4.41Å; N1558-F1560 HydrophobicContact CB-CE2 3.73Å; N1558-F1560 HydrophobicContact CB-CZ 4.29Å; F1560-R1587 PolarHBondContact N-O 3.06Å; F1560-W1588 HydrophobicContact CB-CD2 3.98Å; F1560-W1588 HydrophobicContact CB-CE3 3.41Å; F1560-W1588 VanDerWaalsContact CB-CE3 3.44Å; F1560-W1588 HydrophobicContact CB-CH2 4.46Å; F1560-W1588 HydrophobicContact CB-CZ3 3.74Å; F1560-W1588 HydrophobicContact CD1-CE3 4.24Å; F1560-W1588 AromaticContact CD1-CH2 3.84Å; F1560-W1588 HydrophobicContact CD1-CH2 3.9Å; F1560-W1588 AromaticContact CD1-CZ3 3.64Å; F1560-W1588 HydrophobicContact CD1-CZ3 3.64Å; F1560-W1588 AromaticContact CD2-CD2 3.76Å; F1560-W1588 HydrophobicContact CD2-CD2 3.76Å; F1560-W1588 AromaticContact CD2-CE2 3.66Å; F1560-W1588 AromaticContact CD2-CE3 3.76Å; F1560-W1588 HydrophobicContact CD2-CE3 3.76Å; F1560-W1588 AromaticContact CD2-CH2 3.59Å; F1560-W1588 HydrophobicContact CD2-CH2 3.59Å; F1560-W1588 AromaticContact CD2-CZ2 3.58Å; F1560-W1588 HydrophobicContact CD2-CZ2 3.58Å; F1560-W1588 VanDerWaalsContact CD2-CZ2 3.49Å; F1560-W1588 AromaticContact CD2-CZ3 3.68Å; F1560-W1588 HydrophobicContact CD2-CZ3 3.68Å; F1560-W1588 AromaticContact CE1-CH2 3.86Å; F1560-W1588 HydrophobicContact CE1-CH2 3.91Å; F1560-W1588 HydrophobicContact CE1-CZ3 4.13Å; F1560-W1588 HydrophobicContact CE2-CD2 4.47Å; F1560-W1588 AromaticContact CE2-CE2 3.94Å; F1560-W1588 HydrophobicContact CE2-CE3 4.49Å; F1560-W1588 AromaticContact CE2-CH2 3.59Å; F1560-W1588 HydrophobicContact CE2-CH2 3.59Å; F1560-W1588 AromaticContact CE2-CZ2 3.51Å; F1560-W1588 HydrophobicContact CE2-CZ2 3.51Å; F1560-W1588 VanDerWaalsContact CE2-CZ2 3.46Å; F1560-W1588 HydrophobicContact CE2-CZ3 4.15Å; F1560-W1588 AromaticContact CG-CD2 3.99Å; F1560-W1588 HydrophobicContact CG-CD2 4.04Å; F1560-W1588 AromaticContact CG-CE3 3.55Å; F1560-W1588 HydrophobicContact CG-CE3 3.55Å; F1560-W1588 VanDerWaalsContact CG-CE3 3.48Å; F1560-W1588 AromaticContact CG-CH2 3.75Å; F1560-W1588 HydrophobicContact CG-CH2 3.75Å; F1560-W1588 HydrophobicContact CG-CZ2 4.2Å; F1560-W1588 AromaticContact CG-CZ3 3.4Å; F1560-W1588 HydrophobicContact CG-CZ3 3.4Å; F1560-W1588 VanDerWaalsContact CG-CZ3 3.44Å; F1560-W1588 AromaticContact CZ-CH2 3.76Å; F1560-W1588 HydrophobicContact CZ-CH2 3.76Å; F1560-W1588 AromaticContact CZ-CZ2 3.99Å; F1560-W1588 HydrophobicContact CZ-CZ2 4.08Å; F1560-W1588 HydrophobicContact CZ-CZ3 4.36Å; F1560-W1588 WeakPolarHBondContact O-CA 3.42Å; F1560-R1589 PolarHBondContact O-N 2.9Å; F1560-N1591 PolarHBondContact O-ND2 3.25Å; F1560-N1591 PolarHBondContact O-OD1 3.11Å
1561	T	95.4	Very high	91.7	Very high	22.4 Å²	22.4	36.6 Å²	36.6	14%	0.137	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131	-174	50.5	0	0	0	0	112.7	F1536 Q1537 D1538 N1559 N1563 R1589	F1536-T1561 PolarHBondContact O-N 3Å; Q1537-T1561 VanDerWaalsContact CA-O 3.27Å; Q1537-T1561 WeakPolarHBondContact CA-O 3.29Å; Q1537-T1561 WeakPolarHBondContact CG-OG1 3.29Å; D1538-T1561 PolarHBondContact N-O 3.08Å; D1538-T1561 VanDerWaalsContact N-O 3.11Å; N1559-T1561 WeakPolarHBondContact ND2-CG2 3.19Å; N1559-T1561 PolarHBondContact ND2-OG1 2.89Å; N1559-T1561 WeakPolarHBondContact OD1-CG2 3.35Å; T1561-N1563 PolarHBondContact N-ND2 3.01Å; T1561-N1563 PolarHBondContact O-N 3.03Å; T1561-N1563 VanDerWaalsContact O-N 3.12Å; T1561-N1563 PolarHBondContact O-ND2 2.92Å; T1561-R1589 VanDerWaalsContact CA-O 3.3Å; T1561-R1589 WeakPolarHBondContact CA-O 3.38Å; T1561-R1589 HydrophobicContact CG2-CB 4.31Å
1562	M	95.3	Very high	91.9	Very high	99.8 Å²	99.8	36.6 Å²	36.6	49%	0.492	17%	0.174	S	C	.	.	S	Bend	trans	56.1	25.7	173.6	-60	179	174.1	0	0	114.7	D1538 R1589 Y1590 N1591	D1538-M1562 WeakPolarHBondContact CA-O 3.26Å; M1562-R1589 PolarHBondContact N-O 3.04Å; M1562-R1589 VanDerWaalsContact N-O 3.11Å; M1562-Y1590 WeakPolarHBondContact CA-O 3.42Å; M1562-Y1590 HydrophobicContact CE-CD2 4.32Å; M1562-N1591 PolarHBondContact N-OD1 2.9Å
1563	N	94.7	Very high	92	Very high	0.6 Å²	0.6	35.7 Å²	35.7	0%	0.003	17%	0.171	C	C	.	.			trans	-80.5	139	175.3	-56.4	-72.3	0	0	0	109.8	F1536 N1539 F1542 T1561 L1571 N1591 Q1592	F1536-N1563 PolarHBondContact O-ND2 3.09Å; F1536-N1563 PolarHBondContact O-OD1 3.03Å; N1539-N1563 VanDerWaalsContact CB-OD1 3.29Å; N1539-N1563 WeakPolarHBondContact CB-OD1 3.41Å; N1539-N1563 PolarHBondContact N-OD1 2.92Å; N1539-N1563 PolarHBondContact ND2-OD1 2.84Å; N1539-N1563 WeakPolarHBondContact O-CA 3.4Å; F1542-N1563 HydrophobicContact CB-CB 4.12Å; F1542-N1563 HydrophobicContact CD1-CB 4.19Å; F1542-N1563 HydrophobicContact CG-CB 4.14Å; T1561-N1563 PolarHBondContact N-ND2 3.01Å; T1561-N1563 PolarHBondContact O-N 3.03Å; T1561-N1563 VanDerWaalsContact O-N 3.12Å; T1561-N1563 PolarHBondContact O-ND2 2.92Å; N1563-L1571 HydrophobicContact CB-CD2 4.12Å; N1563-N1591 WeakPolarHBondContact CB-OD1 3.38Å; N1563-N1591 PolarHBondContact N-OD1 3.17Å; N1563-N1591 PolarHBondContact ND2-OD1 3.09Å; N1563-N1591 CarbonylContact O-C 3.54Å; N1563-N1591 VanDerWaalsContact O-CA 3.26Å; N1563-N1591 WeakPolarHBondContact O-CA 3.31Å; N1563-N1591 WeakPolarHBondContact O-CB 3.35Å; N1563-Q1592 PolarHBondContact O-N 3.15Å
1564	R	93.4	Very high	91.9	Very high	119.4 Å²	119.4	35.7 Å²	35.7	45%	0.451	17%	0.172	S	C	.	.	B	Isolated β-bridge	trans	-113.1	113.7	178.8	-71.6	-179.9	-172.6	164.2	4.4	109.4	N1539 V1540 D1541 F1542 H1567 Q1592	N1539-R1564 PolarHBondContact O-N 2.89Å; V1540-R1564 CarbonylContact C-O 3.54Å; D1541-R1564 CarbonylContact C-O 3.52Å; D1541-R1564 VanDerWaalsContact CA-O 3.27Å; D1541-R1564 WeakPolarHBondContact CA-O 3.36Å; D1541-R1564 PolarHBondContact N-O 3.07Å; F1542-R1564 PolarHBondContact N-O 3.03Å; R1564-H1567 PolarHBondContact NH2-NE2 2.64Å; R1564-Q1592 HydrophobicContact CB-CB 4.38Å; R1564-Q1592 HydrophobicContact CG-CB 4.18Å; R1564-Q1592 HydrophobicContact CG-CG 4.44Å
1565	A	90.8	Very high	91.8	Very high	7 Å²	7	35.3 Å²	35.3	6%	0.058	17%	0.171	C	C	.	.			trans	-78	159.8	170	0	0	0	0	0	111.1	F1542 I1569 L1571 Q1592	F1542-A1565 WeakPolarHBondContact O-CA 3.31Å; F1542-A1565 WeakPolarHBondContact O-CB 3.36Å; A1565-I1569 HydrophobicContact CB-CG1 4.44Å; A1565-L1571 HydrophobicContact CB-CD2 3.98Å; A1565-L1571 HydrophobicContact CB-CG 4.42Å; A1565-Q1592 WeakPolarHBondContact CB-O 3.46Å; A1565-Q1592 PolarHBondContact N-O 3.05Å
1566	R	85	Confident	91.4	Very high	102.8 Å²	102.8	36.4 Å²	36.4	39%	0.388	18%	0.183	S	C	.	.			trans	-64.5	148.2	170.8	-161.7	176.8	81.9	-172.9	4	110.1	D1568 I1569	R1566-D1568 WeakPolarHBondContact CD-OD1 3.34Å; R1566-D1568 VanDerWaalsContact CG-OD1 3.26Å; R1566-D1568 WeakPolarHBondContact CG-OD1 3.43Å; R1566-D1568 IonicContact CZ-OD1 3.37Å; R1566-D1568 IonicContact CZ-OD2 3.16Å; R1566-D1568 IonicContact NE-OD1 3.82Å; R1566-D1568 PolarHBondContact NE-OD1 3.13Å; R1566-D1568 IonicContact NE-OD2 3.22Å; R1566-D1568 PolarHBondContact NE-OD2 3.06Å; R1566-D1568 IonicContact NH2-OD1 3.03Å; R1566-D1568 PolarHBondContact NH2-OD1 2.86Å; R1566-D1568 IonicContact NH2-OD2 3.28Å; R1566-D1568 PolarHBondContact NH2-OD2 3.06Å; R1566-D1568 PolarHBondContact O-N 3.14Å; R1566-D1568 VanDerWaalsContact O-N 3.07Å; R1566-I1569 HydrophobicContact CB-CD1 3.86Å; R1566-I1569 HydrophobicContact CB-CG1 4.02Å; R1566-I1569 VanDerWaalsContact NH2-CD1 3.32Å; R1566-I1569 CarbonylContact O-C 3.49Å; R1566-I1569 WeakPolarHBondContact O-CG1 3.3Å; R1566-I1569 PolarHBondContact O-N 3.2Å; R1566-I1569 VanDerWaalsContact O-N 3.1Å; R1566-I1569 VanDerWaalsContact O-O 3.05Å
1567	H	78.4	Confident	91.1	Very high	125.4 Å²	125.4	37.2 Å²	37.2	58%	0.581	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-25	-170.4	-65.2	85.1	0	0	0	115.8	R1564 F1625	R1564-H1567 PolarHBondContact NH2-NE2 2.64Å; H1567-F1625 WeakPolarHBondContact O-CE2 3.48Å; H1567-F1625 WeakPolarHBondContact O-CZ 3.48Å
1568	D	77.2	Confident	90.8	Very high	62 Å²	62	35.5 Å²	35.5	33%	0.332	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-8.7	-177.9	57.2	-35.3	0	0	0	114	R1566	R1566-D1568 WeakPolarHBondContact CD-OD1 3.34Å; R1566-D1568 VanDerWaalsContact CG-OD1 3.26Å; R1566-D1568 WeakPolarHBondContact CG-OD1 3.43Å; R1566-D1568 IonicContact CZ-OD1 3.37Å; R1566-D1568 IonicContact CZ-OD2 3.16Å; R1566-D1568 IonicContact NE-OD1 3.82Å; R1566-D1568 PolarHBondContact NE-OD1 3.13Å; R1566-D1568 IonicContact NE-OD2 3.22Å; R1566-D1568 PolarHBondContact NE-OD2 3.06Å; R1566-D1568 IonicContact NH2-OD1 3.03Å; R1566-D1568 PolarHBondContact NH2-OD1 2.86Å; R1566-D1568 IonicContact NH2-OD2 3.28Å; R1566-D1568 PolarHBondContact NH2-OD2 3.06Å; R1566-D1568 PolarHBondContact O-N 3.14Å; R1566-D1568 VanDerWaalsContact O-N 3.07Å
1569	I	83.9	Confident	90.6	Very high	26 Å²	26	35.5 Å²	35.5	13%	0.133	17%	0.173	C	C	.	.	S	Bend	trans	-125.5	165.7	-174.4	-10.3	173.4	0	0	0	110.2	Q1543 A1565 R1566 K1594 W1595	Q1543-I1569 HydrophobicContact CB-CD1 3.86Å; Q1543-I1569 HydrophobicContact CG-CD1 3.91Å; Q1543-I1569 HydrophobicContact CG-CG2 4.1Å; A1565-I1569 HydrophobicContact CB-CG1 4.44Å; R1566-I1569 HydrophobicContact CB-CD1 3.86Å; R1566-I1569 HydrophobicContact CB-CG1 4.02Å; R1566-I1569 VanDerWaalsContact NH2-CD1 3.32Å; R1566-I1569 CarbonylContact O-C 3.49Å; R1566-I1569 WeakPolarHBondContact O-CG1 3.3Å; R1566-I1569 PolarHBondContact O-N 3.2Å; R1566-I1569 VanDerWaalsContact O-N 3.1Å; R1566-I1569 VanDerWaalsContact O-O 3.05Å; I1569-K1594 VanDerWaalsContact O-CB 3.28Å; I1569-K1594 WeakPolarHBondContact O-CB 3.38Å; I1569-K1594 PolarHBondContact O-N 3.1Å; I1569-K1594 VanDerWaalsContact O-N 3.11Å; I1569-W1595 HydrophobicContact CG2-CZ2 4.17Å
1570	G	88.1	Confident	90.4	Very high	1.6 Å²	1.6	35.7 Å²	35.7	2%	0.016	17%	0.172	C	C	.	.			trans	-104.7	-175.8	168.9	0	0	0	0	0	113.4	W1595	G1570-W1595 CarbonylContact C-O 3.49Å; G1570-W1595 VanDerWaalsContact CA-CD1 3.41Å; G1570-W1595 VanDerWaalsContact CA-CE2 3.46Å; G1570-W1595 WeakPolarHBondContact CA-O 3.35Å; G1570-W1595 VanDerWaalsContact N-CE2 3.3Å; G1570-W1595 VanDerWaalsContact N-CZ2 3.33Å
1571	L	93.4	Very high	90.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.173	C	C	.	.	S	Bend	trans	-74.4	-48.7	-173.4	-63.2	163.5	0	0	0	112.1	F1542 F1544 N1563 A1565 W1588 N1591 W1595 V1596	F1542-L1571 HydrophobicContact CD1-CB 4.37Å; F1542-L1571 HydrophobicContact CD1-CD2 3.8Å; F1542-L1571 HydrophobicContact CE1-CB 4.42Å; F1544-L1571 WeakPolarHBondContact CB-O 3.36Å; F1544-L1571 PolarHBondContact N-O 3.24Å; N1563-L1571 HydrophobicContact CB-CD2 4.12Å; A1565-L1571 HydrophobicContact CB-CD2 3.98Å; A1565-L1571 HydrophobicContact CB-CG 4.42Å; L1571-W1588 HydrophobicContact CB-CZ3 4.22Å; L1571-W1588 HydrophobicContact CD1-CE3 4.39Å; L1571-W1588 HydrophobicContact CD1-CZ3 4.36Å; L1571-N1591 HydrophobicContact CD1-CB 3.26Å; L1571-N1591 HydrophobicContact CD2-CB 4.17Å; L1571-N1591 HydrophobicContact CG-CB 4.35Å; L1571-W1595 PolarHBondContact N-O 3.07Å; L1571-V1596 HydrophobicContact CD1-CB 4.31Å; L1571-V1596 HydrophobicContact CD1-CG1 4.07Å; L1571-V1596 HydrophobicContact CD1-CG2 4.14Å
1572	M	94.9	Very high	90.4	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129	-177.9	-174.3	171.4	155.8	0	0	112.3	F1544 I1555 L1574 M1583 W1588 W1595 V1596 L1597 S1598	F1544-M1572 HydrophobicContact CB-CB 4.15Å; F1544-M1572 HydrophobicContact CB-CG 4.04Å; F1544-M1572 HydrophobicContact CD1-CE 4.01Å; F1544-M1572 HydrophobicContact CD1-CG 3.65Å; F1544-M1572 HydrophobicContact CD1-SD 4.12Å; F1544-M1572 HydrophobicContact CD2-SD 4.47Å; F1544-M1572 HydrophobicContact CE1-CE 3.81Å; F1544-M1572 HydrophobicContact CE1-CG 4.35Å; F1544-M1572 HydrophobicContact CE1-SD 4.27Å; F1544-M1572 HydrophobicContact CG-CG 4.02Å; F1544-M1572 HydrophobicContact CG-SD 4.3Å; F1544-M1572 HydrophobicContact CZ-CE 4.19Å; F1544-M1572 HydrophobicContact CZ-SD 4.46Å; F1544-M1572 CarbonylContact O-C 3.56Å; F1544-M1572 VanDerWaalsContact O-CA 3.28Å; F1544-M1572 WeakPolarHBondContact O-CA 3.29Å; I1555-M1572 HydrophobicContact CD1-CE 3.41Å; I1555-M1572 HydrophobicContact CD1-SD 4.33Å; M1572-L1574 HydrophobicContact CE-CD1 3.96Å; M1572-L1574 HydrophobicContact CE-CD2 3.55Å; M1572-L1574 VanDerWaalsContact CE-CD2 3.47Å; M1572-L1574 HydrophobicContact CE-CG 3.81Å; M1572-M1583 HydrophobicContact CE-CE 3.76Å; M1572-M1583 HydrophobicContact CE-SD 4.01Å; M1572-M1583 HydrophobicContact SD-CE 4.04Å; M1572-W1588 HydrophobicContact CB-CH2 4.02Å; M1572-W1588 HydrophobicContact CE-CH2 4.33Å; M1572-W1588 HydrophobicContact CE-CZ2 3.96Å; M1572-W1588 HydrophobicContact SD-CH2 4.07Å; M1572-W1588 HydrophobicContact SD-CZ2 4.18Å; M1572-W1595 PolarHBondContact O-NE1 2.95Å; M1572-V1596 WeakPolarHBondContact CB-O 3.38Å; M1572-V1596 PolarHBondContact N-O 2.93Å; M1572-L1597 HydrophobicContact CB-CD1 3.98Å; M1572-L1597 HydrophobicContact CE-CD1 3.89Å; M1572-L1597 HydrophobicContact CE-CD2 4.08Å; M1572-L1597 HydrophobicContact CE-CG 4.27Å; M1572-L1597 HydrophobicContact CG-CD1 3.69Å; M1572-L1597 CarbonylContact O-C 3.55Å; M1572-L1597 WeakPolarHBondContact O-CA 3.31Å; M1572-L1597 HydrophobicContact SD-CD1 3.85Å; M1572-S1598 PolarHBondContact O-N 3.09Å
1573	K	94.2	Very high	90.4	Very high	54.6 Å²	54.6	31.9 Å²	31.9	24%	0.237	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	125	175.7	-172.6	173.9	-177	177.7	0	111.1	F1544 L1545 L1546 S1598 D1600	F1544-K1573 PolarHBondContact O-N 3.2Å; L1545-K1573 WeakPolarHBondContact CA-O 3.37Å; L1545-K1573 HydrophobicContact CD1-CB 4.02Å; L1545-K1573 HydrophobicContact CD1-CD 4.22Å; L1545-K1573 HydrophobicContact CD1-CG 4.15Å; L1546-K1573 PolarHBondContact N-O 3.09Å; K1573-S1598 CarbonylContact C-O 3.34Å; K1573-S1598 VanDerWaalsContact CA-O 3.29Å; K1573-S1598 WeakPolarHBondContact CA-O 3.31Å; K1573-D1600 VanDerWaalsContact CE-CB 3.46Å; K1573-D1600 VanDerWaalsContact CE-OD2 3.24Å; K1573-D1600 WeakPolarHBondContact CE-OD2 3.32Å; K1573-D1600 IonicContact NZ-OD2 3.12Å; K1573-D1600 PolarHBondContact NZ-OD2 3.05Å
1574	L	94.6	Very high	90.4	Very high	0.4 Å²	0.4	34 Å²	34	0%	0.002	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.9	171.7	-61.5	-177.9	0	0	0	108.6	F1544 L1546 L1553 M1572 L1581 L1597 S1598 F1599 D1600	F1544-L1574 HydrophobicContact CE1-CD2 4.3Å; L1546-L1574 HydrophobicContact CB-CD2 3.68Å; L1546-L1574 HydrophobicContact CD2-CD2 3.97Å; L1546-L1574 HydrophobicContact CG-CD2 4.33Å; L1546-L1574 CarbonylContact O-C 3.52Å; L1546-L1574 WeakPolarHBondContact O-CA 3.32Å; L1553-L1574 HydrophobicContact CD1-CD1 4.33Å; L1553-L1574 HydrophobicContact CD1-CD2 4.33Å; M1572-L1574 HydrophobicContact CE-CD1 3.96Å; M1572-L1574 HydrophobicContact CE-CD2 3.55Å; M1572-L1574 VanDerWaalsContact CE-CD2 3.47Å; M1572-L1574 HydrophobicContact CE-CG 3.81Å; L1574-L1581 HydrophobicContact CD1-CD1 4.39Å; L1574-L1581 HydrophobicContact CD1-CD2 3.72Å; L1574-L1597 HydrophobicContact CD1-CD1 4.45Å; L1574-L1597 HydrophobicContact CG-CD1 4.37Å; L1574-S1598 PolarHBondContact N-O 3.08Å; L1574-F1599 HydrophobicContact CB-CD1 4.17Å; L1574-F1599 HydrophobicContact CB-CD2 3.82Å; L1574-F1599 HydrophobicContact CB-CE1 4.46Å; L1574-F1599 HydrophobicContact CB-CE2 4.27Å; L1574-F1599 HydrophobicContact CD1-CD1 3.95Å; L1574-F1599 HydrophobicContact CD1-CD2 3.84Å; L1574-F1599 HydrophobicContact CD1-CE1 3.44Å; L1574-F1599 VanDerWaalsContact CD1-CE1 3.44Å; L1574-F1599 HydrophobicContact CD1-CE2 4.07Å; L1574-F1599 HydrophobicContact CD1-CZ 3.92Å; L1574-F1599 HydrophobicContact CG-CD2 4.41Å; L1574-F1599 HydrophobicContact CG-CE1 4.47Å; L1574-F1599 CarbonylContact O-C 3.54Å; L1574-F1599 WeakPolarHBondContact O-CA 3.35Å; L1574-D1600 PolarHBondContact O-N 2.99Å
1575	A	92.1	Very high	90.4	Very high	13 Å²	13	32.7 Å²	32.7	11%	0.107	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	174	-172.6	0	0	0	0	0	113.5	L1546 S1547 K1579 D1600	L1546-A1575 PolarHBondContact O-N 3.14Å; S1547-A1575 VanDerWaalsContact CA-O 3.3Å; S1547-A1575 WeakPolarHBondContact CA-O 3.41Å; A1575-K1579 WeakPolarHBondContact O-CE 3.36Å; A1575-K1579 PolarHBondContact O-NZ 3.15Å; A1575-D1600 VanDerWaalsContact CA-O 3.28Å; A1575-D1600 WeakPolarHBondContact CA-O 3.39Å; A1575-D1600 HydrophobicContact CB-CB 4.48Å
1576	G	88.7	Confident	90.6	Very high	24.6 Å²	24.6	32.4 Å²	32.4	25%	0.254	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	94.7	-129.1	177.3	0	0	0	0	0	112.4	D1600 I1601 K1602 S1603	G1576-D1600 PolarHBondContact N-O 3.36Å; G1576-I1601 CarbonylContact O-C 3.55Å; G1576-I1601 WeakPolarHBondContact O-CA 3.47Å; G1576-K1602 PolarHBondContact O-N 3.23Å; G1576-S1603 PolarHBondContact O-N 3.03Å
1577	M	88.9	Confident	91.1	Very high	18.6 Å²	18.6	33.8 Å²	33.8	9%	0.092	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	164.1	177.1	-131.4	180	-159.4	0	0	112	G1548 Y1549 K1579 S1603 N1604 A1605 L1606 D2147	G1548-M1577 PolarHBondContact O-N 3.1Å; Y1549-M1577 HydrophobicContact CD1-SD 4.17Å; Y1549-M1577 HydrophobicContact CD2-CE 4.05Å; Y1549-M1577 HydrophobicContact CD2-CG 4.5Å; Y1549-M1577 HydrophobicContact CD2-SD 3.48Å; Y1549-M1577 WeakPolarHBondContact CD2-SD 3.27Å; Y1549-M1577 HydrophobicContact CE1-CE 4.43Å; Y1549-M1577 HydrophobicContact CE1-SD 4.02Å; Y1549-M1577 HydrophobicContact CE2-CE 3.59Å; Y1549-M1577 VanDerWaalsContact CE2-CE 3.43Å; Y1549-M1577 HydrophobicContact CE2-SD 3.41Å; Y1549-M1577 VanDerWaalsContact CE2-SD 3.56Å; Y1549-M1577 WeakPolarHBondContact CE2-SD 3.27Å; Y1549-M1577 HydrophobicContact CG-SD 4.1Å; Y1549-M1577 VanDerWaalsContact CZ-SD 3.57Å; Y1549-M1577 WeakPolarHBondContact OH-CE 3.39Å; M1577-K1579 WeakPolarHBondContact O-CD 3.28Å; M1577-K1579 VanDerWaalsContact O-CE 3.32Å; M1577-K1579 WeakPolarHBondContact O-CE 3.49Å; M1577-K1579 WeakPolarHBondContact O-CG 3.42Å; M1577-K1579 PolarHBondContact O-N 3.47Å; M1577-K1579 PolarHBondContact O-NZ 3.06Å; M1577-S1603 WeakPolarHBondContact CA-O 3.38Å; M1577-N1604 HydrophobicContact CE-CB 3.96Å; M1577-N1604 VanDerWaalsContact CE-O 3.24Å; M1577-N1604 WeakPolarHBondContact CE-O 3.27Å; M1577-A1605 VanDerWaalsContact CE-CA 3.43Å; M1577-A1605 HydrophobicContact CE-CB 4.37Å; M1577-A1605 HydrophobicContact CG-CB 4.33Å; M1577-A1605 HydrophobicContact SD-CB 4.34Å; M1577-L1606 HydrophobicContact CE-CG 4.07Å; M1577-D2147 HydrophobicContact CE-CB 3.74Å
1578	E	90.2	Very high	91.9	Very high	15.4 Å²	15.4	27.9 Å²	27.9	7%	0.072	14%	0.135	C	C	.	.			trans	-45.8	138.9	176.8	-71.5	163	153.9	0	0	112.8	Y1550 I1601 S1603 A1605 V1611 Q1648 K2127	Y1550-E1578 WeakPolarHBondContact CA-O 3.17Å; Y1550-E1578 HydrophobicContact CD2-CB 4.44Å; Y1550-E1578 VanDerWaalsContact CD2-O 3.31Å; Y1550-E1578 WeakPolarHBondContact CD2-O 3.3Å; E1578-I1601 HydrophobicContact CB-CG2 4.47Å; E1578-I1601 HydrophobicContact CG-CG2 4.14Å; E1578-I1601 VanDerWaalsContact N-CG2 3.33Å; E1578-S1603 PolarHBondContact N-O 3.03Å; E1578-S1603 WeakPolarHBondContact OE1-CB 3.44Å; E1578-S1603 PolarHBondContact OE1-OG 3.25Å; E1578-A1605 HydrophobicContact CB-CB 3.97Å; E1578-A1605 VanDerWaalsContact OE2-CB 3.32Å; E1578-A1605 WeakPolarHBondContact OE2-CB 3.37Å; E1578-A1605 PolarHBondContact OE2-N 3.21Å; E1578-V1611 HydrophobicContact CB-CB 4.23Å; E1578-V1611 HydrophobicContact CB-CG1 4.37Å; E1578-V1611 HydrophobicContact CB-CG2 4.12Å; E1578-V1611 HydrophobicContact CG-CG2 4.25Å; E1578-V1611 VanDerWaalsContact OE2-CG2 3.31Å; E1578-V1611 WeakPolarHBondContact OE2-CG2 3.35Å; E1578-Q1648 HydrophobicContact CG-CB 4.12Å; E1578-Q1648 HydrophobicContact CG-CG 4.12Å; E1578-K2127 VanDerWaalsContact CD-NZ 3.34Å; E1578-K2127 WeakPolarHBondContact OE1-CE 3.23Å; E1578-K2127 IonicContact OE1-NZ 3.61Å; E1578-K2127 PolarHBondContact OE1-NZ 3.05Å; E1578-K2127 VanDerWaalsContact OE1-NZ 3.14Å; E1578-K2127 WeakPolarHBondContact OE2-CE 3.19Å; E1578-K2127 IonicContact OE2-NZ 3.45Å; E1578-K2127 PolarHBondContact OE2-NZ 3.11Å
1579	K	91.6	Very high	92.7	Very high	1.6 Å²	1.6	30.2 Å²	30.2	1%	0.007	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.8	179.7	-61.5	-74.8	-178.5	-106.9	0	109.9	S1547 G1548 Y1549 A1551 L1553 A1575 M1577 L1581 F1599 I1601 V1611 Q1648	S1547-K1579 PolarHBondContact O-NZ 3.49Å; G1548-K1579 PolarHBondContact O-NZ 3.11Å; Y1549-K1579 WeakPolarHBondContact O-CE 3.33Å; Y1549-K1579 PolarHBondContact O-NZ 3.02Å; A1551-K1579 HydrophobicContact CB-CD 4.06Å; L1553-K1579 HydrophobicContact CD1-CB 3.6Å; L1553-K1579 HydrophobicContact CD1-CD 4.02Å; L1553-K1579 HydrophobicContact CD1-CG 3.82Å; L1553-K1579 HydrophobicContact CG-CB 4.11Å; L1553-K1579 HydrophobicContact CG-CD 4.39Å; L1553-K1579 HydrophobicContact CG-CG 4.38Å; A1575-K1579 WeakPolarHBondContact O-CE 3.36Å; A1575-K1579 PolarHBondContact O-NZ 3.15Å; M1577-K1579 WeakPolarHBondContact O-CD 3.28Å; M1577-K1579 VanDerWaalsContact O-CE 3.32Å; M1577-K1579 WeakPolarHBondContact O-CE 3.49Å; M1577-K1579 WeakPolarHBondContact O-CG 3.42Å; M1577-K1579 PolarHBondContact O-N 3.47Å; M1577-K1579 PolarHBondContact O-NZ 3.06Å; K1579-L1581 PolarHBondContact O-N 3.19Å; K1579-L1581 VanDerWaalsContact O-N 3.14Å; K1579-F1599 HydrophobicContact CB-CE2 4.48Å; K1579-I1601 HydrophobicContact CD-CD1 4.14Å; K1579-I1601 HydrophobicContact CG-CD1 4.29Å; K1579-V1611 WeakPolarHBondContact O-CG1 3.34Å; K1579-Q1648 PolarHBondContact O-NE2 2.96Å
1580	E	92.7	Very high	93.3	Very high	52.6 Å²	52.6	33.2 Å²	33.2	25%	0.246	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	99.7	170.3	-173.2	178	166	0	0	108.1	Y1550 A1551 W1552 L1553 V1611 P1612	Y1550-E1580 HydrophobicContact CE2-CB 4.19Å; Y1550-E1580 PolarHBondContact OH-OE2 3.09Å; A1551-E1580 PolarHBondContact O-N 3.03Å; W1552-E1580 CarbonylContact C-O 3.3Å; W1552-E1580 VanDerWaalsContact CD1-CD 3.49Å; L1553-E1580 PolarHBondContact N-O 3.15Å; E1580-V1611 HydrophobicContact CB-CG1 3.94Å; E1580-P1612 WeakPolarHBondContact CA-O 3.27Å; E1580-P1612 HydrophobicContact CG-CG 3.94Å
1581	L	94.7	Very high	93.6	Very high	1.2 Å²	1.2	33.2 Å²	33.2	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.5	-168.6	174.3	69.7	0	0	0	112.3	L1553 I1555 L1574 K1579 M1583 F1599 P1612 C1613 R1614 V1615	L1553-L1581 HydrophobicContact CB-CB 4.25Å; L1553-L1581 HydrophobicContact CB-CD1 3.47Å; L1553-L1581 VanDerWaalsContact CB-CD1 3.44Å; L1553-L1581 HydrophobicContact CB-CG 4.43Å; L1553-L1581 HydrophobicContact CD1-CB 4.44Å; L1553-L1581 HydrophobicContact CD1-CD1 4.08Å; L1553-L1581 HydrophobicContact CG-CD1 4.42Å; L1553-L1581 WeakPolarHBondContact O-CA 3.25Å; I1555-L1581 HydrophobicContact CD1-CD1 4.21Å; I1555-L1581 HydrophobicContact CG1-CD1 4.32Å; L1574-L1581 HydrophobicContact CD1-CD1 4.39Å; L1574-L1581 HydrophobicContact CD1-CD2 3.72Å; K1579-L1581 PolarHBondContact O-N 3.19Å; K1579-L1581 VanDerWaalsContact O-N 3.14Å; L1581-M1583 HydrophobicContact CD1-CB 4.23Å; L1581-M1583 HydrophobicContact CD2-CB 4.21Å; L1581-M1583 HydrophobicContact CD2-CE 4.47Å; L1581-M1583 HydrophobicContact CG-CB 4.2Å; L1581-F1599 HydrophobicContact CD2-CD2 4.48Å; L1581-F1599 HydrophobicContact CD2-CE1 3.42Å; L1581-F1599 VanDerWaalsContact CD2-CE1 3.47Å; L1581-F1599 HydrophobicContact CD2-CE2 4.16Å; L1581-F1599 HydrophobicContact CD2-CZ 3.52Å; L1581-F1599 VanDerWaalsContact CD2-CZ 3.47Å; L1581-P1612 PolarHBondContact N-O 2.99Å; L1581-P1612 VanDerWaalsContact N-O 3.16Å; L1581-C1613 WeakPolarHBondContact O-CA 3.39Å; L1581-R1614 PolarHBondContact O-N 3.21Å; L1581-V1615 HydrophobicContact CD2-CG2 4.45Å
1582	V	95.3	Very high	93.5	Very high	40.4 Å²	40.4	34.9 Å²	34.9	25%	0.245	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	110.7	160.5	-178.3	0	0	0	0	108.4	L1553 N1554 I1555 E1584	L1553-V1582 PolarHBondContact O-N 3.05Å; N1554-V1582 WeakPolarHBondContact CA-O 3.47Å; I1555-V1582 PolarHBondContact N-O 3Å; V1582-E1584 HydrophobicContact CG1-CG 4.4Å
1583	M	95.5	Very high	93.3	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	105.1	174.7	-172.3	174.1	-148	0	0	110.4	I1555 M1572 L1581 N1586 W1588 L1597 R1614 V1615 H1616 N1618	I1555-M1583 HydrophobicContact CB-CE 4.17Å; I1555-M1583 HydrophobicContact CB-CG 4.23Å; I1555-M1583 HydrophobicContact CD1-CE 3.96Å; I1555-M1583 HydrophobicContact CG2-CE 4.11Å; I1555-M1583 HydrophobicContact CG2-CG 4.35Å; I1555-M1583 VanDerWaalsContact O-CA 3.3Å; I1555-M1583 WeakPolarHBondContact O-CA 3.34Å; M1572-M1583 HydrophobicContact CE-CE 3.76Å; M1572-M1583 HydrophobicContact CE-SD 4.01Å; M1572-M1583 HydrophobicContact SD-CE 4.04Å; L1581-M1583 HydrophobicContact CD1-CB 4.23Å; L1581-M1583 HydrophobicContact CD2-CB 4.21Å; L1581-M1583 HydrophobicContact CD2-CE 4.47Å; L1581-M1583 HydrophobicContact CG-CB 4.2Å; M1583-N1586 HydrophobicContact CE-CB 4.39Å; M1583-N1586 VanDerWaalsContact CG-ND2 3.28Å; M1583-N1586 WeakPolarHBondContact CG-ND2 3.31Å; M1583-W1588 HydrophobicContact CE-CZ2 3.66Å; M1583-L1597 HydrophobicContact CE-CD1 4.09Å; M1583-L1597 HydrophobicContact CE-CD2 4.02Å; M1583-L1597 HydrophobicContact SD-CD1 4.43Å; M1583-L1597 HydrophobicContact SD-CD2 3.46Å; M1583-L1597 WeakPolarHBondContact SD-CD2 3.34Å; M1583-R1614 PolarHBondContact N-O 3.18Å; M1583-V1615 HydrophobicContact CB-CG2 4.33Å; M1583-H1616 PolarHBondContact O-N 3Å; M1583-N1618 PolarHBondContact O-ND2 3.4Å
1584	E	94	Very high	93.1	Very high	45.4 Å²	45.4	34.8 Å²	34.8	21%	0.212	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	150	-175.4	70.2	164.9	172.1	0	0	116	I1555 S1556 S1557 V1582 N1586 H1616 R1617 N1618	I1555-E1584 PolarHBondContact O-N 3.05Å; I1555-E1584 VanDerWaalsContact O-N 3.08Å; S1556-E1584 CarbonylContact C-O 3.41Å; S1556-E1584 VanDerWaalsContact CA-O 3.23Å; S1556-E1584 WeakPolarHBondContact CA-O 3.33Å; S1557-E1584 PolarHBondContact N-O 3.19Å; V1582-E1584 HydrophobicContact CG1-CG 4.4Å; E1584-N1586 PolarHBondContact N-ND2 3.06Å; E1584-N1586 PolarHBondContact O-N 2.94Å; E1584-N1586 VanDerWaalsContact O-N 3.08Å; E1584-N1586 PolarHBondContact O-ND2 3.04Å; E1584-N1586 VanDerWaalsContact O-ND2 3.16Å; E1584-H1616 WeakPolarHBondContact CA-O 3.33Å; E1584-H1616 VanDerWaalsContact CB-CE1 3.45Å; E1584-H1616 WeakPolarHBondContact CB-CE1 3.36Å; E1584-H1616 WeakPolarHBondContact CB-ND1 3.34Å; E1584-H1616 WeakPolarHBondContact CB-O 3.36Å; E1584-H1616 IonicContact OE2-CE1 3.1Å; E1584-H1616 PolarHBondContact OE2-CE1 3.06Å; E1584-H1616 VanDerWaalsContact OE2-CE1 3.27Å; E1584-H1616 IonicContact OE2-ND1 3.3Å; E1584-H1616 IonicContact OE2-NE2 3.2Å; E1584-R1617 IonicContact OE2-NH1 3.11Å; E1584-N1618 VanDerWaalsContact C-OD1 3.31Å
1585	R	94.1	Very high	93	Very high	92.6 Å²	92.6	36.5 Å²	36.5	35%	0.349	16%	0.164	S	C	.	.	S	Bend	trans	57.8	23.5	172.3	-56	-179.9	-176.7	-149.7	0.5	114.3	S1557 R1617 N1618 I1723 N1724	S1557-R1585 WeakPolarHBondContact CA-O 3.31Å; R1585-R1617 WeakPolarHBondContact CA-O 3.37Å; R1585-R1617 HydrophobicContact CG-CB 4.33Å; R1585-R1617 PolarHBondContact N-O 3.11Å; R1585-R1617 VanDerWaalsContact N-O 3.09Å; R1585-N1618 PolarHBondContact N-OD1 3.16Å; R1585-I1723 HydrophobicContact CB-CG1 4.41Å; R1585-I1723 PolarHBondContact NH1-O 2.97Å; R1585-N1724 PolarHBondContact NH1-O 3.15Å
1586	N	95.8	Very high	93.1	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.159	C	C	.	.			trans	-84	146.5	175.2	-55.2	-74.7	0	0	0	110.6	I1555 S1557 N1558 M1583 E1584 N1618 Y1619	I1555-N1586 PolarHBondContact O-ND2 3.22Å; S1557-N1586 PolarHBondContact N-OD1 3.12Å; N1558-N1586 VanDerWaalsContact CB-OD1 3.32Å; N1558-N1586 WeakPolarHBondContact CB-OD1 3.33Å; N1558-N1586 PolarHBondContact N-OD1 2.91Å; N1558-N1586 VanDerWaalsContact N-OD1 3.08Å; N1558-N1586 PolarHBondContact ND2-OD1 3Å; N1558-N1586 CarbonylContact O-C 3.51Å; N1558-N1586 VanDerWaalsContact O-CA 3.29Å; N1558-N1586 WeakPolarHBondContact O-CA 3.43Å; M1583-N1586 HydrophobicContact CE-CB 4.39Å; M1583-N1586 VanDerWaalsContact CG-ND2 3.28Å; M1583-N1586 WeakPolarHBondContact CG-ND2 3.31Å; E1584-N1586 PolarHBondContact N-ND2 3.06Å; E1584-N1586 PolarHBondContact O-N 2.94Å; E1584-N1586 VanDerWaalsContact O-N 3.08Å; E1584-N1586 PolarHBondContact O-ND2 3.04Å; E1584-N1586 VanDerWaalsContact O-ND2 3.16Å; N1586-N1618 VanDerWaalsContact CB-OD1 3.31Å; N1586-N1618 WeakPolarHBondContact CB-OD1 3.38Å; N1586-N1618 PolarHBondContact N-OD1 3.05Å; N1586-N1618 PolarHBondContact ND2-OD1 2.88Å; N1586-N1618 WeakPolarHBondContact O-CA 3.29Å; N1586-Y1619 PolarHBondContact O-N 3.05Å
1587	R	95.2	Very high	93.4	Very high	133 Å²	133	34.8 Å²	34.8	50%	0.502	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.6	177.7	-64.8	179.3	-180	141	-1.4	109.8	N1558 F1560 Y1619 I1723	N1558-R1587 PolarHBondContact O-N 3.02Å; F1560-R1587 PolarHBondContact N-O 3.06Å; R1587-Y1619 HydrophobicContact CG-CD2 4.07Å; R1587-Y1619 HydrophobicContact CG-CG 4.47Å; R1587-I1723 HydrophobicContact CG-CD1 3.81Å; R1587-I1723 VanDerWaalsContact NH2-CG2 3.28Å
1588	W	95.3	Very high	93.6	Very high	1.2 Å²	1.2	34.2 Å²	34.2	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	105.2	176.7	-59.7	89.5	0	0	0	108.5	F1560 L1571 M1572 M1583 V1596 Y1619 F1620 F1621 N1623	F1560-W1588 HydrophobicContact CB-CD2 3.98Å; F1560-W1588 HydrophobicContact CB-CE3 3.41Å; F1560-W1588 VanDerWaalsContact CB-CE3 3.44Å; F1560-W1588 HydrophobicContact CB-CH2 4.46Å; F1560-W1588 HydrophobicContact CB-CZ3 3.74Å; F1560-W1588 HydrophobicContact CD1-CE3 4.24Å; F1560-W1588 AromaticContact CD1-CH2 3.84Å; F1560-W1588 HydrophobicContact CD1-CH2 3.9Å; F1560-W1588 AromaticContact CD1-CZ3 3.64Å; F1560-W1588 HydrophobicContact CD1-CZ3 3.64Å; F1560-W1588 AromaticContact CD2-CD2 3.76Å; F1560-W1588 HydrophobicContact CD2-CD2 3.76Å; F1560-W1588 AromaticContact CD2-CE2 3.66Å; F1560-W1588 AromaticContact CD2-CE3 3.76Å; F1560-W1588 HydrophobicContact CD2-CE3 3.76Å; F1560-W1588 AromaticContact CD2-CH2 3.59Å; F1560-W1588 HydrophobicContact CD2-CH2 3.59Å; F1560-W1588 AromaticContact CD2-CZ2 3.58Å; F1560-W1588 HydrophobicContact CD2-CZ2 3.58Å; F1560-W1588 VanDerWaalsContact CD2-CZ2 3.49Å; F1560-W1588 AromaticContact CD2-CZ3 3.68Å; F1560-W1588 HydrophobicContact CD2-CZ3 3.68Å; F1560-W1588 AromaticContact CE1-CH2 3.86Å; F1560-W1588 HydrophobicContact CE1-CH2 3.91Å; F1560-W1588 HydrophobicContact CE1-CZ3 4.13Å; F1560-W1588 HydrophobicContact CE2-CD2 4.47Å; F1560-W1588 AromaticContact CE2-CE2 3.94Å; F1560-W1588 HydrophobicContact CE2-CE3 4.49Å; F1560-W1588 AromaticContact CE2-CH2 3.59Å; F1560-W1588 HydrophobicContact CE2-CH2 3.59Å; F1560-W1588 AromaticContact CE2-CZ2 3.51Å; F1560-W1588 HydrophobicContact CE2-CZ2 3.51Å; F1560-W1588 VanDerWaalsContact CE2-CZ2 3.46Å; F1560-W1588 HydrophobicContact CE2-CZ3 4.15Å; F1560-W1588 AromaticContact CG-CD2 3.99Å; F1560-W1588 HydrophobicContact CG-CD2 4.04Å; F1560-W1588 AromaticContact CG-CE3 3.55Å; F1560-W1588 HydrophobicContact CG-CE3 3.55Å; F1560-W1588 VanDerWaalsContact CG-CE3 3.48Å; F1560-W1588 AromaticContact CG-CH2 3.75Å; F1560-W1588 HydrophobicContact CG-CH2 3.75Å; F1560-W1588 HydrophobicContact CG-CZ2 4.2Å; F1560-W1588 AromaticContact CG-CZ3 3.4Å; F1560-W1588 HydrophobicContact CG-CZ3 3.4Å; F1560-W1588 VanDerWaalsContact CG-CZ3 3.44Å; F1560-W1588 AromaticContact CZ-CH2 3.76Å; F1560-W1588 HydrophobicContact CZ-CH2 3.76Å; F1560-W1588 AromaticContact CZ-CZ2 3.99Å; F1560-W1588 HydrophobicContact CZ-CZ2 4.08Å; F1560-W1588 HydrophobicContact CZ-CZ3 4.36Å; F1560-W1588 WeakPolarHBondContact O-CA 3.42Å; L1571-W1588 HydrophobicContact CB-CZ3 4.22Å; L1571-W1588 HydrophobicContact CD1-CE3 4.39Å; L1571-W1588 HydrophobicContact CD1-CZ3 4.36Å; M1572-W1588 HydrophobicContact CB-CH2 4.02Å; M1572-W1588 HydrophobicContact CE-CH2 4.33Å; M1572-W1588 HydrophobicContact CE-CZ2 3.96Å; M1572-W1588 HydrophobicContact SD-CH2 4.07Å; M1572-W1588 HydrophobicContact SD-CZ2 4.18Å; M1583-W1588 HydrophobicContact CE-CZ2 3.66Å; W1588-V1596 HydrophobicContact CB-CG1 4.02Å; W1588-V1596 HydrophobicContact CD2-CG1 3.44Å; W1588-V1596 VanDerWaalsContact CD2-CG1 3.45Å; W1588-V1596 HydrophobicContact CE3-CG1 3.33Å; W1588-V1596 HydrophobicContact CG-CG1 3.76Å; W1588-V1596 HydrophobicContact CH2-CG1 4.47Å; W1588-V1596 HydrophobicContact CZ3-CG1 3.94Å; W1588-Y1619 PolarHBondContact N-O 3.05Å; W1588-F1620 HydrophobicContact CB-CD1 3.85Å; W1588-F1620 HydrophobicContact CB-CE1 4.38Å; W1588-F1620 AromaticContact CD1-CD1 3.6Å; W1588-F1620 AromaticContact CD1-CE1 3.33Å; W1588-F1620 AromaticContact CD1-CZ 3.93Å; W1588-F1620 HydrophobicContact CD2-CE1 4.37Å; W1588-F1620 AromaticContact CG-CD1 3.79Å; W1588-F1620 HydrophobicContact CG-CD1 3.79Å; W1588-F1620 AromaticContact CG-CE1 3.81Å; W1588-F1620 HydrophobicContact CG-CE1 3.81Å; W1588-F1620 AromaticContact NE1-CE1 3.66Å; W1588-F1620 AromaticContact NE1-CZ 3.96Å; W1588-F1621 PolarHBondContact O-N 2.87Å; W1588-N1623 PolarHBondContact O-ND2 3.2Å; W1588-N1623 VanDerWaalsContact O-ND2 3.12Å
1589	R	94.3	Very high	93.7	Very high	110.2 Å²	110.2	33.6 Å²	33.6	42%	0.416	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	132.9	-173.8	-166.5	178.8	178.7	160.7	-3.3	113.9	F1560 T1561 M1562 N1591 F1621	F1560-R1589 PolarHBondContact O-N 2.9Å; T1561-R1589 VanDerWaalsContact CA-O 3.3Å; T1561-R1589 WeakPolarHBondContact CA-O 3.38Å; T1561-R1589 HydrophobicContact CG2-CB 4.31Å; M1562-R1589 PolarHBondContact N-O 3.04Å; M1562-R1589 VanDerWaalsContact N-O 3.11Å; R1589-N1591 PolarHBondContact N-ND2 3.07Å; R1589-N1591 VanDerWaalsContact N-ND2 3.16Å; R1589-N1591 PolarHBondContact O-N 3.23Å; R1589-N1591 VanDerWaalsContact O-N 3.15Å; R1589-N1591 PolarHBondContact O-ND2 3.09Å; R1589-F1621 VanDerWaalsContact CA-O 3.28Å; R1589-F1621 WeakPolarHBondContact CA-O 3.28Å; R1589-F1621 HydrophobicContact CG-CB 4.21Å
1590	Y	95.2	Very high	93.8	Very high	89 Å²	89	34.8 Å²	34.8	35%	0.349	15%	0.148	S	C	.	.	S	Bend	trans	54.8	27.9	177	-58	-55.4	0	0	0	114.3	M1562 F1621 D1622	M1562-Y1590 WeakPolarHBondContact CA-O 3.42Å; M1562-Y1590 HydrophobicContact CE-CD2 4.32Å; Y1590-F1621 PolarHBondContact N-O 2.97Å; Y1590-F1621 VanDerWaalsContact N-O 3.16Å; Y1590-D1622 WeakPolarHBondContact CA-O 3.4Å; Y1590-D1622 HydrophobicContact CD1-CB 3.56Å; Y1590-D1622 VanDerWaalsContact CD1-CB 3.49Å; Y1590-D1622 HydrophobicContact CE1-CB 3.36Å; Y1590-D1622 VanDerWaalsContact CE1-CB 3.43Å; Y1590-D1622 VanDerWaalsContact CE1-OD2 3.25Å; Y1590-D1622 WeakPolarHBondContact CE1-OD2 3.37Å; Y1590-D1622 PolarHBondContact OH-OD2 3.17Å
1591	N	94.5	Very high	93.7	Very high	0.6 Å²	0.6	32.3 Å²	32.3	0%	0.003	14%	0.137	C	C	.	.			trans	-85.4	145.3	176.9	-53.3	-77.2	0	0	0	110.2	F1560 M1562 N1563 L1571 R1589 N1623 Y1624	F1560-N1591 PolarHBondContact O-ND2 3.25Å; F1560-N1591 PolarHBondContact O-OD1 3.11Å; M1562-N1591 PolarHBondContact N-OD1 2.9Å; N1563-N1591 WeakPolarHBondContact CB-OD1 3.38Å; N1563-N1591 PolarHBondContact N-OD1 3.17Å; N1563-N1591 PolarHBondContact ND2-OD1 3.09Å; N1563-N1591 CarbonylContact O-C 3.54Å; N1563-N1591 VanDerWaalsContact O-CA 3.26Å; N1563-N1591 WeakPolarHBondContact O-CA 3.31Å; N1563-N1591 WeakPolarHBondContact O-CB 3.35Å; L1571-N1591 HydrophobicContact CD1-CB 3.26Å; L1571-N1591 HydrophobicContact CD2-CB 4.17Å; L1571-N1591 HydrophobicContact CG-CB 4.35Å; R1589-N1591 PolarHBondContact N-ND2 3.07Å; R1589-N1591 VanDerWaalsContact N-ND2 3.16Å; R1589-N1591 PolarHBondContact O-N 3.23Å; R1589-N1591 VanDerWaalsContact O-N 3.15Å; R1589-N1591 PolarHBondContact O-ND2 3.09Å; N1591-N1623 VanDerWaalsContact CB-OD1 3.31Å; N1591-N1623 WeakPolarHBondContact CB-OD1 3.3Å; N1591-N1623 PolarHBondContact N-OD1 3.33Å; N1591-N1623 VanDerWaalsContact N-OD1 3.09Å; N1591-N1623 PolarHBondContact ND2-OD1 3.22Å; N1591-N1623 VanDerWaalsContact O-CA 3.27Å; N1591-N1623 WeakPolarHBondContact O-CA 3.39Å; N1591-N1623 WeakPolarHBondContact O-CB 3.17Å; N1591-Y1624 PolarHBondContact O-N 3.11Å
1592	Q	92.4	Very high	93.4	Very high	36.6 Å²	36.6	34.9 Å²	34.9	17%	0.171	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-103.9	125.6	175.9	-176.6	-178.2	-2.6	0	0	109.5	N1563 R1564 A1565 Y1624	N1563-Q1592 PolarHBondContact O-N 3.15Å; R1564-Q1592 HydrophobicContact CB-CB 4.38Å; R1564-Q1592 HydrophobicContact CG-CB 4.18Å; R1564-Q1592 HydrophobicContact CG-CG 4.44Å; A1565-Q1592 WeakPolarHBondContact CB-O 3.46Å; A1565-Q1592 PolarHBondContact N-O 3.05Å; Q1592-Y1624 VanDerWaalsContact CA-O 3.29Å; Q1592-Y1624 WeakPolarHBondContact CA-O 3.38Å; Q1592-Y1624 HydrophobicContact CB-CD2 4.4Å; Q1592-Y1624 HydrophobicContact CB-CE1 4.25Å; Q1592-Y1624 HydrophobicContact CB-CE2 3.84Å; Q1592-Y1624 HydrophobicContact CG-CD2 4.14Å; Q1592-Y1624 HydrophobicContact CG-CE2 3.66Å; Q1592-Y1624 PolarHBondContact OE1-OH 2.84Å
1593	G	89.8	Confident	93	Very high	4.8 Å²	4.8	33.8 Å²	33.8	5%	0.049	14%	0.142	C	C	.	.	S	Bend	trans	175.8	157.3	175.5	0	0	0	0	0	112.7	W1595 Y1624 F1625	G1593-W1595 PolarHBondContact O-N 3.06Å; G1593-Y1624 PolarHBondContact N-O 2.98Å; G1593-Y1624 VanDerWaalsContact N-O 3.16Å; G1593-F1625 VanDerWaalsContact C-CD2 3.46Å; G1593-F1625 WeakPolarHBondContact O-CB 3.4Å
1594	K	89.2	Confident	92.3	Very high	49.6 Å²	49.6	35.2 Å²	35.2	22%	0.216	15%	0.15	C	C	.	.	S	Bend	trans	-58.4	-38.5	-179.2	-168.2	174.9	169.2	-178.9	0	111.5	I1569 F1625 R1638 S1639 F1640	I1569-K1594 VanDerWaalsContact O-CB 3.28Å; I1569-K1594 WeakPolarHBondContact O-CB 3.38Å; I1569-K1594 PolarHBondContact O-N 3.1Å; I1569-K1594 VanDerWaalsContact O-N 3.11Å; K1594-F1625 HydrophobicContact CB-CD2 4.24Å; K1594-F1625 HydrophobicContact CB-CE2 3.98Å; K1594-F1625 HydrophobicContact CB-CZ 4.19Å; K1594-F1625 HydrophobicContact CG-CE1 4.38Å; K1594-F1625 HydrophobicContact CG-CE2 4.41Å; K1594-F1625 HydrophobicContact CG-CZ 4.17Å; K1594-R1638 WeakPolarHBondContact CE-O 3.34Å; K1594-R1638 WeakPolarHBondContact CG-O 3.39Å; K1594-S1639 CarbonylContact O-C 3.4Å; K1594-S1639 WeakPolarHBondContact O-CA 3.42Å; K1594-S1639 VanDerWaalsContact O-CB 3.27Å; K1594-S1639 WeakPolarHBondContact O-CB 3.33Å; K1594-F1640 PolarHBondContact O-N 2.96Å; K1594-F1640 VanDerWaalsContact O-N 3.1Å
1595	W	92.7	Very high	91.6	Very high	35.6 Å²	35.6	33.4 Å²	33.4	14%	0.135	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.4	167.9	52.9	79.1	0	0	0	111.9	I1569 G1570 L1571 M1572 G1593 S1598 F1640	I1569-W1595 HydrophobicContact CG2-CZ2 4.17Å; G1570-W1595 CarbonylContact C-O 3.49Å; G1570-W1595 VanDerWaalsContact CA-CD1 3.41Å; G1570-W1595 VanDerWaalsContact CA-CE2 3.46Å; G1570-W1595 WeakPolarHBondContact CA-O 3.35Å; G1570-W1595 VanDerWaalsContact N-CE2 3.3Å; G1570-W1595 VanDerWaalsContact N-CZ2 3.33Å; L1571-W1595 PolarHBondContact N-O 3.07Å; M1572-W1595 PolarHBondContact O-NE1 2.95Å; G1593-W1595 PolarHBondContact O-N 3.06Å; W1595-S1598 VanDerWaalsContact CD1-CB 3.45Å; W1595-S1598 VanDerWaalsContact NE1-CB 3.32Å; W1595-F1640 CarbonylContact C-O 3.58Å; W1595-F1640 WeakPolarHBondContact CA-O 3.38Å; W1595-F1640 HydrophobicContact CB-CD1 4.32Å; W1595-F1640 HydrophobicContact CB-CD2 3.53Å; W1595-F1640 HydrophobicContact CB-CE1 4.12Å; W1595-F1640 HydrophobicContact CB-CE2 3.25Å; W1595-F1640 HydrophobicContact CB-CG 4.06Å; W1595-F1640 HydrophobicContact CB-CZ 3.58Å; W1595-F1640 VanDerWaalsContact CB-CZ 3.5Å; W1595-F1640 VanDerWaalsContact CB-O 3.24Å; W1595-F1640 WeakPolarHBondContact CB-O 3.23Å; W1595-F1640 HydrophobicContact CD2-CE1 4.19Å; W1595-F1640 AromaticContact CD2-CE2 3.96Å; W1595-F1640 HydrophobicContact CD2-CE2 4.21Å; W1595-F1640 AromaticContact CD2-CZ 3.72Å; W1595-F1640 HydrophobicContact CD2-CZ 3.72Å; W1595-F1640 VanDerWaalsContact CD2-CZ 3.49Å; W1595-F1640 HydrophobicContact CE3-CD1 4.34Å; W1595-F1640 AromaticContact CE3-CE1 3.58Å; W1595-F1640 HydrophobicContact CE3-CE1 3.74Å; W1595-F1640 VanDerWaalsContact CE3-CE1 3.48Å; W1595-F1640 HydrophobicContact CE3-CE2 4.25Å; W1595-F1640 AromaticContact CE3-CZ 3.6Å; W1595-F1640 HydrophobicContact CE3-CZ 3.6Å; W1595-F1640 HydrophobicContact CG-CD2 4.44Å; W1595-F1640 HydrophobicContact CG-CE1 4.36Å; W1595-F1640 AromaticContact CG-CE2 3.69Å; W1595-F1640 HydrophobicContact CG-CE2 3.69Å; W1595-F1640 AromaticContact CG-CZ 3.71Å; W1595-F1640 HydrophobicContact CG-CZ 3.71Å; W1595-F1640 AromaticContact CZ3-CE1 3.93Å; W1595-F1640 HydrophobicContact CZ3-CE1 4.11Å; W1595-F1640 AromaticContact CZ3-CZ 3.84Å; W1595-F1640 HydrophobicContact CZ3-CZ 4.14Å
1596	V	94.1	Very high	90.6	Very high	2.2 Å²	2.2	31.8 Å²	31.8	1%	0.013	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-56.8	173.2	-176.5	0	0	0	0	110.4	L1571 M1572 W1588 F1620 N1623 F1640 A1641 L1662	L1571-V1596 HydrophobicContact CD1-CB 4.31Å; L1571-V1596 HydrophobicContact CD1-CG1 4.07Å; L1571-V1596 HydrophobicContact CD1-CG2 4.14Å; M1572-V1596 WeakPolarHBondContact CB-O 3.38Å; M1572-V1596 PolarHBondContact N-O 2.93Å; W1588-V1596 HydrophobicContact CB-CG1 4.02Å; W1588-V1596 HydrophobicContact CD2-CG1 3.44Å; W1588-V1596 VanDerWaalsContact CD2-CG1 3.45Å; W1588-V1596 HydrophobicContact CE3-CG1 3.33Å; W1588-V1596 HydrophobicContact CG-CG1 3.76Å; W1588-V1596 HydrophobicContact CH2-CG1 4.47Å; W1588-V1596 HydrophobicContact CZ3-CG1 3.94Å; V1596-F1620 HydrophobicContact CB-CD1 4.31Å; V1596-F1620 HydrophobicContact CB-CE1 4.36Å; V1596-F1620 HydrophobicContact CG1-CD1 3.87Å; V1596-F1620 HydrophobicContact CG1-CE1 3.82Å; V1596-N1623 HydrophobicContact CG2-CB 3.8Å; V1596-F1640 PolarHBondContact N-O 2.93Å; V1596-A1641 VanDerWaalsContact CB-O 3.3Å; V1596-A1641 WeakPolarHBondContact CB-O 3.36Å; V1596-A1641 PolarHBondContact N-O 3.19Å; V1596-L1662 HydrophobicContact CG2-CD1 4.4Å
1597	L	94.7	Very high	89.3	Confident	0.4 Å²	0.4	33.4 Å²	33.4	0%	0.002	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127	-179.9	-177.8	57	0	0	0	110.9	M1572 L1574 M1583 F1599 A1641 L1642 G1643	M1572-L1597 HydrophobicContact CB-CD1 3.98Å; M1572-L1597 HydrophobicContact CE-CD1 3.89Å; M1572-L1597 HydrophobicContact CE-CD2 4.08Å; M1572-L1597 HydrophobicContact CE-CG 4.27Å; M1572-L1597 HydrophobicContact CG-CD1 3.69Å; M1572-L1597 CarbonylContact O-C 3.55Å; M1572-L1597 WeakPolarHBondContact O-CA 3.31Å; M1572-L1597 HydrophobicContact SD-CD1 3.85Å; L1574-L1597 HydrophobicContact CD1-CD1 4.45Å; L1574-L1597 HydrophobicContact CG-CD1 4.37Å; M1583-L1597 HydrophobicContact CE-CD1 4.09Å; M1583-L1597 HydrophobicContact CE-CD2 4.02Å; M1583-L1597 HydrophobicContact SD-CD1 4.43Å; M1583-L1597 HydrophobicContact SD-CD2 3.46Å; M1583-L1597 WeakPolarHBondContact SD-CD2 3.34Å; L1597-F1599 HydrophobicContact CD1-CD2 4.43Å; L1597-F1599 HydrophobicContact CD1-CE2 4.21Å; L1597-F1599 HydrophobicContact CD1-CZ 4.46Å; L1597-F1599 HydrophobicContact CD2-CD2 4.39Å; L1597-F1599 HydrophobicContact CD2-CE2 3.52Å; L1597-F1599 HydrophobicContact CD2-CZ 4.03Å; L1597-F1599 HydrophobicContact CG-CD2 4.18Å; L1597-F1599 HydrophobicContact CG-CE2 3.65Å; L1597-F1599 HydrophobicContact CG-CZ 4.39Å; L1597-A1641 PolarHBondContact N-O 3.03Å; L1597-L1642 HydrophobicContact CB-CD1 4.02Å; L1597-L1642 HydrophobicContact CD2-CD1 3.78Å; L1597-L1642 HydrophobicContact CG-CD1 3.84Å; L1597-L1642 CarbonylContact O-C 3.52Å; L1597-L1642 VanDerWaalsContact O-CA 3.31Å; L1597-L1642 WeakPolarHBondContact O-CA 3.43Å; L1597-G1643 PolarHBondContact O-N 3.01Å
1598	S	94.1	Very high	88	Confident	5.2 Å²	5.2	32.1 Å²	32.1	4%	0.036	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	122.3	174.2	176.6	0	0	0	0	110.4	M1572 K1573 L1574 W1595 G1643	M1572-S1598 PolarHBondContact O-N 3.09Å; K1573-S1598 CarbonylContact C-O 3.34Å; K1573-S1598 VanDerWaalsContact CA-O 3.29Å; K1573-S1598 WeakPolarHBondContact CA-O 3.31Å; L1574-S1598 PolarHBondContact N-O 3.08Å; W1595-S1598 VanDerWaalsContact CD1-CB 3.45Å; W1595-S1598 VanDerWaalsContact NE1-CB 3.32Å; S1598-G1643 CarbonylContact C-O 3.56Å; S1598-G1643 WeakPolarHBondContact CA-O 3.28Å
1599	F	93.4	Very high	87	Confident	3.8 Å²	3.8	37.7 Å²	37.7	2%	0.017	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.7	167.7	-81.2	-98	0	0	0	108.1	L1574 K1579 L1581 L1597 V1615 L1642 G1643 L1644 F1645 V1650	L1574-F1599 HydrophobicContact CB-CD1 4.17Å; L1574-F1599 HydrophobicContact CB-CD2 3.82Å; L1574-F1599 HydrophobicContact CB-CE1 4.46Å; L1574-F1599 HydrophobicContact CB-CE2 4.27Å; L1574-F1599 HydrophobicContact CD1-CD1 3.95Å; L1574-F1599 HydrophobicContact CD1-CD2 3.84Å; L1574-F1599 HydrophobicContact CD1-CE1 3.44Å; L1574-F1599 VanDerWaalsContact CD1-CE1 3.44Å; L1574-F1599 HydrophobicContact CD1-CE2 4.07Å; L1574-F1599 HydrophobicContact CD1-CZ 3.92Å; L1574-F1599 HydrophobicContact CG-CD2 4.41Å; L1574-F1599 HydrophobicContact CG-CE1 4.47Å; L1574-F1599 CarbonylContact O-C 3.54Å; L1574-F1599 WeakPolarHBondContact O-CA 3.35Å; K1579-F1599 HydrophobicContact CB-CE2 4.48Å; L1581-F1599 HydrophobicContact CD2-CD2 4.48Å; L1581-F1599 HydrophobicContact CD2-CE1 3.42Å; L1581-F1599 VanDerWaalsContact CD2-CE1 3.47Å; L1581-F1599 HydrophobicContact CD2-CE2 4.16Å; L1581-F1599 HydrophobicContact CD2-CZ 3.52Å; L1581-F1599 VanDerWaalsContact CD2-CZ 3.47Å; L1597-F1599 HydrophobicContact CD1-CD2 4.43Å; L1597-F1599 HydrophobicContact CD1-CE2 4.21Å; L1597-F1599 HydrophobicContact CD1-CZ 4.46Å; L1597-F1599 HydrophobicContact CD2-CD2 4.39Å; L1597-F1599 HydrophobicContact CD2-CE2 3.52Å; L1597-F1599 HydrophobicContact CD2-CZ 4.03Å; L1597-F1599 HydrophobicContact CG-CD2 4.18Å; L1597-F1599 HydrophobicContact CG-CE2 3.65Å; L1597-F1599 HydrophobicContact CG-CZ 4.39Å; F1599-V1615 HydrophobicContact CE2-CG2 4.05Å; F1599-V1615 HydrophobicContact CZ-CG2 3.72Å; F1599-L1642 HydrophobicContact CD2-CD1 3.95Å; F1599-L1642 HydrophobicContact CE2-CD1 3.72Å; F1599-G1643 PolarHBondContact N-O 2.81Å; F1599-L1644 HydrophobicContact CB-CD2 4.39Å; F1599-L1644 HydrophobicContact CD2-CD2 3.69Å; F1599-L1644 HydrophobicContact CE2-CD2 4.25Å; F1599-L1644 HydrophobicContact CG-CD2 4.24Å; F1599-F1645 CarbonylContact O-C 3.58Å; F1599-F1645 VanDerWaalsContact O-CA 3.28Å; F1599-F1645 WeakPolarHBondContact O-CA 3.32Å; F1599-F1645 VanDerWaalsContact O-CB 3.24Å; F1599-F1645 WeakPolarHBondContact O-CB 3.28Å; F1599-F1645 WeakPolarHBondContact O-CD2 3.35Å; F1599-F1645 PolarHBondContact O-N 2.96Å; F1599-V1650 HydrophobicContact CD1-CG2 4.25Å; F1599-V1650 HydrophobicContact CE1-CG2 4.37Å; F1599-V1650 HydrophobicContact CG-CG2 4.34Å; F1599-V1650 HydrophobicContact CZ-CG1 4.42Å
1600	D	91.7	Very high	86.3	Confident	25.8 Å²	25.8	37.8 Å²	37.8	14%	0.138	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	70.8	-178.6	-175.1	15.4	0	0	0	109.4	K1573 L1574 A1575 G1576 K1602 F1645	K1573-D1600 VanDerWaalsContact CE-CB 3.46Å; K1573-D1600 VanDerWaalsContact CE-OD2 3.24Å; K1573-D1600 WeakPolarHBondContact CE-OD2 3.32Å; K1573-D1600 IonicContact NZ-OD2 3.12Å; K1573-D1600 PolarHBondContact NZ-OD2 3.05Å; L1574-D1600 PolarHBondContact O-N 2.99Å; A1575-D1600 VanDerWaalsContact CA-O 3.28Å; A1575-D1600 WeakPolarHBondContact CA-O 3.39Å; A1575-D1600 HydrophobicContact CB-CB 4.48Å; G1576-D1600 PolarHBondContact N-O 3.36Å; D1600-K1602 VanDerWaalsContact OD1-CE 3.24Å; D1600-K1602 WeakPolarHBondContact OD1-CE 3.44Å; D1600-K1602 IonicContact OD1-NZ 3.82Å; D1600-K1602 PolarHBondContact OD1-NZ 2.84Å; D1600-F1645 WeakPolarHBondContact CA-O 3.4Å
1601	I	92	Very high	85.9	Confident	1.4 Å²	1.4	34.2 Å²	34.2	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114.2	-172.5	-55.1	-59.2	0	0	0	109.6	G1576 E1578 K1579 S1603 F1645 G1646 V1647 Q1648	G1576-I1601 CarbonylContact O-C 3.55Å; G1576-I1601 WeakPolarHBondContact O-CA 3.47Å; E1578-I1601 HydrophobicContact CB-CG2 4.47Å; E1578-I1601 HydrophobicContact CG-CG2 4.14Å; E1578-I1601 VanDerWaalsContact N-CG2 3.33Å; K1579-I1601 HydrophobicContact CD-CD1 4.14Å; K1579-I1601 HydrophobicContact CG-CD1 4.29Å; I1601-S1603 WeakPolarHBondContact CG2-O 3.43Å; I1601-F1645 PolarHBondContact N-O 2.84Å; I1601-F1645 VanDerWaalsContact N-O 3.12Å; I1601-G1646 CarbonylContact O-C 3.47Å; I1601-G1646 WeakPolarHBondContact O-CA 3.37Å; I1601-V1647 HydrophobicContact CG2-CG2 4Å; I1601-V1647 PolarHBondContact O-N 3.18Å; I1601-Q1648 HydrophobicContact CB-CB 3.93Å; I1601-Q1648 HydrophobicContact CG1-CB 4.03Å; I1601-Q1648 HydrophobicContact CG2-CB 3.9Å
1602	K	88.3	Confident	85.6	Confident	54.8 Å²	54.8	36.3 Å²	36.3	24%	0.238	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-6.4	-176.7	-59.4	-65.5	-165.4	-163.6	0	112.7	G1576 D1600 Y2144 V2146	G1576-K1602 PolarHBondContact O-N 3.23Å; D1600-K1602 VanDerWaalsContact OD1-CE 3.24Å; D1600-K1602 WeakPolarHBondContact OD1-CE 3.44Å; D1600-K1602 IonicContact OD1-NZ 3.82Å; D1600-K1602 PolarHBondContact OD1-NZ 2.84Å; K1602-Y2144 HydrophobicContact CB-CD2 4.33Å; K1602-Y2144 HydrophobicContact CB-CE2 4.22Å; K1602-Y2144 HydrophobicContact CD-CE2 4.21Å; K1602-Y2144 HydrophobicContact CG-CD2 4.21Å; K1602-Y2144 HydrophobicContact CG-CE2 4.08Å; K1602-V2146 HydrophobicContact CB-CG1 4.46Å; K1602-V2146 WeakPolarHBondContact O-CG1 3.28Å
1603	S	85.9	Confident	85.7	Confident	18.2 Å²	18.2	34.7 Å²	34.7	13%	0.127	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.4	-174.7	-75.6	0	0	0	0	111.8	G1576 M1577 E1578 I1601 A1605 V2146 D2147	G1576-S1603 PolarHBondContact O-N 3.03Å; M1577-S1603 WeakPolarHBondContact CA-O 3.38Å; E1578-S1603 PolarHBondContact N-O 3.03Å; E1578-S1603 WeakPolarHBondContact OE1-CB 3.44Å; E1578-S1603 PolarHBondContact OE1-OG 3.25Å; I1601-S1603 WeakPolarHBondContact CG2-O 3.43Å; S1603-A1605 PolarHBondContact OG-N 2.02Å; S1603-V2146 WeakPolarHBondContact OG-CA 3.28Å; S1603-D2147 CarbonylContact C-O 3.54Å; S1603-D2147 VanDerWaalsContact CA-O 3.28Å; S1603-D2147 WeakPolarHBondContact CA-O 3.22Å; S1603-D2147 VanDerWaalsContact CB-O 3.24Å; S1603-D2147 WeakPolarHBondContact CB-O 3.33Å; S1603-D2147 PolarHBondContact OG-N 3.05Å
1604	N	81.7	Confident	85.9	Confident	29.2 Å²	29.2	39.9 Å²	39.9	16%	0.156	20%	0.202	C	C	.	.			trans	-92.3	127.2	171.5	-72	-11.7	0	0	0	109.8	M1577 L1606 V1647 D2147 Y2149	M1577-N1604 HydrophobicContact CE-CB 3.96Å; M1577-N1604 VanDerWaalsContact CE-O 3.24Å; M1577-N1604 WeakPolarHBondContact CE-O 3.27Å; N1604-L1606 PolarHBondContact O-N 3.02Å; N1604-V1647 WeakPolarHBondContact OD1-CG2 3.26Å; N1604-D2147 PolarHBondContact N-O 3.13Å; N1604-Y2149 HydrophobicContact CB-CD1 3.89Å; N1604-Y2149 HydrophobicContact CB-CE1 3.89Å; N1604-Y2149 PolarHBondContact ND2-O 3.01Å
1605	A	78.6	Confident	86.1	Confident	7.8 Å²	7.8	37.5 Å²	37.5	6%	0.064	19%	0.192	C	C	.	.			trans	-68.6	136.5	174.5	0	0	0	0	0	110.8	Y1550 M1577 E1578 S1603 V1607 V1611 Y2149	Y1550-A1605 HydrophobicContact CD2-CB 3.61Å; Y1550-A1605 HydrophobicContact CE2-CB 4.2Å; Y1550-A1605 HydrophobicContact CG-CB 4.35Å; M1577-A1605 VanDerWaalsContact CE-CA 3.43Å; M1577-A1605 HydrophobicContact CE-CB 4.37Å; M1577-A1605 HydrophobicContact CG-CB 4.33Å; M1577-A1605 HydrophobicContact SD-CB 4.34Å; E1578-A1605 HydrophobicContact CB-CB 3.97Å; E1578-A1605 VanDerWaalsContact OE2-CB 3.32Å; E1578-A1605 WeakPolarHBondContact OE2-CB 3.37Å; E1578-A1605 PolarHBondContact OE2-N 3.21Å; S1603-A1605 PolarHBondContact OG-N 2.02Å; A1605-V1607 HydrophobicContact CB-CB 4.42Å; A1605-V1607 HydrophobicContact CB-CG2 3.93Å; A1605-V1607 PolarHBondContact O-N 3.22Å; A1605-V1611 HydrophobicContact CB-CG2 3.78Å; A1605-Y2149 VanDerWaalsContact O-CE1 3.25Å; A1605-Y2149 WeakPolarHBondContact O-CE1 3.29Å
1606	L	73	Confident	86.1	Confident	59 Å²	59	37.6 Å²	37.6	31%	0.309	19%	0.193	S	C	.	.	S	Bend	trans	-73.2	39.4	176	-62.7	174.6	0	0	0	112.4	V1521 Y1549 M1577 N1604 Y2149 M2191 H2223	V1521-L1606 HydrophobicContact CG1-CB 4.15Å; V1521-L1606 HydrophobicContact CG1-CD1 4.31Å; V1521-L1606 HydrophobicContact CG2-CD1 3.94Å; Y1549-L1606 WeakPolarHBondContact OH-CD1 2.94Å; M1577-L1606 HydrophobicContact CE-CG 4.07Å; N1604-L1606 PolarHBondContact O-N 3.02Å; L1606-Y2149 HydrophobicContact CD2-CD1 4.27Å; L1606-M2191 HydrophobicContact CB-CE 4.11Å; L1606-M2191 HydrophobicContact CD1-CE 3.96Å; L1606-M2191 HydrophobicContact CD2-CE 4.23Å; L1606-M2191 HydrophobicContact CD2-SD 4.11Å; L1606-M2191 HydrophobicContact CG-CE 4.17Å; L1606-H2223 WeakPolarHBondContact CD2-NE2 3.28Å
1607	V	70.1	Confident	86.1	Confident	33.6 Å²	33.6	41.3 Å²	41.3	20%	0.204	21%	0.207	C	C	.	.			trans	-119.7	132.1	-175.1	-137	0	0	0	0	109.2	L1523 A1605 Y1609 V1611 Y2149	L1523-V1607 HydrophobicContact CD2-CG1 4.43Å; A1605-V1607 HydrophobicContact CB-CB 4.42Å; A1605-V1607 HydrophobicContact CB-CG2 3.93Å; A1605-V1607 PolarHBondContact O-N 3.22Å; V1607-Y1609 VanDerWaalsContact C-N 3.28Å; V1607-Y1609 HydrophobicContact CB-CD1 4.23Å; V1607-Y1609 HydrophobicContact CB-CE1 4.05Å; V1607-Y1609 HydrophobicContact CG1-CD1 3.31Å; V1607-Y1609 HydrophobicContact CG1-CD2 4.2Å; V1607-Y1609 HydrophobicContact CG1-CE1 3.54Å; V1607-Y1609 HydrophobicContact CG1-CE2 3.95Å; V1607-Y1609 HydrophobicContact CG1-CG 3.9Å; V1607-Y1609 HydrophobicContact CG2-CD2 4.49Å; V1607-Y1609 HydrophobicContact CG2-CE1 4.38Å; V1607-Y1609 HydrophobicContact CG2-CE2 4.27Å; V1607-Y1609 PolarHBondContact O-N 3.03Å; V1607-V1611 HydrophobicContact CG2-CG2 3.64Å; V1607-Y2149 PolarHBondContact O-OH 3.15Å
1608	N	66.3	Low	86	Confident	104.8 Å²	104.8	41.3 Å²	41.3	56%	0.56	21%	0.207	S	C	*	.	S	Bend	trans	-76.4	-0.8	-171.2	-78.3	-9.3	0	0	0	114.5	R2189	N1608-R2189 PolarHBondContact OD1-O 2.78Å
1609	Y	75.3	Confident	86	Confident	119.6 Å²	119.6	42.8 Å²	42.8	47%	0.469	21%	0.212	S	C	.	.	S	Bend	trans	-110.7	152.5	-179.9	59.4	-98.8	0	0	0	111.3	V1607 V1611	V1607-Y1609 VanDerWaalsContact C-N 3.28Å; V1607-Y1609 HydrophobicContact CB-CD1 4.23Å; V1607-Y1609 HydrophobicContact CB-CE1 4.05Å; V1607-Y1609 HydrophobicContact CG1-CD1 3.31Å; V1607-Y1609 HydrophobicContact CG1-CD2 4.2Å; V1607-Y1609 HydrophobicContact CG1-CE1 3.54Å; V1607-Y1609 HydrophobicContact CG1-CE2 3.95Å; V1607-Y1609 HydrophobicContact CG1-CG 3.9Å; V1607-Y1609 HydrophobicContact CG2-CD2 4.49Å; V1607-Y1609 HydrophobicContact CG2-CE1 4.38Å; V1607-Y1609 HydrophobicContact CG2-CE2 4.27Å; V1607-Y1609 PolarHBondContact O-N 3.03Å; Y1609-V1611 HydrophobicContact CD2-CG2 4.26Å; Y1609-V1611 HydrophobicContact CE2-CG2 3.98Å; Y1609-V1611 PolarHBondContact O-N 3.39Å
1610	P	78.5	Confident	86	Confident	112.6 Å²	112.6	42.6 Å²	42.6	73%	0.731	21%	0.211	S	C	*	.			trans	-63.5	124.9	173.4	26.4	-33.5	0	0	0	109.9	P1612	P1610-P1612 VanDerWaalsContact O-CD 3.29Å; P1610-P1612 WeakPolarHBondContact O-CD 3.34Å
1611	V	86.5	Confident	86	Confident	12.4 Å²	12.4	42.7 Å²	42.7	8%	0.075	21%	0.21	C	C	.	.			trans	-76.6	116.2	-179.9	176.9	0	0	0	0	109.1	Y1550 E1578 K1579 E1580 A1605 V1607 Y1609 C1613 Q1648	Y1550-V1611 HydrophobicContact CD2-CG1 4.48Å; Y1550-V1611 HydrophobicContact CD2-CG2 4.48Å; Y1550-V1611 HydrophobicContact CE2-CG1 3.82Å; Y1550-V1611 HydrophobicContact CE2-CG2 3.99Å; E1578-V1611 HydrophobicContact CB-CB 4.23Å; E1578-V1611 HydrophobicContact CB-CG1 4.37Å; E1578-V1611 HydrophobicContact CB-CG2 4.12Å; E1578-V1611 HydrophobicContact CG-CG2 4.25Å; E1578-V1611 VanDerWaalsContact OE2-CG2 3.31Å; E1578-V1611 WeakPolarHBondContact OE2-CG2 3.35Å; K1579-V1611 WeakPolarHBondContact O-CG1 3.34Å; E1580-V1611 HydrophobicContact CB-CG1 3.94Å; A1605-V1611 HydrophobicContact CB-CG2 3.78Å; V1607-V1611 HydrophobicContact CG2-CG2 3.64Å; Y1609-V1611 HydrophobicContact CD2-CG2 4.26Å; Y1609-V1611 HydrophobicContact CE2-CG2 3.98Å; Y1609-V1611 PolarHBondContact O-N 3.39Å; V1611-C1613 PolarHBondContact O-N 3.26Å; V1611-Q1648 PolarHBondContact O-NE2 3.34Å
1612	P	90	Very high	86.1	Confident	45.2 Å²	45.2	44.4 Å²	44.4	29%	0.294	22%	0.22	S	C	.	.			trans	-72.1	130.6	-175.8	27	-29.5	0	0	0	110.9	E1580 L1581 P1610	E1580-P1612 WeakPolarHBondContact CA-O 3.27Å; E1580-P1612 HydrophobicContact CG-CG 3.94Å; L1581-P1612 PolarHBondContact N-O 2.99Å; L1581-P1612 VanDerWaalsContact N-O 3.16Å; P1610-P1612 VanDerWaalsContact O-CD 3.29Å; P1610-P1612 WeakPolarHBondContact O-CD 3.34Å
1613	C	93.2	Very high	86.3	Confident	3.2 Å²	3.2	41.9 Å²	41.9	2%	0.022	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	115.4	175.2	-177.7	0	0	0	0	109.2	L1581 V1611 Q1648 V1650 E1651	L1581-C1613 WeakPolarHBondContact O-CA 3.39Å; V1611-C1613 PolarHBondContact O-N 3.26Å; C1613-Q1648 HydrophobicContact CB-CG 4.43Å; C1613-Q1648 VanDerWaalsContact CB-NE2 3.35Å; C1613-V1650 HydrophobicContact CB-CG1 4.47Å; C1613-V1650 HydrophobicContact CB-CG2 4.27Å; C1613-E1651 PolarHBondContact O-N 2.98Å
1614	R	93.8	Very high	86.6	Confident	113.6 Å²	113.6	44 Å²	44	43%	0.429	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.1	-174.2	-56.7	-170.5	-179.1	116.1	2.1	111.2	L1581 M1583 E1651	L1581-R1614 PolarHBondContact O-N 3.21Å; M1583-R1614 PolarHBondContact N-O 3.18Å; R1614-E1651 WeakPolarHBondContact CA-O 3.24Å; R1614-E1651 WeakPolarHBondContact CD-OE2 3.18Å; R1614-E1651 HydrophobicContact CG-CB 4.35Å; R1614-E1651 WeakPolarHBondContact CG-OE2 3.25Å; R1614-E1651 IonicContact NE-OE2 3.37Å; R1614-E1651 PolarHBondContact NE-OE2 3.08Å; R1614-E1651 VanDerWaalsContact NE-OE2 3.11Å
1615	V	94.8	Very high	86.8	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	103.4	171.6	179.8	0	0	0	0	107	L1581 M1583 F1599 N1618 V1650 E1651 V1652 H1653 N1655	L1581-V1615 HydrophobicContact CD2-CG2 4.45Å; M1583-V1615 HydrophobicContact CB-CG2 4.33Å; F1599-V1615 HydrophobicContact CE2-CG2 4.05Å; F1599-V1615 HydrophobicContact CZ-CG2 3.72Å; V1615-N1618 WeakPolarHBondContact CG1-ND2 3.41Å; V1615-V1650 HydrophobicContact CB-CG1 4.37Å; V1615-V1650 HydrophobicContact CG2-CG1 3.75Å; V1615-E1651 PolarHBondContact N-O 3.04Å; V1615-V1652 HydrophobicContact CB-CG2 4.48Å; V1615-V1652 WeakPolarHBondContact O-CA 3.35Å; V1615-H1653 PolarHBondContact O-N 3.05Å; V1615-H1653 VanDerWaalsContact O-N 3.1Å; V1615-N1655 PolarHBondContact O-ND2 2.91Å
1616	H	92.9	Very high	86.8	Confident	37 Å²	37	47.9 Å²	47.9	17%	0.171	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.2	-177	66.2	69.2	0	0	0	115.5	M1583 E1584 N1618 H1653 N1655	M1583-H1616 PolarHBondContact O-N 3Å; E1584-H1616 WeakPolarHBondContact CA-O 3.33Å; E1584-H1616 VanDerWaalsContact CB-CE1 3.45Å; E1584-H1616 WeakPolarHBondContact CB-CE1 3.36Å; E1584-H1616 WeakPolarHBondContact CB-ND1 3.34Å; E1584-H1616 WeakPolarHBondContact CB-O 3.36Å; E1584-H1616 IonicContact OE2-CE1 3.1Å; E1584-H1616 PolarHBondContact OE2-CE1 3.06Å; E1584-H1616 VanDerWaalsContact OE2-CE1 3.27Å; E1584-H1616 IonicContact OE2-ND1 3.3Å; E1584-H1616 IonicContact OE2-NE2 3.2Å; H1616-N1618 VanDerWaalsContact C-N 3.25Å; H1616-N1618 PolarHBondContact N-ND2 3.23Å; H1616-N1618 PolarHBondContact O-N 3.1Å; H1616-N1618 PolarHBondContact O-ND2 3.16Å; H1616-N1618 VanDerWaalsContact O-ND2 3.13Å; H1616-H1653 WeakPolarHBondContact CA-O 3.37Å; H1616-H1653 HydrophobicContact CB-CB 4.49Å; H1616-H1653 WeakPolarHBondContact CB-O 3.29Å; H1616-N1655 VanDerWaalsContact C-OD1 3.29Å; H1616-N1655 WeakPolarHBondContact CA-OD1 3.39Å
1617	R	92.3	Very high	86.6	Confident	79.8 Å²	79.8	47.8 Å²	47.8	30%	0.301	24%	0.235	S	C	.	.	S	Bend	trans	59.4	30.2	178.2	-54	176.2	178.9	172.1	-4.5	113.3	E1584 R1585 H1653 F1654 N1655 S1722 I1723 E1726	E1584-R1617 IonicContact OE2-NH1 3.11Å; R1585-R1617 WeakPolarHBondContact CA-O 3.37Å; R1585-R1617 HydrophobicContact CG-CB 4.33Å; R1585-R1617 PolarHBondContact N-O 3.11Å; R1585-R1617 VanDerWaalsContact N-O 3.09Å; R1617-H1653 PolarHBondContact N-O 2.92Å; R1617-F1654 WeakPolarHBondContact CA-O 3.29Å; R1617-F1654 HydrophobicContact CG-CB 4.09Å; R1617-F1654 PolarHBondContact N-O 2.94Å; R1617-F1654 VanDerWaalsContact N-O 3.15Å; R1617-N1655 PolarHBondContact N-OD1 2.94Å; R1617-S1722 WeakPolarHBondContact CD-O 3.36Å; R1617-S1722 WeakPolarHBondContact CG-O 2.91Å; R1617-I1723 HydrophobicContact CB-CG2 4.06Å; R1617-I1723 HydrophobicContact CG-CG2 4.39Å; R1617-I1723 WeakPolarHBondContact O-CG1 3.25Å; R1617-E1726 IonicContact CZ-OE1 3.39Å; R1617-E1726 IonicContact NH2-OE1 3.7Å; R1617-E1726 PolarHBondContact NH2-OE1 3.47Å; R1617-E1726 IonicContact NH2-OE2 2.79Å
1618	N	94	Very high	86.2	Confident	0.2 Å²	0.2	52 Å²	52	0%	0.001	26%	0.262	C	S	.	.			trans	-98.2	152.1	175.8	-56.3	-76	0	0	0	111.2	M1583 E1584 R1585 N1586 V1615 H1616 F1620 N1655 N1656	M1583-N1618 PolarHBondContact O-ND2 3.4Å; E1584-N1618 VanDerWaalsContact C-OD1 3.31Å; R1585-N1618 PolarHBondContact N-OD1 3.16Å; N1586-N1618 VanDerWaalsContact CB-OD1 3.31Å; N1586-N1618 WeakPolarHBondContact CB-OD1 3.38Å; N1586-N1618 PolarHBondContact N-OD1 3.05Å; N1586-N1618 PolarHBondContact ND2-OD1 2.88Å; N1586-N1618 WeakPolarHBondContact O-CA 3.29Å; V1615-N1618 WeakPolarHBondContact CG1-ND2 3.41Å; H1616-N1618 VanDerWaalsContact C-N 3.25Å; H1616-N1618 PolarHBondContact N-ND2 3.23Å; H1616-N1618 PolarHBondContact O-N 3.1Å; H1616-N1618 PolarHBondContact O-ND2 3.16Å; H1616-N1618 VanDerWaalsContact O-ND2 3.13Å; N1618-F1620 HydrophobicContact CB-CD2 4.41Å; N1618-F1620 HydrophobicContact CB-CE2 3.72Å; N1618-F1620 HydrophobicContact CB-CZ 4.2Å; N1618-N1655 WeakPolarHBondContact CB-OD1 3.27Å; N1618-N1655 PolarHBondContact N-OD1 3.08Å; N1618-N1655 PolarHBondContact ND2-OD1 3.01Å; N1618-N1655 VanDerWaalsContact ND2-OD1 3.08Å; N1618-N1655 CarbonylContact O-C 3.57Å; N1618-N1655 WeakPolarHBondContact O-CA 3.38Å; N1618-N1656 PolarHBondContact O-N 3.16Å
1619	Y	93.8	Very high	85.7	Confident	36 Å²	36	54.3 Å²	54.3	14%	0.141	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121	-178.7	-73.6	-94.2	0	0	0	109.7	N1586 R1587 W1588 F1621 N1656 E1720 R1721 S1722 I1723	N1586-Y1619 PolarHBondContact O-N 3.05Å; R1587-Y1619 HydrophobicContact CG-CD2 4.07Å; R1587-Y1619 HydrophobicContact CG-CG 4.47Å; W1588-Y1619 PolarHBondContact N-O 3.05Å; Y1619-F1621 VanDerWaalsContact CB-CE2 3.44Å; Y1619-F1621 HydrophobicContact CD1-CD2 4.34Å; Y1619-F1621 HydrophobicContact CD1-CE1 4.36Å; Y1619-F1621 AromaticContact CD1-CE2 3.38Å; Y1619-F1621 HydrophobicContact CD1-CE2 3.38Å; Y1619-F1621 AromaticContact CD1-CZ 3.45Å; Y1619-F1621 HydrophobicContact CD1-CZ 3.65Å; Y1619-F1621 VanDerWaalsContact CD1-CZ 3.41Å; Y1619-F1621 HydrophobicContact CD2-CD2 4.24Å; Y1619-F1621 AromaticContact CD2-CE2 3.33Å; Y1619-F1621 HydrophobicContact CD2-CE2 3.33Å; Y1619-F1621 AromaticContact CD2-CZ 3.71Å; Y1619-F1621 HydrophobicContact CD2-CZ 3.71Å; Y1619-F1621 AromaticContact CE1-CE2 3.97Å; Y1619-F1621 HydrophobicContact CE1-CE2 4.12Å; Y1619-F1621 AromaticContact CE1-CZ 3.82Å; Y1619-F1621 HydrophobicContact CE1-CZ 3.94Å; Y1619-F1621 HydrophobicContact CE2-CE2 4Å; Y1619-F1621 HydrophobicContact CE2-CZ 4.16Å; Y1619-F1621 AromaticContact CG-CE2 3.82Å; Y1619-F1621 HydrophobicContact CG-CE2 3.99Å; Y1619-F1621 AromaticContact CG-CZ 3.87Å; Y1619-F1621 HydrophobicContact CG-CZ 4.19Å; Y1619-N1656 HydrophobicContact CD1-CB 3.98Å; Y1619-N1656 VanDerWaalsContact CD1-CB 3.47Å; Y1619-N1656 HydrophobicContact CD2-CB 4.12Å; Y1619-N1656 HydrophobicContact CE1-CB 4.17Å; Y1619-N1656 HydrophobicContact CE2-CB 4.19Å; Y1619-N1656 HydrophobicContact CG-CB 4.32Å; Y1619-E1720 PolarHBondContact OH-O 3.04Å; Y1619-R1721 VanDerWaalsContact OH-C 3.25Å; Y1619-R1721 VanDerWaalsContact OH-CA 3.29Å; Y1619-R1721 WeakPolarHBondContact OH-CA 3.37Å; Y1619-S1722 WeakPolarHBondContact CE2-OG 3.42Å; Y1619-S1722 PolarHBondContact OH-N 3.01Å; Y1619-S1722 VanDerWaalsContact OH-N 3.11Å; Y1619-I1723 HydrophobicContact CD1-CD1 4.07Å; Y1619-I1723 HydrophobicContact CD1-CG1 3.7Å; Y1619-I1723 HydrophobicContact CD2-CB 4.02Å; Y1619-I1723 HydrophobicContact CD2-CD1 3.6Å; Y1619-I1723 VanDerWaalsContact CD2-CD1 3.43Å; Y1619-I1723 HydrophobicContact CD2-CG1 3.87Å; Y1619-I1723 HydrophobicContact CE1-CB 4.22Å; Y1619-I1723 HydrophobicContact CE1-CD1 3.95Å; Y1619-I1723 HydrophobicContact CE1-CG1 3.78Å; Y1619-I1723 HydrophobicContact CE1-CG2 4.12Å; Y1619-I1723 HydrophobicContact CE2-CB 3.89Å; Y1619-I1723 HydrophobicContact CE2-CD1 3.61Å; Y1619-I1723 VanDerWaalsContact CE2-CD1 3.42Å; Y1619-I1723 HydrophobicContact CE2-CG1 3.72Å; Y1619-I1723 HydrophobicContact CE2-CG2 4.14Å; Y1619-I1723 HydrophobicContact CG-CD1 3.76Å; Y1619-I1723 HydrophobicContact CG-CG1 3.98Å; Y1619-I1723 VanDerWaalsContact OH-CG2 3.23Å; Y1619-I1723 WeakPolarHBondContact OH-CG2 3.18Å; Y1619-I1723 PolarHBondContact OH-N 3.44Å
1620	F	94.2	Very high	84.7	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	96.3	178	-61.9	-88.2	0	0	0	109.3	W1588 V1596 N1618 A1641 N1655 N1656 F1657 R1658 N1659	W1588-F1620 HydrophobicContact CB-CD1 3.85Å; W1588-F1620 HydrophobicContact CB-CE1 4.38Å; W1588-F1620 AromaticContact CD1-CD1 3.6Å; W1588-F1620 AromaticContact CD1-CE1 3.33Å; W1588-F1620 AromaticContact CD1-CZ 3.93Å; W1588-F1620 HydrophobicContact CD2-CE1 4.37Å; W1588-F1620 AromaticContact CG-CD1 3.79Å; W1588-F1620 HydrophobicContact CG-CD1 3.79Å; W1588-F1620 AromaticContact CG-CE1 3.81Å; W1588-F1620 HydrophobicContact CG-CE1 3.81Å; W1588-F1620 AromaticContact NE1-CE1 3.66Å; W1588-F1620 AromaticContact NE1-CZ 3.96Å; V1596-F1620 HydrophobicContact CB-CD1 4.31Å; V1596-F1620 HydrophobicContact CB-CE1 4.36Å; V1596-F1620 HydrophobicContact CG1-CD1 3.87Å; V1596-F1620 HydrophobicContact CG1-CE1 3.82Å; N1618-F1620 HydrophobicContact CB-CD2 4.41Å; N1618-F1620 HydrophobicContact CB-CE2 3.72Å; N1618-F1620 HydrophobicContact CB-CZ 4.2Å; F1620-A1641 HydrophobicContact CB-CB 4.48Å; F1620-N1655 HydrophobicContact CE2-CB 4.49Å; F1620-N1656 PolarHBondContact N-O 3.05Å; F1620-F1657 HydrophobicContact CB-CD1 3.92Å; F1620-F1657 HydrophobicContact CB-CE1 4.45Å; F1620-F1657 AromaticContact CD2-CD1 3.53Å; F1620-F1657 HydrophobicContact CD2-CD1 3.53Å; F1620-F1657 AromaticContact CD2-CE1 3.28Å; F1620-F1657 HydrophobicContact CD2-CE1 3.28Å; F1620-F1657 HydrophobicContact CD2-CG 4.47Å; F1620-F1657 HydrophobicContact CD2-CZ 4.1Å; F1620-F1657 HydrophobicContact CE2-CD1 4.26Å; F1620-F1657 AromaticContact CE2-CE1 3.53Å; F1620-F1657 HydrophobicContact CE2-CE1 3.53Å; F1620-F1657 HydrophobicContact CE2-CZ 4.07Å; F1620-F1657 AromaticContact CG-CD1 3.91Å; F1620-F1657 HydrophobicContact CG-CD1 3.91Å; F1620-F1657 AromaticContact CG-CE1 3.95Å; F1620-F1657 HydrophobicContact CG-CE1 3.95Å; F1620-F1657 HydrophobicContact CZ-CE1 4.36Å; F1620-R1658 CarbonylContact O-C 3.5Å; F1620-R1658 PolarHBondContact O-N 2.98Å; F1620-N1659 PolarHBondContact O-ND2 2.88Å; F1620-N1659 VanDerWaalsContact O-ND2 3.1Å; F1620-N1659 PolarHBondContact O-OD1 3.22Å
1621	F	91.3	Very high	83.5	Confident	27.4 Å²	27.4	52.9 Å²	52.9	12%	0.12	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.8	-172.3	-66.5	-40.5	0	0	0	113.6	W1588 R1589 Y1590 Y1619 N1623 N1656 R1658 N1659 E1719	W1588-F1621 PolarHBondContact O-N 2.87Å; R1589-F1621 VanDerWaalsContact CA-O 3.28Å; R1589-F1621 WeakPolarHBondContact CA-O 3.28Å; R1589-F1621 HydrophobicContact CG-CB 4.21Å; Y1590-F1621 PolarHBondContact N-O 2.97Å; Y1590-F1621 VanDerWaalsContact N-O 3.16Å; Y1619-F1621 VanDerWaalsContact CB-CE2 3.44Å; Y1619-F1621 HydrophobicContact CD1-CD2 4.34Å; Y1619-F1621 HydrophobicContact CD1-CE1 4.36Å; Y1619-F1621 AromaticContact CD1-CE2 3.38Å; Y1619-F1621 HydrophobicContact CD1-CE2 3.38Å; Y1619-F1621 AromaticContact CD1-CZ 3.45Å; Y1619-F1621 HydrophobicContact CD1-CZ 3.65Å; Y1619-F1621 VanDerWaalsContact CD1-CZ 3.41Å; Y1619-F1621 HydrophobicContact CD2-CD2 4.24Å; Y1619-F1621 AromaticContact CD2-CE2 3.33Å; Y1619-F1621 HydrophobicContact CD2-CE2 3.33Å; Y1619-F1621 AromaticContact CD2-CZ 3.71Å; Y1619-F1621 HydrophobicContact CD2-CZ 3.71Å; Y1619-F1621 AromaticContact CE1-CE2 3.97Å; Y1619-F1621 HydrophobicContact CE1-CE2 4.12Å; Y1619-F1621 AromaticContact CE1-CZ 3.82Å; Y1619-F1621 HydrophobicContact CE1-CZ 3.94Å; Y1619-F1621 HydrophobicContact CE2-CE2 4Å; Y1619-F1621 HydrophobicContact CE2-CZ 4.16Å; Y1619-F1621 AromaticContact CG-CE2 3.82Å; Y1619-F1621 HydrophobicContact CG-CE2 3.99Å; Y1619-F1621 AromaticContact CG-CZ 3.87Å; Y1619-F1621 HydrophobicContact CG-CZ 4.19Å; F1621-N1623 PolarHBondContact N-ND2 3.18Å; F1621-N1623 PolarHBondContact O-N 2.91Å; F1621-N1623 PolarHBondContact O-ND2 2.98Å; F1621-N1656 HydrophobicContact CE1-CB 4.34Å; F1621-N1656 VanDerWaalsContact CE1-CG 3.47Å; F1621-N1656 WeakPolarHBondContact CE1-ND2 3.47Å; F1621-N1656 VanDerWaalsContact CE1-OD1 3.26Å; F1621-N1656 WeakPolarHBondContact CE1-OD1 3.32Å; F1621-N1656 HydrophobicContact CZ-CB 4.44Å; F1621-N1656 WeakPolarHBondContact CZ-ND2 3.28Å; F1621-R1658 CarbonylContact C-O 3.47Å; F1621-R1658 WeakPolarHBondContact CA-O 3.32Å; F1621-R1658 HydrophobicContact CD1-CB 3.94Å; F1621-R1658 HydrophobicContact CE1-CB 4.27Å; F1621-N1659 VanDerWaalsContact C-OD1 3.3Å; F1621-E1719 VanDerWaalsContact CE1-OE1 3.28Å; F1621-E1719 WeakPolarHBondContact CE1-OE1 3.32Å; F1621-E1719 VanDerWaalsContact CZ-OE1 3.28Å; F1621-E1719 WeakPolarHBondContact CZ-OE1 3.37Å
1622	D	92.7	Very high	82	Confident	38 Å²	38	55.6 Å²	55.6	20%	0.203	27%	0.274	C	S	.	.	S	Bend	trans	50	30.2	167.2	-52	-37.5	0	0	0	113	Y1590 R1658 N1659	Y1590-D1622 WeakPolarHBondContact CA-O 3.4Å; Y1590-D1622 HydrophobicContact CD1-CB 3.56Å; Y1590-D1622 VanDerWaalsContact CD1-CB 3.49Å; Y1590-D1622 HydrophobicContact CE1-CB 3.36Å; Y1590-D1622 VanDerWaalsContact CE1-CB 3.43Å; Y1590-D1622 VanDerWaalsContact CE1-OD2 3.25Å; Y1590-D1622 WeakPolarHBondContact CE1-OD2 3.37Å; Y1590-D1622 PolarHBondContact OH-OD2 3.17Å; D1622-R1658 PolarHBondContact N-O 3.05Å; D1622-R1658 IonicContact OD1-CZ 3.34Å; D1622-R1658 IonicContact OD1-NE 3.14Å; D1622-R1658 IonicContact OD1-NH2 3.56Å; D1622-R1658 PolarHBondContact OD1-NH2 2.83Å; D1622-R1658 IonicContact OD2-NH2 3.35Å; D1622-R1658 PolarHBondContact OD2-NH2 2.94Å; D1622-N1659 PolarHBondContact N-OD1 2.98Å
1623	N	93.5	Very high	80.4	Confident	1.4 Å²	1.4	55.5 Å²	55.5	1%	0.007	27%	0.272	C	S	.	.			trans	-75.6	147.7	169.5	-54.9	-74.5	0	0	0	107.8	W1588 N1591 V1596 F1621 N1659 L1662	W1588-N1623 PolarHBondContact O-ND2 3.2Å; W1588-N1623 VanDerWaalsContact O-ND2 3.12Å; N1591-N1623 VanDerWaalsContact CB-OD1 3.31Å; N1591-N1623 WeakPolarHBondContact CB-OD1 3.3Å; N1591-N1623 PolarHBondContact N-OD1 3.33Å; N1591-N1623 VanDerWaalsContact N-OD1 3.09Å; N1591-N1623 PolarHBondContact ND2-OD1 3.22Å; N1591-N1623 VanDerWaalsContact O-CA 3.27Å; N1591-N1623 WeakPolarHBondContact O-CA 3.39Å; N1591-N1623 WeakPolarHBondContact O-CB 3.17Å; V1596-N1623 HydrophobicContact CG2-CB 3.8Å; F1621-N1623 PolarHBondContact N-ND2 3.18Å; F1621-N1623 PolarHBondContact O-N 2.91Å; F1621-N1623 PolarHBondContact O-ND2 2.98Å; N1623-N1659 VanDerWaalsContact CB-OD1 3.31Å; N1623-N1659 WeakPolarHBondContact CB-OD1 3.37Å; N1623-N1659 PolarHBondContact N-OD1 3.08Å; N1623-N1659 PolarHBondContact ND2-OD1 2.83Å; N1623-L1662 HydrophobicContact CB-CD1 4.16Å
1624	Y	91.5	Very high	78.7	Confident	62.8 Å²	62.8	58.9 Å²	58.9	25%	0.246	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-145.6	152.1	-169.8	66.6	-88.4	0	0	0	112.9	N1591 Q1592 G1593 L1626 L1661	N1591-Y1624 PolarHBondContact O-N 3.11Å; Q1592-Y1624 VanDerWaalsContact CA-O 3.29Å; Q1592-Y1624 WeakPolarHBondContact CA-O 3.38Å; Q1592-Y1624 HydrophobicContact CB-CD2 4.4Å; Q1592-Y1624 HydrophobicContact CB-CE1 4.25Å; Q1592-Y1624 HydrophobicContact CB-CE2 3.84Å; Q1592-Y1624 HydrophobicContact CG-CD2 4.14Å; Q1592-Y1624 HydrophobicContact CG-CE2 3.66Å; Q1592-Y1624 PolarHBondContact OE1-OH 2.84Å; G1593-Y1624 PolarHBondContact N-O 2.98Å; G1593-Y1624 VanDerWaalsContact N-O 3.16Å; Y1624-L1626 HydrophobicContact CD2-CD1 4.05Å; Y1624-L1626 HydrophobicContact CD2-CG 4.12Å; Y1624-L1626 HydrophobicContact CE2-CD1 4.39Å; Y1624-L1661 VanDerWaalsContact CB-CB 3.45Å; Y1624-L1661 HydrophobicContact CG-CD1 4.37Å
1625	F	86.9	Confident	77.4	Confident	30.2 Å²	30.2	54.2 Å²	54.2	13%	0.132	27%	0.274	C	S	.	.			trans	-136.9	106.5	171.1	-176.4	-108.2	0	0	0	109.5	H1567 G1593 K1594 T1627 L1661 L1662	H1567-F1625 WeakPolarHBondContact O-CE2 3.48Å; H1567-F1625 WeakPolarHBondContact O-CZ 3.48Å; G1593-F1625 VanDerWaalsContact C-CD2 3.46Å; G1593-F1625 WeakPolarHBondContact O-CB 3.4Å; K1594-F1625 HydrophobicContact CB-CD2 4.24Å; K1594-F1625 HydrophobicContact CB-CE2 3.98Å; K1594-F1625 HydrophobicContact CB-CZ 4.19Å; K1594-F1625 HydrophobicContact CG-CE1 4.38Å; K1594-F1625 HydrophobicContact CG-CE2 4.41Å; K1594-F1625 HydrophobicContact CG-CZ 4.17Å; F1625-T1627 HydrophobicContact CD1-CG2 4.27Å; F1625-T1627 HydrophobicContact CE1-CG2 3.43Å; F1625-T1627 VanDerWaalsContact CE1-CG2 3.47Å; F1625-T1627 HydrophobicContact CE2-CG2 4.2Å; F1625-T1627 HydrophobicContact CZ-CG2 3.4Å; F1625-T1627 VanDerWaalsContact CZ-CG2 3.44Å; F1625-L1661 PolarHBondContact N-O 3.03Å; F1625-L1661 VanDerWaalsContact N-O 3.16Å; F1625-L1662 HydrophobicContact CB-CD2 3.9Å
1626	L	78	Confident	76.2	Confident	88.8 Å²	88.8	58.3 Å²	58.3	47%	0.465	29%	0.289	S	S	.	.			trans	-109.7	120.1	-178.5	-61.8	170.7	0	0	0	109.2	Y1624 D1630 L1661 D1663	Y1624-L1626 HydrophobicContact CD2-CD1 4.05Å; Y1624-L1626 HydrophobicContact CD2-CG 4.12Å; Y1624-L1626 HydrophobicContact CE2-CD1 4.39Å; L1626-D1630 HydrophobicContact CB-CB 4.17Å; L1626-D1630 HydrophobicContact CD2-CB 4.05Å; L1626-L1661 PolarHBondContact N-O 2.89Å; L1626-L1661 VanDerWaalsContact N-O 3.13Å; L1626-D1663 WeakPolarHBondContact CD1-OD1 3.44Å
1627	T	69.4	Low	75.4	Confident	57.6 Å²	57.6	56.9 Å²	56.9	35%	0.353	28%	0.283	S	S	.	.			trans	-112.7	146.8	168.5	53.2	0	0	0	0	109.5	F1625 E1629 D1630	F1625-T1627 HydrophobicContact CD1-CG2 4.27Å; F1625-T1627 HydrophobicContact CE1-CG2 3.43Å; F1625-T1627 VanDerWaalsContact CE1-CG2 3.47Å; F1625-T1627 HydrophobicContact CE2-CG2 4.2Å; F1625-T1627 HydrophobicContact CZ-CG2 3.4Å; F1625-T1627 VanDerWaalsContact CZ-CG2 3.44Å; T1627-E1629 PolarHBondContact O-N 3.11Å; T1627-D1630 WeakPolarHBondContact CB-OD2 3.42Å; T1627-D1630 PolarHBondContact N-OD2 2.88Å; T1627-D1630 PolarHBondContact O-N 2.92Å; T1627-D1630 PolarHBondContact OG1-OD2 2.96Å
1628	P	61.2	Low	74.8	Confident	120.6 Å²	120.6	55.8 Å²	55.8	78%	0.783	28%	0.279	S	S	*	.	S	Bend	trans	-61.5	95.9	174.4	0.4	3.4	0	0	0	112.1	D1630 L1661	P1628-D1630 PolarHBondContact O-N 3.17Å; P1628-L1661 HydrophobicContact CG-CD2 4.29Å
1629	E	56.5	Low	74.5	Confident	153 Å²	153	55.8 Å²	55.8	72%	0.715	28%	0.279	S	S	*	.			trans	-73.1	48.9	180	-63.6	178.9	169.2	0	0	114.4	T1627 N1631	T1627-E1629 PolarHBondContact O-N 3.11Å; E1629-N1631 PolarHBondContact O-N 3.02Å
1630	D	53.9	Low	74.4	Confident	114.2 Å²	114.2	54.3 Å²	54.3	61%	0.611	27%	0.273	S	S	*	.			trans	-94.7	120.9	162.7	-73.7	-37.4	0	0	0	109	L1626 T1627 P1628 Y1632 R1638	L1626-D1630 HydrophobicContact CB-CB 4.17Å; L1626-D1630 HydrophobicContact CD2-CB 4.05Å; T1627-D1630 WeakPolarHBondContact CB-OD2 3.42Å; T1627-D1630 PolarHBondContact N-OD2 2.88Å; T1627-D1630 PolarHBondContact O-N 2.92Å; T1627-D1630 PolarHBondContact OG1-OD2 2.96Å; P1628-D1630 PolarHBondContact O-N 3.17Å; D1630-Y1632 PolarHBondContact O-N 3.22Å; D1630-R1638 PolarHBondContact O-NH1 2.82Å
1631	N	53.5	Low	74.4	Confident	89.6 Å²	89.6	54.3 Å²	54.3	48%	0.479	27%	0.273	S	S	.	.			trans	-62.8	105.7	176.9	-70.1	-11.1	0	0	0	111.4	E1629 V1633 R1638 I1842	E1629-N1631 PolarHBondContact O-N 3.02Å; N1631-V1633 PolarHBondContact O-N 2.75Å; N1631-R1638 PolarHBondContact O-NH1 2.99Å; N1631-R1638 PolarHBondContact O-NH2 2.77Å; N1631-I1842 HydrophobicContact CB-CD1 3.78Å
1632	Y	54.9	Low	74.5	Confident	69.4 Å²	69.4	53 Å²	53	27%	0.272	27%	0.268	S	S	.	.			trans	-75.1	97.1	175.9	-137.1	-89	0	0	0	112.6	D1630 D1634 N1635 D1663 F1664 Q1696 Y1802 P1803 V1828 I1833 V2001	D1630-Y1632 PolarHBondContact O-N 3.22Å; Y1632-D1634 VanDerWaalsContact C-N 3.31Å; Y1632-D1634 WeakPolarHBondContact CD1-OD1 3.38Å; Y1632-D1634 HydrophobicContact CE1-CB 4.34Å; Y1632-D1634 VanDerWaalsContact CE1-CG 3.42Å; Y1632-D1634 WeakPolarHBondContact CE1-OD1 3.34Å; Y1632-D1634 PolarHBondContact O-N 3.22Å; Y1632-D1634 PolarHBondContact OH-OD1 2.97Å; Y1632-N1635 PolarHBondContact O-N 2.87Å; Y1632-D1663 HydrophobicContact CD2-CB 4.01Å; Y1632-D1663 WeakPolarHBondContact CD2-OD1 3.42Å; Y1632-D1663 HydrophobicContact CE2-CB 3.94Å; Y1632-D1663 VanDerWaalsContact CE2-O 3.29Å; Y1632-D1663 WeakPolarHBondContact CE2-O 3.33Å; Y1632-D1663 WeakPolarHBondContact CE2-OD1 3.39Å; Y1632-F1664 HydrophobicContact CE2-CE1 4.44Å; Y1632-F1664 HydrophobicContact CE2-CE2 4.45Å; Y1632-F1664 HydrophobicContact CE2-CZ 4.19Å; Y1632-F1664 AromaticContact CZ-CZ 3.91Å; Y1632-F1664 WeakPolarHBondContact OH-CE1 3.17Å; Y1632-F1664 WeakPolarHBondContact OH-CZ 3.12Å; Y1632-Q1696 PolarHBondContact OH-O 2.92Å; Y1632-Y1802 AromaticContact CD1-CD1 3.92Å; Y1632-Y1802 HydrophobicContact CD1-CD1 4.16Å; Y1632-Y1802 HydrophobicContact CD1-CE1 4.32Å; Y1632-Y1802 AromaticContact CE1-CD1 3.97Å; Y1632-Y1802 HydrophobicContact CE1-CD1 4.13Å; Y1632-Y1802 HydrophobicContact CE1-CE1 4.47Å; Y1632-Y1802 AromaticContact CE2-CD1 3.9Å; Y1632-Y1802 HydrophobicContact CE2-CD1 3.9Å; Y1632-Y1802 HydrophobicContact CE2-CE1 4.03Å; Y1632-Y1802 AromaticContact CZ-CD1 3.98Å; Y1632-Y1802 WeakPolarHBondContact OH-CD1 3.38Å; Y1632-P1803 HydrophobicContact CD1-CG 3.75Å; Y1632-P1803 HydrophobicContact CD2-CG 4.23Å; Y1632-P1803 HydrophobicContact CE1-CG 3.64Å; Y1632-P1803 HydrophobicContact CE2-CG 4.18Å; Y1632-P1803 HydrophobicContact CG-CG 4.07Å; Y1632-P1803 WeakPolarHBondContact OH-CD 3.39Å; Y1632-P1803 WeakPolarHBondContact OH-CG 3.44Å; Y1632-V1828 HydrophobicContact CE1-CG1 4.45Å; Y1632-I1833 HydrophobicContact CD2-CD1 4.47Å; Y1632-I1833 HydrophobicContact CE1-CD1 3.53Å; Y1632-I1833 HydrophobicContact CE1-CG1 4.34Å; Y1632-I1833 HydrophobicContact CE2-CD1 4.26Å; Y1632-I1833 WeakPolarHBondContact OH-CD1 3.34Å; Y1632-V2001 HydrophobicContact CD2-CG1 4.38Å; Y1632-V2001 HydrophobicContact CE1-CG1 4.33Å; Y1632-V2001 HydrophobicContact CE2-CB 4.31Å; Y1632-V2001 HydrophobicContact CE2-CG1 3.46Å; Y1632-V2001 WeakPolarHBondContact OH-CB 3.2Å; Y1632-V2001 WeakPolarHBondContact OH-CG1 3.39Å; Y1632-V2001 WeakPolarHBondContact OH-CG2 3.38Å
1633	V	55.7	Low	74.6	Confident	43.4 Å²	43.4	51.2 Å²	51.2	26%	0.263	26%	0.258	S	S	.	.			trans	-86.9	65.2	174.4	-177.2	0	0	0	0	109.9	N1631 N1635 W1636 R1638 D1663	N1631-V1633 PolarHBondContact O-N 2.75Å; V1633-N1635 VanDerWaalsContact C-N 3.31Å; V1633-N1635 HydrophobicContact CG1-CB 4Å; V1633-N1635 WeakPolarHBondContact CG1-OD1 3.29Å; V1633-N1635 PolarHBondContact O-N 3.13Å; V1633-N1635 VanDerWaalsContact O-N 3.07Å; V1633-W1636 HydrophobicContact CG1-CB 4.37Å; V1633-W1636 PolarHBondContact O-N 2.57Å; V1633-R1638 HydrophobicContact CB-CG 4.42Å; V1633-R1638 HydrophobicContact CG1-CG 4.43Å; V1633-R1638 VanDerWaalsContact CG1-NH2 3.3Å; V1633-R1638 VanDerWaalsContact CG2-NH1 3.35Å; V1633-R1638 VanDerWaalsContact CG2-NH2 3.33Å; V1633-D1663 HydrophobicContact CG1-CB 3.93Å; V1633-D1663 VanDerWaalsContact CG1-CG 3.46Å; V1633-D1663 VanDerWaalsContact CG1-OD1 3.26Å; V1633-D1663 WeakPolarHBondContact CG1-OD1 3.36Å; V1633-D1663 PolarHBondContact N-OD1 2.84Å
1634	D	58.9	Low	74.6	Confident	74.4 Å²	74.4	51.2 Å²	51.2	40%	0.398	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.5	178.6	-71.9	-13.4	0	0	0	111.8	Y1632 W1636	Y1632-D1634 VanDerWaalsContact C-N 3.31Å; Y1632-D1634 WeakPolarHBondContact CD1-OD1 3.38Å; Y1632-D1634 HydrophobicContact CE1-CB 4.34Å; Y1632-D1634 VanDerWaalsContact CE1-CG 3.42Å; Y1632-D1634 WeakPolarHBondContact CE1-OD1 3.34Å; Y1632-D1634 PolarHBondContact O-N 3.22Å; Y1632-D1634 PolarHBondContact OH-OD1 2.97Å; D1634-W1636 CarbonylContact O-C 3.51Å; D1634-W1636 WeakPolarHBondContact O-CA 3.38Å; D1634-W1636 PolarHBondContact O-N 3.02Å
1635	N	64.7	Low	74.5	Confident	15 Å²	15	49.9 Å²	49.9	8%	0.08	25%	0.253	C	S	.	.	S	Bend	trans	-89.4	-2.3	-167.7	-50.9	1.9	0	0	0	114.1	Y1632 V1633 F1699 W1704 R1780 Y1802 P1803 N1804 V1805	Y1632-N1635 PolarHBondContact O-N 2.87Å; V1633-N1635 VanDerWaalsContact C-N 3.31Å; V1633-N1635 HydrophobicContact CG1-CB 4Å; V1633-N1635 WeakPolarHBondContact CG1-OD1 3.29Å; V1633-N1635 PolarHBondContact O-N 3.13Å; V1633-N1635 VanDerWaalsContact O-N 3.07Å; N1635-F1699 WeakPolarHBondContact O-CZ 3.31Å; N1635-W1704 VanDerWaalsContact O-CE2 3.27Å; N1635-W1704 WeakPolarHBondContact O-CZ2 3.32Å; N1635-W1704 PolarHBondContact O-NE1 2.8Å; N1635-W1704 VanDerWaalsContact O-NE1 3.11Å; N1635-R1780 WeakPolarHBondContact CB-O 3.46Å; N1635-R1780 VanDerWaalsContact CG-O 3.28Å; N1635-R1780 PolarHBondContact ND2-O 3.03Å; N1635-R1780 PolarHBondContact OD1-O 2.81Å; N1635-R1780 VanDerWaalsContact OD1-O 3.04Å; N1635-Y1802 WeakPolarHBondContact ND2-CB 3.41Å; N1635-P1803 PolarHBondContact ND2-O 3.01Å; N1635-N1804 HydrophobicContact CB-CB 4.28Å; N1635-V1805 HydrophobicContact CB-CG2 4.5Å; N1635-V1805 VanDerWaalsContact ND2-CG2 3.27Å; N1635-V1805 WeakPolarHBondContact ND2-CG2 3.23Å
1636	W	70.3	Confident	74.6	Confident	85.8 Å²	85.8	48.6 Å²	48.6	33%	0.325	25%	0.249	S	C	.	.	S	Bend	trans	-134.4	127.9	178.6	178.8	-75.3	0	0	0	109.2	V1633 D1634 R1638 F1645 W1704 F1707 N1804 N2037	V1633-W1636 HydrophobicContact CG1-CB 4.37Å; V1633-W1636 PolarHBondContact O-N 2.57Å; D1634-W1636 CarbonylContact O-C 3.51Å; D1634-W1636 WeakPolarHBondContact O-CA 3.38Å; D1634-W1636 PolarHBondContact O-N 3.02Å; W1636-R1638 VanDerWaalsContact C-N 3.28Å; W1636-R1638 PolarHBondContact O-N 2.89Å; W1636-F1645 HydrophobicContact CH2-CE1 4.29Å; W1636-W1704 HydrophobicContact CB-CZ2 4.41Å; W1636-W1704 HydrophobicContact CD2-CH2 4.25Å; W1636-W1704 HydrophobicContact CD2-CZ2 4.39Å; W1636-W1704 AromaticContact CE3-CH2 3.5Å; W1636-W1704 HydrophobicContact CE3-CH2 3.5Å; W1636-W1704 AromaticContact CE3-CZ2 3.66Å; W1636-W1704 HydrophobicContact CE3-CZ2 3.78Å; W1636-W1704 AromaticContact CE3-CZ3 3.52Å; W1636-W1704 HydrophobicContact CE3-CZ3 3.52Å; W1636-W1704 HydrophobicContact CG-CZ2 4.44Å; W1636-W1704 HydrophobicContact CH2-CH2 4.35Å; W1636-W1704 AromaticContact CZ3-CH2 3.6Å; W1636-W1704 HydrophobicContact CZ3-CH2 3.6Å; W1636-W1704 VanDerWaalsContact CZ3-CH2 3.41Å; W1636-W1704 AromaticContact CZ3-CZ2 4Å; W1636-W1704 HydrophobicContact CZ3-CZ2 4.05Å; W1636-W1704 AromaticContact CZ3-CZ3 3.55Å; W1636-W1704 HydrophobicContact CZ3-CZ3 4.01Å; W1636-F1707 HydrophobicContact CZ3-CZ 4.47Å; W1636-N1804 VanDerWaalsContact CE3-ND2 3.28Å; W1636-N1804 WeakPolarHBondContact CZ3-ND2 3.27Å; W1636-N2037 HydrophobicContact CE3-CB 3.93Å; W1636-N2037 HydrophobicContact CH2-CB 4.07Å; W1636-N2037 VanDerWaalsContact CH2-CG 3.43Å; W1636-N2037 WeakPolarHBondContact CH2-ND2 3.39Å; W1636-N2037 WeakPolarHBondContact CH2-OD1 3.35Å; W1636-N2037 WeakPolarHBondContact CZ2-ND2 3.44Å; W1636-N2037 HydrophobicContact CZ3-CB 3.39Å; W1636-N2037 VanDerWaalsContact CZ3-ND2 3.27Å; W1636-N2037 WeakPolarHBondContact CZ3-ND2 3.12Å; W1636-N2037 WeakPolarHBondContact CZ3-OD1 3.43Å
1637	P	77.1	Confident	75.1	Confident	7.8 Å²	7.8	45.2 Å²	45.2	5%	0.051	23%	0.232	C	C	.	.			trans	-68.9	88.9	176.4	29.3	-33.9	0	0	0	110.1	S1639 F1640 F1664 V1667 F1699	P1637-S1639 VanDerWaalsContact C-N 3.32Å; P1637-S1639 PolarHBondContact O-N 3.2Å; P1637-F1640 HydrophobicContact CB-CD1 4.17Å; P1637-F1640 HydrophobicContact CG-CD1 4.17Å; P1637-F1640 HydrophobicContact CG-CE1 4.45Å; P1637-F1664 HydrophobicContact CB-CD2 3.98Å; P1637-F1664 HydrophobicContact CB-CE2 4.22Å; P1637-V1667 HydrophobicContact CB-CG1 4.46Å; P1637-V1667 HydrophobicContact CB-CG2 3.96Å; P1637-V1667 HydrophobicContact CG-CG1 4.42Å; P1637-V1667 HydrophobicContact CG-CG2 4.01Å; P1637-F1699 HydrophobicContact CB-CD1 4.43Å; P1637-F1699 HydrophobicContact CB-CD2 4.35Å; P1637-F1699 HydrophobicContact CB-CE2 4.46Å; P1637-F1699 HydrophobicContact CB-CG 4.32Å; P1637-F1699 HydrophobicContact CG-CD1 4.36Å; P1637-F1699 HydrophobicContact CG-CE1 4.34Å; P1637-F1699 HydrophobicContact CG-CE2 4.42Å; P1637-F1699 HydrophobicContact CG-CG 4.42Å; P1637-F1699 HydrophobicContact CG-CZ 4.23Å
1638	R	77.8	Confident	76	Confident	56.6 Å²	56.6	42.7 Å²	42.7	21%	0.214	22%	0.216	C	C	.	.			trans	-68.4	-40.6	179.8	-32.3	175.9	-75.8	178.7	-0.9	109.4	K1594 D1630 N1631 V1633 W1636 D1663	K1594-R1638 WeakPolarHBondContact CE-O 3.34Å; K1594-R1638 WeakPolarHBondContact CG-O 3.39Å; D1630-R1638 PolarHBondContact O-NH1 2.82Å; N1631-R1638 PolarHBondContact O-NH1 2.99Å; N1631-R1638 PolarHBondContact O-NH2 2.77Å; V1633-R1638 HydrophobicContact CB-CG 4.42Å; V1633-R1638 HydrophobicContact CG1-CG 4.43Å; V1633-R1638 VanDerWaalsContact CG1-NH2 3.3Å; V1633-R1638 VanDerWaalsContact CG2-NH1 3.35Å; V1633-R1638 VanDerWaalsContact CG2-NH2 3.33Å; W1636-R1638 VanDerWaalsContact C-N 3.28Å; W1636-R1638 PolarHBondContact O-N 2.89Å; R1638-D1663 VanDerWaalsContact CB-OD2 3.3Å; R1638-D1663 WeakPolarHBondContact CB-OD2 3.35Å; R1638-D1663 WeakPolarHBondContact CD-OD2 3.45Å; R1638-D1663 WeakPolarHBondContact CG-OD2 3.5Å; R1638-D1663 IonicContact CZ-OD1 2.97Å; R1638-D1663 IonicContact CZ-OD2 3.4Å; R1638-D1663 IonicContact NE-OD1 3.05Å; R1638-D1663 PolarHBondContact NE-OD1 2.84Å; R1638-D1663 IonicContact NE-OD2 3Å; R1638-D1663 PolarHBondContact NE-OD2 3.03Å; R1638-D1663 VanDerWaalsContact NE-OD2 3.16Å; R1638-D1663 IonicContact NH2-OD1 3.41Å; R1638-D1663 PolarHBondContact NH2-OD1 2.97Å; R1638-D1663 IonicContact NH2-OD2 3.42Å
1639	S	88.1	Confident	77.3	Confident	0.2 Å²	0.2	40.4 Å²	40.4	0%	0.001	20%	0.197	C	C	.	.	S	Bend	trans	-139.8	142.9	176.5	66	0	0	0	0	114.1	K1594 P1637 D1663 F1664	K1594-S1639 CarbonylContact O-C 3.4Å; K1594-S1639 WeakPolarHBondContact O-CA 3.42Å; K1594-S1639 VanDerWaalsContact O-CB 3.27Å; K1594-S1639 WeakPolarHBondContact O-CB 3.33Å; P1637-S1639 VanDerWaalsContact C-N 3.32Å; P1637-S1639 PolarHBondContact O-N 3.2Å; S1639-D1663 WeakPolarHBondContact CB-OD2 3.4Å; S1639-D1663 PolarHBondContact N-OD2 2.99Å; S1639-D1663 VanDerWaalsContact N-OD2 3.12Å; S1639-D1663 WeakPolarHBondContact O-CB 3.47Å; S1639-D1663 VanDerWaalsContact OG-CG 3.26Å; S1639-D1663 PolarHBondContact OG-N 3.05Å; S1639-D1663 PolarHBondContact OG-OD2 2.85Å; S1639-F1664 PolarHBondContact O-N 3Å; S1639-F1664 VanDerWaalsContact O-N 3.12Å
1640	F	92.3	Very high	78.9	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.022	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	152.4	-179.5	55.3	-94.2	0	0	0	114.8	K1594 W1595 V1596 P1637 G1643 F1645 F1664 V1667	K1594-F1640 PolarHBondContact O-N 2.96Å; K1594-F1640 VanDerWaalsContact O-N 3.1Å; W1595-F1640 CarbonylContact C-O 3.58Å; W1595-F1640 WeakPolarHBondContact CA-O 3.38Å; W1595-F1640 HydrophobicContact CB-CD1 4.32Å; W1595-F1640 HydrophobicContact CB-CD2 3.53Å; W1595-F1640 HydrophobicContact CB-CE1 4.12Å; W1595-F1640 HydrophobicContact CB-CE2 3.25Å; W1595-F1640 HydrophobicContact CB-CG 4.06Å; W1595-F1640 HydrophobicContact CB-CZ 3.58Å; W1595-F1640 VanDerWaalsContact CB-CZ 3.5Å; W1595-F1640 VanDerWaalsContact CB-O 3.24Å; W1595-F1640 WeakPolarHBondContact CB-O 3.23Å; W1595-F1640 HydrophobicContact CD2-CE1 4.19Å; W1595-F1640 AromaticContact CD2-CE2 3.96Å; W1595-F1640 HydrophobicContact CD2-CE2 4.21Å; W1595-F1640 AromaticContact CD2-CZ 3.72Å; W1595-F1640 HydrophobicContact CD2-CZ 3.72Å; W1595-F1640 VanDerWaalsContact CD2-CZ 3.49Å; W1595-F1640 HydrophobicContact CE3-CD1 4.34Å; W1595-F1640 AromaticContact CE3-CE1 3.58Å; W1595-F1640 HydrophobicContact CE3-CE1 3.74Å; W1595-F1640 VanDerWaalsContact CE3-CE1 3.48Å; W1595-F1640 HydrophobicContact CE3-CE2 4.25Å; W1595-F1640 AromaticContact CE3-CZ 3.6Å; W1595-F1640 HydrophobicContact CE3-CZ 3.6Å; W1595-F1640 HydrophobicContact CG-CD2 4.44Å; W1595-F1640 HydrophobicContact CG-CE1 4.36Å; W1595-F1640 AromaticContact CG-CE2 3.69Å; W1595-F1640 HydrophobicContact CG-CE2 3.69Å; W1595-F1640 AromaticContact CG-CZ 3.71Å; W1595-F1640 HydrophobicContact CG-CZ 3.71Å; W1595-F1640 AromaticContact CZ3-CE1 3.93Å; W1595-F1640 HydrophobicContact CZ3-CE1 4.11Å; W1595-F1640 AromaticContact CZ3-CZ 3.84Å; W1595-F1640 HydrophobicContact CZ3-CZ 4.14Å; V1596-F1640 PolarHBondContact N-O 2.93Å; P1637-F1640 HydrophobicContact CB-CD1 4.17Å; P1637-F1640 HydrophobicContact CG-CD1 4.17Å; P1637-F1640 HydrophobicContact CG-CE1 4.45Å; F1640-G1643 VanDerWaalsContact CE2-CA 3.45Å; F1640-F1645 HydrophobicContact CE1-CE2 4.29Å; F1640-F1645 HydrophobicContact CE1-CZ 4.24Å; F1640-F1645 HydrophobicContact CE2-CE2 4.15Å; F1640-F1645 AromaticContact CZ-CE2 3.65Å; F1640-F1645 HydrophobicContact CZ-CE2 3.65Å; F1640-F1645 AromaticContact CZ-CZ 3.97Å; F1640-F1645 HydrophobicContact CZ-CZ 4.05Å; F1640-F1664 CarbonylContact C-O 3.35Å; F1640-F1664 WeakPolarHBondContact CA-O 3.37Å; F1640-F1664 HydrophobicContact CB-CB 4.15Å; F1640-V1667 HydrophobicContact CB-CG2 3.59Å; F1640-V1667 HydrophobicContact CD1-CG2 3.77Å; F1640-V1667 HydrophobicContact CD2-CG2 4.21Å; F1640-V1667 HydrophobicContact CE1-CG2 4.38Å; F1640-V1667 HydrophobicContact CG-CB 4.47Å; F1640-V1667 HydrophobicContact CG-CG2 3.59Å
1641	A	93.6	Very high	80.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	-49.3	175.3	0	0	0	0	0	112	V1596 L1597 F1620 F1657 L1662 F1664 E1665	V1596-A1641 VanDerWaalsContact CB-O 3.3Å; V1596-A1641 WeakPolarHBondContact CB-O 3.36Å; V1596-A1641 PolarHBondContact N-O 3.19Å; L1597-A1641 PolarHBondContact N-O 3.03Å; F1620-A1641 HydrophobicContact CB-CB 4.48Å; A1641-F1657 HydrophobicContact CB-CD1 4.17Å; A1641-F1657 HydrophobicContact CB-CE1 4.43Å; A1641-L1662 HydrophobicContact CB-CD1 4Å; A1641-F1664 PolarHBondContact N-O 3.01Å; A1641-F1664 VanDerWaalsContact N-O 3.1Å; A1641-E1665 CarbonylContact C-O 3.48Å; A1641-E1665 WeakPolarHBondContact CA-O 3.34Å; A1641-E1665 VanDerWaalsContact CB-O 3.29Å; A1641-E1665 WeakPolarHBondContact CB-O 3.33Å; A1641-E1665 WeakPolarHBondContact CB-OE2 3.2Å; A1641-E1665 PolarHBondContact N-O 3.07Å; A1641-E1665 VanDerWaalsContact N-O 3.17Å
1642	L	95	Very high	82.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.9	-178.3	175	62.9	0	0	0	111.5	L1597 F1599 L1644 V1652 F1657 E1665 V1666 V1667	L1597-L1642 HydrophobicContact CB-CD1 4.02Å; L1597-L1642 HydrophobicContact CD2-CD1 3.78Å; L1597-L1642 HydrophobicContact CG-CD1 3.84Å; L1597-L1642 CarbonylContact O-C 3.52Å; L1597-L1642 VanDerWaalsContact O-CA 3.31Å; L1597-L1642 WeakPolarHBondContact O-CA 3.43Å; F1599-L1642 HydrophobicContact CD2-CD1 3.95Å; F1599-L1642 HydrophobicContact CE2-CD1 3.72Å; L1642-L1644 HydrophobicContact CD1-CD2 4.18Å; L1642-L1644 HydrophobicContact CD2-CD2 4.49Å; L1642-L1644 HydrophobicContact CG-CD2 4.32Å; L1642-V1652 HydrophobicContact CD2-CB 4.41Å; L1642-V1652 HydrophobicContact CD2-CG1 3.71Å; L1642-V1652 HydrophobicContact CD2-CG2 3.74Å; L1642-F1657 HydrophobicContact CB-CE1 4.15Å; L1642-F1657 HydrophobicContact CB-CZ 4.35Å; L1642-F1657 HydrophobicContact CD2-CE1 4.48Å; L1642-F1657 HydrophobicContact CD2-CZ 4.05Å; L1642-E1665 PolarHBondContact N-O 3.08Å; L1642-V1666 HydrophobicContact CB-CG2 4.33Å; L1642-V1666 HydrophobicContact CD2-CG1 4.43Å; L1642-V1666 HydrophobicContact CD2-CG2 4.46Å; L1642-V1666 HydrophobicContact CG-CG1 4.5Å; L1642-V1666 CarbonylContact O-C 3.42Å; L1642-V1666 VanDerWaalsContact O-CA 3.24Å; L1642-V1666 WeakPolarHBondContact O-CA 3.38Å; L1642-V1667 PolarHBondContact O-N 3.01Å
1643	G	93.5	Very high	84.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.6	174.9	0	0	0	0	0	112.1	L1597 S1598 F1599 F1640	L1597-G1643 PolarHBondContact O-N 3.01Å; S1598-G1643 CarbonylContact C-O 3.56Å; S1598-G1643 WeakPolarHBondContact CA-O 3.28Å; F1599-G1643 PolarHBondContact N-O 2.81Å; F1640-G1643 VanDerWaalsContact CE2-CA 3.45Å
1644	L	93.4	Very high	86.1	Confident	0.2 Å²	0.2	25.8 Å²	25.8	0%	0.001	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	100.1	176.6	-56.1	-178.4	0	0	0	109.1	F1599 L1642 V1650 V1652 V1667 G1669 L1670 A1679	F1599-L1644 HydrophobicContact CB-CD2 4.39Å; F1599-L1644 HydrophobicContact CD2-CD2 3.69Å; F1599-L1644 HydrophobicContact CE2-CD2 4.25Å; F1599-L1644 HydrophobicContact CG-CD2 4.24Å; L1642-L1644 HydrophobicContact CD1-CD2 4.18Å; L1642-L1644 HydrophobicContact CD2-CD2 4.49Å; L1642-L1644 HydrophobicContact CG-CD2 4.32Å; L1644-V1650 HydrophobicContact CD1-CB 4.26Å; L1644-V1650 HydrophobicContact CD2-CB 3.73Å; L1644-V1650 HydrophobicContact CD2-CG1 4.09Å; L1644-V1650 HydrophobicContact CD2-CG2 3.83Å; L1644-V1652 HydrophobicContact CD1-CG2 4.17Å; L1644-V1652 HydrophobicContact CD2-CG2 4.46Å; L1644-V1667 PolarHBondContact N-O 3.07Å; L1644-G1669 CarbonylContact O-C 3.52Å; L1644-G1669 WeakPolarHBondContact O-CA 3.28Å; L1644-G1669 PolarHBondContact O-N 2.91Å; L1644-L1670 HydrophobicContact CB-CD2 4.11Å; L1644-L1670 HydrophobicContact CB-CG 4.2Å; L1644-L1670 PolarHBondContact O-N 3.1Å; L1644-L1670 VanDerWaalsContact O-N 3.15Å; L1644-A1679 HydrophobicContact CD1-CB 4.4Å
1645	F	90.8	Very high	87.7	Confident	36 Å²	36	22.3 Å²	22.3	16%	0.158	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.1	180	-54.5	-79.4	0	0	0	112.2	F1599 D1600 I1601 W1636 F1640 V1667 G1669 F1707	F1599-F1645 CarbonylContact O-C 3.58Å; F1599-F1645 VanDerWaalsContact O-CA 3.28Å; F1599-F1645 WeakPolarHBondContact O-CA 3.32Å; F1599-F1645 VanDerWaalsContact O-CB 3.24Å; F1599-F1645 WeakPolarHBondContact O-CB 3.28Å; F1599-F1645 WeakPolarHBondContact O-CD2 3.35Å; F1599-F1645 PolarHBondContact O-N 2.96Å; D1600-F1645 WeakPolarHBondContact CA-O 3.4Å; I1601-F1645 PolarHBondContact N-O 2.84Å; I1601-F1645 VanDerWaalsContact N-O 3.12Å; W1636-F1645 HydrophobicContact CH2-CE1 4.29Å; F1640-F1645 HydrophobicContact CE1-CE2 4.29Å; F1640-F1645 HydrophobicContact CE1-CZ 4.24Å; F1640-F1645 HydrophobicContact CE2-CE2 4.15Å; F1640-F1645 AromaticContact CZ-CE2 3.65Å; F1640-F1645 HydrophobicContact CZ-CE2 3.65Å; F1640-F1645 AromaticContact CZ-CZ 3.97Å; F1640-F1645 HydrophobicContact CZ-CZ 4.05Å; F1645-V1667 HydrophobicContact CE1-CG1 3.74Å; F1645-V1667 HydrophobicContact CZ-CB 4.16Å; F1645-V1667 HydrophobicContact CZ-CG1 3.66Å; F1645-G1669 WeakPolarHBondContact CA-O 3.27Å; F1645-F1707 HydrophobicContact CD1-CE1 4.5Å; F1645-F1707 HydrophobicContact CD1-CZ 4.36Å; F1645-F1707 HydrophobicContact CE1-CE1 4.49Å; F1645-F1707 HydrophobicContact CE1-CE2 4.4Å; F1645-F1707 AromaticContact CE1-CZ 3.91Å; F1645-F1707 HydrophobicContact CE1-CZ 3.95Å
1646	G	88	Confident	89	Confident	4 Å²	4	21.7 Å²	21.7	4%	0.041	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	97.5	-136.6	173.7	0	0	0	0	0	113.3	I1601 G1669 L1670 R1671	I1601-G1646 CarbonylContact O-C 3.47Å; I1601-G1646 WeakPolarHBondContact O-CA 3.37Å; G1646-G1669 PolarHBondContact N-O 2.92Å; G1646-L1670 CarbonylContact O-C 3.52Å; G1646-L1670 WeakPolarHBondContact O-CA 3.3Å; G1646-R1671 PolarHBondContact O-N 2.98Å
1647	V	87.9	Confident	90.1	Very high	15.8 Å²	15.8	17.6 Å²	17.6	10%	0.096	8%	0.084	C	C	.	.	S	Bend	trans	-109.7	-14.4	-166.1	-55.7	0	0	0	0	114.9	I1601 N1604 N1649 C2123 V2125	I1601-V1647 HydrophobicContact CG2-CG2 4Å; I1601-V1647 PolarHBondContact O-N 3.18Å; N1604-V1647 WeakPolarHBondContact OD1-CG2 3.26Å; V1647-N1649 PolarHBondContact O-N 3.2Å; V1647-C2123 HydrophobicContact CG1-CB 4.34Å; V1647-C2123 WeakPolarHBondContact CG1-O 3.41Å; V1647-V2125 WeakPolarHBondContact O-CA 3.36Å; V1647-V2125 WeakPolarHBondContact O-CG2 3.19Å
1648	Q	88.9	Confident	90.7	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.028	10%	0.096	C	C	.	.			trans	-88	122.5	-177.9	-170.7	172	10.1	0	0	111.4	E1578 K1579 I1601 V1611 C1613 L1670	E1578-Q1648 HydrophobicContact CG-CB 4.12Å; E1578-Q1648 HydrophobicContact CG-CG 4.12Å; K1579-Q1648 PolarHBondContact O-NE2 2.96Å; I1601-Q1648 HydrophobicContact CB-CB 3.93Å; I1601-Q1648 HydrophobicContact CG1-CB 4.03Å; I1601-Q1648 HydrophobicContact CG2-CB 3.9Å; V1611-Q1648 PolarHBondContact O-NE2 3.34Å; C1613-Q1648 HydrophobicContact CB-CG 4.43Å; C1613-Q1648 VanDerWaalsContact CB-NE2 3.35Å; Q1648-L1670 WeakPolarHBondContact O-CD2 3.36Å
1649	N	87.7	Confident	91.3	Very high	71.6 Å²	71.6	18.5 Å²	18.5	38%	0.383	9%	0.086	S	C	.	.			trans	-74.1	138.3	171	-162	6	0	0	0	110.9	V1647 L1670 V2125	V1647-N1649 PolarHBondContact O-N 3.2Å; N1649-L1670 HydrophobicContact CB-CD1 4.44Å; N1649-V2125 HydrophobicContact CB-CG1 4.05Å
1650	V	90.9	Very high	91.1	Very high	0.8 Å²	0.8	23 Å²	23	1%	0.005	11%	0.114	C	C	.	.			trans	-124.6	126.4	-177.5	-178.2	0	0	0	0	109.3	F1599 C1613 V1615 L1644 V1652	F1599-V1650 HydrophobicContact CD1-CG2 4.25Å; F1599-V1650 HydrophobicContact CE1-CG2 4.37Å; F1599-V1650 HydrophobicContact CG-CG2 4.34Å; F1599-V1650 HydrophobicContact CZ-CG1 4.42Å; C1613-V1650 HydrophobicContact CB-CG1 4.47Å; C1613-V1650 HydrophobicContact CB-CG2 4.27Å; V1615-V1650 HydrophobicContact CB-CG1 4.37Å; V1615-V1650 HydrophobicContact CG2-CG1 3.75Å; L1644-V1650 HydrophobicContact CD1-CB 4.26Å; L1644-V1650 HydrophobicContact CD2-CB 3.73Å; L1644-V1650 HydrophobicContact CD2-CG1 4.09Å; L1644-V1650 HydrophobicContact CD2-CG2 3.83Å; V1650-V1652 HydrophobicContact CB-CG2 4.43Å; V1650-V1652 HydrophobicContact CG1-CG2 4.03Å; V1650-V1652 PolarHBondContact O-N 2.9Å
1651	E	92.3	Very high	90.9	Very high	81.2 Å²	81.2	26.7 Å²	26.7	38%	0.379	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	111.5	174.9	-67.2	179.7	166.9	0	0	109.4	C1613 R1614 V1615	C1613-E1651 PolarHBondContact O-N 2.98Å; R1614-E1651 WeakPolarHBondContact CA-O 3.24Å; R1614-E1651 WeakPolarHBondContact CD-OE2 3.18Å; R1614-E1651 HydrophobicContact CG-CB 4.35Å; R1614-E1651 WeakPolarHBondContact CG-OE2 3.25Å; R1614-E1651 IonicContact NE-OE2 3.37Å; R1614-E1651 PolarHBondContact NE-OE2 3.08Å; R1614-E1651 VanDerWaalsContact NE-OE2 3.11Å; V1615-E1651 PolarHBondContact N-O 3.04Å
1652	V	93.8	Very high	90.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	103	-177.8	-175.6	0	0	0	0	109	V1615 L1642 L1644 V1650 N1655 F1657 N1680 I1681 N1684	V1615-V1652 HydrophobicContact CB-CG2 4.48Å; V1615-V1652 WeakPolarHBondContact O-CA 3.35Å; L1642-V1652 HydrophobicContact CD2-CB 4.41Å; L1642-V1652 HydrophobicContact CD2-CG1 3.71Å; L1642-V1652 HydrophobicContact CD2-CG2 3.74Å; L1644-V1652 HydrophobicContact CD1-CG2 4.17Å; L1644-V1652 HydrophobicContact CD2-CG2 4.46Å; V1650-V1652 HydrophobicContact CB-CG2 4.43Å; V1650-V1652 HydrophobicContact CG1-CG2 4.03Å; V1650-V1652 PolarHBondContact O-N 2.9Å; V1652-N1655 VanDerWaalsContact CG1-ND2 3.3Å; V1652-N1655 WeakPolarHBondContact CG1-ND2 3.42Å; V1652-F1657 HydrophobicContact CG1-CE2 4.35Å; V1652-F1657 HydrophobicContact CG1-CZ 4.22Å; V1652-N1680 PolarHBondContact N-O 2.97Å; V1652-N1680 VanDerWaalsContact N-O 3.1Å; V1652-I1681 HydrophobicContact CB-CB 4.49Å; V1652-I1681 HydrophobicContact CB-CG1 4.35Å; V1652-I1681 HydrophobicContact CB-CG2 4.2Å; V1652-I1681 HydrophobicContact CG1-CG2 4.13Å; V1652-I1681 HydrophobicContact CG2-CG1 4.49Å; V1652-I1681 CarbonylContact O-C 3.56Å; V1652-I1681 VanDerWaalsContact O-CA 3.3Å; V1652-I1681 WeakPolarHBondContact O-CA 3.28Å; V1652-N1684 PolarHBondContact O-ND2 3.02Å
1653	H	91.6	Very high	90.2	Very high	28.8 Å²	28.8	28.1 Å²	28.1	13%	0.133	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	149.8	-174.6	-60.8	-54.9	0	0	0	113.2	V1615 H1616 R1617 N1655 N1680 S1682 N1684	V1615-H1653 PolarHBondContact O-N 3.05Å; V1615-H1653 VanDerWaalsContact O-N 3.1Å; H1616-H1653 WeakPolarHBondContact CA-O 3.37Å; H1616-H1653 HydrophobicContact CB-CB 4.49Å; H1616-H1653 WeakPolarHBondContact CB-O 3.29Å; R1617-H1653 PolarHBondContact N-O 2.92Å; H1653-N1655 VanDerWaalsContact C-N 3.26Å; H1653-N1655 PolarHBondContact N-ND2 3.07Å; H1653-N1655 PolarHBondContact O-N 3.09Å; H1653-N1655 VanDerWaalsContact O-N 3.1Å; H1653-N1655 PolarHBondContact O-ND2 3.1Å; H1653-N1655 VanDerWaalsContact O-ND2 3.11Å; H1653-N1680 VanDerWaalsContact CE1-CG 3.41Å; H1653-N1680 PolarHBondContact CE1-ND2 2.92Å; H1653-N1680 VanDerWaalsContact CE1-ND2 3.29Å; H1653-N1680 PolarHBondContact CE1-OD1 3.09Å; H1653-N1680 VanDerWaalsContact CE1-OD1 3.28Å; H1653-N1680 PolarHBondContact NE2-ND2 2.99Å; H1653-S1682 WeakPolarHBondContact CA-O 3.45Å; H1653-S1682 PolarHBondContact CE1-OG 3.06Å; H1653-S1682 PolarHBondContact ND1-O 2.98Å; H1653-S1682 PolarHBondContact ND1-OG 3.19Å; H1653-S1682 VanDerWaalsContact ND1-OG 3.17Å; H1653-N1684 VanDerWaalsContact C-OD1 3.28Å; H1653-N1684 WeakPolarHBondContact CA-OD1 3.26Å
1654	F	91	Very high	90.1	Very high	52.8 Å²	52.8	28.6 Å²	28.6	23%	0.232	14%	0.143	C	C	.	.	S	Bend	trans	58.3	25.8	172.9	-47.6	-68.6	0	0	0	114.4	R1617 H1683 N1684 F1716 S1722 I1723 W1725 W1727 P1729	R1617-F1654 WeakPolarHBondContact CA-O 3.29Å; R1617-F1654 HydrophobicContact CG-CB 4.09Å; R1617-F1654 PolarHBondContact N-O 2.94Å; R1617-F1654 VanDerWaalsContact N-O 3.15Å; F1654-H1683 WeakPolarHBondContact CA-O 3.31Å; F1654-H1683 HydrophobicContact CD1-CB 3.91Å; F1654-H1683 HydrophobicContact CE1-CB 3.71Å; F1654-H1683 AromaticContact CE1-CG 3.96Å; F1654-H1683 HydrophobicContact CG-CB 4.46Å; F1654-H1683 HydrophobicContact CZ-CB 4.28Å; F1654-H1683 PolarHBondContact N-O 3.07Å; F1654-N1684 PolarHBondContact N-OD1 2.96Å; F1654-F1716 HydrophobicContact CD1-CE2 4.02Å; F1654-F1716 AromaticContact CD1-CZ 3.86Å; F1654-F1716 HydrophobicContact CD1-CZ 3.91Å; F1654-F1716 HydrophobicContact CE1-CZ 4.25Å; F1654-S1722 VanDerWaalsContact O-CB 3.26Å; F1654-S1722 WeakPolarHBondContact O-CB 3.41Å; F1654-S1722 PolarHBondContact O-OG 3.23Å; F1654-I1723 WeakPolarHBondContact O-CD1 3.21Å; F1654-I1723 WeakPolarHBondContact O-CG1 3.26Å; F1654-W1725 AromaticContact CD1-CE2 3.71Å; F1654-W1725 AromaticContact CD1-CZ2 3.92Å; F1654-W1725 HydrophobicContact CD1-CZ2 3.92Å; F1654-W1725 AromaticContact CD1-NE1 3.36Å; F1654-W1725 HydrophobicContact CE1-CD2 4.35Å; F1654-W1725 AromaticContact CE1-CE2 3.51Å; F1654-W1725 HydrophobicContact CE1-CH2 4.1Å; F1654-W1725 AromaticContact CE1-CZ2 3.36Å; F1654-W1725 HydrophobicContact CE1-CZ2 3.36Å; F1654-W1725 AromaticContact CE1-NE1 3.69Å; F1654-W1725 HydrophobicContact CE2-CZ2 4.25Å; F1654-W1725 HydrophobicContact CZ-CH2 4.11Å; F1654-W1725 AromaticContact CZ-CZ2 3.56Å; F1654-W1725 HydrophobicContact CZ-CZ2 3.56Å; F1654-W1727 HydrophobicContact CB-CZ3 4.49Å; F1654-W1727 AromaticContact CD1-CH2 3.78Å; F1654-W1727 HydrophobicContact CD1-CH2 3.78Å; F1654-W1727 AromaticContact CD1-CZ3 3.97Å; F1654-W1727 HydrophobicContact CD1-CZ3 4.1Å; F1654-W1727 HydrophobicContact CE1-CH2 4.26Å; F1654-W1727 HydrophobicContact CG-CH2 4.4Å; F1654-W1727 HydrophobicContact CG-CZ3 4.41Å; F1654-P1729 HydrophobicContact CE1-CB 4.18Å; F1654-P1729 HydrophobicContact CE1-CG 4.14Å; F1654-P1729 HydrophobicContact CZ-CG 4.27Å
1655	N	92.6	Very high	90	Very high	1.2 Å²	1.2	28.6 Å²	28.6	1%	0.006	14%	0.143	C	C	.	.			trans	-94.1	154.7	175.6	-54.2	-74.7	0	0	0	110.7	V1615 H1616 R1617 N1618 F1620 V1652 H1653 F1657 N1684 Y1685	V1615-N1655 PolarHBondContact O-ND2 2.91Å; H1616-N1655 VanDerWaalsContact C-OD1 3.29Å; H1616-N1655 WeakPolarHBondContact CA-OD1 3.39Å; R1617-N1655 PolarHBondContact N-OD1 2.94Å; N1618-N1655 WeakPolarHBondContact CB-OD1 3.27Å; N1618-N1655 PolarHBondContact N-OD1 3.08Å; N1618-N1655 PolarHBondContact ND2-OD1 3.01Å; N1618-N1655 VanDerWaalsContact ND2-OD1 3.08Å; N1618-N1655 CarbonylContact O-C 3.57Å; N1618-N1655 WeakPolarHBondContact O-CA 3.38Å; F1620-N1655 HydrophobicContact CE2-CB 4.49Å; V1652-N1655 VanDerWaalsContact CG1-ND2 3.3Å; V1652-N1655 WeakPolarHBondContact CG1-ND2 3.42Å; H1653-N1655 VanDerWaalsContact C-N 3.26Å; H1653-N1655 PolarHBondContact N-ND2 3.07Å; H1653-N1655 PolarHBondContact O-N 3.09Å; H1653-N1655 VanDerWaalsContact O-N 3.1Å; H1653-N1655 PolarHBondContact O-ND2 3.1Å; H1653-N1655 VanDerWaalsContact O-ND2 3.11Å; N1655-F1657 HydrophobicContact CB-CD2 4.3Å; N1655-F1657 HydrophobicContact CB-CE2 3.67Å; N1655-F1657 HydrophobicContact CB-CZ 3.88Å; N1655-N1684 WeakPolarHBondContact CB-OD1 3.26Å; N1655-N1684 PolarHBondContact N-OD1 2.81Å; N1655-N1684 PolarHBondContact ND2-OD1 2.97Å; N1655-N1684 VanDerWaalsContact ND2-OD1 3.14Å; N1655-N1684 WeakPolarHBondContact O-CA 3.32Å; N1655-Y1685 PolarHBondContact O-N 3.23Å
1656	N	92.1	Very high	90.1	Very high	2.2 Å²	2.2	26.9 Å²	26.9	1%	0.012	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	108.7	179	-177	-18.3	0	0	0	108.6	N1618 Y1619 F1620 F1621 Y1685 E1719 I1723	N1618-N1656 PolarHBondContact O-N 3.16Å; Y1619-N1656 HydrophobicContact CD1-CB 3.98Å; Y1619-N1656 VanDerWaalsContact CD1-CB 3.47Å; Y1619-N1656 HydrophobicContact CD2-CB 4.12Å; Y1619-N1656 HydrophobicContact CE1-CB 4.17Å; Y1619-N1656 HydrophobicContact CE2-CB 4.19Å; Y1619-N1656 HydrophobicContact CG-CB 4.32Å; F1620-N1656 PolarHBondContact N-O 3.05Å; F1621-N1656 HydrophobicContact CE1-CB 4.34Å; F1621-N1656 VanDerWaalsContact CE1-CG 3.47Å; F1621-N1656 WeakPolarHBondContact CE1-ND2 3.47Å; F1621-N1656 VanDerWaalsContact CE1-OD1 3.26Å; F1621-N1656 WeakPolarHBondContact CE1-OD1 3.32Å; F1621-N1656 HydrophobicContact CZ-CB 4.44Å; F1621-N1656 WeakPolarHBondContact CZ-ND2 3.28Å; N1656-Y1685 VanDerWaalsContact OD1-CD1 3.26Å; N1656-Y1685 WeakPolarHBondContact OD1-CD1 3.27Å; N1656-E1719 WeakPolarHBondContact ND2-CG 3.36Å; N1656-E1719 PolarHBondContact ND2-OE1 3.17Å; N1656-I1723 HydrophobicContact CB-CD1 3.34Å; N1656-I1723 HydrophobicContact CB-CG1 4.33Å; N1656-I1723 VanDerWaalsContact N-CD1 3.33Å
1657	F	92.9	Very high	90.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.2	178.6	-61.5	-77.5	0	0	0	109.6	F1620 A1641 L1642 V1652 N1655 E1665 V1666 N1684 Y1685 F1686 G1687	F1620-F1657 HydrophobicContact CB-CD1 3.92Å; F1620-F1657 HydrophobicContact CB-CE1 4.45Å; F1620-F1657 AromaticContact CD2-CD1 3.53Å; F1620-F1657 HydrophobicContact CD2-CD1 3.53Å; F1620-F1657 AromaticContact CD2-CE1 3.28Å; F1620-F1657 HydrophobicContact CD2-CE1 3.28Å; F1620-F1657 HydrophobicContact CD2-CG 4.47Å; F1620-F1657 HydrophobicContact CD2-CZ 4.1Å; F1620-F1657 HydrophobicContact CE2-CD1 4.26Å; F1620-F1657 AromaticContact CE2-CE1 3.53Å; F1620-F1657 HydrophobicContact CE2-CE1 3.53Å; F1620-F1657 HydrophobicContact CE2-CZ 4.07Å; F1620-F1657 AromaticContact CG-CD1 3.91Å; F1620-F1657 HydrophobicContact CG-CD1 3.91Å; F1620-F1657 AromaticContact CG-CE1 3.95Å; F1620-F1657 HydrophobicContact CG-CE1 3.95Å; F1620-F1657 HydrophobicContact CZ-CE1 4.36Å; A1641-F1657 HydrophobicContact CB-CD1 4.17Å; A1641-F1657 HydrophobicContact CB-CE1 4.43Å; L1642-F1657 HydrophobicContact CB-CE1 4.15Å; L1642-F1657 HydrophobicContact CB-CZ 4.35Å; L1642-F1657 HydrophobicContact CD2-CE1 4.48Å; L1642-F1657 HydrophobicContact CD2-CZ 4.05Å; V1652-F1657 HydrophobicContact CG1-CE2 4.35Å; V1652-F1657 HydrophobicContact CG1-CZ 4.22Å; N1655-F1657 HydrophobicContact CB-CD2 4.3Å; N1655-F1657 HydrophobicContact CB-CE2 3.67Å; N1655-F1657 HydrophobicContact CB-CZ 3.88Å; F1657-E1665 HydrophobicContact CB-CB 4.1Å; F1657-E1665 HydrophobicContact CB-CG 4.03Å; F1657-E1665 HydrophobicContact CD1-CB 4.47Å; F1657-E1665 HydrophobicContact CG-CB 4.34Å; F1657-V1666 HydrophobicContact CD2-CG2 4.41Å; F1657-V1666 HydrophobicContact CE1-CG2 4.31Å; F1657-V1666 HydrophobicContact CE2-CG2 4.02Å; F1657-V1666 HydrophobicContact CZ-CG2 3.94Å; F1657-N1684 HydrophobicContact CD2-CB 4.19Å; F1657-N1684 HydrophobicContact CE2-CB 4.09Å; F1657-Y1685 WeakPolarHBondContact CA-O 3.43Å; F1657-Y1685 VanDerWaalsContact CB-O 3.31Å; F1657-Y1685 WeakPolarHBondContact CB-O 3.29Å; F1657-Y1685 PolarHBondContact N-O 3.23Å; F1657-F1686 HydrophobicContact CB-CD1 4.31Å; F1657-F1686 HydrophobicContact CD2-CD1 4.19Å; F1657-F1686 AromaticContact CD2-CE1 3.91Å; F1657-F1686 HydrophobicContact CD2-CE1 4.08Å; F1657-F1686 HydrophobicContact CE2-CE1 4.45Å; F1657-F1686 CarbonylContact O-C 3.57Å; F1657-F1686 VanDerWaalsContact O-CA 3.31Å; F1657-F1686 WeakPolarHBondContact O-CA 3.32Å; F1657-G1687 PolarHBondContact O-N 2.8Å
1658	R	90.8	Very high	90.6	Very high	82 Å²	82	26 Å²	26	31%	0.309	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	82.3	174.8	-171.5	-170.8	94.2	-174.9	5.2	109.7	F1620 F1621 D1622 E1719	F1620-R1658 CarbonylContact O-C 3.5Å; F1620-R1658 PolarHBondContact O-N 2.98Å; F1621-R1658 CarbonylContact C-O 3.47Å; F1621-R1658 WeakPolarHBondContact CA-O 3.32Å; F1621-R1658 HydrophobicContact CD1-CB 3.94Å; F1621-R1658 HydrophobicContact CE1-CB 4.27Å; D1622-R1658 PolarHBondContact N-O 3.05Å; D1622-R1658 IonicContact OD1-CZ 3.34Å; D1622-R1658 IonicContact OD1-NE 3.14Å; D1622-R1658 IonicContact OD1-NH2 3.56Å; D1622-R1658 PolarHBondContact OD1-NH2 2.83Å; D1622-R1658 IonicContact OD2-NH2 3.35Å; D1622-R1658 PolarHBondContact OD2-NH2 2.94Å; R1658-E1719 WeakPolarHBondContact CD-OE2 3.39Å; R1658-E1719 IonicContact CZ-OE2 3.07Å; R1658-E1719 IonicContact NH1-OE1 3.54Å; R1658-E1719 PolarHBondContact NH1-OE1 3Å; R1658-E1719 IonicContact NH1-OE2 3.36Å; R1658-E1719 PolarHBondContact NH1-OE2 2.91Å
1659	N	90.4	Very high	90.5	Very high	1.2 Å²	1.2	25.8 Å²	25.8	1%	0.006	13%	0.129	C	C	.	.			trans	-128.4	87.9	-178.7	-55.8	-70.8	0	0	0	110.3	F1620 F1621 D1622 N1623 L1661 L1662 E1665 R1697	F1620-N1659 PolarHBondContact O-ND2 2.88Å; F1620-N1659 VanDerWaalsContact O-ND2 3.1Å; F1620-N1659 PolarHBondContact O-OD1 3.22Å; F1621-N1659 VanDerWaalsContact C-OD1 3.3Å; D1622-N1659 PolarHBondContact N-OD1 2.98Å; N1623-N1659 VanDerWaalsContact CB-OD1 3.31Å; N1623-N1659 WeakPolarHBondContact CB-OD1 3.37Å; N1623-N1659 PolarHBondContact N-OD1 3.08Å; N1623-N1659 PolarHBondContact ND2-OD1 2.83Å; N1659-L1661 VanDerWaalsContact C-N 3.29Å; N1659-L1661 PolarHBondContact O-N 3.13Å; N1659-L1662 HydrophobicContact CB-CB 4.15Å; N1659-L1662 HydrophobicContact CB-CD1 3.64Å; N1659-L1662 HydrophobicContact CB-CG 3.95Å; N1659-L1662 PolarHBondContact O-N 3.15Å; N1659-E1665 WeakPolarHBondContact CA-OE1 3.37Å; N1659-E1665 WeakPolarHBondContact CB-OE1 2.97Å; N1659-E1665 PolarHBondContact N-OE1 3.05Å; N1659-E1665 PolarHBondContact ND2-OE2 3.25Å; N1659-R1697 VanDerWaalsContact C-NH2 3.26Å; N1659-R1697 PolarHBondContact O-NH2 2.87Å
1660	T	84.5	Confident	90.5	Very high	93.8 Å²	93.8	22.6 Å²	22.6	58%	0.575	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.1	-175.2	55.9	0	0	0	0	114.3
1661	L	88	Confident	90	Very high	83.4 Å²	83.4	25.5 Å²	25.5	44%	0.437	12%	0.123	S	C	.	.	B	Isolated β-bridge	trans	-104	12.6	-176.9	-61.5	178	0	0	0	113.2	Y1624 F1625 L1626 P1628 N1659	Y1624-L1661 VanDerWaalsContact CB-CB 3.45Å; Y1624-L1661 HydrophobicContact CG-CD1 4.37Å; F1625-L1661 PolarHBondContact N-O 3.03Å; F1625-L1661 VanDerWaalsContact N-O 3.16Å; L1626-L1661 PolarHBondContact N-O 2.89Å; L1626-L1661 VanDerWaalsContact N-O 3.13Å; P1628-L1661 HydrophobicContact CG-CD2 4.29Å; N1659-L1661 VanDerWaalsContact C-N 3.29Å; N1659-L1661 PolarHBondContact O-N 3.13Å
1662	L	87.7	Confident	89.1	Confident	5.2 Å²	5.2	23.1 Å²	23.1	3%	0.027	11%	0.113	C	C	.	.	S	Bend	trans	-102.2	152.5	161.6	-64.4	176.5	0	0	0	108.3	V1596 N1623 F1625 A1641 N1659 R1697	V1596-L1662 HydrophobicContact CG2-CD1 4.4Å; N1623-L1662 HydrophobicContact CB-CD1 4.16Å; F1625-L1662 HydrophobicContact CB-CD2 3.9Å; A1641-L1662 HydrophobicContact CB-CD1 4Å; N1659-L1662 HydrophobicContact CB-CB 4.15Å; N1659-L1662 HydrophobicContact CB-CD1 3.64Å; N1659-L1662 HydrophobicContact CB-CG 3.95Å; N1659-L1662 PolarHBondContact O-N 3.15Å; L1662-R1697 PolarHBondContact O-NH1 3.22Å
1663	D	85.5	Confident	87.8	Confident	23.8 Å²	23.8	24.9 Å²	24.9	13%	0.127	13%	0.125	C	C	.	.	S	Bend	trans	-69.3	-50.3	177.8	-55.5	-55.2	0	0	0	109.9	L1626 Y1632 V1633 R1638 S1639 R1697	L1626-D1663 WeakPolarHBondContact CD1-OD1 3.44Å; Y1632-D1663 HydrophobicContact CD2-CB 4.01Å; Y1632-D1663 WeakPolarHBondContact CD2-OD1 3.42Å; Y1632-D1663 HydrophobicContact CE2-CB 3.94Å; Y1632-D1663 VanDerWaalsContact CE2-O 3.29Å; Y1632-D1663 WeakPolarHBondContact CE2-O 3.33Å; Y1632-D1663 WeakPolarHBondContact CE2-OD1 3.39Å; V1633-D1663 HydrophobicContact CG1-CB 3.93Å; V1633-D1663 VanDerWaalsContact CG1-CG 3.46Å; V1633-D1663 VanDerWaalsContact CG1-OD1 3.26Å; V1633-D1663 WeakPolarHBondContact CG1-OD1 3.36Å; V1633-D1663 PolarHBondContact N-OD1 2.84Å; R1638-D1663 VanDerWaalsContact CB-OD2 3.3Å; R1638-D1663 WeakPolarHBondContact CB-OD2 3.35Å; R1638-D1663 WeakPolarHBondContact CD-OD2 3.45Å; R1638-D1663 WeakPolarHBondContact CG-OD2 3.5Å; R1638-D1663 IonicContact CZ-OD1 2.97Å; R1638-D1663 IonicContact CZ-OD2 3.4Å; R1638-D1663 IonicContact NE-OD1 3.05Å; R1638-D1663 PolarHBondContact NE-OD1 2.84Å; R1638-D1663 IonicContact NE-OD2 3Å; R1638-D1663 PolarHBondContact NE-OD2 3.03Å; R1638-D1663 VanDerWaalsContact NE-OD2 3.16Å; R1638-D1663 IonicContact NH2-OD1 3.41Å; R1638-D1663 PolarHBondContact NH2-OD1 2.97Å; R1638-D1663 IonicContact NH2-OD2 3.42Å; S1639-D1663 WeakPolarHBondContact CB-OD2 3.4Å; S1639-D1663 PolarHBondContact N-OD2 2.99Å; S1639-D1663 VanDerWaalsContact N-OD2 3.12Å; S1639-D1663 WeakPolarHBondContact O-CB 3.47Å; S1639-D1663 VanDerWaalsContact OG-CG 3.26Å; S1639-D1663 PolarHBondContact OG-N 3.05Å; S1639-D1663 PolarHBondContact OG-OD2 2.85Å; D1663-R1697 PolarHBondContact O-NH1 3.29Å; D1663-R1697 VanDerWaalsContact O-NH1 3.08Å
1664	F	90.5	Very high	86.5	Confident	9.8 Å²	9.8	27.1 Å²	27.1	4%	0.043	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	153.5	-178.1	-56.5	-79.2	0	0	0	112.2	Y1632 P1637 S1639 F1640 A1641 V1667 Q1696 R1697 F1699	Y1632-F1664 HydrophobicContact CE2-CE1 4.44Å; Y1632-F1664 HydrophobicContact CE2-CE2 4.45Å; Y1632-F1664 HydrophobicContact CE2-CZ 4.19Å; Y1632-F1664 AromaticContact CZ-CZ 3.91Å; Y1632-F1664 WeakPolarHBondContact OH-CE1 3.17Å; Y1632-F1664 WeakPolarHBondContact OH-CZ 3.12Å; P1637-F1664 HydrophobicContact CB-CD2 3.98Å; P1637-F1664 HydrophobicContact CB-CE2 4.22Å; S1639-F1664 PolarHBondContact O-N 3Å; S1639-F1664 VanDerWaalsContact O-N 3.12Å; F1640-F1664 CarbonylContact C-O 3.35Å; F1640-F1664 WeakPolarHBondContact CA-O 3.37Å; F1640-F1664 HydrophobicContact CB-CB 4.15Å; A1641-F1664 PolarHBondContact N-O 3.01Å; A1641-F1664 VanDerWaalsContact N-O 3.1Å; F1664-V1667 HydrophobicContact CB-CG2 4.44Å; F1664-Q1696 WeakPolarHBondContact CE1-O 3.4Å; F1664-R1697 CarbonylContact C-O 3.55Å; F1664-R1697 WeakPolarHBondContact CA-O 3.44Å; F1664-F1699 HydrophobicContact CB-CB 4.47Å; F1664-F1699 HydrophobicContact CD1-CB 4Å; F1664-F1699 HydrophobicContact CD1-CD2 4.32Å; F1664-F1699 HydrophobicContact CD2-CB 4.36Å; F1664-F1699 HydrophobicContact CD2-CD2 4.37Å; F1664-F1699 HydrophobicContact CE1-CB 4.3Å; F1664-F1699 AromaticContact CE1-CD2 3.83Å; F1664-F1699 HydrophobicContact CE1-CD2 3.83Å; F1664-F1699 HydrophobicContact CE1-CG 4.42Å; F1664-F1699 AromaticContact CE2-CD2 3.9Å; F1664-F1699 HydrophobicContact CE2-CD2 3.9Å; F1664-F1699 HydrophobicContact CE2-CE2 4.39Å; F1664-F1699 HydrophobicContact CG-CB 4.13Å; F1664-F1699 HydrophobicContact CG-CD2 4.45Å; F1664-F1699 AromaticContact CZ-CD2 3.61Å; F1664-F1699 HydrophobicContact CZ-CD2 3.61Å; F1664-F1699 VanDerWaalsContact CZ-CD2 3.47Å; F1664-F1699 HydrophobicContact CZ-CE2 4.25Å; F1664-F1699 HydrophobicContact CZ-CG 4.48Å
1665	E	92.4	Very high	85.1	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.009	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-48.4	170.1	-64	-67.5	-178.1	0	0	110.3	A1641 L1642 F1657 N1659 F1686 R1697	A1641-E1665 CarbonylContact C-O 3.48Å; A1641-E1665 WeakPolarHBondContact CA-O 3.34Å; A1641-E1665 VanDerWaalsContact CB-O 3.29Å; A1641-E1665 WeakPolarHBondContact CB-O 3.33Å; A1641-E1665 WeakPolarHBondContact CB-OE2 3.2Å; A1641-E1665 PolarHBondContact N-O 3.07Å; A1641-E1665 VanDerWaalsContact N-O 3.17Å; L1642-E1665 PolarHBondContact N-O 3.08Å; F1657-E1665 HydrophobicContact CB-CB 4.1Å; F1657-E1665 HydrophobicContact CB-CG 4.03Å; F1657-E1665 HydrophobicContact CD1-CB 4.47Å; F1657-E1665 HydrophobicContact CG-CB 4.34Å; N1659-E1665 WeakPolarHBondContact CA-OE1 3.37Å; N1659-E1665 WeakPolarHBondContact CB-OE1 2.97Å; N1659-E1665 PolarHBondContact N-OE1 3.05Å; N1659-E1665 PolarHBondContact ND2-OE2 3.25Å; E1665-F1686 HydrophobicContact CB-CD1 4.17Å; E1665-F1686 HydrophobicContact CB-CE1 4.46Å; E1665-F1686 HydrophobicContact CG-CD1 4.42Å; E1665-R1697 HydrophobicContact CB-CB 4.49Å; E1665-R1697 HydrophobicContact CG-CB 4.08Å; E1665-R1697 HydrophobicContact CG-CG 4.5Å; E1665-R1697 PolarHBondContact N-O 3.09Å; E1665-R1697 IonicContact OE1-CZ 3.46Å; E1665-R1697 IonicContact OE1-NE 3.95Å; E1665-R1697 IonicContact OE1-NH1 3.12Å; E1665-R1697 PolarHBondContact OE1-NH1 3.21Å; E1665-R1697 IonicContact OE1-NH2 2.7Å; E1665-R1697 PolarHBondContact OE1-NH2 2.86Å
1666	V	93.6	Very high	83.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134.9	-177.4	-174.5	0	0	0	0	111.4	L1642 F1657 I1681 F1686 R1697 I1698 F1699	L1642-V1666 HydrophobicContact CB-CG2 4.33Å; L1642-V1666 HydrophobicContact CD2-CG1 4.43Å; L1642-V1666 HydrophobicContact CD2-CG2 4.46Å; L1642-V1666 HydrophobicContact CG-CG1 4.5Å; L1642-V1666 CarbonylContact O-C 3.42Å; L1642-V1666 VanDerWaalsContact O-CA 3.24Å; L1642-V1666 WeakPolarHBondContact O-CA 3.38Å; F1657-V1666 HydrophobicContact CD2-CG2 4.41Å; F1657-V1666 HydrophobicContact CE1-CG2 4.31Å; F1657-V1666 HydrophobicContact CE2-CG2 4.02Å; F1657-V1666 HydrophobicContact CZ-CG2 3.94Å; V1666-I1681 HydrophobicContact CG1-CD1 3.73Å; V1666-I1681 HydrophobicContact CG1-CG1 4.48Å; V1666-I1681 HydrophobicContact CG1-CG2 4.39Å; V1666-I1681 HydrophobicContact CG2-CG2 4.37Å; V1666-F1686 HydrophobicContact CG2-CE1 3.97Å; V1666-R1697 PolarHBondContact N-O 3.11Å; V1666-I1698 CarbonylContact O-C 3.19Å; V1666-I1698 WeakPolarHBondContact O-CA 3.33Å; V1666-F1699 PolarHBondContact O-N 3.22Å
1667	V	92.8	Very high	83.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	116.3	172.6	-176.8	0	0	0	0	109.4	P1637 F1640 L1642 L1644 F1645 F1664 G1669 F1699 F1707	P1637-V1667 HydrophobicContact CB-CG1 4.46Å; P1637-V1667 HydrophobicContact CB-CG2 3.96Å; P1637-V1667 HydrophobicContact CG-CG1 4.42Å; P1637-V1667 HydrophobicContact CG-CG2 4.01Å; F1640-V1667 HydrophobicContact CB-CG2 3.59Å; F1640-V1667 HydrophobicContact CD1-CG2 3.77Å; F1640-V1667 HydrophobicContact CD2-CG2 4.21Å; F1640-V1667 HydrophobicContact CE1-CG2 4.38Å; F1640-V1667 HydrophobicContact CG-CB 4.47Å; F1640-V1667 HydrophobicContact CG-CG2 3.59Å; L1642-V1667 PolarHBondContact O-N 3.01Å; L1644-V1667 PolarHBondContact N-O 3.07Å; F1645-V1667 HydrophobicContact CE1-CG1 3.74Å; F1645-V1667 HydrophobicContact CZ-CB 4.16Å; F1645-V1667 HydrophobicContact CZ-CG1 3.66Å; F1664-V1667 HydrophobicContact CB-CG2 4.44Å; V1667-G1669 VanDerWaalsContact C-N 3.31Å; V1667-G1669 PolarHBondContact O-N 3.1Å; V1667-G1669 VanDerWaalsContact O-N 3.16Å; V1667-F1699 CarbonylContact C-O 3.49Å; V1667-F1699 WeakPolarHBondContact CA-O 3.31Å; V1667-F1699 HydrophobicContact CB-CB 4.3Å; V1667-F1699 HydrophobicContact CG1-CB 4.13Å; V1667-F1699 HydrophobicContact CG1-CD1 3.99Å; V1667-F1699 HydrophobicContact CG1-CG 4.39Å; V1667-F1699 HydrophobicContact CG2-CB 3.96Å; V1667-F1707 HydrophobicContact CG1-CD2 4.5Å; V1667-F1707 HydrophobicContact CG1-CE2 4.1Å
1668	A	91.8	Very high	82.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.			trans	-92.3	53.8	-178.7	0	0	0	0	0	112.4	L1670 A1679 I1681 F1699 D1700 F1707 C1708 A1710	A1668-L1670 VanDerWaalsContact C-N 3.26Å; A1668-L1670 PolarHBondContact O-N 3Å; A1668-L1670 VanDerWaalsContact O-N 3.08Å; A1668-A1679 HydrophobicContact CB-CB 4.27Å; A1668-I1681 HydrophobicContact CB-CD1 4.31Å; A1668-F1699 PolarHBondContact N-O 3.08Å; A1668-D1700 HydrophobicContact CB-CB 4.07Å; A1668-F1707 WeakPolarHBondContact O-CB 3.4Å; A1668-C1708 PolarHBondContact O-N 2.99Å; A1668-C1708 VanDerWaalsContact O-N 3.12Å; A1668-C1708 PolarHBondContact O-SG 3.15Å; A1668-A1710 HydrophobicContact CB-CB 4.19Å
1669	G	87.8	Confident	82.6	Confident	2.6 Å²	2.6	36.9 Å²	36.9	3%	0.027	19%	0.19	C	C	.	.			trans	-76.5	29.7	-175.3	0	0	0	0	0	117.4	L1644 F1645 G1646 V1667 R1671 F1707	L1644-G1669 CarbonylContact O-C 3.52Å; L1644-G1669 WeakPolarHBondContact O-CA 3.28Å; L1644-G1669 PolarHBondContact O-N 2.91Å; F1645-G1669 WeakPolarHBondContact CA-O 3.27Å; G1646-G1669 PolarHBondContact N-O 2.92Å; V1667-G1669 VanDerWaalsContact C-N 3.31Å; V1667-G1669 PolarHBondContact O-N 3.1Å; V1667-G1669 VanDerWaalsContact O-N 3.16Å; G1669-R1671 PolarHBondContact O-N 2.76Å; G1669-F1707 VanDerWaalsContact CA-CD1 3.43Å
1670	L	87.7	Confident	82.6	Confident	3.4 Å²	3.4	39.3 Å²	39.3	2%	0.018	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-72.9	139	178.4	-60.2	175.8	0	0	0	110.8	L1644 G1646 Q1648 N1649 A1668 T1672 A1679 F1707 C1708 V2125	L1644-L1670 HydrophobicContact CB-CD2 4.11Å; L1644-L1670 HydrophobicContact CB-CG 4.2Å; L1644-L1670 PolarHBondContact O-N 3.1Å; L1644-L1670 VanDerWaalsContact O-N 3.15Å; G1646-L1670 CarbonylContact O-C 3.52Å; G1646-L1670 WeakPolarHBondContact O-CA 3.3Å; Q1648-L1670 WeakPolarHBondContact O-CD2 3.36Å; N1649-L1670 HydrophobicContact CB-CD1 4.44Å; A1668-L1670 VanDerWaalsContact C-N 3.26Å; A1668-L1670 PolarHBondContact O-N 3Å; A1668-L1670 VanDerWaalsContact O-N 3.08Å; L1670-T1672 HydrophobicContact CB-CG2 4.34Å; L1670-T1672 PolarHBondContact O-N 2.94Å; L1670-A1679 HydrophobicContact CD1-CB 4.17Å; L1670-F1707 CarbonylContact O-C 3.5Å; L1670-C1708 HydrophobicContact CB-CB 3.95Å; L1670-C1708 PolarHBondContact O-N 3Å; L1670-V2125 HydrophobicContact CB-CG2 3.88Å; L1670-V2125 HydrophobicContact CD1-CG2 4.47Å
1671	R	80.5	Confident	83	Confident	61.8 Å²	61.8	34.8 Å²	34.8	23%	0.233	18%	0.175	C	C	.	.			trans	-85.4	107.7	178.8	-67.4	-173.3	-178.6	176.6	1	110.1	G1646 G1669 Y2115 E2121 V2125 Y2144	G1646-R1671 PolarHBondContact O-N 2.98Å; G1669-R1671 PolarHBondContact O-N 2.76Å; R1671-Y2115 PolarHBondContact NH2-OH 3Å; R1671-E2121 IonicContact CZ-OE1 3.19Å; R1671-E2121 IonicContact NH1-OE1 3.03Å; R1671-E2121 PolarHBondContact NH1-OE1 3.03Å; R1671-V2125 WeakPolarHBondContact O-CG2 3.24Å; R1671-V2125 PolarHBondContact O-N 3.2Å; R1671-V2125 VanDerWaalsContact O-N 3.16Å; R1671-Y2144 PolarHBondContact NH2-OH 3.29Å; R1671-Y2144 VanDerWaalsContact NH2-OH 3.09Å
1672	T	73.4	Confident	83.1	Confident	30.6 Å²	30.6	31.3 Å²	31.3	19%	0.188	16%	0.157	C	C	.	.			trans	-116.6	144.6	176.4	91.6	0	0	0	0	110.8	L1670 M1674 S1677 C1708 V2125	L1670-T1672 HydrophobicContact CB-CG2 4.34Å; L1670-T1672 PolarHBondContact O-N 2.94Å; T1672-M1674 PolarHBondContact OG1-N 3.09Å; T1672-M1674 VanDerWaalsContact OG1-N 3.09Å; T1672-M1674 PolarHBondContact OG1-O 2.99Å; T1672-M1674 VanDerWaalsContact OG1-O 3.05Å; T1672-S1677 VanDerWaalsContact CB-OG 3.27Å; T1672-S1677 WeakPolarHBondContact CB-OG 3.33Å; T1672-S1677 WeakPolarHBondContact CG2-OG 3.39Å; T1672-S1677 PolarHBondContact OG1-OG 2.84Å; T1672-C1708 HydrophobicContact CG2-CB 3.72Å; T1672-V2125 HydrophobicContact CG2-CG2 4.39Å
1673	T	65.4	Low	83.3	Confident	39.2 Å²	39.2	33.5 Å²	33.5	24%	0.24	17%	0.168	C	C	.	.	S	Bend	trans	-92.4	-16	173.8	49.1	0	0	0	0	111.8	I2120 E2121	T1673-I2120 HydrophobicContact CG2-CB 4.44Å; T1673-I2120 HydrophobicContact CG2-CG2 4.14Å; T1673-E2121 HydrophobicContact CG2-CB 3.89Å
1674	M	65.2	Low	83.5	Confident	74 Å²	74	32.4 Å²	32.4	37%	0.365	16%	0.161	S	C	.	.	S	Bend	trans	-122.1	137	-177.2	-63.2	-169	169.4	0	0	110.7	T1672 L1676 S1677 V2014 I2120 I2129	T1672-M1674 PolarHBondContact OG1-N 3.09Å; T1672-M1674 VanDerWaalsContact OG1-N 3.09Å; T1672-M1674 PolarHBondContact OG1-O 2.99Å; T1672-M1674 VanDerWaalsContact OG1-O 3.05Å; M1674-L1676 HydrophobicContact CB-CD1 4.25Å; M1674-L1676 HydrophobicContact CB-CG 4.22Å; M1674-L1676 PolarHBondContact O-N 2.89Å; M1674-L1676 VanDerWaalsContact O-N 3.08Å; M1674-L1676 HydrophobicContact SD-CD1 3.9Å; M1674-S1677 PolarHBondContact O-N 3.04Å; M1674-S1677 VanDerWaalsContact O-N 3.08Å; M1674-S1677 PolarHBondContact O-OG 3.28Å; M1674-V2014 HydrophobicContact CE-CB 3.83Å; M1674-V2014 HydrophobicContact CE-CG2 3.32Å; M1674-V2014 HydrophobicContact CG-CG2 4.13Å; M1674-V2014 HydrophobicContact SD-CG2 4.09Å; M1674-I2120 HydrophobicContact CE-CD1 4.05Å; M1674-I2129 HydrophobicContact CE-CG2 4.21Å
1675	F	61.9	Low	83.5	Confident	69.2 Å²	69.2	33.1 Å²	33.1	30%	0.304	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-13.2	174.5	-155.6	-92.2	0	0	0	114.5	S1677 F1701 L1709 R1750 Y1752 T1784 M1786 L1808 L1810 Y2117	F1675-S1677 VanDerWaalsContact C-N 3.34Å; F1675-F1701 HydrophobicContact CD2-CE1 4.36Å; F1675-F1701 HydrophobicContact CD2-CE2 4.32Å; F1675-F1701 HydrophobicContact CD2-CZ 4.27Å; F1675-F1701 AromaticContact CE1-CE1 3.93Å; F1675-F1701 HydrophobicContact CE1-CE1 3.93Å; F1675-F1701 AromaticContact CE1-CE2 3.78Å; F1675-F1701 HydrophobicContact CE1-CE2 3.78Å; F1675-F1701 AromaticContact CE1-CZ 3.4Å; F1675-F1701 HydrophobicContact CE1-CZ 3.4Å; F1675-F1701 AromaticContact CE2-CD1 3.69Å; F1675-F1701 HydrophobicContact CE2-CD1 4.02Å; F1675-F1701 HydrophobicContact CE2-CD2 4.32Å; F1675-F1701 AromaticContact CE2-CE1 3.75Å; F1675-F1701 HydrophobicContact CE2-CE1 4.06Å; F1675-F1701 AromaticContact CE2-CE2 3.88Å; F1675-F1701 HydrophobicContact CE2-CE2 4.01Å; F1675-F1701 HydrophobicContact CE2-CG 4.12Å; F1675-F1701 AromaticContact CE2-CZ 3.67Å; F1675-F1701 HydrophobicContact CE2-CZ 3.9Å; F1675-F1701 HydrophobicContact CZ-CD1 4.39Å; F1675-F1701 HydrophobicContact CZ-CE2 4.33Å; F1675-F1701 AromaticContact CZ-CZ 3.92Å; F1675-F1701 HydrophobicContact CZ-CZ 4.07Å; F1675-L1709 HydrophobicContact CE1-CD2 4.4Å; F1675-L1709 HydrophobicContact CZ-CD2 4.38Å; F1675-R1750 VanDerWaalsContact CE2-CD 3.44Å; F1675-R1750 HydrophobicContact CE2-CG 4.3Å; F1675-R1750 HydrophobicContact CZ-CG 4.36Å; F1675-Y1752 WeakPolarHBondContact CZ-OH 3.2Å; F1675-T1784 HydrophobicContact CZ-CG2 4.37Å; F1675-M1786 HydrophobicContact CD1-CE 4.04Å; F1675-M1786 HydrophobicContact CD2-CE 4.06Å; F1675-M1786 HydrophobicContact CE1-CE 3.81Å; F1675-M1786 HydrophobicContact CE1-SD 4.24Å; F1675-M1786 HydrophobicContact CE2-CE 3.81Å; F1675-M1786 HydrophobicContact CE2-SD 4.24Å; F1675-M1786 HydrophobicContact CG-CE 4.24Å; F1675-M1786 HydrophobicContact CZ-CE 3.82Å; F1675-M1786 VanDerWaalsContact CZ-CE 3.47Å; F1675-M1786 HydrophobicContact CZ-SD 4.19Å; F1675-L1808 HydrophobicContact CZ-CD2 4.5Å; F1675-L1810 HydrophobicContact CD2-CD1 4.35Å; F1675-L1810 HydrophobicContact CE1-CD1 4.18Å; F1675-L1810 HydrophobicContact CE2-CD1 3.17Å; F1675-L1810 HydrophobicContact CE2-CD2 3.78Å; F1675-L1810 HydrophobicContact CE2-CG 4.03Å; F1675-L1810 HydrophobicContact CZ-CD1 3.12Å; F1675-L1810 HydrophobicContact CZ-CD2 4.24Å; F1675-L1810 HydrophobicContact CZ-CG 4.22Å; F1675-Y2117 PolarHBondContact N-OH 3.18Å
1676	L	67.6	Low	83.4	Confident	143.8 Å²	143.8	33.1 Å²	33.1	75%	0.753	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-26	-174	-68.4	170.1	0	0	0	113.7	M1674 K1678	M1674-L1676 HydrophobicContact CB-CD1 4.25Å; M1674-L1676 HydrophobicContact CB-CG 4.22Å; M1674-L1676 PolarHBondContact O-N 2.89Å; M1674-L1676 VanDerWaalsContact O-N 3.08Å; M1674-L1676 HydrophobicContact SD-CD1 3.9Å; L1676-K1678 PolarHBondContact O-N 2.97Å
1677	S	75.4	Confident	82.9	Confident	23 Å²	23	34.1 Å²	34.1	16%	0.161	18%	0.175	C	C	.	.			trans	-76.4	124.8	-177.9	40.1	0	0	0	0	110.4	T1672 M1674 F1675 C1708 D2126	T1672-S1677 VanDerWaalsContact CB-OG 3.27Å; T1672-S1677 WeakPolarHBondContact CB-OG 3.33Å; T1672-S1677 WeakPolarHBondContact CG2-OG 3.39Å; T1672-S1677 PolarHBondContact OG1-OG 2.84Å; M1674-S1677 PolarHBondContact O-N 3.04Å; M1674-S1677 VanDerWaalsContact O-N 3.08Å; M1674-S1677 PolarHBondContact O-OG 3.28Å; F1675-S1677 VanDerWaalsContact C-N 3.34Å; S1677-C1708 PolarHBondContact O-SG 3Å; S1677-D2126 PolarHBondContact OG-OD1 2.83Å; S1677-D2126 PolarHBondContact OG-OD2 3.15Å; S1677-D2126 VanDerWaalsContact OG-OD2 3.12Å
1678	K	84.9	Confident	82.2	Confident	108 Å²	108	38.5 Å²	38.5	47%	0.47	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.7	179.7	-57.1	-174.3	-176.3	-176.4	0	110.3	L1676 C1708 L1709 N1711	L1676-K1678 PolarHBondContact O-N 2.97Å; K1678-C1708 VanDerWaalsContact C-SG 3.57Å; K1678-C1708 VanDerWaalsContact CA-SG 3.56Å; K1678-L1709 CarbonylContact C-O 3.59Å; K1678-L1709 VanDerWaalsContact CA-O 3.31Å; K1678-L1709 WeakPolarHBondContact CA-O 3.35Å; K1678-L1709 WeakPolarHBondContact CB-O 3.27Å; K1678-L1709 HydrophobicContact CD-CD2 4.05Å; K1678-L1709 HydrophobicContact CG-CB 4.33Å; K1678-L1709 HydrophobicContact CG-CD2 4.34Å; K1678-N1711 HydrophobicContact CB-CB 4.33Å; K1678-N1711 HydrophobicContact CD-CB 4.46Å
1679	A	87.8	Confident	81.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.3	168.8	0	0	0	0	0	108.8	L1644 A1668 L1670 I1681 C1708 L1709 N1711	L1644-A1679 HydrophobicContact CD1-CB 4.4Å; A1668-A1679 HydrophobicContact CB-CB 4.27Å; L1670-A1679 HydrophobicContact CD1-CB 4.17Å; A1679-I1681 HydrophobicContact CB-CD1 4.11Å; A1679-I1681 HydrophobicContact CB-CG1 4.32Å; A1679-I1681 PolarHBondContact O-N 3.13Å; A1679-C1708 WeakPolarHBondContact CB-SG 3.25Å; A1679-C1708 PolarHBondContact N-SG 3.01Å; A1679-L1709 PolarHBondContact N-O 3.28Å; A1679-N1711 WeakPolarHBondContact O-CB 3.37Å; A1679-N1711 PolarHBondContact O-N 3.11Å
1680	N	90.5	Very high	80.9	Confident	51.6 Å²	51.6	47 Å²	47	28%	0.276	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	103.7	-177.9	-166.2	6	0	0	0	110.4	V1652 H1653 S1682	V1652-N1680 PolarHBondContact N-O 2.97Å; V1652-N1680 VanDerWaalsContact N-O 3.1Å; H1653-N1680 VanDerWaalsContact CE1-CG 3.41Å; H1653-N1680 PolarHBondContact CE1-ND2 2.92Å; H1653-N1680 VanDerWaalsContact CE1-ND2 3.29Å; H1653-N1680 PolarHBondContact CE1-OD1 3.09Å; H1653-N1680 VanDerWaalsContact CE1-OD1 3.28Å; H1653-N1680 PolarHBondContact NE2-ND2 2.99Å; N1680-S1682 PolarHBondContact OD1-OG 3.11Å; N1680-S1682 VanDerWaalsContact OD1-OG 3.05Å
1681	I	91.7	Very high	80.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.263	C	S	.	.			trans	-122	33.9	-177	-50.1	159.4	0	0	0	109.2	V1652 V1666 A1668 A1679 N1684 F1686 A1710 N1711	V1652-I1681 HydrophobicContact CB-CB 4.49Å; V1652-I1681 HydrophobicContact CB-CG1 4.35Å; V1652-I1681 HydrophobicContact CB-CG2 4.2Å; V1652-I1681 HydrophobicContact CG1-CG2 4.13Å; V1652-I1681 HydrophobicContact CG2-CG1 4.49Å; V1652-I1681 CarbonylContact O-C 3.56Å; V1652-I1681 VanDerWaalsContact O-CA 3.3Å; V1652-I1681 WeakPolarHBondContact O-CA 3.28Å; V1666-I1681 HydrophobicContact CG1-CD1 3.73Å; V1666-I1681 HydrophobicContact CG1-CG1 4.48Å; V1666-I1681 HydrophobicContact CG1-CG2 4.39Å; V1666-I1681 HydrophobicContact CG2-CG2 4.37Å; A1668-I1681 HydrophobicContact CB-CD1 4.31Å; A1679-I1681 HydrophobicContact CB-CD1 4.11Å; A1679-I1681 HydrophobicContact CB-CG1 4.32Å; A1679-I1681 PolarHBondContact O-N 3.13Å; I1681-N1684 VanDerWaalsContact C-ND2 3.28Å; I1681-N1684 WeakPolarHBondContact CG2-ND2 3.36Å; I1681-N1684 PolarHBondContact O-ND2 3.02Å; I1681-F1686 HydrophobicContact CG2-CE1 4.44Å; I1681-F1686 HydrophobicContact CG2-CZ 4.03Å; I1681-A1710 HydrophobicContact CD1-CB 3.78Å; I1681-N1711 CarbonylContact C-O 3.48Å; I1681-N1711 VanDerWaalsContact C-O 3.22Å; I1681-N1711 WeakPolarHBondContact CA-O 3.33Å; I1681-N1711 PolarHBondContact N-O 3.02Å
1682	S	91.1	Very high	80.6	Confident	9.2 Å²	9.2	52.3 Å²	52.3	6%	0.064	28%	0.275	C	S	.	.			trans	-77.9	160.7	179.6	61	0	0	0	0	112.3	H1653 N1680 N1684 N1711 N1713	H1653-S1682 WeakPolarHBondContact CA-O 3.45Å; H1653-S1682 PolarHBondContact CE1-OG 3.06Å; H1653-S1682 PolarHBondContact ND1-O 2.98Å; H1653-S1682 PolarHBondContact ND1-OG 3.19Å; H1653-S1682 VanDerWaalsContact ND1-OG 3.17Å; N1680-S1682 PolarHBondContact OD1-OG 3.11Å; N1680-S1682 VanDerWaalsContact OD1-OG 3.05Å; S1682-N1684 PolarHBondContact O-N 2.89Å; S1682-N1684 PolarHBondContact O-ND2 3.15Å; S1682-N1711 PolarHBondContact N-O 3.12Å; S1682-N1711 VanDerWaalsContact N-O 3.16Å; S1682-N1713 VanDerWaalsContact CB-O 3.29Å; S1682-N1713 WeakPolarHBondContact CB-O 3.35Å
1683	H	91	Very high	81	Confident	52 Å²	52	51.1 Å²	51.1	24%	0.241	27%	0.27	C	S	.	.	S	Bend	trans	59.1	43	177.9	-54.4	81.9	0	0	0	113.3	F1654 P1714 F1716	F1654-H1683 WeakPolarHBondContact CA-O 3.31Å; F1654-H1683 HydrophobicContact CD1-CB 3.91Å; F1654-H1683 HydrophobicContact CE1-CB 3.71Å; F1654-H1683 AromaticContact CE1-CG 3.96Å; F1654-H1683 HydrophobicContact CG-CB 4.46Å; F1654-H1683 HydrophobicContact CZ-CB 4.28Å; F1654-H1683 PolarHBondContact N-O 3.07Å; H1683-P1714 WeakPolarHBondContact CA-O 3.4Å; H1683-P1714 PolarHBondContact N-O 3.15Å; H1683-P1714 WeakPolarHBondContact NE2-CG 3.28Å; H1683-F1716 VanDerWaalsContact C-CE2 3.49Å; H1683-F1716 HydrophobicContact CB-CE2 4.13Å; H1683-F1716 HydrophobicContact CB-CZ 3.99Å; H1683-F1716 WeakPolarHBondContact O-CD2 3.36Å; H1683-F1716 WeakPolarHBondContact O-CE2 3.38Å
1684	N	91.1	Very high	82	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.			trans	-116.7	154.3	173.4	-59.8	-67.5	0	0	0	110.6	V1652 H1653 F1654 N1655 F1657 I1681 S1682 F1686 F1716	V1652-N1684 PolarHBondContact O-ND2 3.02Å; H1653-N1684 VanDerWaalsContact C-OD1 3.28Å; H1653-N1684 WeakPolarHBondContact CA-OD1 3.26Å; F1654-N1684 PolarHBondContact N-OD1 2.96Å; N1655-N1684 WeakPolarHBondContact CB-OD1 3.26Å; N1655-N1684 PolarHBondContact N-OD1 2.81Å; N1655-N1684 PolarHBondContact ND2-OD1 2.97Å; N1655-N1684 VanDerWaalsContact ND2-OD1 3.14Å; N1655-N1684 WeakPolarHBondContact O-CA 3.32Å; F1657-N1684 HydrophobicContact CD2-CB 4.19Å; F1657-N1684 HydrophobicContact CE2-CB 4.09Å; I1681-N1684 VanDerWaalsContact C-ND2 3.28Å; I1681-N1684 WeakPolarHBondContact CG2-ND2 3.36Å; I1681-N1684 PolarHBondContact O-ND2 3.02Å; S1682-N1684 PolarHBondContact O-N 2.89Å; S1682-N1684 PolarHBondContact O-ND2 3.15Å; N1684-F1686 HydrophobicContact CB-CE1 4.47Å; N1684-F1686 HydrophobicContact CB-CE2 3.94Å; N1684-F1686 HydrophobicContact CB-CZ 3.93Å; N1684-F1716 PolarHBondContact O-N 3.09Å
1685	Y	90.7	Very high	82.9	Confident	24.6 Å²	24.6	49.7 Å²	49.7	10%	0.096	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-98.5	133.7	170.2	176.9	-102.2	0	0	0	109.2	N1655 N1656 F1657 G1687 F1716 V1717 T1718 E1719	N1655-Y1685 PolarHBondContact O-N 3.23Å; N1656-Y1685 VanDerWaalsContact OD1-CD1 3.26Å; N1656-Y1685 WeakPolarHBondContact OD1-CD1 3.27Å; F1657-Y1685 WeakPolarHBondContact CA-O 3.43Å; F1657-Y1685 VanDerWaalsContact CB-O 3.31Å; F1657-Y1685 WeakPolarHBondContact CB-O 3.29Å; F1657-Y1685 PolarHBondContact N-O 3.23Å; Y1685-G1687 VanDerWaalsContact CE1-CA 3.44Å; Y1685-G1687 VanDerWaalsContact CE1-N 3.3Å; Y1685-G1687 VanDerWaalsContact CZ-CA 3.45Å; Y1685-G1687 VanDerWaalsContact OH-C 3.31Å; Y1685-G1687 WeakPolarHBondContact OH-CA 3.45Å; Y1685-F1716 HydrophobicContact CD2-CB 4.39Å; Y1685-F1716 WeakPolarHBondContact CD2-O 3.24Å; Y1685-V1717 WeakPolarHBondContact CE2-O 3.33Å; Y1685-T1718 VanDerWaalsContact CD2-C 3.45Å; Y1685-T1718 WeakPolarHBondContact CD2-O 3.4Å; Y1685-T1718 VanDerWaalsContact CE2-C 3.45Å; Y1685-E1719 HydrophobicContact CD1-CB 4.33Å; Y1685-E1719 HydrophobicContact CD1-CG 4.3Å; Y1685-E1719 HydrophobicContact CE1-CB 3.91Å; Y1685-E1719 HydrophobicContact CE1-CG 3.97Å; Y1685-E1719 HydrophobicContact CE2-CB 4.31Å
1686	F	89.3	Confident	84	Confident	2.4 Å²	2.4	52.1 Å²	52.1	1%	0.011	27%	0.274	C	S	.	.			trans	-116	13.7	-174.7	-65.7	-81.6	0	0	0	114.3	F1657 E1665 V1666 I1681 N1684 Q1688 V1694 R1697 I1698 V1712	F1657-F1686 HydrophobicContact CB-CD1 4.31Å; F1657-F1686 HydrophobicContact CD2-CD1 4.19Å; F1657-F1686 AromaticContact CD2-CE1 3.91Å; F1657-F1686 HydrophobicContact CD2-CE1 4.08Å; F1657-F1686 HydrophobicContact CE2-CE1 4.45Å; F1657-F1686 CarbonylContact O-C 3.57Å; F1657-F1686 VanDerWaalsContact O-CA 3.31Å; F1657-F1686 WeakPolarHBondContact O-CA 3.32Å; E1665-F1686 HydrophobicContact CB-CD1 4.17Å; E1665-F1686 HydrophobicContact CB-CE1 4.46Å; E1665-F1686 HydrophobicContact CG-CD1 4.42Å; V1666-F1686 HydrophobicContact CG2-CE1 3.97Å; I1681-F1686 HydrophobicContact CG2-CE1 4.44Å; I1681-F1686 HydrophobicContact CG2-CZ 4.03Å; N1684-F1686 HydrophobicContact CB-CE1 4.47Å; N1684-F1686 HydrophobicContact CB-CE2 3.94Å; N1684-F1686 HydrophobicContact CB-CZ 3.93Å; F1686-Q1688 PolarHBondContact O-N 2.98Å; F1686-Q1688 VanDerWaalsContact O-N 3.17Å; F1686-V1694 HydrophobicContact CB-CG1 4.28Å; F1686-V1694 HydrophobicContact CB-CG2 4.39Å; F1686-V1694 HydrophobicContact CD2-CG1 3.69Å; F1686-V1694 HydrophobicContact CE2-CG1 4.23Å; F1686-V1694 HydrophobicContact CG-CG1 4.07Å; F1686-R1697 PolarHBondContact O-NH1 2.98Å; F1686-I1698 HydrophobicContact CD1-CD1 4.33Å; F1686-I1698 HydrophobicContact CD1-CG1 4.36Å; F1686-I1698 HydrophobicContact CE1-CD1 3.83Å; F1686-I1698 HydrophobicContact CE1-CG1 4.03Å; F1686-I1698 HydrophobicContact CE2-CD1 4.24Å; F1686-I1698 HydrophobicContact CZ-CD1 3.74Å; F1686-I1698 HydrophobicContact CZ-CG1 4.4Å; F1686-V1712 HydrophobicContact CD2-CG1 4.41Å; F1686-V1712 HydrophobicContact CE2-CG1 3.57Å; F1686-V1712 HydrophobicContact CZ-CG1 4.05Å
1687	G	83.9	Confident	85	Confident	21.6 Å²	21.6	47.3 Å²	47.3	22%	0.223	25%	0.246	C	C	.	.	S	Bend	trans	77.2	4	178.5	0	0	0	0	0	115.1	F1657 Y1685 D1689	F1657-G1687 PolarHBondContact O-N 2.8Å; Y1685-G1687 VanDerWaalsContact CE1-CA 3.44Å; Y1685-G1687 VanDerWaalsContact CE1-N 3.3Å; Y1685-G1687 VanDerWaalsContact CZ-CA 3.45Å; Y1685-G1687 VanDerWaalsContact OH-C 3.31Å; Y1685-G1687 WeakPolarHBondContact OH-CA 3.45Å; G1687-D1689 VanDerWaalsContact C-N 3.3Å; G1687-D1689 PolarHBondContact O-N 3.03Å
1688	Q	78.6	Confident	85.7	Confident	90.6 Å²	90.6	46.4 Å²	46.4	42%	0.423	24%	0.239	S	C	.	.			trans	-119.7	132.4	179.5	-65.8	-86.9	-25.4	0	0	110	F1686 V1694 R1697	F1686-Q1688 PolarHBondContact O-N 2.98Å; F1686-Q1688 VanDerWaalsContact O-N 3.17Å; Q1688-V1694 HydrophobicContact CB-CG2 4.2Å; Q1688-R1697 HydrophobicContact CG-CG 4.31Å
1689	D	72	Confident	85.9	Confident	104.4 Å²	104.4	41.4 Å²	41.4	56%	0.558	22%	0.217	S	C	*	.	S	Bend	trans	-98.8	-17.5	178.5	49.6	-15.7	0	0	0	112.9	G1687 R1697	G1687-D1689 VanDerWaalsContact C-N 3.3Å; G1687-D1689 PolarHBondContact O-N 3.03Å; D1689-R1697 IonicContact OD1-NH2 3.95Å; D1689-R1697 PolarHBondContact OD1-NH2 3.03Å; D1689-R1697 IonicContact OD2-CZ 3.36Å; D1689-R1697 IonicContact OD2-NE 2.64Å; D1689-R1697 PolarHBondContact OD2-NE 3.4Å; D1689-R1697 IonicContact OD2-NH2 2.81Å; D1689-R1697 PolarHBondContact OD2-NH2 3.11Å
1690	T	80.2	Confident	86	Confident	78.4 Å²	78.4	42.1 Å²	42.1	48%	0.481	22%	0.221	S	C	.	.	S	Bend	trans	-88.7	146	177.5	59.3	0	0	0	0	112.4	V1692 G1693 V1694	T1690-V1692 VanDerWaalsContact C-N 3.34Å; T1690-V1692 PolarHBondContact O-N 3.15Å; T1690-V1692 VanDerWaalsContact O-N 3.12Å; T1690-G1693 WeakPolarHBondContact O-CA 3.35Å; T1690-G1693 PolarHBondContact O-N 3.1Å; T1690-G1693 VanDerWaalsContact O-N 3.12Å; T1690-G1693 PolarHBondContact OG1-N 3.1Å; T1690-V1694 WeakPolarHBondContact O-CG2 3.37Å; T1690-V1694 PolarHBondContact O-N 3.2Å; T1690-V1694 VanDerWaalsContact O-N 3.1Å
1691	E	80.4	Confident	85.9	Confident	94.8 Å²	94.8	40 Å²	40	44%	0.443	21%	0.21	S	C	.	.	H	α-helix	trans	-55.5	-44	178.3	-65.3	177.8	-155	0	0	112.4	G1693 V1694 L1695 V1737 A1738	E1691-G1693 VanDerWaalsContact C-N 3.34Å; E1691-G1693 PolarHBondContact O-N 3.17Å; E1691-V1694 PolarHBondContact O-N 3.07Å; E1691-L1695 PolarHBondContact O-N 3.32Å; E1691-L1695 VanDerWaalsContact O-N 3.14Å; E1691-V1737 HydrophobicContact CB-CG1 4.43Å; E1691-V1737 HydrophobicContact CB-CG2 4.45Å; E1691-A1738 PolarHBondContact OE2-N 2.82Å
1692	V	80.1	Confident	85.7	Confident	80 Å²	80	41.4 Å²	41.4	49%	0.485	22%	0.217	S	C	.	.	H	α-helix	trans	-66	-38.9	177.6	-177.8	0	0	0	0	111.4	T1690 V1694 L1695 Q1696	T1690-V1692 VanDerWaalsContact C-N 3.34Å; T1690-V1692 PolarHBondContact O-N 3.15Å; T1690-V1692 VanDerWaalsContact O-N 3.12Å; V1692-V1694 VanDerWaalsContact C-N 3.31Å; V1692-V1694 PolarHBondContact O-N 3.03Å; V1692-L1695 PolarHBondContact O-N 2.97Å; V1692-Q1696 HydrophobicContact CG1-CG 4.46Å; V1692-Q1696 WeakPolarHBondContact O-CG 3.31Å; V1692-Q1696 PolarHBondContact O-N 3Å; V1692-Q1696 VanDerWaalsContact O-N 3.16Å
1693	G	82.2	Confident	85.5	Confident	6.8 Å²	6.8	41.4 Å²	41.4	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-63.7	-36	177.2	0	0	0	0	0	112.6	T1690 E1691 L1695 Q1696 R1697	T1690-G1693 WeakPolarHBondContact O-CA 3.35Å; T1690-G1693 PolarHBondContact O-N 3.1Å; T1690-G1693 VanDerWaalsContact O-N 3.12Å; T1690-G1693 PolarHBondContact OG1-N 3.1Å; E1691-G1693 VanDerWaalsContact C-N 3.34Å; E1691-G1693 PolarHBondContact O-N 3.17Å; G1693-L1695 PolarHBondContact O-N 3.44Å; G1693-Q1696 PolarHBondContact O-N 2.86Å; G1693-R1697 WeakPolarHBondContact O-CG 3.36Å; G1693-R1697 PolarHBondContact O-N 3.12Å
1694	V	85.8	Confident	85.3	Confident	0.4 Å²	0.4	39.8 Å²	39.8	0%	0.002	21%	0.208	C	C	.	.	H	α-helix	trans	-65.7	-47.2	175.3	175.9	0	0	0	0	111.2	F1686 Q1688 T1690 E1691 V1692 Q1696 R1697 I1698 V1712 Y1715	F1686-V1694 HydrophobicContact CB-CG1 4.28Å; F1686-V1694 HydrophobicContact CB-CG2 4.39Å; F1686-V1694 HydrophobicContact CD2-CG1 3.69Å; F1686-V1694 HydrophobicContact CE2-CG1 4.23Å; F1686-V1694 HydrophobicContact CG-CG1 4.07Å; Q1688-V1694 HydrophobicContact CB-CG2 4.2Å; T1690-V1694 WeakPolarHBondContact O-CG2 3.37Å; T1690-V1694 PolarHBondContact O-N 3.2Å; T1690-V1694 VanDerWaalsContact O-N 3.1Å; E1691-V1694 PolarHBondContact O-N 3.07Å; V1692-V1694 VanDerWaalsContact C-N 3.31Å; V1692-V1694 PolarHBondContact O-N 3.03Å; V1694-Q1696 VanDerWaalsContact C-N 3.33Å; V1694-Q1696 PolarHBondContact O-N 3.02Å; V1694-R1697 PolarHBondContact O-N 3.18Å; V1694-R1697 VanDerWaalsContact O-N 3.11Å; V1694-I1698 HydrophobicContact CG1-CD1 4.1Å; V1694-I1698 PolarHBondContact O-N 3.49Å; V1694-V1712 HydrophobicContact CG1-CG1 4.15Å; V1694-Y1715 HydrophobicContact CG2-CD2 4.17Å; V1694-Y1715 HydrophobicContact CG2-CE2 4.03Å
1695	L	84.6	Confident	85.1	Confident	82.4 Å²	82.4	39.9 Å²	39.9	43%	0.431	21%	0.209	S	C	.	.	H	α-helix	trans	-62.9	-37.4	178.9	-72.7	176.5	0	0	0	112.5	E1691 V1692 G1693 R1697 I1698 V1737	E1691-L1695 PolarHBondContact O-N 3.32Å; E1691-L1695 VanDerWaalsContact O-N 3.14Å; V1692-L1695 PolarHBondContact O-N 2.97Å; G1693-L1695 PolarHBondContact O-N 3.44Å; L1695-R1697 PolarHBondContact O-N 2.92Å; L1695-I1698 PolarHBondContact O-N 3.29Å; L1695-I1698 VanDerWaalsContact O-N 3.14Å; L1695-I1698 VanDerWaalsContact O-O 3.07Å; L1695-V1737 HydrophobicContact CD1-CG1 3.61Å; L1695-V1737 HydrophobicContact CD2-CG1 4.06Å; L1695-V1737 HydrophobicContact CG-CG1 3.79Å
1696	Q	84.6	Confident	84.8	Confident	119.4 Å²	119.4	40.4 Å²	40.4	56%	0.558	21%	0.212	S	C	*	.	H	α-helix	trans	-64.9	-22.4	176.9	-74.3	178	-7.6	0	0	113.6	Y1632 F1664 V1692 G1693 V1694 I1698	Y1632-Q1696 PolarHBondContact OH-O 2.92Å; F1664-Q1696 WeakPolarHBondContact CE1-O 3.4Å; V1692-Q1696 HydrophobicContact CG1-CG 4.46Å; V1692-Q1696 WeakPolarHBondContact O-CG 3.31Å; V1692-Q1696 PolarHBondContact O-N 3Å; V1692-Q1696 VanDerWaalsContact O-N 3.16Å; G1693-Q1696 PolarHBondContact O-N 2.86Å; V1694-Q1696 VanDerWaalsContact C-N 3.33Å; V1694-Q1696 PolarHBondContact O-N 3.02Å; Q1696-I1698 VanDerWaalsContact C-N 3.31Å
1697	R	88.3	Confident	84.7	Confident	44 Å²	44	40.9 Å²	40.9	17%	0.166	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.5	179	-65.5	-78.8	-156.5	171.2	4.8	113.3	N1659 L1662 D1663 F1664 E1665 V1666 F1686 Q1688 D1689 G1693 V1694 L1695	N1659-R1697 VanDerWaalsContact C-NH2 3.26Å; N1659-R1697 PolarHBondContact O-NH2 2.87Å; L1662-R1697 PolarHBondContact O-NH1 3.22Å; D1663-R1697 PolarHBondContact O-NH1 3.29Å; D1663-R1697 VanDerWaalsContact O-NH1 3.08Å; F1664-R1697 CarbonylContact C-O 3.55Å; F1664-R1697 WeakPolarHBondContact CA-O 3.44Å; E1665-R1697 HydrophobicContact CB-CB 4.49Å; E1665-R1697 HydrophobicContact CG-CB 4.08Å; E1665-R1697 HydrophobicContact CG-CG 4.5Å; E1665-R1697 PolarHBondContact N-O 3.09Å; E1665-R1697 IonicContact OE1-CZ 3.46Å; E1665-R1697 IonicContact OE1-NE 3.95Å; E1665-R1697 IonicContact OE1-NH1 3.12Å; E1665-R1697 PolarHBondContact OE1-NH1 3.21Å; E1665-R1697 IonicContact OE1-NH2 2.7Å; E1665-R1697 PolarHBondContact OE1-NH2 2.86Å; V1666-R1697 PolarHBondContact N-O 3.11Å; F1686-R1697 PolarHBondContact O-NH1 2.98Å; Q1688-R1697 HydrophobicContact CG-CG 4.31Å; D1689-R1697 IonicContact OD1-NH2 3.95Å; D1689-R1697 PolarHBondContact OD1-NH2 3.03Å; D1689-R1697 IonicContact OD2-CZ 3.36Å; D1689-R1697 IonicContact OD2-NE 2.64Å; D1689-R1697 PolarHBondContact OD2-NE 3.4Å; D1689-R1697 IonicContact OD2-NH2 2.81Å; D1689-R1697 PolarHBondContact OD2-NH2 3.11Å; G1693-R1697 WeakPolarHBondContact O-CG 3.36Å; G1693-R1697 PolarHBondContact O-N 3.12Å; V1694-R1697 PolarHBondContact O-N 3.18Å; V1694-R1697 VanDerWaalsContact O-N 3.11Å; L1695-R1697 PolarHBondContact O-N 2.92Å
1698	I	90.2	Very high	84.9	Confident	4.4 Å²	4.4	40 Å²	40	2%	0.023	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.9	-179.4	-61.3	171.9	0	0	0	108	V1666 F1686 V1694 L1695 Q1696 D1700 A1710 V1712	V1666-I1698 CarbonylContact O-C 3.19Å; V1666-I1698 WeakPolarHBondContact O-CA 3.33Å; F1686-I1698 HydrophobicContact CD1-CD1 4.33Å; F1686-I1698 HydrophobicContact CD1-CG1 4.36Å; F1686-I1698 HydrophobicContact CE1-CD1 3.83Å; F1686-I1698 HydrophobicContact CE1-CG1 4.03Å; F1686-I1698 HydrophobicContact CE2-CD1 4.24Å; F1686-I1698 HydrophobicContact CZ-CD1 3.74Å; F1686-I1698 HydrophobicContact CZ-CG1 4.4Å; V1694-I1698 HydrophobicContact CG1-CD1 4.1Å; V1694-I1698 PolarHBondContact O-N 3.49Å; L1695-I1698 PolarHBondContact O-N 3.29Å; L1695-I1698 VanDerWaalsContact O-N 3.14Å; L1695-I1698 VanDerWaalsContact O-O 3.07Å; Q1696-I1698 VanDerWaalsContact C-N 3.31Å; I1698-D1700 HydrophobicContact CG2-CB 4.42Å; I1698-A1710 HydrophobicContact CG2-CB 3.86Å; I1698-V1712 HydrophobicContact CD1-CB 4.34Å; I1698-V1712 HydrophobicContact CD1-CG1 3.88Å; I1698-V1712 HydrophobicContact CD1-CG2 3.43Å; I1698-V1712 VanDerWaalsContact CD1-CG2 3.43Å
1699	F	90	Very high	85.4	Confident	1.8 Å²	1.8	36.7 Å²	36.7	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	113.7	176.3	-164.3	-79.8	0	0	0	109.8	N1635 P1637 F1664 V1666 V1667 A1668 D1703 W1704 F1707	N1635-F1699 WeakPolarHBondContact O-CZ 3.31Å; P1637-F1699 HydrophobicContact CB-CD1 4.43Å; P1637-F1699 HydrophobicContact CB-CD2 4.35Å; P1637-F1699 HydrophobicContact CB-CE2 4.46Å; P1637-F1699 HydrophobicContact CB-CG 4.32Å; P1637-F1699 HydrophobicContact CG-CD1 4.36Å; P1637-F1699 HydrophobicContact CG-CE1 4.34Å; P1637-F1699 HydrophobicContact CG-CE2 4.42Å; P1637-F1699 HydrophobicContact CG-CG 4.42Å; P1637-F1699 HydrophobicContact CG-CZ 4.23Å; F1664-F1699 HydrophobicContact CB-CB 4.47Å; F1664-F1699 HydrophobicContact CD1-CB 4Å; F1664-F1699 HydrophobicContact CD1-CD2 4.32Å; F1664-F1699 HydrophobicContact CD2-CB 4.36Å; F1664-F1699 HydrophobicContact CD2-CD2 4.37Å; F1664-F1699 HydrophobicContact CE1-CB 4.3Å; F1664-F1699 AromaticContact CE1-CD2 3.83Å; F1664-F1699 HydrophobicContact CE1-CD2 3.83Å; F1664-F1699 HydrophobicContact CE1-CG 4.42Å; F1664-F1699 AromaticContact CE2-CD2 3.9Å; F1664-F1699 HydrophobicContact CE2-CD2 3.9Å; F1664-F1699 HydrophobicContact CE2-CE2 4.39Å; F1664-F1699 HydrophobicContact CG-CB 4.13Å; F1664-F1699 HydrophobicContact CG-CD2 4.45Å; F1664-F1699 AromaticContact CZ-CD2 3.61Å; F1664-F1699 HydrophobicContact CZ-CD2 3.61Å; F1664-F1699 VanDerWaalsContact CZ-CD2 3.47Å; F1664-F1699 HydrophobicContact CZ-CE2 4.25Å; F1664-F1699 HydrophobicContact CZ-CG 4.48Å; V1666-F1699 PolarHBondContact O-N 3.22Å; V1667-F1699 CarbonylContact C-O 3.49Å; V1667-F1699 WeakPolarHBondContact CA-O 3.31Å; V1667-F1699 HydrophobicContact CB-CB 4.3Å; V1667-F1699 HydrophobicContact CG1-CB 4.13Å; V1667-F1699 HydrophobicContact CG1-CD1 3.99Å; V1667-F1699 HydrophobicContact CG1-CG 4.39Å; V1667-F1699 HydrophobicContact CG2-CB 3.96Å; A1668-F1699 PolarHBondContact N-O 3.08Å; F1699-D1703 VanDerWaalsContact CA-OD2 3.24Å; F1699-D1703 WeakPolarHBondContact CA-OD2 3.26Å; F1699-D1703 HydrophobicContact CD1-CB 4.01Å; F1699-D1703 HydrophobicContact CD2-CB 3.8Å; F1699-D1703 HydrophobicContact CE1-CB 3.73Å; F1699-D1703 HydrophobicContact CE2-CB 3.53Å; F1699-D1703 VanDerWaalsContact CE2-CB 3.44Å; F1699-D1703 HydrophobicContact CG-CB 4.05Å; F1699-D1703 HydrophobicContact CZ-CB 3.5Å; F1699-D1703 VanDerWaalsContact CZ-CB 3.47Å; F1699-W1704 HydrophobicContact CE1-CB 3.97Å; F1699-W1704 AromaticContact CE1-CD2 3.86Å; F1699-W1704 HydrophobicContact CE1-CD2 3.86Å; F1699-W1704 HydrophobicContact CE1-CE3 4.29Å; F1699-W1704 AromaticContact CE1-CG 3.72Å; F1699-W1704 HydrophobicContact CE1-CG 3.72Å; F1699-W1704 HydrophobicContact CZ-CB 4.38Å; F1699-W1704 AromaticContact CZ-CD1 3.63Å; F1699-W1704 AromaticContact CZ-CD2 3.9Å; F1699-W1704 HydrophobicContact CZ-CD2 3.9Å; F1699-W1704 AromaticContact CZ-CE2 3.91Å; F1699-W1704 HydrophobicContact CZ-CE3 4.33Å; F1699-W1704 AromaticContact CZ-CG 3.74Å; F1699-W1704 HydrophobicContact CZ-CG 3.74Å; F1699-W1704 AromaticContact CZ-NE1 3.71Å; F1699-F1707 AromaticContact CD1-CD2 3.74Å; F1699-F1707 HydrophobicContact CD1-CD2 3.74Å; F1699-F1707 AromaticContact CD1-CE2 3.67Å; F1699-F1707 HydrophobicContact CD1-CE2 3.67Å; F1699-F1707 AromaticContact CE1-CD2 3.65Å; F1699-F1707 HydrophobicContact CE1-CD2 3.65Å; F1699-F1707 AromaticContact CE1-CE2 3.44Å; F1699-F1707 HydrophobicContact CE1-CE2 3.44Å; F1699-F1707 VanDerWaalsContact CE1-CE2 3.45Å
1700	D	89.7	Confident	86.2	Confident	15.4 Å²	15.4	32.3 Å²	32.3	8%	0.082	17%	0.168	C	C	.	.	S	Bend	trans	-140.9	-157.1	-173	83.5	-9.1	0	0	0	113.9	A1668 I1698 D1702 D1703 W1704 A1710	A1668-D1700 HydrophobicContact CB-CB 4.07Å; I1698-D1700 HydrophobicContact CG2-CB 4.42Å; D1700-D1702 PolarHBondContact O-N 3.25Å; D1700-D1702 WeakPolarHBondContact OD1-CB 3.48Å; D1700-D1702 PolarHBondContact OD1-N 3.05Å; D1700-D1703 PolarHBondContact N-OD2 3.22Å; D1700-D1703 PolarHBondContact O-N 3.12Å; D1700-D1703 VanDerWaalsContact O-N 3.14Å; D1700-W1704 PolarHBondContact O-N 3.04Å; D1700-W1704 VanDerWaalsContact O-N 3.08Å; D1700-A1710 HydrophobicContact CB-CB 3.85Å; D1700-A1710 WeakPolarHBondContact OD2-CB 3.36Å; D1700-A1710 PolarHBondContact OD2-N 3.1Å; D1700-A1710 VanDerWaalsContact OD2-N 3.09Å
1701	F	88.2	Confident	86.7	Confident	8.4 Å²	8.4	31.4 Å²	31.4	4%	0.037	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-33.8	176.8	179.8	-89.4	0	0	0	113.9	F1675 D1703 W1704 N1705 F1707 C1708 L1709 R1750 T1784 M1786 L1808 Y2117	F1675-F1701 HydrophobicContact CD2-CE1 4.36Å; F1675-F1701 HydrophobicContact CD2-CE2 4.32Å; F1675-F1701 HydrophobicContact CD2-CZ 4.27Å; F1675-F1701 AromaticContact CE1-CE1 3.93Å; F1675-F1701 HydrophobicContact CE1-CE1 3.93Å; F1675-F1701 AromaticContact CE1-CE2 3.78Å; F1675-F1701 HydrophobicContact CE1-CE2 3.78Å; F1675-F1701 AromaticContact CE1-CZ 3.4Å; F1675-F1701 HydrophobicContact CE1-CZ 3.4Å; F1675-F1701 AromaticContact CE2-CD1 3.69Å; F1675-F1701 HydrophobicContact CE2-CD1 4.02Å; F1675-F1701 HydrophobicContact CE2-CD2 4.32Å; F1675-F1701 AromaticContact CE2-CE1 3.75Å; F1675-F1701 HydrophobicContact CE2-CE1 4.06Å; F1675-F1701 AromaticContact CE2-CE2 3.88Å; F1675-F1701 HydrophobicContact CE2-CE2 4.01Å; F1675-F1701 HydrophobicContact CE2-CG 4.12Å; F1675-F1701 AromaticContact CE2-CZ 3.67Å; F1675-F1701 HydrophobicContact CE2-CZ 3.9Å; F1675-F1701 HydrophobicContact CZ-CD1 4.39Å; F1675-F1701 HydrophobicContact CZ-CE2 4.33Å; F1675-F1701 AromaticContact CZ-CZ 3.92Å; F1675-F1701 HydrophobicContact CZ-CZ 4.07Å; F1701-D1703 VanDerWaalsContact C-N 3.26Å; F1701-D1703 PolarHBondContact O-N 3.17Å; F1701-W1704 WeakPolarHBondContact CA-O 3.24Å; F1701-W1704 CarbonylContact O-C 3.5Å; F1701-W1704 VanDerWaalsContact O-C 3.28Å; F1701-N1705 HydrophobicContact CD2-CB 4.37Å; F1701-N1705 HydrophobicContact CE1-CB 4.3Å; F1701-N1705 HydrophobicContact CE2-CB 3.83Å; F1701-N1705 VanDerWaalsContact CE2-O 3.3Å; F1701-N1705 WeakPolarHBondContact CE2-O 3.34Å; F1701-N1705 HydrophobicContact CZ-CB 3.85Å; F1701-N1705 WeakPolarHBondContact O-CA 3.13Å; F1701-N1705 PolarHBondContact O-N 3Å; F1701-F1707 VanDerWaalsContact CD2-O 3.3Å; F1701-F1707 WeakPolarHBondContact CD2-O 3.29Å; F1701-C1708 PolarHBondContact N-O 3.09Å; F1701-L1709 HydrophobicContact CB-CB 4.35Å; F1701-L1709 HydrophobicContact CB-CD1 4.3Å; F1701-R1750 HydrophobicContact CD1-CG 4.06Å; F1701-R1750 HydrophobicContact CE1-CG 3.72Å; F1701-T1784 HydrophobicContact CE1-CG2 4.09Å; F1701-T1784 WeakPolarHBondContact CE1-OG1 3.11Å; F1701-T1784 HydrophobicContact CZ-CG2 3.96Å; F1701-T1784 WeakPolarHBondContact CZ-OG1 3.49Å; F1701-M1786 HydrophobicContact CE1-CE 4.41Å; F1701-L1808 HydrophobicContact CZ-CD2 4.36Å; F1701-Y2117 HydrophobicContact CE2-CE2 4.5Å
1702	D	87.2	Confident	87.2	Confident	29.4 Å²	29.4	27.3 Å²	27.3	16%	0.157	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-17.4	-178.8	-73.7	-36.3	0	0	0	112	D1700 G1749 R1750	D1700-D1702 PolarHBondContact O-N 3.25Å; D1700-D1702 WeakPolarHBondContact OD1-CB 3.48Å; D1700-D1702 PolarHBondContact OD1-N 3.05Å; D1702-G1749 VanDerWaalsContact O-CA 3.31Å; D1702-G1749 WeakPolarHBondContact O-CA 3.23Å; D1702-G1749 PolarHBondContact O-N 3.28Å; D1702-G1749 WeakPolarHBondContact OD1-CA 3.19Å; D1702-R1750 WeakPolarHBondContact OD1-CD 3.3Å; D1702-R1750 VanDerWaalsContact OD1-CG 3.24Å; D1702-R1750 WeakPolarHBondContact OD1-CG 3.36Å; D1702-R1750 IonicContact OD1-CZ 3.43Å; D1702-R1750 PolarHBondContact OD1-N 2.92Å; D1702-R1750 VanDerWaalsContact OD1-N 3.13Å; D1702-R1750 IonicContact OD1-NE 3.25Å; D1702-R1750 PolarHBondContact OD1-NE 3.13Å; D1702-R1750 IonicContact OD1-NH2 3.42Å; D1702-R1750 IonicContact OD2-CZ 3.29Å; D1702-R1750 IonicContact OD2-NE 3.15Å; D1702-R1750 PolarHBondContact OD2-NE 2.98Å; D1702-R1750 IonicContact OD2-NH2 3.18Å; D1702-R1750 PolarHBondContact OD2-NH2 2.99Å
1703	D	87.5	Confident	87.6	Confident	7.8 Å²	7.8	26.1 Å²	26.1	4%	0.042	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-53.7	170.8	-56.9	-73.7	0	0	0	111.9	F1699 D1700 F1701 K1781 D1782	F1699-D1703 VanDerWaalsContact CA-OD2 3.24Å; F1699-D1703 WeakPolarHBondContact CA-OD2 3.26Å; F1699-D1703 HydrophobicContact CD1-CB 4.01Å; F1699-D1703 HydrophobicContact CD2-CB 3.8Å; F1699-D1703 HydrophobicContact CE1-CB 3.73Å; F1699-D1703 HydrophobicContact CE2-CB 3.53Å; F1699-D1703 VanDerWaalsContact CE2-CB 3.44Å; F1699-D1703 HydrophobicContact CG-CB 4.05Å; F1699-D1703 HydrophobicContact CZ-CB 3.5Å; F1699-D1703 VanDerWaalsContact CZ-CB 3.47Å; D1700-D1703 PolarHBondContact N-OD2 3.22Å; D1700-D1703 PolarHBondContact O-N 3.12Å; D1700-D1703 VanDerWaalsContact O-N 3.14Å; F1701-D1703 VanDerWaalsContact C-N 3.26Å; F1701-D1703 PolarHBondContact O-N 3.17Å; D1703-K1781 VanDerWaalsContact OD1-CD 3.27Å; D1703-K1781 WeakPolarHBondContact OD1-CD 3.38Å; D1703-K1781 WeakPolarHBondContact OD1-CE 3.25Å; D1703-K1781 IonicContact OD1-NZ 3.23Å; D1703-K1781 PolarHBondContact OD1-NZ 3.08Å; D1703-D1782 VanDerWaalsContact O-CB 3.23Å; D1703-D1782 WeakPolarHBondContact O-CB 3.36Å; D1703-D1782 VanDerWaalsContact O-CG 3.31Å; D1703-D1782 PolarHBondContact O-N 3.06Å; D1703-D1782 VanDerWaalsContact O-N 3.12Å
1704	W	87.2	Confident	88	Confident	18.2 Å²	18.2	26.9 Å²	26.9	7%	0.069	14%	0.137	C	C	.	.			trans	-126.1	114.9	174.7	-78.9	2.8	0	0	0	110.8	N1635 W1636 F1699 D1700 F1701 I1706 F1707 D1782 H2036	N1635-W1704 VanDerWaalsContact O-CE2 3.27Å; N1635-W1704 WeakPolarHBondContact O-CZ2 3.32Å; N1635-W1704 PolarHBondContact O-NE1 2.8Å; N1635-W1704 VanDerWaalsContact O-NE1 3.11Å; W1636-W1704 HydrophobicContact CB-CZ2 4.41Å; W1636-W1704 HydrophobicContact CD2-CH2 4.25Å; W1636-W1704 HydrophobicContact CD2-CZ2 4.39Å; W1636-W1704 AromaticContact CE3-CH2 3.5Å; W1636-W1704 HydrophobicContact CE3-CH2 3.5Å; W1636-W1704 AromaticContact CE3-CZ2 3.66Å; W1636-W1704 HydrophobicContact CE3-CZ2 3.78Å; W1636-W1704 AromaticContact CE3-CZ3 3.52Å; W1636-W1704 HydrophobicContact CE3-CZ3 3.52Å; W1636-W1704 HydrophobicContact CG-CZ2 4.44Å; W1636-W1704 HydrophobicContact CH2-CH2 4.35Å; W1636-W1704 AromaticContact CZ3-CH2 3.6Å; W1636-W1704 HydrophobicContact CZ3-CH2 3.6Å; W1636-W1704 VanDerWaalsContact CZ3-CH2 3.41Å; W1636-W1704 AromaticContact CZ3-CZ2 4Å; W1636-W1704 HydrophobicContact CZ3-CZ2 4.05Å; W1636-W1704 AromaticContact CZ3-CZ3 3.55Å; W1636-W1704 HydrophobicContact CZ3-CZ3 4.01Å; F1699-W1704 HydrophobicContact CE1-CB 3.97Å; F1699-W1704 AromaticContact CE1-CD2 3.86Å; F1699-W1704 HydrophobicContact CE1-CD2 3.86Å; F1699-W1704 HydrophobicContact CE1-CE3 4.29Å; F1699-W1704 AromaticContact CE1-CG 3.72Å; F1699-W1704 HydrophobicContact CE1-CG 3.72Å; F1699-W1704 HydrophobicContact CZ-CB 4.38Å; F1699-W1704 AromaticContact CZ-CD1 3.63Å; F1699-W1704 AromaticContact CZ-CD2 3.9Å; F1699-W1704 HydrophobicContact CZ-CD2 3.9Å; F1699-W1704 AromaticContact CZ-CE2 3.91Å; F1699-W1704 HydrophobicContact CZ-CE3 4.33Å; F1699-W1704 AromaticContact CZ-CG 3.74Å; F1699-W1704 HydrophobicContact CZ-CG 3.74Å; F1699-W1704 AromaticContact CZ-NE1 3.71Å; D1700-W1704 PolarHBondContact O-N 3.04Å; D1700-W1704 VanDerWaalsContact O-N 3.08Å; F1701-W1704 WeakPolarHBondContact CA-O 3.24Å; F1701-W1704 CarbonylContact O-C 3.5Å; F1701-W1704 VanDerWaalsContact O-C 3.28Å; W1704-I1706 HydrophobicContact CB-CG1 4.12Å; W1704-I1706 HydrophobicContact CE3-CD1 3.97Å; W1704-I1706 HydrophobicContact CE3-CG1 4.3Å; W1704-I1706 HydrophobicContact CZ3-CD1 4.34Å; W1704-I1706 PolarHBondContact O-N 3.2Å; W1704-F1707 HydrophobicContact CB-CD2 3.91Å; W1704-F1707 HydrophobicContact CB-CE2 4.29Å; W1704-F1707 HydrophobicContact CB-CG 4.22Å; W1704-F1707 HydrophobicContact CD2-CE2 4.17Å; W1704-F1707 HydrophobicContact CD2-CZ 4.33Å; W1704-F1707 HydrophobicContact CE3-CD1 4.46Å; W1704-F1707 HydrophobicContact CE3-CD2 4.21Å; W1704-F1707 AromaticContact CE3-CE1 3.86Å; W1704-F1707 HydrophobicContact CE3-CE1 3.92Å; W1704-F1707 AromaticContact CE3-CE2 3.48Å; W1704-F1707 HydrophobicContact CE3-CE2 3.48Å; W1704-F1707 VanDerWaalsContact CE3-CE2 3.46Å; W1704-F1707 AromaticContact CE3-CZ 3.31Å; W1704-F1707 HydrophobicContact CE3-CZ 3.31Å; W1704-F1707 HydrophobicContact CG-CE2 4.48Å; W1704-F1707 HydrophobicContact CZ3-CE1 4.34Å; W1704-F1707 AromaticContact CZ3-CE2 3.94Å; W1704-F1707 HydrophobicContact CZ3-CE2 4.13Å; W1704-F1707 AromaticContact CZ3-CZ 3.67Å; W1704-F1707 HydrophobicContact CZ3-CZ 3.67Å; W1704-F1707 WeakPolarHBondContact O-CB 3.33Å; W1704-F1707 PolarHBondContact O-N 3.09Å; W1704-D1782 VanDerWaalsContact CA-OD2 3.3Å; W1704-D1782 WeakPolarHBondContact CA-OD2 3.32Å; W1704-H2036 AromaticContact CD1-CD2 3.43Å; W1704-H2036 VanDerWaalsContact CD1-CD2 3.41Å; W1704-H2036 AromaticContact CD1-NE2 3.8Å; W1704-H2036 HydrophobicContact CD2-CB 4.17Å; W1704-H2036 AromaticContact CD2-CD2 3.36Å; W1704-H2036 VanDerWaalsContact CD2-CD2 3.4Å; W1704-H2036 AromaticContact CD2-CG 3.9Å; W1704-H2036 AromaticContact CE2-CD2 3.66Å; W1704-H2036 HydrophobicContact CE3-CB 3.95Å; W1704-H2036 AromaticContact CE3-CD2 3.9Å; W1704-H2036 AromaticContact CG-CD2 3.28Å; W1704-H2036 AromaticContact CG-NE2 3.66Å; W1704-H2036 HydrophobicContact CH2-CB 4.27Å; W1704-H2036 HydrophobicContact CZ2-CB 4.31Å; W1704-H2036 HydrophobicContact CZ3-CB 4Å; W1704-H2036 AromaticContact NE1-CD2 3.68Å
1705	N	86.1	Confident	88.1	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.016	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	9.3	-176.3	58.4	26	0	0	0	114.8	F1701 D1782 T1784 R1806 L1808 H2036	F1701-N1705 HydrophobicContact CD2-CB 4.37Å; F1701-N1705 HydrophobicContact CE1-CB 4.3Å; F1701-N1705 HydrophobicContact CE2-CB 3.83Å; F1701-N1705 VanDerWaalsContact CE2-O 3.3Å; F1701-N1705 WeakPolarHBondContact CE2-O 3.34Å; F1701-N1705 HydrophobicContact CZ-CB 3.85Å; F1701-N1705 WeakPolarHBondContact O-CA 3.13Å; F1701-N1705 PolarHBondContact O-N 3Å; N1705-D1782 HydrophobicContact CB-CB 4.29Å; N1705-D1782 PolarHBondContact N-OD2 3.07Å; N1705-D1782 PolarHBondContact ND2-OD2 2.95Å; N1705-D1782 PolarHBondContact OD1-OD2 3.25Å; N1705-D1782 VanDerWaalsContact OD1-OD2 3.11Å; N1705-T1784 WeakPolarHBondContact CB-OG1 3.3Å; N1705-T1784 PolarHBondContact ND2-OG1 3.28Å; N1705-R1806 PolarHBondContact ND2-O 2.77Å; N1705-R1806 PolarHBondContact OD1-NE 3.21Å; N1705-R1806 PolarHBondContact OD1-NH2 3.22Å; N1705-L1808 HydrophobicContact CB-CB 4.44Å; N1705-L1808 HydrophobicContact CB-CD2 4.06Å; N1705-L1808 VanDerWaalsContact ND2-CB 3.3Å; N1705-L1808 WeakPolarHBondContact ND2-CB 3.29Å; N1705-H2036 PolarHBondContact OD1-CE1 3.37Å
1706	I	84.8	Confident	88.3	Confident	34 Å²	34	23.7 Å²	23.7	17%	0.174	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-16	165.6	53	163.8	0	0	0	112.9	W1704 R1806 H2036 Y2115	W1704-I1706 HydrophobicContact CB-CG1 4.12Å; W1704-I1706 HydrophobicContact CE3-CD1 3.97Å; W1704-I1706 HydrophobicContact CE3-CG1 4.3Å; W1704-I1706 HydrophobicContact CZ3-CD1 4.34Å; W1704-I1706 PolarHBondContact O-N 3.2Å; I1706-R1806 VanDerWaalsContact CG2-NH2 3.27Å; I1706-H2036 HydrophobicContact CD1-CB 3.82Å; I1706-H2036 WeakPolarHBondContact CG2-ND1 3.23Å; I1706-Y2115 HydrophobicContact CG2-CD1 4.43Å; I1706-Y2115 HydrophobicContact CG2-CG 4.22Å
1707	F	88.1	Confident	88.4	Confident	14.4 Å²	14.4	19.8 Å²	19.8	6%	0.063	10%	0.103	C	C	.	.	S	Bend	trans	-88.2	176.9	-176.1	-71.4	-12.2	0	0	0	111.7	W1636 F1645 V1667 A1668 G1669 L1670 F1699 F1701 W1704	W1636-F1707 HydrophobicContact CZ3-CZ 4.47Å; F1645-F1707 HydrophobicContact CD1-CE1 4.5Å; F1645-F1707 HydrophobicContact CD1-CZ 4.36Å; F1645-F1707 HydrophobicContact CE1-CE1 4.49Å; F1645-F1707 HydrophobicContact CE1-CE2 4.4Å; F1645-F1707 AromaticContact CE1-CZ 3.91Å; F1645-F1707 HydrophobicContact CE1-CZ 3.95Å; V1667-F1707 HydrophobicContact CG1-CD2 4.5Å; V1667-F1707 HydrophobicContact CG1-CE2 4.1Å; A1668-F1707 WeakPolarHBondContact O-CB 3.4Å; G1669-F1707 VanDerWaalsContact CA-CD1 3.43Å; L1670-F1707 CarbonylContact O-C 3.5Å; F1699-F1707 AromaticContact CD1-CD2 3.74Å; F1699-F1707 HydrophobicContact CD1-CD2 3.74Å; F1699-F1707 AromaticContact CD1-CE2 3.67Å; F1699-F1707 HydrophobicContact CD1-CE2 3.67Å; F1699-F1707 AromaticContact CE1-CD2 3.65Å; F1699-F1707 HydrophobicContact CE1-CD2 3.65Å; F1699-F1707 AromaticContact CE1-CE2 3.44Å; F1699-F1707 HydrophobicContact CE1-CE2 3.44Å; F1699-F1707 VanDerWaalsContact CE1-CE2 3.45Å; F1701-F1707 VanDerWaalsContact CD2-O 3.3Å; F1701-F1707 WeakPolarHBondContact CD2-O 3.29Å; W1704-F1707 HydrophobicContact CB-CD2 3.91Å; W1704-F1707 HydrophobicContact CB-CE2 4.29Å; W1704-F1707 HydrophobicContact CB-CG 4.22Å; W1704-F1707 HydrophobicContact CD2-CE2 4.17Å; W1704-F1707 HydrophobicContact CD2-CZ 4.33Å; W1704-F1707 HydrophobicContact CE3-CD1 4.46Å; W1704-F1707 HydrophobicContact CE3-CD2 4.21Å; W1704-F1707 AromaticContact CE3-CE1 3.86Å; W1704-F1707 HydrophobicContact CE3-CE1 3.92Å; W1704-F1707 AromaticContact CE3-CE2 3.48Å; W1704-F1707 HydrophobicContact CE3-CE2 3.48Å; W1704-F1707 VanDerWaalsContact CE3-CE2 3.46Å; W1704-F1707 AromaticContact CE3-CZ 3.31Å; W1704-F1707 HydrophobicContact CE3-CZ 3.31Å; W1704-F1707 HydrophobicContact CG-CE2 4.48Å; W1704-F1707 HydrophobicContact CZ3-CE1 4.34Å; W1704-F1707 AromaticContact CZ3-CE2 3.94Å; W1704-F1707 HydrophobicContact CZ3-CE2 4.13Å; W1704-F1707 AromaticContact CZ3-CZ 3.67Å; W1704-F1707 HydrophobicContact CZ3-CZ 3.67Å; W1704-F1707 WeakPolarHBondContact O-CB 3.33Å; W1704-F1707 PolarHBondContact O-N 3.09Å
1708	C	87.4	Confident	88.2	Confident	2.6 Å²	2.6	20.3 Å²	20.3	2%	0.018	11%	0.111	C	C	.	.	P	Polyproline II helix	trans	-95.4	153.3	178.5	112.8	0	0	0	0	110.2	A1668 L1670 T1672 S1677 K1678 A1679 F1701 A1710	A1668-C1708 PolarHBondContact O-N 2.99Å; A1668-C1708 VanDerWaalsContact O-N 3.12Å; A1668-C1708 PolarHBondContact O-SG 3.15Å; L1670-C1708 HydrophobicContact CB-CB 3.95Å; L1670-C1708 PolarHBondContact O-N 3Å; T1672-C1708 HydrophobicContact CG2-CB 3.72Å; S1677-C1708 PolarHBondContact O-SG 3Å; K1678-C1708 VanDerWaalsContact C-SG 3.57Å; K1678-C1708 VanDerWaalsContact CA-SG 3.56Å; A1679-C1708 WeakPolarHBondContact CB-SG 3.25Å; A1679-C1708 PolarHBondContact N-SG 3.01Å; F1701-C1708 PolarHBondContact N-O 3.09Å; C1708-A1710 PolarHBondContact O-N 3.12Å
1709	L	88	Confident	87.9	Confident	20.4 Å²	20.4	23.5 Å²	23.5	11%	0.107	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	132.8	175.6	-172.1	74.4	0	0	0	110.3	F1675 K1678 A1679 F1701 R1750	F1675-L1709 HydrophobicContact CE1-CD2 4.4Å; F1675-L1709 HydrophobicContact CZ-CD2 4.38Å; K1678-L1709 CarbonylContact C-O 3.59Å; K1678-L1709 VanDerWaalsContact CA-O 3.31Å; K1678-L1709 WeakPolarHBondContact CA-O 3.35Å; K1678-L1709 WeakPolarHBondContact CB-O 3.27Å; K1678-L1709 HydrophobicContact CD-CD2 4.05Å; K1678-L1709 HydrophobicContact CG-CB 4.33Å; K1678-L1709 HydrophobicContact CG-CD2 4.34Å; A1679-L1709 PolarHBondContact N-O 3.28Å; F1701-L1709 HydrophobicContact CB-CB 4.35Å; F1701-L1709 HydrophobicContact CB-CD1 4.3Å; L1709-R1750 VanDerWaalsContact CD1-CZ 3.49Å
1710	A	89.8	Confident	87.3	Confident	11.6 Å²	11.6	27.3 Å²	27.3	10%	0.096	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	120.1	175.1	0	0	0	0	0	110.8	A1668 I1681 I1698 D1700 C1708 V1712	A1668-A1710 HydrophobicContact CB-CB 4.19Å; I1681-A1710 HydrophobicContact CD1-CB 3.78Å; I1698-A1710 HydrophobicContact CG2-CB 3.86Å; D1700-A1710 HydrophobicContact CB-CB 3.85Å; D1700-A1710 WeakPolarHBondContact OD2-CB 3.36Å; D1700-A1710 PolarHBondContact OD2-N 3.1Å; D1700-A1710 VanDerWaalsContact OD2-N 3.09Å; C1708-A1710 PolarHBondContact O-N 3.12Å; A1710-V1712 HydrophobicContact CB-CG2 4.14Å; A1710-V1712 PolarHBondContact O-N 2.92Å
1711	N	91	Very high	86.7	Confident	59.8 Å²	59.8	34 Å²	34	32%	0.32	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	96.4	169.5	-175.9	31.3	0	0	0	110.2	K1678 A1679 I1681 S1682	K1678-N1711 HydrophobicContact CB-CB 4.33Å; K1678-N1711 HydrophobicContact CD-CB 4.46Å; A1679-N1711 WeakPolarHBondContact O-CB 3.37Å; A1679-N1711 PolarHBondContact O-N 3.11Å; I1681-N1711 CarbonylContact C-O 3.48Å; I1681-N1711 VanDerWaalsContact C-O 3.22Å; I1681-N1711 WeakPolarHBondContact CA-O 3.33Å; I1681-N1711 PolarHBondContact N-O 3.02Å; S1682-N1711 PolarHBondContact N-O 3.12Å; S1682-N1711 VanDerWaalsContact N-O 3.16Å
1712	V	89.6	Confident	86.1	Confident	8.8 Å²	8.8	33.8 Å²	33.8	5%	0.053	17%	0.168	C	C	.	.			trans	-89.9	-20.7	-175.6	-171.3	0	0	0	0	112.4	F1686 V1694 I1698 A1710 P1714	F1686-V1712 HydrophobicContact CD2-CG1 4.41Å; F1686-V1712 HydrophobicContact CE2-CG1 3.57Å; F1686-V1712 HydrophobicContact CZ-CG1 4.05Å; V1694-V1712 HydrophobicContact CG1-CG1 4.15Å; I1698-V1712 HydrophobicContact CD1-CB 4.34Å; I1698-V1712 HydrophobicContact CD1-CG1 3.88Å; I1698-V1712 HydrophobicContact CD1-CG2 3.43Å; I1698-V1712 VanDerWaalsContact CD1-CG2 3.43Å; A1710-V1712 HydrophobicContact CB-CG2 4.14Å; A1710-V1712 PolarHBondContact O-N 2.92Å; V1712-P1714 CarbonylContact O-C 3.57Å; V1712-P1714 VanDerWaalsContact O-C 3.23Å; V1712-P1714 VanDerWaalsContact O-O 3.08Å
1713	N	89.1	Confident	85.5	Confident	55.8 Å²	55.8	33.8 Å²	33.8	30%	0.298	17%	0.168	S	C	.	.			trans	-82.4	135.7	-170.9	-72.3	-15.8	0	0	0	112.4	S1682 V1737	S1682-N1713 VanDerWaalsContact CB-O 3.29Å; S1682-N1713 WeakPolarHBondContact CB-O 3.35Å; N1713-V1737 PolarHBondContact ND2-O 3.21Å; N1713-V1737 PolarHBondContact OD1-N 2.88Å
1714	P	90.1	Very high	84.9	Confident	23.4 Å²	23.4	37.1 Å²	37.1	15%	0.152	19%	0.185	C	C	.	.	S	Bend	cis	-79.9	154.9	-11.1	33.8	-35.4	0	0	0	112.4	H1683 V1712 L1734 G1735	H1683-P1714 WeakPolarHBondContact CA-O 3.4Å; H1683-P1714 PolarHBondContact N-O 3.15Å; H1683-P1714 WeakPolarHBondContact NE2-CG 3.28Å; V1712-P1714 CarbonylContact O-C 3.57Å; V1712-P1714 VanDerWaalsContact O-C 3.23Å; V1712-P1714 VanDerWaalsContact O-O 3.08Å; P1714-L1734 HydrophobicContact CB-CB 4.1Å; P1714-L1734 HydrophobicContact CB-CD1 4.27Å; P1714-L1734 HydrophobicContact CB-CD2 4.13Å; P1714-L1734 HydrophobicContact CB-CG 4.4Å; P1714-L1734 HydrophobicContact CG-CD1 4.15Å; P1714-L1734 HydrophobicContact CG-CD2 4.22Å; P1714-G1735 CarbonylContact C-O 3.57Å; P1714-G1735 VanDerWaalsContact CA-O 3.3Å; P1714-G1735 WeakPolarHBondContact CA-O 3.43Å; P1714-G1735 WeakPolarHBondContact CB-O 3.32Å
1715	Y	89.2	Confident	84.2	Confident	10.8 Å²	10.8	44.7 Å²	44.7	4%	0.042	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	160.3	174	70.3	-86.7	0	0	0	111.6	V1694 V1717 L1734 G1735 V1737	V1694-Y1715 HydrophobicContact CG2-CD2 4.17Å; V1694-Y1715 HydrophobicContact CG2-CE2 4.03Å; Y1715-V1717 HydrophobicContact CE2-CG2 4.18Å; Y1715-L1734 CarbonylContact O-C 3.47Å; Y1715-L1734 WeakPolarHBondContact O-CA 3.39Å; Y1715-G1735 VanDerWaalsContact CD1-C 3.49Å; Y1715-G1735 VanDerWaalsContact CD1-O 3.26Å; Y1715-G1735 WeakPolarHBondContact CD1-O 3.41Å; Y1715-G1735 VanDerWaalsContact CE1-C 3.44Å; Y1715-G1735 PolarHBondContact N-O 3.26Å; Y1715-G1735 PolarHBondContact O-N 3.15Å; Y1715-V1737 HydrophobicContact CD1-CG2 3.85Å; Y1715-V1737 HydrophobicContact CE1-CG2 3.5Å; Y1715-V1737 VanDerWaalsContact CE1-CG2 3.47Å
1716	F	88	Confident	83.7	Confident	3.6 Å²	3.6	50.4 Å²	50.4	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.2	175.9	-67.3	-54.4	0	0	0	111.1	F1654 H1683 N1684 Y1685 E1720 S1722 W1725 W1727 A1732 Q1733 L1734	F1654-F1716 HydrophobicContact CD1-CE2 4.02Å; F1654-F1716 AromaticContact CD1-CZ 3.86Å; F1654-F1716 HydrophobicContact CD1-CZ 3.91Å; F1654-F1716 HydrophobicContact CE1-CZ 4.25Å; H1683-F1716 VanDerWaalsContact C-CE2 3.49Å; H1683-F1716 HydrophobicContact CB-CE2 4.13Å; H1683-F1716 HydrophobicContact CB-CZ 3.99Å; H1683-F1716 WeakPolarHBondContact O-CD2 3.36Å; H1683-F1716 WeakPolarHBondContact O-CE2 3.38Å; N1684-F1716 PolarHBondContact O-N 3.09Å; Y1685-F1716 HydrophobicContact CD2-CB 4.39Å; Y1685-F1716 WeakPolarHBondContact CD2-O 3.24Å; F1716-E1720 HydrophobicContact CB-CG 4.19Å; F1716-E1720 HydrophobicContact CD1-CG 4.06Å; F1716-E1720 HydrophobicContact CD2-CB 4.44Å; F1716-E1720 HydrophobicContact CD2-CG 3.99Å; F1716-E1720 HydrophobicContact CE1-CG 4.42Å; F1716-E1720 HydrophobicContact CE2-CG 4.36Å; F1716-E1720 HydrophobicContact CG-CG 3.83Å; F1716-S1722 WeakPolarHBondContact CE2-O 3.48Å; F1716-W1725 HydrophobicContact CE1-CB 4.48Å; F1716-W1725 HydrophobicContact CZ-CG 4.24Å; F1716-W1727 HydrophobicContact CE2-CH2 4.25Å; F1716-W1727 HydrophobicContact CE2-CZ2 4.4Å; F1716-W1727 AromaticContact CZ-CH2 3.88Å; F1716-W1727 HydrophobicContact CZ-CH2 3.88Å; F1716-W1727 HydrophobicContact CZ-CZ2 4.04Å; F1716-A1732 HydrophobicContact CD1-CB 3.55Å; F1716-A1732 VanDerWaalsContact CD1-CB 3.5Å; F1716-A1732 HydrophobicContact CE1-CB 3.45Å; F1716-A1732 HydrophobicContact CZ-CB 4.16Å; F1716-Q1733 WeakPolarHBondContact CA-O 3.41Å; F1716-L1734 HydrophobicContact CD1-CD2 3.67Å; F1716-L1734 HydrophobicContact CE1-CD2 3.61Å; F1716-L1734 VanDerWaalsContact CE1-CD2 3.5Å
1717	V	86.9	Confident	83.2	Confident	38 Å²	38	53 Å²	53	23%	0.23	25%	0.248	C	C	.	.	S	Bend	trans	-81.4	-34.3	177.8	-178.1	0	0	0	0	111.5	Y1685 Y1715 Q1733	Y1685-V1717 WeakPolarHBondContact CE2-O 3.33Å; Y1715-V1717 HydrophobicContact CE2-CG2 4.18Å; V1717-Q1733 HydrophobicContact CB-CB 4.44Å; V1717-Q1733 HydrophobicContact CB-CG 4.2Å; V1717-Q1733 HydrophobicContact CG2-CG 4.25Å; V1717-Q1733 PolarHBondContact N-O 2.98Å; V1717-Q1733 VanDerWaalsContact N-O 3.08Å
1718	T	84.2	Confident	82.5	Confident	53.8 Å²	53.8	60 Å²	60	33%	0.33	27%	0.274	S	S	.	.	S	Bend	trans	-110.8	147.1	-177.7	48.4	0	0	0	0	112	Y1685 E1720 Q1733	Y1685-T1718 VanDerWaalsContact CD2-C 3.45Å; Y1685-T1718 WeakPolarHBondContact CD2-O 3.4Å; Y1685-T1718 VanDerWaalsContact CE2-C 3.45Å; T1718-E1720 PolarHBondContact O-N 3.2Å; T1718-E1720 VanDerWaalsContact O-N 3.09Å; T1718-E1720 PolarHBondContact OG1-OE1 3.03Å; T1718-Q1733 HydrophobicContact CG2-CB 4.44Å
1719	E	83.5	Confident	81.8	Confident	72.8 Å²	72.8	63.1 Å²	63.1	34%	0.34	30%	0.295	S	S	.	.			trans	-67.2	67.8	178.5	-167.9	-177.8	156.9	0	0	111.1	F1621 N1656 R1658 Y1685 R1721 S1722	F1621-E1719 VanDerWaalsContact CE1-OE1 3.28Å; F1621-E1719 WeakPolarHBondContact CE1-OE1 3.32Å; F1621-E1719 VanDerWaalsContact CZ-OE1 3.28Å; F1621-E1719 WeakPolarHBondContact CZ-OE1 3.37Å; N1656-E1719 WeakPolarHBondContact ND2-CG 3.36Å; N1656-E1719 PolarHBondContact ND2-OE1 3.17Å; R1658-E1719 WeakPolarHBondContact CD-OE2 3.39Å; R1658-E1719 IonicContact CZ-OE2 3.07Å; R1658-E1719 IonicContact NH1-OE1 3.54Å; R1658-E1719 PolarHBondContact NH1-OE1 3Å; R1658-E1719 IonicContact NH1-OE2 3.36Å; R1658-E1719 PolarHBondContact NH1-OE2 2.91Å; Y1685-E1719 HydrophobicContact CD1-CB 4.33Å; Y1685-E1719 HydrophobicContact CD1-CG 4.3Å; Y1685-E1719 HydrophobicContact CE1-CB 3.91Å; Y1685-E1719 HydrophobicContact CE1-CG 3.97Å; Y1685-E1719 HydrophobicContact CE2-CB 4.31Å; E1719-R1721 PolarHBondContact O-N 3.11Å; E1719-S1722 WeakPolarHBondContact O-CB 3.3Å; E1719-S1722 PolarHBondContact O-N 2.9Å; E1719-S1722 PolarHBondContact O-OG 3.26Å
1720	E	78.5	Confident	81.2	Confident	81.4 Å²	81.4	70.4 Å²	70.4	38%	0.38	33%	0.328	S	S	.	.			trans	-73.5	133	-173.3	-64.6	-94.2	152.9	0	0	113.7	Y1619 F1716 T1718 S1722 W1727 A1732	Y1619-E1720 PolarHBondContact OH-O 3.04Å; F1716-E1720 HydrophobicContact CB-CG 4.19Å; F1716-E1720 HydrophobicContact CD1-CG 4.06Å; F1716-E1720 HydrophobicContact CD2-CB 4.44Å; F1716-E1720 HydrophobicContact CD2-CG 3.99Å; F1716-E1720 HydrophobicContact CE1-CG 4.42Å; F1716-E1720 HydrophobicContact CE2-CG 4.36Å; F1716-E1720 HydrophobicContact CG-CG 3.83Å; T1718-E1720 PolarHBondContact O-N 3.2Å; T1718-E1720 VanDerWaalsContact O-N 3.09Å; T1718-E1720 PolarHBondContact OG1-OE1 3.03Å; E1720-S1722 PolarHBondContact O-N 3.05Å; E1720-W1727 HydrophobicContact CB-CZ2 3.82Å; E1720-W1727 HydrophobicContact CG-CZ2 3.93Å; E1720-W1727 PolarHBondContact OE2-NE1 2.94Å; E1720-A1732 VanDerWaalsContact CD-CB 3.43Å; E1720-A1732 HydrophobicContact CG-CB 3.74Å; E1720-A1732 WeakPolarHBondContact OE1-CA 3.22Å
1721	R	75.9	Confident	80.5	Confident	155.2 Å²	155.2	74.3 Å²	74.3	59%	0.586	35%	0.347	S	S	*	.			trans	-90.2	25.7	178.8	-64	-169.3	-179.7	-174.5	-0	113.4	Y1619 E1719 I1723 N1724 W1727 D1731 A1732	Y1619-R1721 VanDerWaalsContact OH-C 3.25Å; Y1619-R1721 VanDerWaalsContact OH-CA 3.29Å; Y1619-R1721 WeakPolarHBondContact OH-CA 3.37Å; E1719-R1721 PolarHBondContact O-N 3.11Å; R1721-I1723 VanDerWaalsContact C-N 3.3Å; R1721-I1723 PolarHBondContact O-N 3.05Å; R1721-N1724 HydrophobicContact CB-CB 4.39Å; R1721-N1724 WeakPolarHBondContact O-CB 3.32Å; R1721-N1724 PolarHBondContact O-N 2.92Å; R1721-W1727 WeakPolarHBondContact O-CB 3.3Å; R1721-D1731 WeakPolarHBondContact CD-O 3.44Å; R1721-D1731 PolarHBondContact NH1-O 2.92Å; R1721-D1731 IonicContact NH1-OD1 2.88Å; R1721-A1732 HydrophobicContact CB-CB 4.13Å
1722	S	76	Confident	79.9	Confident	5.8 Å²	5.8	72.2 Å²	72.2	4%	0.041	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-23.3	-173.9	67.5	0	0	0	0	115	R1617 Y1619 F1654 F1716 E1719 E1720 N1724	R1617-S1722 WeakPolarHBondContact CD-O 3.36Å; R1617-S1722 WeakPolarHBondContact CG-O 2.91Å; Y1619-S1722 WeakPolarHBondContact CE2-OG 3.42Å; Y1619-S1722 PolarHBondContact OH-N 3.01Å; Y1619-S1722 VanDerWaalsContact OH-N 3.11Å; F1654-S1722 VanDerWaalsContact O-CB 3.26Å; F1654-S1722 WeakPolarHBondContact O-CB 3.41Å; F1654-S1722 PolarHBondContact O-OG 3.23Å; F1716-S1722 WeakPolarHBondContact CE2-O 3.48Å; E1719-S1722 WeakPolarHBondContact O-CB 3.3Å; E1719-S1722 PolarHBondContact O-N 2.9Å; E1719-S1722 PolarHBondContact O-OG 3.26Å; E1720-S1722 PolarHBondContact O-N 3.05Å; S1722-N1724 VanDerWaalsContact C-N 3.32Å
1723	I	75.4	Confident	79.5	Confident	29 Å²	29	77.3 Å²	77.3	15%	0.149	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-20.8	179.7	-81.2	177.2	0	0	0	112.9	R1585 R1587 R1617 Y1619 F1654 N1656 R1721 W1725	R1585-I1723 HydrophobicContact CB-CG1 4.41Å; R1585-I1723 PolarHBondContact NH1-O 2.97Å; R1587-I1723 HydrophobicContact CG-CD1 3.81Å; R1587-I1723 VanDerWaalsContact NH2-CG2 3.28Å; R1617-I1723 HydrophobicContact CB-CG2 4.06Å; R1617-I1723 HydrophobicContact CG-CG2 4.39Å; R1617-I1723 WeakPolarHBondContact O-CG1 3.25Å; Y1619-I1723 HydrophobicContact CD1-CD1 4.07Å; Y1619-I1723 HydrophobicContact CD1-CG1 3.7Å; Y1619-I1723 HydrophobicContact CD2-CB 4.02Å; Y1619-I1723 HydrophobicContact CD2-CD1 3.6Å; Y1619-I1723 VanDerWaalsContact CD2-CD1 3.43Å; Y1619-I1723 HydrophobicContact CD2-CG1 3.87Å; Y1619-I1723 HydrophobicContact CE1-CB 4.22Å; Y1619-I1723 HydrophobicContact CE1-CD1 3.95Å; Y1619-I1723 HydrophobicContact CE1-CG1 3.78Å; Y1619-I1723 HydrophobicContact CE1-CG2 4.12Å; Y1619-I1723 HydrophobicContact CE2-CB 3.89Å; Y1619-I1723 HydrophobicContact CE2-CD1 3.61Å; Y1619-I1723 VanDerWaalsContact CE2-CD1 3.42Å; Y1619-I1723 HydrophobicContact CE2-CG1 3.72Å; Y1619-I1723 HydrophobicContact CE2-CG2 4.14Å; Y1619-I1723 HydrophobicContact CG-CD1 3.76Å; Y1619-I1723 HydrophobicContact CG-CG1 3.98Å; Y1619-I1723 VanDerWaalsContact OH-CG2 3.23Å; Y1619-I1723 WeakPolarHBondContact OH-CG2 3.18Å; Y1619-I1723 PolarHBondContact OH-N 3.44Å; F1654-I1723 WeakPolarHBondContact O-CD1 3.21Å; F1654-I1723 WeakPolarHBondContact O-CG1 3.26Å; N1656-I1723 HydrophobicContact CB-CD1 3.34Å; N1656-I1723 HydrophobicContact CB-CG1 4.33Å; N1656-I1723 VanDerWaalsContact N-CD1 3.33Å; R1721-I1723 VanDerWaalsContact C-N 3.3Å; R1721-I1723 PolarHBondContact O-N 3.05Å; I1723-W1725 PolarHBondContact O-N 3.39Å
1724	N	74.8	Confident	79.3	Confident	76.2 Å²	76.2	78.6 Å²	78.6	41%	0.407	37%	0.368	S	S	.	.	S	Bend	trans	-82.3	123.6	-175.7	-84.1	-5.4	0	0	0	111.4	R1585 R1721 S1722 E1726 W1727	R1585-N1724 PolarHBondContact NH1-O 3.15Å; R1721-N1724 HydrophobicContact CB-CB 4.39Å; R1721-N1724 WeakPolarHBondContact O-CB 3.32Å; R1721-N1724 PolarHBondContact O-N 2.92Å; S1722-N1724 VanDerWaalsContact C-N 3.32Å; N1724-E1726 VanDerWaalsContact C-N 3.28Å; N1724-E1726 PolarHBondContact O-N 2.78Å; N1724-E1726 VanDerWaalsContact O-N 3.11Å; N1724-W1727 HydrophobicContact CB-CB 4.43Å; N1724-W1727 PolarHBondContact ND2-NE1 2.99Å; N1724-W1727 PolarHBondContact O-N 3.12Å; N1724-W1727 VanDerWaalsContact O-N 3.14Å
1725	W	71.6	Confident	79.1	Confident	178 Å²	178	78 Å²	78	67%	0.674	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-25	-175.7	70.9	-89.7	0	0	0	113.4	F1654 F1716 I1723 W1727 R1728 P1729 A1732	F1654-W1725 AromaticContact CD1-CE2 3.71Å; F1654-W1725 AromaticContact CD1-CZ2 3.92Å; F1654-W1725 HydrophobicContact CD1-CZ2 3.92Å; F1654-W1725 AromaticContact CD1-NE1 3.36Å; F1654-W1725 HydrophobicContact CE1-CD2 4.35Å; F1654-W1725 AromaticContact CE1-CE2 3.51Å; F1654-W1725 HydrophobicContact CE1-CH2 4.1Å; F1654-W1725 AromaticContact CE1-CZ2 3.36Å; F1654-W1725 HydrophobicContact CE1-CZ2 3.36Å; F1654-W1725 AromaticContact CE1-NE1 3.69Å; F1654-W1725 HydrophobicContact CE2-CZ2 4.25Å; F1654-W1725 HydrophobicContact CZ-CH2 4.11Å; F1654-W1725 AromaticContact CZ-CZ2 3.56Å; F1654-W1725 HydrophobicContact CZ-CZ2 3.56Å; F1716-W1725 HydrophobicContact CE1-CB 4.48Å; F1716-W1725 HydrophobicContact CZ-CG 4.24Å; I1723-W1725 PolarHBondContact O-N 3.39Å; W1725-W1727 PolarHBondContact O-N 3.14Å; W1725-R1728 CarbonylContact O-C 3.59Å; W1725-R1728 PolarHBondContact O-N 3.09Å; W1725-P1729 WeakPolarHBondContact O-CA 3.1Å; W1725-A1732 HydrophobicContact CB-CB 4.42Å
1726	E	75.2	Confident	79	Confident	122.8 Å²	122.8	83.9 Å²	83.9	57%	0.574	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-21.7	179.3	-76.7	172.8	-179.8	0	0	113.3	R1617 N1724	R1617-E1726 IonicContact CZ-OE1 3.39Å; R1617-E1726 IonicContact NH2-OE1 3.7Å; R1617-E1726 PolarHBondContact NH2-OE1 3.47Å; R1617-E1726 IonicContact NH2-OE2 2.79Å; N1724-E1726 VanDerWaalsContact C-N 3.28Å; N1724-E1726 PolarHBondContact O-N 2.78Å; N1724-E1726 VanDerWaalsContact O-N 3.11Å
1727	W	74.5	Confident	78.7	Confident	87.8 Å²	87.8	84.5 Å²	84.5	33%	0.333	40%	0.4	S	S	.	.			trans	-78.4	127.9	-175.8	-142	89.3	0	0	0	111.7	F1654 F1716 E1720 R1721 N1724 W1725 P1729 D1731 A1732	F1654-W1727 HydrophobicContact CB-CZ3 4.49Å; F1654-W1727 AromaticContact CD1-CH2 3.78Å; F1654-W1727 HydrophobicContact CD1-CH2 3.78Å; F1654-W1727 AromaticContact CD1-CZ3 3.97Å; F1654-W1727 HydrophobicContact CD1-CZ3 4.1Å; F1654-W1727 HydrophobicContact CE1-CH2 4.26Å; F1654-W1727 HydrophobicContact CG-CH2 4.4Å; F1654-W1727 HydrophobicContact CG-CZ3 4.41Å; F1716-W1727 HydrophobicContact CE2-CH2 4.25Å; F1716-W1727 HydrophobicContact CE2-CZ2 4.4Å; F1716-W1727 AromaticContact CZ-CH2 3.88Å; F1716-W1727 HydrophobicContact CZ-CH2 3.88Å; F1716-W1727 HydrophobicContact CZ-CZ2 4.04Å; E1720-W1727 HydrophobicContact CB-CZ2 3.82Å; E1720-W1727 HydrophobicContact CG-CZ2 3.93Å; E1720-W1727 PolarHBondContact OE2-NE1 2.94Å; R1721-W1727 WeakPolarHBondContact O-CB 3.3Å; N1724-W1727 HydrophobicContact CB-CB 4.43Å; N1724-W1727 PolarHBondContact ND2-NE1 2.99Å; N1724-W1727 PolarHBondContact O-N 3.12Å; N1724-W1727 VanDerWaalsContact O-N 3.14Å; W1725-W1727 PolarHBondContact O-N 3.14Å; W1727-P1729 HydrophobicContact CH2-CB 4.2Å; W1727-P1729 HydrophobicContact CH2-CG 4.2Å; W1727-P1729 HydrophobicContact CZ3-CB 4.43Å; W1727-P1729 HydrophobicContact CZ3-CG 3.97Å; W1727-D1731 HydrophobicContact CE3-CB 4.16Å; W1727-A1732 HydrophobicContact CZ2-CB 4.05Å
1728	R	74.8	Confident	78.5	Confident	162.6 Å²	162.6	86 Å²	86	61%	0.614	42%	0.416	S	S	*	.			trans	-113.8	131.4	176.8	-62.6	-176.2	-178.2	-172.8	1.3	110	W1725 E1730 D1731	W1725-R1728 CarbonylContact O-C 3.59Å; W1725-R1728 PolarHBondContact O-N 3.09Å; R1728-E1730 HydrophobicContact CB-CB 4.39Å; R1728-E1730 PolarHBondContact O-N 3.21Å; R1728-E1730 VanDerWaalsContact O-N 3.13Å; R1728-D1731 HydrophobicContact CB-CB 4.22Å; R1728-D1731 VanDerWaalsContact CB-OD2 3.32Å; R1728-D1731 WeakPolarHBondContact CB-OD2 3.43Å; R1728-D1731 WeakPolarHBondContact CD-OD2 3.22Å; R1728-D1731 PolarHBondContact N-OD2 3.26Å; R1728-D1731 IonicContact NH1-OD2 3.51Å; R1728-D1731 PolarHBondContact O-N 3.06Å; R1728-D1731 VanDerWaalsContact O-N 3.11Å
1729	P	71.8	Confident	78.3	Confident	68.4 Å²	68.4	88 Å²	88	44%	0.444	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-57.7	-26.1	175.9	-24.3	33.5	0	0	0	113.9	F1654 W1725 W1727 D1731 A1732	F1654-P1729 HydrophobicContact CE1-CB 4.18Å; F1654-P1729 HydrophobicContact CE1-CG 4.14Å; F1654-P1729 HydrophobicContact CZ-CG 4.27Å; W1725-P1729 WeakPolarHBondContact O-CA 3.1Å; W1727-P1729 HydrophobicContact CH2-CB 4.2Å; W1727-P1729 HydrophobicContact CH2-CG 4.2Å; W1727-P1729 HydrophobicContact CZ3-CB 4.43Å; W1727-P1729 HydrophobicContact CZ3-CG 3.97Å; P1729-D1731 VanDerWaalsContact C-N 3.27Å; P1729-D1731 PolarHBondContact O-N 3.08Å; P1729-A1732 WeakPolarHBondContact O-CB 3.41Å; P1729-A1732 PolarHBondContact O-N 3.18Å
1730	E	75.4	Confident	78.2	Confident	172 Å²	172	92.1 Å²	92.1	80%	0.804	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-64.5	-25	178.9	-63.9	172.5	-171.9	0	0	113.3	R1728 A1732	R1728-E1730 HydrophobicContact CB-CB 4.39Å; R1728-E1730 PolarHBondContact O-N 3.21Å; R1728-E1730 VanDerWaalsContact O-N 3.13Å; E1730-A1732 VanDerWaalsContact C-N 3.3Å; E1730-A1732 PolarHBondContact O-N 2.77Å
1731	D	75.5	Confident	78.3	Confident	95 Å²	95	90.4 Å²	90.4	51%	0.508	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-81.9	-12.4	-177.9	-62.4	-38.3	0	0	0	112.6	R1721 W1727 R1728 P1729 Q1733	R1721-D1731 WeakPolarHBondContact CD-O 3.44Å; R1721-D1731 PolarHBondContact NH1-O 2.92Å; R1721-D1731 IonicContact NH1-OD1 2.88Å; W1727-D1731 HydrophobicContact CE3-CB 4.16Å; R1728-D1731 HydrophobicContact CB-CB 4.22Å; R1728-D1731 VanDerWaalsContact CB-OD2 3.32Å; R1728-D1731 WeakPolarHBondContact CB-OD2 3.43Å; R1728-D1731 WeakPolarHBondContact CD-OD2 3.22Å; R1728-D1731 PolarHBondContact N-OD2 3.26Å; R1728-D1731 IonicContact NH1-OD2 3.51Å; R1728-D1731 PolarHBondContact O-N 3.06Å; R1728-D1731 VanDerWaalsContact O-N 3.11Å; P1729-D1731 VanDerWaalsContact C-N 3.27Å; P1729-D1731 PolarHBondContact O-N 3.08Å; D1731-Q1733 PolarHBondContact O-N 2.92Å; D1731-Q1733 VanDerWaalsContact O-N 3.1Å
1732	A	77.3	Confident	78.6	Confident	15.8 Å²	15.8	83.6 Å²	83.6	13%	0.131	41%	0.405	C	S	.	.	S	Bend	trans	-83.4	134.6	-172.2	0	0	0	0	0	112.5	F1716 E1720 R1721 W1725 W1727 P1729 E1730 L1734	F1716-A1732 HydrophobicContact CD1-CB 3.55Å; F1716-A1732 VanDerWaalsContact CD1-CB 3.5Å; F1716-A1732 HydrophobicContact CE1-CB 3.45Å; F1716-A1732 HydrophobicContact CZ-CB 4.16Å; E1720-A1732 VanDerWaalsContact CD-CB 3.43Å; E1720-A1732 HydrophobicContact CG-CB 3.74Å; E1720-A1732 WeakPolarHBondContact OE1-CA 3.22Å; R1721-A1732 HydrophobicContact CB-CB 4.13Å; W1725-A1732 HydrophobicContact CB-CB 4.42Å; W1727-A1732 HydrophobicContact CZ2-CB 4.05Å; P1729-A1732 WeakPolarHBondContact O-CB 3.41Å; P1729-A1732 PolarHBondContact O-N 3.18Å; E1730-A1732 VanDerWaalsContact C-N 3.3Å; E1730-A1732 PolarHBondContact O-N 2.77Å; A1732-L1734 PolarHBondContact O-N 2.84Å; A1732-L1734 VanDerWaalsContact O-N 3.14Å
1733	Q	82.1	Confident	78.9	Confident	114.6 Å²	114.6	86.2 Å²	86.2	54%	0.536	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-80.2	114.9	173.6	-171.1	174.3	-5.9	0	0	110.3	F1716 V1717 T1718 D1731	F1716-Q1733 WeakPolarHBondContact CA-O 3.41Å; V1717-Q1733 HydrophobicContact CB-CB 4.44Å; V1717-Q1733 HydrophobicContact CB-CG 4.2Å; V1717-Q1733 HydrophobicContact CG2-CG 4.25Å; V1717-Q1733 PolarHBondContact N-O 2.98Å; V1717-Q1733 VanDerWaalsContact N-O 3.08Å; T1718-Q1733 HydrophobicContact CG2-CB 4.44Å; D1731-Q1733 PolarHBondContact O-N 2.92Å; D1731-Q1733 VanDerWaalsContact O-N 3.1Å
1734	L	85.4	Confident	79	Confident	83.2 Å²	83.2	87 Å²	87	44%	0.436	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	134.1	-179.2	-63.5	176.1	0	0	0	111.4	P1714 Y1715 F1716 A1732	P1714-L1734 HydrophobicContact CB-CB 4.1Å; P1714-L1734 HydrophobicContact CB-CD1 4.27Å; P1714-L1734 HydrophobicContact CB-CD2 4.13Å; P1714-L1734 HydrophobicContact CB-CG 4.4Å; P1714-L1734 HydrophobicContact CG-CD1 4.15Å; P1714-L1734 HydrophobicContact CG-CD2 4.22Å; Y1715-L1734 CarbonylContact O-C 3.47Å; Y1715-L1734 WeakPolarHBondContact O-CA 3.39Å; F1716-L1734 HydrophobicContact CD1-CD2 3.67Å; F1716-L1734 HydrophobicContact CE1-CD2 3.61Å; F1716-L1734 VanDerWaalsContact CE1-CD2 3.5Å; A1732-L1734 PolarHBondContact O-N 2.84Å; A1732-L1734 VanDerWaalsContact O-N 3.14Å
1735	G	85	Confident	79.2	Confident	10.4 Å²	10.4	90.7 Å²	90.7	11%	0.107	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	157.3	169.1	0	0	0	0	0	111.2	P1714 Y1715	P1714-G1735 CarbonylContact C-O 3.57Å; P1714-G1735 VanDerWaalsContact CA-O 3.3Å; P1714-G1735 WeakPolarHBondContact CA-O 3.43Å; P1714-G1735 WeakPolarHBondContact CB-O 3.32Å; Y1715-G1735 VanDerWaalsContact CD1-C 3.49Å; Y1715-G1735 VanDerWaalsContact CD1-O 3.26Å; Y1715-G1735 WeakPolarHBondContact CD1-O 3.41Å; Y1715-G1735 VanDerWaalsContact CE1-C 3.44Å; Y1715-G1735 PolarHBondContact N-O 3.26Å; Y1715-G1735 PolarHBondContact O-N 3.15Å
1736	M	86.9	Confident	79.6	Confident	135 Å²	135	84.8 Å²	84.8	67%	0.665	42%	0.42	S	S	*	.			trans	-128.5	131	172.3	-66.5	-172.6	179.3	0	0	108.7
1737	V	82.9	Confident	80	Confident	17 Å²	17	79 Å²	79	10%	0.103	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-87.2	123	173.6	-178.3	0	0	0	0	108.7	E1691 L1695 N1713 Y1715	E1691-V1737 HydrophobicContact CB-CG1 4.43Å; E1691-V1737 HydrophobicContact CB-CG2 4.45Å; L1695-V1737 HydrophobicContact CD1-CG1 3.61Å; L1695-V1737 HydrophobicContact CD2-CG1 4.06Å; L1695-V1737 HydrophobicContact CG-CG1 3.79Å; N1713-V1737 PolarHBondContact ND2-O 3.21Å; N1713-V1737 PolarHBondContact OD1-N 2.88Å; Y1715-V1737 HydrophobicContact CD1-CG2 3.85Å; Y1715-V1737 HydrophobicContact CE1-CG2 3.5Å; Y1715-V1737 VanDerWaalsContact CE1-CG2 3.47Å
1738	A	81.5	Confident	80.6	Confident	69.2 Å²	69.2	77.8 Å²	77.8	57%	0.572	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-84.1	144.5	169.3	0	0	0	0	0	110.3	E1691 E1740	E1691-A1738 PolarHBondContact OE2-N 2.82Å; A1738-E1740 PolarHBondContact O-N 3.13Å
1739	Y	81	Confident	81.2	Confident	96.2 Å²	96.2	70.2 Å²	70.2	38%	0.377	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-73.1	123.6	171.9	170.1	-95.3	0	0	0	109.8	E1741 R1750 Y1752	Y1739-E1741 HydrophobicContact CE1-CB 4.37Å; Y1739-E1741 HydrophobicContact CE1-CG 3.9Å; Y1739-E1741 PolarHBondContact OH-OE2 3.31Å; Y1739-R1750 HydrophobicContact CE2-CB 4.39Å; Y1739-R1750 WeakPolarHBondContact OH-CB 3.32Å; Y1739-R1750 PolarHBondContact OH-O 3.2Å; Y1739-Y1752 HydrophobicContact CD1-CD2 4.37Å; Y1739-Y1752 HydrophobicContact CD1-CE2 4.37Å; Y1739-Y1752 AromaticContact CE1-CD2 3.59Å; Y1739-Y1752 HydrophobicContact CE1-CD2 3.59Å; Y1739-Y1752 AromaticContact CE1-CE2 3.82Å; Y1739-Y1752 HydrophobicContact CE1-CE2 3.93Å; Y1739-Y1752 HydrophobicContact CE2-CD2 4.31Å; Y1739-Y1752 HydrophobicContact CE2-CE2 4.2Å; Y1739-Y1752 AromaticContact CZ-CD2 3.68Å; Y1739-Y1752 VanDerWaalsContact CZ-CD2 3.48Å; Y1739-Y1752 AromaticContact CZ-CE2 3.82Å; Y1739-Y1752 WeakPolarHBondContact OH-CD2 3.43Å
1740	E	80	Confident	82.1	Confident	157.8 Å²	157.8	68.3 Å²	68.3	74%	0.737	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-104.5	133.2	173.5	-170	173.1	-174.1	0	0	109.9	A1738	A1738-E1740 PolarHBondContact O-N 3.13Å
1741	E	81.7	Confident	82.8	Confident	46 Å²	46	60.2 Å²	60.2	22%	0.215	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-73.7	135.4	179.6	-135.3	144	-164.5	0	0	110.8	Y1739 S1743 L1751 Y1752 K1753	Y1739-E1741 HydrophobicContact CE1-CB 4.37Å; Y1739-E1741 HydrophobicContact CE1-CG 3.9Å; Y1739-E1741 PolarHBondContact OH-OE2 3.31Å; E1741-S1743 PolarHBondContact O-N 3.4Å; E1741-L1751 HydrophobicContact CG-CD1 4.13Å; E1741-L1751 WeakPolarHBondContact OE1-CA 3.17Å; E1741-L1751 VanDerWaalsContact OE1-CD1 3.32Å; E1741-L1751 WeakPolarHBondContact OE1-CD1 3.41Å; E1741-Y1752 VanDerWaalsContact OE1-CB 3.26Å; E1741-Y1752 WeakPolarHBondContact OE1-CB 3.38Å; E1741-Y1752 PolarHBondContact OE1-N 3.02Å; E1741-Y1752 PolarHBondContact OE2-N 2.79Å; E1741-K1753 VanDerWaalsContact CD-CE 3.42Å; E1741-K1753 HydrophobicContact CG-CB 4.24Å; E1741-K1753 HydrophobicContact CG-CD 4.04Å; E1741-K1753 HydrophobicContact CG-CG 4.29Å; E1741-K1753 WeakPolarHBondContact OE1-CA 3.15Å; E1741-K1753 VanDerWaalsContact OE1-CB 3.26Å; E1741-K1753 WeakPolarHBondContact OE1-CB 3.43Å; E1741-K1753 VanDerWaalsContact OE1-CD 3.29Å; E1741-K1753 WeakPolarHBondContact OE1-CD 3.31Å; E1741-K1753 WeakPolarHBondContact OE1-CE 3.46Å; E1741-K1753 WeakPolarHBondContact OE1-CG 3.39Å; E1741-K1753 PolarHBondContact OE1-N 2.97Å; E1741-K1753 IonicContact OE1-NZ 3.59Å; E1741-K1753 WeakPolarHBondContact OE2-CB 3.36Å; E1741-K1753 WeakPolarHBondContact OE2-CD 3.48Å; E1741-K1753 WeakPolarHBondContact OE2-CE 3.33Å; E1741-K1753 WeakPolarHBondContact OE2-CG 3.29Å; E1741-K1753 IonicContact OE2-NZ 2.85Å; E1741-K1753 PolarHBondContact OE2-NZ 3.24Å
1742	P	82.1	Confident	83.5	Confident	12.4 Å²	12.4	60.5 Å²	60.5	8%	0.081	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-61.5	141.2	-179.3	26.3	-36.5	0	0	0	111.8	D1746 H1748 R1750 L1751	P1742-D1746 WeakPolarHBondContact CB-O 3.37Å; P1742-H1748 WeakPolarHBondContact CB-O 3.34Å; P1742-H1748 VanDerWaalsContact CG-O 3.29Å; P1742-H1748 WeakPolarHBondContact CG-O 3.24Å; P1742-R1750 VanDerWaalsContact CD-O 3.28Å; P1742-R1750 WeakPolarHBondContact CD-O 3.36Å; P1742-R1750 WeakPolarHBondContact CG-O 3.37Å; P1742-L1751 HydrophobicContact CG-CD1 3.99Å
1743	S	81.5	Confident	84.1	Confident	61.6 Å²	61.6	66.2 Å²	66.2	43%	0.431	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-73	155.9	176.2	100.3	0	0	0	0	111.3	E1741 Y1745 D1746	E1741-S1743 PolarHBondContact O-N 3.4Å; S1743-Y1745 PolarHBondContact O-N 2.83Å; S1743-Y1745 VanDerWaalsContact O-N 3.08Å; S1743-Y1745 PolarHBondContact OG-N 2.97Å; S1743-D1746 CarbonylContact O-C 3.31Å; S1743-D1746 VanDerWaalsContact O-C 3.28Å; S1743-D1746 PolarHBondContact O-N 3.04Å; S1743-D1746 VanDerWaalsContact O-N 3.13Å; S1743-D1746 PolarHBondContact OG-N 3.1Å
1744	V	78.9	Confident	84.6	Confident	44 Å²	44	64.2 Å²	64.2	27%	0.267	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.7	175.7	-173.3	0	0	0	0	112.4	L1755 L1757 Y1777	V1744-L1755 HydrophobicContact CG2-CB 4.45Å; V1744-L1755 HydrophobicContact CG2-CD1 4.18Å; V1744-L1755 HydrophobicContact CG2-CD2 4.09Å; V1744-L1755 HydrophobicContact CG2-CG 4.34Å; V1744-L1757 HydrophobicContact CG1-CD2 3.61Å; V1744-Y1777 HydrophobicContact CG1-CE1 3.83Å; V1744-Y1777 VanDerWaalsContact O-CD1 3.27Å; V1744-Y1777 WeakPolarHBondContact O-CD1 3.42Å; V1744-Y1777 VanDerWaalsContact O-CE1 3.3Å; V1744-Y1777 WeakPolarHBondContact O-CE1 3.32Å
1745	Y	77.3	Confident	84.8	Confident	154.6 Å²	154.6	61.8 Å²	61.8	61%	0.606	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-16.4	-179.3	-60.2	-74.6	0	0	0	114.1	S1743 Q1760	S1743-Y1745 PolarHBondContact O-N 2.83Å; S1743-Y1745 VanDerWaalsContact O-N 3.08Å; S1743-Y1745 PolarHBondContact OG-N 2.97Å; Y1745-Q1760 VanDerWaalsContact CE1-NE2 3.31Å; Y1745-Q1760 PolarHBondContact OH-NE2 3.18Å
1746	D	80.4	Confident	85.1	Confident	54.4 Å²	54.4	64.5 Å²	64.5	29%	0.291	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-143.1	77	-179.3	-171.8	24	0	0	0	108.6	P1742 S1743 H1748	P1742-D1746 WeakPolarHBondContact CB-O 3.37Å; S1743-D1746 CarbonylContact O-C 3.31Å; S1743-D1746 VanDerWaalsContact O-C 3.28Å; S1743-D1746 PolarHBondContact O-N 3.04Å; S1743-D1746 VanDerWaalsContact O-N 3.13Å; S1743-D1746 PolarHBondContact OG-N 3.1Å; D1746-H1748 PolarHBondContact O-N 2.96Å; D1746-H1748 PolarHBondContact O-ND1 3.09Å; D1746-H1748 IonicContact OD1-ND1 3.24Å; D1746-H1748 IonicContact OD2-CE1 3.06Å; D1746-H1748 PolarHBondContact OD2-CE1 3.29Å; D1746-H1748 IonicContact OD2-ND1 3.19Å; D1746-H1748 PolarHBondContact OD2-ND1 3.02Å
1747	L	84.9	Confident	85.2	Confident	1.6 Å²	1.6	58 Å²	58	1%	0.008	30%	0.295	C	S	.	.			trans	-76.7	114.8	-179.7	-67.9	170.3	0	0	0	109.2	L1755 L1757 I1779 L1783	L1747-L1755 HydrophobicContact CD2-CD1 3.78Å; L1747-L1757 HydrophobicContact CD1-CD1 3.88Å; L1747-L1757 HydrophobicContact CD1-CD2 3.88Å; L1747-L1757 HydrophobicContact CD1-CG 4.42Å; L1747-I1779 HydrophobicContact CB-CG1 4.34Å; L1747-I1779 WeakPolarHBondContact O-CG2 3.38Å; L1747-L1783 HydrophobicContact CB-CD1 4.27Å; L1747-L1783 HydrophobicContact CB-CD2 4.26Å; L1747-L1783 HydrophobicContact CD1-CD2 4.39Å
1748	H	86.8	Confident	85.5	Confident	62 Å²	62	62.8 Å²	62.8	29%	0.287	31%	0.314	S	S	.	.			trans	-152.6	165.1	177.7	61	-86.1	0	0	0	111	P1742 D1746 K1781	P1742-H1748 WeakPolarHBondContact CB-O 3.34Å; P1742-H1748 VanDerWaalsContact CG-O 3.29Å; P1742-H1748 WeakPolarHBondContact CG-O 3.24Å; D1746-H1748 PolarHBondContact O-N 2.96Å; D1746-H1748 PolarHBondContact O-ND1 3.09Å; D1746-H1748 IonicContact OD1-ND1 3.24Å; D1746-H1748 IonicContact OD2-CE1 3.06Å; D1746-H1748 PolarHBondContact OD2-CE1 3.29Å; D1746-H1748 IonicContact OD2-ND1 3.19Å; D1746-H1748 PolarHBondContact OD2-ND1 3.02Å; H1748-K1781 HydrophobicContact CB-CB 3.91Å; H1748-K1781 HydrophobicContact CB-CD 4.34Å; H1748-K1781 HydrophobicContact CB-CG 4.44Å
1749	G	87.2	Confident	85.6	Confident	2.4 Å²	2.4	63.1 Å²	63.1	3%	0.025	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61.2	-147.9	175.6	0	0	0	0	0	113	D1702 D1782 L1783 T1784	D1702-G1749 VanDerWaalsContact O-CA 3.31Å; D1702-G1749 WeakPolarHBondContact O-CA 3.23Å; D1702-G1749 PolarHBondContact O-N 3.28Å; D1702-G1749 WeakPolarHBondContact OD1-CA 3.19Å; G1749-D1782 WeakPolarHBondContact CA-O 3.44Å; G1749-D1782 PolarHBondContact N-O 3.05Å; G1749-L1783 CarbonylContact O-C 3.49Å; G1749-L1783 WeakPolarHBondContact O-CA 3.17Å; G1749-T1784 PolarHBondContact O-N 2.98Å
1750	R	89.9	Confident	85.4	Confident	29.8 Å²	29.8	60.8 Å²	60.8	11%	0.112	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	142.6	179.1	-70.2	164.9	-65.8	152.7	-2.5	111.8	F1675 F1701 D1702 L1709 Y1739 P1742 Y1752 T1784 M1786	F1675-R1750 VanDerWaalsContact CE2-CD 3.44Å; F1675-R1750 HydrophobicContact CE2-CG 4.3Å; F1675-R1750 HydrophobicContact CZ-CG 4.36Å; F1701-R1750 HydrophobicContact CD1-CG 4.06Å; F1701-R1750 HydrophobicContact CE1-CG 3.72Å; D1702-R1750 WeakPolarHBondContact OD1-CD 3.3Å; D1702-R1750 VanDerWaalsContact OD1-CG 3.24Å; D1702-R1750 WeakPolarHBondContact OD1-CG 3.36Å; D1702-R1750 IonicContact OD1-CZ 3.43Å; D1702-R1750 PolarHBondContact OD1-N 2.92Å; D1702-R1750 VanDerWaalsContact OD1-N 3.13Å; D1702-R1750 IonicContact OD1-NE 3.25Å; D1702-R1750 PolarHBondContact OD1-NE 3.13Å; D1702-R1750 IonicContact OD1-NH2 3.42Å; D1702-R1750 IonicContact OD2-CZ 3.29Å; D1702-R1750 IonicContact OD2-NE 3.15Å; D1702-R1750 PolarHBondContact OD2-NE 2.98Å; D1702-R1750 IonicContact OD2-NH2 3.18Å; D1702-R1750 PolarHBondContact OD2-NH2 2.99Å; L1709-R1750 VanDerWaalsContact CD1-CZ 3.49Å; Y1739-R1750 HydrophobicContact CE2-CB 4.39Å; Y1739-R1750 WeakPolarHBondContact OH-CB 3.32Å; Y1739-R1750 PolarHBondContact OH-O 3.2Å; P1742-R1750 VanDerWaalsContact CD-O 3.28Å; P1742-R1750 WeakPolarHBondContact CD-O 3.36Å; P1742-R1750 WeakPolarHBondContact CG-O 3.37Å; R1750-Y1752 HydrophobicContact CB-CD2 4.44Å; R1750-Y1752 HydrophobicContact CB-CE2 3.97Å; R1750-Y1752 PolarHBondContact NH1-OH 3Å; R1750-Y1752 VanDerWaalsContact NH1-OH 3.13Å; R1750-T1784 CarbonylContact C-O 3.57Å; R1750-T1784 WeakPolarHBondContact CA-O 3.42Å; R1750-M1786 HydrophobicContact CB-CE 4.22Å; R1750-M1786 HydrophobicContact CB-CG 3.99Å; R1750-M1786 HydrophobicContact CB-SD 4.26Å; R1750-M1786 HydrophobicContact CG-CE 3.46Å; R1750-M1786 VanDerWaalsContact CG-CE 3.46Å; R1750-M1786 HydrophobicContact CG-CG 4.22Å; R1750-M1786 HydrophobicContact CG-SD 3.89Å
1751	L	90.6	Very high	84.9	Confident	0.2 Å²	0.2	59.6 Å²	59.6	0%	0.001	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	111.7	173	-178	71.3	0	0	0	109.9	E1741 P1742 K1753 L1755 L1783 T1784 M1786 A1789 L1791	E1741-L1751 HydrophobicContact CG-CD1 4.13Å; E1741-L1751 WeakPolarHBondContact OE1-CA 3.17Å; E1741-L1751 VanDerWaalsContact OE1-CD1 3.32Å; E1741-L1751 WeakPolarHBondContact OE1-CD1 3.41Å; P1742-L1751 HydrophobicContact CG-CD1 3.99Å; L1751-K1753 VanDerWaalsContact CD1-O 3.24Å; L1751-K1753 WeakPolarHBondContact CD1-O 3.43Å; L1751-K1753 VanDerWaalsContact CG-O 3.26Å; L1751-K1753 WeakPolarHBondContact CG-O 3.3Å; L1751-L1755 HydrophobicContact CD1-CD1 3.35Å; L1751-L1755 HydrophobicContact CD1-CG 3.83Å; L1751-L1755 HydrophobicContact CD2-CB 4.39Å; L1751-L1755 HydrophobicContact CD2-CD1 4.14Å; L1751-L1755 HydrophobicContact CD2-CG 4.32Å; L1751-L1755 HydrophobicContact CG-CD1 4.39Å; L1751-L1783 HydrophobicContact CB-CD1 4.42Å; L1751-T1784 PolarHBondContact N-O 3.18Å; L1751-M1786 VanDerWaalsContact O-CB 3.28Å; L1751-M1786 WeakPolarHBondContact O-CB 3.35Å; L1751-M1786 WeakPolarHBondContact O-CG 3.45Å; L1751-M1786 PolarHBondContact O-N 3.04Å; L1751-A1789 VanDerWaalsContact O-CB 3.26Å; L1751-A1789 WeakPolarHBondContact O-CB 3.31Å; L1751-L1791 HydrophobicContact CD2-CB 4.47Å; L1751-L1791 HydrophobicContact CD2-CD1 4.33Å
1752	Y	89.7	Confident	84.1	Confident	101.8 Å²	101.8	62.1 Å²	62.1	40%	0.399	29%	0.294	S	S	.	.			trans	-97.8	-28.2	177.7	-67.8	-82	0	0	0	113	F1675 Y1739 E1741 R1750 M1786 A1789	F1675-Y1752 WeakPolarHBondContact CZ-OH 3.2Å; Y1739-Y1752 HydrophobicContact CD1-CD2 4.37Å; Y1739-Y1752 HydrophobicContact CD1-CE2 4.37Å; Y1739-Y1752 AromaticContact CE1-CD2 3.59Å; Y1739-Y1752 HydrophobicContact CE1-CD2 3.59Å; Y1739-Y1752 AromaticContact CE1-CE2 3.82Å; Y1739-Y1752 HydrophobicContact CE1-CE2 3.93Å; Y1739-Y1752 HydrophobicContact CE2-CD2 4.31Å; Y1739-Y1752 HydrophobicContact CE2-CE2 4.2Å; Y1739-Y1752 AromaticContact CZ-CD2 3.68Å; Y1739-Y1752 VanDerWaalsContact CZ-CD2 3.48Å; Y1739-Y1752 AromaticContact CZ-CE2 3.82Å; Y1739-Y1752 WeakPolarHBondContact OH-CD2 3.43Å; E1741-Y1752 VanDerWaalsContact OE1-CB 3.26Å; E1741-Y1752 WeakPolarHBondContact OE1-CB 3.38Å; E1741-Y1752 PolarHBondContact OE1-N 3.02Å; E1741-Y1752 PolarHBondContact OE2-N 2.79Å; R1750-Y1752 HydrophobicContact CB-CD2 4.44Å; R1750-Y1752 HydrophobicContact CB-CE2 3.97Å; R1750-Y1752 PolarHBondContact NH1-OH 3Å; R1750-Y1752 VanDerWaalsContact NH1-OH 3.13Å; Y1752-M1786 HydrophobicContact CD1-CB 3.8Å; Y1752-M1786 HydrophobicContact CD1-CG 3.91Å; Y1752-M1786 HydrophobicContact CD2-CG 4.48Å; Y1752-M1786 HydrophobicContact CE1-CB 3.96Å; Y1752-M1786 HydrophobicContact CE1-CE 3.78Å; Y1752-M1786 HydrophobicContact CE1-CG 3.7Å; Y1752-M1786 HydrophobicContact CE1-SD 4.42Å; Y1752-M1786 HydrophobicContact CE2-CG 4.36Å; Y1752-M1786 HydrophobicContact CG-CB 4.37Å; Y1752-M1786 HydrophobicContact CG-CG 4.35Å; Y1752-A1789 WeakPolarHBondContact O-CB 3.33Å
1753	K	90.6	Very high	83.1	Confident	135 Å²	135	69.4 Å²	69.4	59%	0.587	32%	0.324	S	S	*	.	S	Bend	trans	-93.3	142.8	176	-69.5	-179.9	-161.4	154.4	0	111.4	E1741 L1751 L1755	E1741-K1753 VanDerWaalsContact CD-CE 3.42Å; E1741-K1753 HydrophobicContact CG-CB 4.24Å; E1741-K1753 HydrophobicContact CG-CD 4.04Å; E1741-K1753 HydrophobicContact CG-CG 4.29Å; E1741-K1753 WeakPolarHBondContact OE1-CA 3.15Å; E1741-K1753 VanDerWaalsContact OE1-CB 3.26Å; E1741-K1753 WeakPolarHBondContact OE1-CB 3.43Å; E1741-K1753 VanDerWaalsContact OE1-CD 3.29Å; E1741-K1753 WeakPolarHBondContact OE1-CD 3.31Å; E1741-K1753 WeakPolarHBondContact OE1-CE 3.46Å; E1741-K1753 WeakPolarHBondContact OE1-CG 3.39Å; E1741-K1753 PolarHBondContact OE1-N 2.97Å; E1741-K1753 IonicContact OE1-NZ 3.59Å; E1741-K1753 WeakPolarHBondContact OE2-CB 3.36Å; E1741-K1753 WeakPolarHBondContact OE2-CD 3.48Å; E1741-K1753 WeakPolarHBondContact OE2-CE 3.33Å; E1741-K1753 WeakPolarHBondContact OE2-CG 3.29Å; E1741-K1753 IonicContact OE2-NZ 2.85Å; E1741-K1753 PolarHBondContact OE2-NZ 3.24Å; L1751-K1753 VanDerWaalsContact CD1-O 3.24Å; L1751-K1753 WeakPolarHBondContact CD1-O 3.43Å; L1751-K1753 VanDerWaalsContact CG-O 3.26Å; L1751-K1753 WeakPolarHBondContact CG-O 3.3Å; K1753-L1755 PolarHBondContact O-N 3.06Å
1754	S	91.4	Very high	81.7	Confident	74 Å²	74	74.2 Å²	74.2	52%	0.517	33%	0.333	S	S	.	.			trans	-68.4	131.6	174.5	-60	0	0	0	0	110.9	K1790	S1754-K1790 CarbonylContact C-O 3.53Å; S1754-K1790 WeakPolarHBondContact CA-O 3.39Å; S1754-K1790 VanDerWaalsContact CB-O 3.27Å; S1754-K1790 WeakPolarHBondContact CB-O 3.32Å; S1754-K1790 WeakPolarHBondContact OG-CB 3.48Å; S1754-K1790 PolarHBondContact OG-N 3.04Å
1755	L	90.6	Very high	80.7	Confident	32.8 Å²	32.8	78.3 Å²	78.3	17%	0.172	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150	-179.2	-68.7	179.9	0	0	0	111.1	V1744 L1747 L1751 K1753 K1790 L1791 T1792	V1744-L1755 HydrophobicContact CG2-CB 4.45Å; V1744-L1755 HydrophobicContact CG2-CD1 4.18Å; V1744-L1755 HydrophobicContact CG2-CD2 4.09Å; V1744-L1755 HydrophobicContact CG2-CG 4.34Å; L1747-L1755 HydrophobicContact CD2-CD1 3.78Å; L1751-L1755 HydrophobicContact CD1-CD1 3.35Å; L1751-L1755 HydrophobicContact CD1-CG 3.83Å; L1751-L1755 HydrophobicContact CD2-CB 4.39Å; L1751-L1755 HydrophobicContact CD2-CD1 4.14Å; L1751-L1755 HydrophobicContact CD2-CG 4.32Å; L1751-L1755 HydrophobicContact CG-CD1 4.39Å; K1753-L1755 PolarHBondContact O-N 3.06Å; L1755-K1790 PolarHBondContact N-O 3.07Å; L1755-L1791 HydrophobicContact CB-CD1 3.96Å; L1755-L1791 WeakPolarHBondContact O-CA 3.23Å; L1755-T1792 PolarHBondContact O-N 3.04Å; L1755-T1792 PolarHBondContact O-OG1 3.09Å
1756	T	91	Very high	79.6	Confident	65.8 Å²	65.8	76.6 Å²	76.6	40%	0.404	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.4	174.9	-39	0	0	0	0	109.9	K1758 T1792 E1794	T1756-K1758 HydrophobicContact CG2-CG 4.22Å; T1756-T1792 CarbonylContact C-O 3.53Å; T1756-T1792 WeakPolarHBondContact CA-O 3.27Å; T1756-T1792 VanDerWaalsContact CA-OG1 3.25Å; T1756-T1792 WeakPolarHBondContact CA-OG1 3.41Å; T1756-T1792 VanDerWaalsContact CB-OG1 3.26Å; T1756-T1792 WeakPolarHBondContact CB-OG1 3.29Å; T1756-T1792 WeakPolarHBondContact CG2-OG1 3.3Å; T1756-T1792 PolarHBondContact OG1-OG1 3.12Å; T1756-E1794 HydrophobicContact CG2-CG 4.04Å
1757	L	89.7	Confident	78	Confident	0.4 Å²	0.4	82 Å²	82	0%	0.002	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	120.3	174	-58.2	-177.1	0	0	0	109.3	V1744 L1747 Y1777 L1791 T1792 I1793 E1794 V1797 I1799	V1744-L1757 HydrophobicContact CG1-CD2 3.61Å; L1747-L1757 HydrophobicContact CD1-CD1 3.88Å; L1747-L1757 HydrophobicContact CD1-CD2 3.88Å; L1747-L1757 HydrophobicContact CD1-CG 4.42Å; L1757-Y1777 HydrophobicContact CB-CD2 4.45Å; L1757-Y1777 HydrophobicContact CB-CE2 4.02Å; L1757-Y1777 HydrophobicContact CD1-CD2 4.49Å; L1757-Y1777 HydrophobicContact CD2-CD1 4.1Å; L1757-Y1777 HydrophobicContact CD2-CD2 4.19Å; L1757-Y1777 HydrophobicContact CD2-CE1 3.98Å; L1757-Y1777 HydrophobicContact CD2-CE2 4.29Å; L1757-Y1777 HydrophobicContact CD2-CG 4.22Å; L1757-L1791 HydrophobicContact CD1-CD1 4.38Å; L1757-L1791 HydrophobicContact CD2-CD1 4.46Å; L1757-L1791 HydrophobicContact CG-CD1 4.17Å; L1757-T1792 PolarHBondContact N-O 3.09Å; L1757-I1793 HydrophobicContact CB-CG2 4.5Å; L1757-I1793 HydrophobicContact CD1-CG1 4.23Å; L1757-E1794 WeakPolarHBondContact O-CB 3.42Å; L1757-E1794 PolarHBondContact O-N 3.19Å; L1757-E1794 VanDerWaalsContact O-N 3.08Å; L1757-V1797 HydrophobicContact CB-CG1 4.35Å; L1757-I1799 HydrophobicContact CD1-CD1 3.79Å; L1757-I1799 HydrophobicContact CD1-CG1 4.42Å
1758	K	88.7	Confident	76.4	Confident	117.8 Å²	117.8	85.4 Å²	85.4	51%	0.512	41%	0.407	S	S	.	.			trans	-111.6	148.2	-178.7	-57.4	-164.8	173.5	179.4	0	110.4	T1756 Q1760 Y1777 E1794	T1756-K1758 HydrophobicContact CG2-CG 4.22Å; K1758-Q1760 PolarHBondContact O-N 3Å; K1758-Y1777 PolarHBondContact N-OH 2.88Å; K1758-Y1777 VanDerWaalsContact O-CE2 3.24Å; K1758-Y1777 WeakPolarHBondContact O-CE2 3.35Å; K1758-Y1777 VanDerWaalsContact O-CZ 3.31Å; K1758-Y1777 PolarHBondContact O-OH 3.03Å; K1758-E1794 WeakPolarHBondContact CA-OE2 2.98Å; K1758-E1794 WeakPolarHBondContact CE-OE1 3.31Å; K1758-E1794 WeakPolarHBondContact CG-OE2 3.26Å
1759	R	83.1	Confident	74.7	Confident	75.4 Å²	75.4	90.1 Å²	90.1	29%	0.285	42%	0.423	S	S	.	.			trans	-65.2	125.1	177.5	-171.8	176.4	135.5	177.9	8.3	111.4	R1761 D1774 G1796 V1797 E1821	R1759-R1761 HydrophobicContact CG-CG 4.43Å; R1759-R1761 VanDerWaalsContact CZ-NE 3.27Å; R1759-R1761 VanDerWaalsContact CZ-NH2 3.34Å; R1759-R1761 VanDerWaalsContact NH2-CZ 3.29Å; R1759-R1761 VanDerWaalsContact NH2-NE 3.1Å; R1759-R1761 PolarHBondContact O-N 3.19Å; R1759-D1774 WeakPolarHBondContact CD-OD2 3.37Å; R1759-D1774 HydrophobicContact CG-CB 4.38Å; R1759-D1774 WeakPolarHBondContact CG-OD1 3.47Å; R1759-D1774 IonicContact CZ-OD1 3.14Å; R1759-D1774 IonicContact CZ-OD2 3.02Å; R1759-D1774 VanDerWaalsContact CZ-OD2 3.24Å; R1759-D1774 IonicContact NE-OD1 3.44Å; R1759-D1774 PolarHBondContact NE-OD1 2.92Å; R1759-D1774 IonicContact NE-OD2 3.36Å; R1759-D1774 PolarHBondContact NE-OD2 2.93Å; R1759-D1774 IonicContact NH2-OD1 3.22Å; R1759-D1774 IonicContact NH2-OD2 3.18Å; R1759-D1774 PolarHBondContact NH2-OD2 3.03Å; R1759-G1796 WeakPolarHBondContact CD-O 3.15Å; R1759-V1797 HydrophobicContact CB-CG2 4.38Å; R1759-E1821 IonicContact CZ-OE1 3.3Å; R1759-E1821 VanDerWaalsContact CZ-OE1 3.22Å; R1759-E1821 IonicContact NH1-OE1 3.15Å; R1759-E1821 PolarHBondContact NH1-OE1 2.95Å; R1759-E1821 IonicContact NH2-OE1 3.9Å; R1759-E1821 PolarHBondContact NH2-OE1 3.05Å
1760	Q	76.5	Confident	73	Confident	47.4 Å²	47.4	98.7 Å²	98.7	22%	0.221	46%	0.456	C	S	.	.			trans	-97	102.5	-179.1	-63.3	-169.5	-1.1	0	0	111.6	Y1745 K1758 K1775 Y1777	Y1745-Q1760 VanDerWaalsContact CE1-NE2 3.31Å; Y1745-Q1760 PolarHBondContact OH-NE2 3.18Å; K1758-Q1760 PolarHBondContact O-N 3Å; Q1760-K1775 HydrophobicContact CB-CB 4.41Å; Q1760-K1775 PolarHBondContact O-N 3.16Å; Q1760-K1775 VanDerWaalsContact O-N 3.11Å; Q1760-Y1777 PolarHBondContact NE2-OH 2.87Å
1761	R	71	Confident	71.3	Confident	133 Å²	133	103.4 Å²	103.4	50%	0.502	48%	0.478	S	S	.	.			trans	-95.7	112.1	172.2	-68.5	-177.8	179.9	-175.2	3.6	110.1	R1759 K1763 F1771 D1774 E1821	R1759-R1761 HydrophobicContact CG-CG 4.43Å; R1759-R1761 VanDerWaalsContact CZ-NE 3.27Å; R1759-R1761 VanDerWaalsContact CZ-NH2 3.34Å; R1759-R1761 VanDerWaalsContact NH2-CZ 3.29Å; R1759-R1761 VanDerWaalsContact NH2-NE 3.1Å; R1759-R1761 PolarHBondContact O-N 3.19Å; R1761-K1763 PolarHBondContact O-N 3.01Å; R1761-F1771 HydrophobicContact CB-CD1 4.39Å; R1761-F1771 HydrophobicContact CB-CE1 4.49Å; R1761-D1774 WeakPolarHBondContact CG-OD1 3.35Å; R1761-E1821 IonicContact NH2-OE1 2.97Å; R1761-E1821 PolarHBondContact NH2-OE1 2.95Å
1762	E	64.9	Low	69.5	Low	97.6 Å²	97.6	109 Å²	109	46%	0.456	50%	0.502	S	S	.	.			trans	-78.1	122.1	169.5	-114.4	-178.5	-178.3	0	0	109.8	W1764 K1772	E1762-W1764 PolarHBondContact OE1-NE1 3.23Å; E1762-K1772 HydrophobicContact CB-CB 4.05Å; E1762-K1772 HydrophobicContact CB-CD 4.24Å; E1762-K1772 PolarHBondContact O-N 3Å; E1762-K1772 WeakPolarHBondContact OE2-CD 3.32Å; E1762-K1772 WeakPolarHBondContact OE2-CE 3.39Å; E1762-K1772 IonicContact OE2-NZ 3.56Å; E1762-K1772 PolarHBondContact OE2-NZ 3.11Å
1763	K	59.7	Low	68.2	Low	166.2 Å²	166.2	109.6 Å²	109.6	72%	0.723	52%	0.519	S	S	*	.	B	Isolated β-bridge	trans	-91.7	116.4	174.4	-115.3	-178.6	178.7	-179.8	0	109.3	R1761 Y1769 F1771	R1761-K1763 PolarHBondContact O-N 3.01Å; K1763-Y1769 VanDerWaalsContact CE-CD1 3.43Å; K1763-Y1769 HydrophobicContact CG-CD1 4.47Å; K1763-F1771 HydrophobicContact CB-CE1 4.48Å; K1763-F1771 HydrophobicContact CG-CD1 4.08Å; K1763-F1771 HydrophobicContact CG-CE1 4.07Å
1764	W	52	Low	67.1	Low	162.8 Å²	162.8	105.4 Å²	105.4	62%	0.617	50%	0.503	S	S	*	.			trans	-78.7	144.1	169	-83.2	70.9	0	0	0	111.2	E1762 V1766 Y1769 Y1770 K1772	E1762-W1764 PolarHBondContact OE1-NE1 3.23Å; W1764-V1766 VanDerWaalsContact C-N 3.33Å; W1764-V1766 PolarHBondContact O-N 3.01Å; W1764-Y1769 WeakPolarHBondContact CB-O 3.34Å; W1764-Y1769 WeakPolarHBondContact O-CD1 3.4Å; W1764-Y1770 WeakPolarHBondContact CB-O 3.49Å; W1764-Y1770 VanDerWaalsContact CD1-O 3.24Å; W1764-Y1770 PolarHBondContact N-O 3.16Å; W1764-K1772 HydrophobicContact CZ2-CG 4.31Å
1765	T	58.4	Low	66.4	Low	129.6 Å²	129.6	107 Å²	107	80%	0.795	50%	0.5	S	S	*	.	S	Bend	trans	-86.6	71.6	175.4	48.5	0	0	0	0	111.5
1766	V	55.5	Low	66.1	Low	119.2 Å²	119.2	106.4 Å²	106.4	72%	0.722	50%	0.498	S	S	*	.	S	Bend	trans	-139.7	126.8	163.1	-171.6	0	0	0	0	110.8	W1764 P1768 Y1769	W1764-V1766 VanDerWaalsContact C-N 3.33Å; W1764-V1766 PolarHBondContact O-N 3.01Å; V1766-P1768 CarbonylContact O-C 3.37Å; V1766-Y1769 WeakPolarHBondContact O-CA 3.35Å; V1766-Y1769 PolarHBondContact O-N 3.34Å
1767	F	45.7	Very low	66	Low	167 Å²	167	103.9 Å²	103.9	73%	0.732	48%	0.482	S	S	*	.	S	Bend	trans	-54.2	137	176.7	-161	-97	0	0	0	113.5	Y1769 Y1770	F1767-Y1769 AromaticContact CD2-CD2 3.95Å; F1767-Y1769 HydrophobicContact CD2-CD2 4.04Å; F1767-Y1769 AromaticContact CD2-CE2 3.74Å; F1767-Y1769 HydrophobicContact CD2-CE2 3.84Å; F1767-Y1769 HydrophobicContact CE2-CD2 4.16Å; F1767-Y1769 AromaticContact CE2-CE2 3.77Å; F1767-Y1769 HydrophobicContact CE2-CE2 4.22Å; F1767-Y1770 HydrophobicContact CE2-CE1 4.05Å; F1767-Y1770 HydrophobicContact CE2-CE2 4.16Å; F1767-Y1770 AromaticContact CE2-CZ 3.55Å; F1767-Y1770 WeakPolarHBondContact CE2-OH 3.05Å; F1767-Y1770 HydrophobicContact CZ-CE2 4.4Å; F1767-Y1770 WeakPolarHBondContact CZ-OH 3.37Å
1768	P	52	Low	65.8	Low	73.6 Å²	73.6	105.6 Å²	105.6	48%	0.478	49%	0.488	S	S	.	.	S	Bend	cis	-101	108.2	12.4	32.3	-22.3	0	0	0	112.5	V1766 Y1770	V1766-P1768 CarbonylContact O-C 3.37Å; P1768-Y1770 HydrophobicContact CG-CE2 3.76Å; P1768-Y1770 WeakPolarHBondContact O-CD2 3.4Å; P1768-Y1770 PolarHBondContact O-N 3.27Å
1769	Y	50.2	Low	65.8	Low	159.6 Å²	159.6	100.1 Å²	100.1	63%	0.626	47%	0.465	S	S	*	.			trans	-82.8	119.7	-178	-58.7	-76.6	0	0	0	112.4	K1763 W1764 V1766 F1767 F1771	K1763-Y1769 VanDerWaalsContact CE-CD1 3.43Å; K1763-Y1769 HydrophobicContact CG-CD1 4.47Å; W1764-Y1769 WeakPolarHBondContact CB-O 3.34Å; W1764-Y1769 WeakPolarHBondContact O-CD1 3.4Å; V1766-Y1769 WeakPolarHBondContact O-CA 3.35Å; V1766-Y1769 PolarHBondContact O-N 3.34Å; F1767-Y1769 AromaticContact CD2-CD2 3.95Å; F1767-Y1769 HydrophobicContact CD2-CD2 4.04Å; F1767-Y1769 AromaticContact CD2-CE2 3.74Å; F1767-Y1769 HydrophobicContact CD2-CE2 3.84Å; F1767-Y1769 HydrophobicContact CE2-CD2 4.16Å; F1767-Y1769 AromaticContact CE2-CE2 3.77Å; F1767-Y1769 HydrophobicContact CE2-CE2 4.22Å; Y1769-F1771 PolarHBondContact O-N 2.73Å
1770	Y	51.5	Low	65.8	Low	183 Å²	183	100.9 Å²	100.9	72%	0.718	47%	0.468	S	S	*	.			trans	-80.4	120.5	174.9	-64.7	-83.4	0	0	0	110.8	W1764 F1767 P1768 K1772	W1764-Y1770 WeakPolarHBondContact CB-O 3.49Å; W1764-Y1770 VanDerWaalsContact CD1-O 3.24Å; W1764-Y1770 PolarHBondContact N-O 3.16Å; F1767-Y1770 HydrophobicContact CE2-CE1 4.05Å; F1767-Y1770 HydrophobicContact CE2-CE2 4.16Å; F1767-Y1770 AromaticContact CE2-CZ 3.55Å; F1767-Y1770 WeakPolarHBondContact CE2-OH 3.05Å; F1767-Y1770 HydrophobicContact CZ-CE2 4.4Å; F1767-Y1770 WeakPolarHBondContact CZ-OH 3.37Å; P1768-Y1770 HydrophobicContact CG-CE2 3.76Å; P1768-Y1770 WeakPolarHBondContact O-CD2 3.4Å; P1768-Y1770 PolarHBondContact O-N 3.27Å; Y1770-K1772 PolarHBondContact O-N 3.12Å
1771	F	54	Low	66.3	Low	128.4 Å²	128.4	100.9 Å²	100.9	56%	0.563	47%	0.467	S	S	*	.			trans	-79.9	130.8	169.2	-64.8	-81.9	0	0	0	109	R1761 K1763 Y1769	R1761-F1771 HydrophobicContact CB-CD1 4.39Å; R1761-F1771 HydrophobicContact CB-CE1 4.49Å; K1763-F1771 HydrophobicContact CB-CE1 4.48Å; K1763-F1771 HydrophobicContact CG-CD1 4.08Å; K1763-F1771 HydrophobicContact CG-CE1 4.07Å; Y1769-F1771 PolarHBondContact O-N 2.73Å
1772	K	53.8	Low	67.2	Low	117.8 Å²	117.8	94.6 Å²	94.6	51%	0.512	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-65.7	154.5	163.2	-133	-173.2	177.5	178.9	0	108.5	E1762 W1764 Y1770 D1774	E1762-K1772 HydrophobicContact CB-CB 4.05Å; E1762-K1772 HydrophobicContact CB-CD 4.24Å; E1762-K1772 PolarHBondContact O-N 3Å; E1762-K1772 WeakPolarHBondContact OE2-CD 3.32Å; E1762-K1772 WeakPolarHBondContact OE2-CE 3.39Å; E1762-K1772 IonicContact OE2-NZ 3.56Å; E1762-K1772 PolarHBondContact OE2-NZ 3.11Å; W1764-K1772 HydrophobicContact CZ2-CG 4.31Å; Y1770-K1772 PolarHBondContact O-N 3.12Å; K1772-D1774 PolarHBondContact O-N 3.01Å
1773	P	61.1	Low	68.5	Low	115 Å²	115	90 Å²	90	75%	0.747	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-49.4	139	169.3	-24.2	32.8	0	0	0	110.8	K1775	P1773-K1775 PolarHBondContact O-N 3.09Å
1774	D	67.6	Low	70	Confident	48 Å²	48	82.1 Å²	82.1	26%	0.257	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-53.7	136.6	179.8	-68.3	-50.5	0	0	0	110	R1759 R1761 K1772 P1776	R1759-D1774 WeakPolarHBondContact CD-OD2 3.37Å; R1759-D1774 HydrophobicContact CG-CB 4.38Å; R1759-D1774 WeakPolarHBondContact CG-OD1 3.47Å; R1759-D1774 IonicContact CZ-OD1 3.14Å; R1759-D1774 IonicContact CZ-OD2 3.02Å; R1759-D1774 VanDerWaalsContact CZ-OD2 3.24Å; R1759-D1774 IonicContact NE-OD1 3.44Å; R1759-D1774 PolarHBondContact NE-OD1 2.92Å; R1759-D1774 IonicContact NE-OD2 3.36Å; R1759-D1774 PolarHBondContact NE-OD2 2.93Å; R1759-D1774 IonicContact NH2-OD1 3.22Å; R1759-D1774 IonicContact NH2-OD2 3.18Å; R1759-D1774 PolarHBondContact NH2-OD2 3.03Å; R1761-D1774 WeakPolarHBondContact CG-OD1 3.35Å; K1772-D1774 PolarHBondContact O-N 3.01Å; D1774-P1776 VanDerWaalsContact O-CD 3.31Å; D1774-P1776 WeakPolarHBondContact O-CD 3.22Å
1775	K	77.6	Confident	71.9	Confident	106.8 Å²	106.8	74.3 Å²	74.3	46%	0.464	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-73.1	120.9	178.2	-174.4	179.3	178.5	-178.7	0	108.8	Q1760 P1773	Q1760-K1775 HydrophobicContact CB-CB 4.41Å; Q1760-K1775 PolarHBondContact O-N 3.16Å; Q1760-K1775 VanDerWaalsContact O-N 3.11Å; P1773-K1775 PolarHBondContact O-N 3.09Å
1776	P	84	Confident	73.5	Confident	19.6 Å²	19.6	68.7 Å²	68.7	13%	0.127	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-74.1	155.3	178.5	31.4	-34.9	0	0	0	110.9	D1774 Y1778 E1798 H1800	D1774-P1776 VanDerWaalsContact O-CD 3.31Å; D1774-P1776 WeakPolarHBondContact O-CD 3.22Å; P1776-Y1778 HydrophobicContact CG-CE1 4.29Å; P1776-Y1778 HydrophobicContact CG-CE2 4.13Å; P1776-Y1778 WeakPolarHBondContact CG-OH 3.4Å; P1776-Y1778 WeakPolarHBondContact O-CE2 3.35Å; P1776-E1798 CarbonylContact C-O 3.46Å; P1776-E1798 VanDerWaalsContact CA-O 3.28Å; P1776-E1798 WeakPolarHBondContact CA-O 3.35Å; P1776-E1798 HydrophobicContact CB-CB 4.41Å; P1776-E1798 HydrophobicContact CB-CG 4.33Å; P1776-H1800 HydrophobicContact CB-CB 4.42Å
1777	Y	88.5	Confident	75	Confident	14 Å²	14	65.9 Å²	65.9	6%	0.055	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	144.5	166.7	-69.9	-81.2	0	0	0	110	V1744 L1757 K1758 Q1760 V1797 E1798 I1799 H1800	V1744-Y1777 HydrophobicContact CG1-CE1 3.83Å; V1744-Y1777 VanDerWaalsContact O-CD1 3.27Å; V1744-Y1777 WeakPolarHBondContact O-CD1 3.42Å; V1744-Y1777 VanDerWaalsContact O-CE1 3.3Å; V1744-Y1777 WeakPolarHBondContact O-CE1 3.32Å; L1757-Y1777 HydrophobicContact CB-CD2 4.45Å; L1757-Y1777 HydrophobicContact CB-CE2 4.02Å; L1757-Y1777 HydrophobicContact CD1-CD2 4.49Å; L1757-Y1777 HydrophobicContact CD2-CD1 4.1Å; L1757-Y1777 HydrophobicContact CD2-CD2 4.19Å; L1757-Y1777 HydrophobicContact CD2-CE1 3.98Å; L1757-Y1777 HydrophobicContact CD2-CE2 4.29Å; L1757-Y1777 HydrophobicContact CD2-CG 4.22Å; K1758-Y1777 PolarHBondContact N-OH 2.88Å; K1758-Y1777 VanDerWaalsContact O-CE2 3.24Å; K1758-Y1777 WeakPolarHBondContact O-CE2 3.35Å; K1758-Y1777 VanDerWaalsContact O-CZ 3.31Å; K1758-Y1777 PolarHBondContact O-OH 3.03Å; Q1760-Y1777 PolarHBondContact NE2-OH 2.87Å; Y1777-V1797 HydrophobicContact CD2-CG1 3.62Å; Y1777-V1797 HydrophobicContact CE2-CG1 3.82Å; Y1777-E1798 PolarHBondContact N-O 3.17Å; Y1777-I1799 CarbonylContact O-C 3.49Å; Y1777-I1799 WeakPolarHBondContact O-CA 3.44Å; Y1777-H1800 PolarHBondContact O-N 3.18Å
1778	Y	86	Confident	77	Confident	36.8 Å²	36.8	61.1 Å²	61.1	14%	0.144	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.3	178.9	-62.8	-81.9	0	0	0	110.6	P1776 H1800 Y1802 V1828 D1832 F1836	P1776-Y1778 HydrophobicContact CG-CE1 4.29Å; P1776-Y1778 HydrophobicContact CG-CE2 4.13Å; P1776-Y1778 WeakPolarHBondContact CG-OH 3.4Å; P1776-Y1778 WeakPolarHBondContact O-CE2 3.35Å; Y1778-H1800 WeakPolarHBondContact CA-O 3.33Å; Y1778-H1800 HydrophobicContact CD1-CB 3.86Å; Y1778-H1800 HydrophobicContact CE1-CB 3.92Å; Y1778-H1800 AromaticContact CE1-ND1 3.8Å; Y1778-Y1802 HydrophobicContact CD1-CE2 4.32Å; Y1778-V1828 HydrophobicContact CD1-CG2 4.19Å; Y1778-V1828 HydrophobicContact CE1-CG2 4.33Å; Y1778-D1832 HydrophobicContact CE1-CB 4.32Å; Y1778-D1832 PolarHBondContact OH-OD1 2.72Å; Y1778-D1832 VanDerWaalsContact OH-OD1 3.07Å; Y1778-D1832 PolarHBondContact OH-OD2 2.83Å; Y1778-F1836 HydrophobicContact CE1-CE2 4.35Å; Y1778-F1836 HydrophobicContact CE2-CE2 4.25Å; Y1778-F1836 HydrophobicContact CE2-CZ 4.29Å
1779	I	88.5	Confident	78.8	Confident	2.2 Å²	2.2	57.6 Å²	57.6	1%	0.011	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	109.5	171.6	-57	-180	0	0	0	107.2	L1747 K1781 L1783 I1799 H1800 I1801 Y1802 V1805 I1807	L1747-I1779 HydrophobicContact CB-CG1 4.34Å; L1747-I1779 WeakPolarHBondContact O-CG2 3.38Å; I1779-K1781 VanDerWaalsContact CG2-O 3.25Å; I1779-K1781 WeakPolarHBondContact CG2-O 3.21Å; I1779-L1783 HydrophobicContact CD1-CD2 4.26Å; I1779-L1783 HydrophobicContact CG2-CB 4.33Å; I1779-I1799 HydrophobicContact CD1-CG2 3.67Å; I1779-I1799 HydrophobicContact CG1-CG2 3.88Å; I1779-H1800 PolarHBondContact N-O 3.28Å; I1779-H1800 VanDerWaalsContact N-O 3.11Å; I1779-I1801 HydrophobicContact CB-CG1 4.39Å; I1779-I1801 HydrophobicContact CB-CG2 4.42Å; I1779-I1801 HydrophobicContact CD1-CG1 4.36Å; I1779-Y1802 WeakPolarHBondContact O-CD2 3.36Å; I1779-Y1802 PolarHBondContact O-N 2.85Å; I1779-Y1802 VanDerWaalsContact O-N 3.07Å; I1779-V1805 HydrophobicContact CG2-CG1 3.78Å; I1779-I1807 HydrophobicContact CD1-CD1 3.72Å; I1779-I1807 HydrophobicContact CD1-CG1 4.29Å
1780	R	83.4	Confident	80.8	Confident	92 Å²	92	53.9 Å²	53.9	35%	0.347	27%	0.269	S	S	.	.			trans	-95.4	-30.4	-174	-66	179	-179.2	-177.1	0	113.6	N1635 Y1802 V1805	N1635-R1780 WeakPolarHBondContact CB-O 3.46Å; N1635-R1780 VanDerWaalsContact CG-O 3.28Å; N1635-R1780 PolarHBondContact ND2-O 3.03Å; N1635-R1780 PolarHBondContact OD1-O 2.81Å; N1635-R1780 VanDerWaalsContact OD1-O 3.04Å; R1780-Y1802 HydrophobicContact CB-CD2 4.4Å; R1780-Y1802 HydrophobicContact CG-CD1 4.42Å; R1780-Y1802 HydrophobicContact CG-CD2 3.87Å; R1780-Y1802 HydrophobicContact CG-CE1 4.29Å; R1780-Y1802 HydrophobicContact CG-CE2 3.7Å; R1780-Y1802 HydrophobicContact CG-CG 4.41Å; R1780-V1805 VanDerWaalsContact O-CG2 3.28Å; R1780-V1805 WeakPolarHBondContact O-CG2 3.4Å
1781	K	86.9	Confident	82.8	Confident	47.2 Å²	47.2	45.4 Å²	45.4	21%	0.205	24%	0.236	C	C	.	.	S	Bend	trans	-127.5	167.1	-180	-63.4	177.8	172.4	-160.8	0	109.4	D1703 H1748 I1779 L1783 V1805	D1703-K1781 VanDerWaalsContact OD1-CD 3.27Å; D1703-K1781 WeakPolarHBondContact OD1-CD 3.38Å; D1703-K1781 WeakPolarHBondContact OD1-CE 3.25Å; D1703-K1781 IonicContact OD1-NZ 3.23Å; D1703-K1781 PolarHBondContact OD1-NZ 3.08Å; H1748-K1781 HydrophobicContact CB-CB 3.91Å; H1748-K1781 HydrophobicContact CB-CD 4.34Å; H1748-K1781 HydrophobicContact CB-CG 4.44Å; I1779-K1781 VanDerWaalsContact CG2-O 3.25Å; I1779-K1781 WeakPolarHBondContact CG2-O 3.21Å; K1781-L1783 PolarHBondContact O-N 3.03Å; K1781-V1805 VanDerWaalsContact C-CG1 3.44Å; K1781-V1805 WeakPolarHBondContact O-CG1 3.25Å
1782	D	90	Very high	84.7	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.217	C	C	.	.			trans	-57.1	136.4	-179.8	-77.9	4.4	0	0	0	111.5	D1703 W1704 N1705 G1749 V1805 R1806 H2036	D1703-D1782 VanDerWaalsContact O-CB 3.23Å; D1703-D1782 WeakPolarHBondContact O-CB 3.36Å; D1703-D1782 VanDerWaalsContact O-CG 3.31Å; D1703-D1782 PolarHBondContact O-N 3.06Å; D1703-D1782 VanDerWaalsContact O-N 3.12Å; W1704-D1782 VanDerWaalsContact CA-OD2 3.3Å; W1704-D1782 WeakPolarHBondContact CA-OD2 3.32Å; N1705-D1782 HydrophobicContact CB-CB 4.29Å; N1705-D1782 PolarHBondContact N-OD2 3.07Å; N1705-D1782 PolarHBondContact ND2-OD2 2.95Å; N1705-D1782 PolarHBondContact OD1-OD2 3.25Å; N1705-D1782 VanDerWaalsContact OD1-OD2 3.11Å; G1749-D1782 WeakPolarHBondContact CA-O 3.44Å; G1749-D1782 PolarHBondContact N-O 3.05Å; D1782-V1805 VanDerWaalsContact OD1-CA 3.32Å; D1782-V1805 WeakPolarHBondContact OD1-CA 3.37Å; D1782-R1806 WeakPolarHBondContact CA-O 3.29Å; D1782-R1806 WeakPolarHBondContact CB-O 3.33Å; D1782-R1806 PolarHBondContact OD1-N 3.1Å; D1782-H2036 IonicContact OD1-NE2 3.5Å; D1782-H2036 IonicContact OD2-CD2 3.22Å; D1782-H2036 IonicContact OD2-CE1 3.27Å; D1782-H2036 PolarHBondContact OD2-CE1 3.21Å; D1782-H2036 IonicContact OD2-NE2 3.73Å; D1782-H2036 PolarHBondContact OD2-NE2 3.09Å
1783	L	91.9	Very high	86.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.7	177	178.5	65.8	0	0	0	108.8	L1747 G1749 L1751 I1779 K1781 L1791 R1806 I1807 L1808	L1747-L1783 HydrophobicContact CB-CD1 4.27Å; L1747-L1783 HydrophobicContact CB-CD2 4.26Å; L1747-L1783 HydrophobicContact CD1-CD2 4.39Å; G1749-L1783 CarbonylContact O-C 3.49Å; G1749-L1783 WeakPolarHBondContact O-CA 3.17Å; L1751-L1783 HydrophobicContact CB-CD1 4.42Å; I1779-L1783 HydrophobicContact CD1-CD2 4.26Å; I1779-L1783 HydrophobicContact CG2-CB 4.33Å; K1781-L1783 PolarHBondContact O-N 3.03Å; L1783-L1791 HydrophobicContact CD2-CD2 4.12Å; L1783-R1806 PolarHBondContact N-O 3.14Å; L1783-R1806 VanDerWaalsContact N-O 3.16Å; L1783-I1807 HydrophobicContact CB-CG1 4.41Å; L1783-I1807 HydrophobicContact CB-CG2 4.44Å; L1783-I1807 HydrophobicContact CD2-CG2 4.35Å; L1783-I1807 CarbonylContact O-C 3.58Å; L1783-I1807 WeakPolarHBondContact O-CA 3.26Å; L1783-L1808 PolarHBondContact O-N 2.95Å
1784	T	91.7	Very high	88	Confident	0.4 Å²	0.4	33.9 Å²	33.9	0%	0.002	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	109.9	175.7	-57.4	0	0	0	0	110.2	F1675 F1701 N1705 G1749 R1750 L1751 M1786 L1808 L1810	F1675-T1784 HydrophobicContact CZ-CG2 4.37Å; F1701-T1784 HydrophobicContact CE1-CG2 4.09Å; F1701-T1784 WeakPolarHBondContact CE1-OG1 3.11Å; F1701-T1784 HydrophobicContact CZ-CG2 3.96Å; F1701-T1784 WeakPolarHBondContact CZ-OG1 3.49Å; N1705-T1784 WeakPolarHBondContact CB-OG1 3.3Å; N1705-T1784 PolarHBondContact ND2-OG1 3.28Å; G1749-T1784 PolarHBondContact O-N 2.98Å; R1750-T1784 CarbonylContact C-O 3.57Å; R1750-T1784 WeakPolarHBondContact CA-O 3.42Å; L1751-T1784 PolarHBondContact N-O 3.18Å; T1784-M1786 HydrophobicContact CG2-CE 4.45Å; T1784-M1786 HydrophobicContact CG2-SD 4.03Å; T1784-M1786 PolarHBondContact O-N 3.16Å; T1784-L1808 CarbonylContact C-O 3.39Å; T1784-L1808 WeakPolarHBondContact CA-O 3.42Å; T1784-L1808 HydrophobicContact CG2-CB 4.36Å; T1784-L1808 HydrophobicContact CG2-CD2 3.95Å; T1784-L1808 HydrophobicContact CG2-CG 4.19Å; T1784-L1810 HydrophobicContact CG2-CD1 4Å; T1784-L1810 HydrophobicContact CG2-CG 4.43Å
1785	I	92.6	Very high	89.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	109.1	172.7	-55.4	171.8	0	0	0	107.7	A1789 L1791 L1808 V1809 L1810 G1811 L1813	I1785-A1789 HydrophobicContact CG2-CB 4Å; I1785-A1789 WeakPolarHBondContact CG2-O 3.38Å; I1785-L1791 HydrophobicContact CD1-CB 3.51Å; I1785-L1791 VanDerWaalsContact CD1-CB 3.46Å; I1785-L1791 HydrophobicContact CD1-CD2 3.85Å; I1785-L1791 HydrophobicContact CD1-CG 4.34Å; I1785-L1791 HydrophobicContact CG1-CB 4.27Å; I1785-L1791 HydrophobicContact CG1-CD2 4.46Å; I1785-L1808 PolarHBondContact N-O 3.25Å; I1785-V1809 HydrophobicContact CD1-CG1 4.19Å; I1785-V1809 HydrophobicContact CD1-CG2 4.07Å; I1785-L1810 CarbonylContact O-C 3.39Å; I1785-L1810 WeakPolarHBondContact O-CA 3.42Å; I1785-L1810 WeakPolarHBondContact O-CB 3.33Å; I1785-L1810 PolarHBondContact O-N 2.99Å; I1785-G1811 PolarHBondContact O-N 2.83Å; I1785-L1813 HydrophobicContact CD1-CB 4.33Å; I1785-L1813 HydrophobicContact CD1-CD1 4.21Å
1786	M	90.2	Very high	89.7	Confident	10.4 Å²	10.4	32.2 Å²	32.2	5%	0.051	17%	0.173	C	C	.	.			trans	-72.2	158.8	-175.5	-69.7	-64	-85	0	0	112.3	F1675 F1701 R1750 L1751 Y1752 T1784 G1788 A1789 L1810 G1811	F1675-M1786 HydrophobicContact CD1-CE 4.04Å; F1675-M1786 HydrophobicContact CD2-CE 4.06Å; F1675-M1786 HydrophobicContact CE1-CE 3.81Å; F1675-M1786 HydrophobicContact CE1-SD 4.24Å; F1675-M1786 HydrophobicContact CE2-CE 3.81Å; F1675-M1786 HydrophobicContact CE2-SD 4.24Å; F1675-M1786 HydrophobicContact CG-CE 4.24Å; F1675-M1786 HydrophobicContact CZ-CE 3.82Å; F1675-M1786 VanDerWaalsContact CZ-CE 3.47Å; F1675-M1786 HydrophobicContact CZ-SD 4.19Å; F1701-M1786 HydrophobicContact CE1-CE 4.41Å; R1750-M1786 HydrophobicContact CB-CE 4.22Å; R1750-M1786 HydrophobicContact CB-CG 3.99Å; R1750-M1786 HydrophobicContact CB-SD 4.26Å; R1750-M1786 HydrophobicContact CG-CE 3.46Å; R1750-M1786 VanDerWaalsContact CG-CE 3.46Å; R1750-M1786 HydrophobicContact CG-CG 4.22Å; R1750-M1786 HydrophobicContact CG-SD 3.89Å; L1751-M1786 VanDerWaalsContact O-CB 3.28Å; L1751-M1786 WeakPolarHBondContact O-CB 3.35Å; L1751-M1786 WeakPolarHBondContact O-CG 3.45Å; L1751-M1786 PolarHBondContact O-N 3.04Å; Y1752-M1786 HydrophobicContact CD1-CB 3.8Å; Y1752-M1786 HydrophobicContact CD1-CG 3.91Å; Y1752-M1786 HydrophobicContact CD2-CG 4.48Å; Y1752-M1786 HydrophobicContact CE1-CB 3.96Å; Y1752-M1786 HydrophobicContact CE1-CE 3.78Å; Y1752-M1786 HydrophobicContact CE1-CG 3.7Å; Y1752-M1786 HydrophobicContact CE1-SD 4.42Å; Y1752-M1786 HydrophobicContact CE2-CG 4.36Å; Y1752-M1786 HydrophobicContact CG-CB 4.37Å; Y1752-M1786 HydrophobicContact CG-CG 4.35Å; T1784-M1786 HydrophobicContact CG2-CE 4.45Å; T1784-M1786 HydrophobicContact CG2-SD 4.03Å; T1784-M1786 PolarHBondContact O-N 3.16Å; M1786-G1788 PolarHBondContact O-N 3.04Å; M1786-A1789 WeakPolarHBondContact O-CB 3.29Å; M1786-A1789 PolarHBondContact O-N 3.18Å; M1786-L1810 HydrophobicContact SD-CD1 4.1Å; M1786-G1811 VanDerWaalsContact O-CA 3.28Å; M1786-G1811 WeakPolarHBondContact O-CA 3.37Å; M1786-G1811 PolarHBondContact O-N 2.83Å
1787	P	87.8	Confident	90	Very high	60.4 Å²	60.4	31.4 Å²	31.4	39%	0.392	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	130.5	176.4	-24.3	34.7	0	0	0	111.6	A1789 L1810 D2012 M2020	P1787-A1789 VanDerWaalsContact C-N 3.3Å; P1787-A1789 PolarHBondContact O-N 3.06Å; P1787-L1810 HydrophobicContact CG-CB 4.08Å; P1787-D2012 HydrophobicContact CB-CB 3.9Å; P1787-D2012 HydrophobicContact CG-CB 3.57Å; P1787-M2020 HydrophobicContact CB-CE 4.28Å
1788	G	87.6	Confident	90	Very high	66.2 Å²	66.2	32.9 Å²	32.9	68%	0.682	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.7	-16.9	-177.1	0	0	0	0	0	115.2	M1786	M1786-G1788 PolarHBondContact O-N 3.04Å
1789	A	90.7	Very high	90.3	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	17%	0.169	C	C	.	.			trans	-82.5	145.7	170.9	0	0	0	0	0	111	L1751 Y1752 I1785 M1786 P1787 G1811 S1812	L1751-A1789 VanDerWaalsContact O-CB 3.26Å; L1751-A1789 WeakPolarHBondContact O-CB 3.31Å; Y1752-A1789 WeakPolarHBondContact O-CB 3.33Å; I1785-A1789 HydrophobicContact CG2-CB 4Å; I1785-A1789 WeakPolarHBondContact CG2-O 3.38Å; M1786-A1789 WeakPolarHBondContact O-CB 3.29Å; M1786-A1789 PolarHBondContact O-N 3.18Å; P1787-A1789 VanDerWaalsContact C-N 3.3Å; P1787-A1789 PolarHBondContact O-N 3.06Å; A1789-G1811 WeakPolarHBondContact O-CA 3.26Å; A1789-S1812 PolarHBondContact O-N 2.78Å
1790	K	92.1	Very high	90.3	Very high	81.8 Å²	81.8	31.7 Å²	31.7	36%	0.356	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.5	176.6	-173.9	-179.8	-179.2	-175.7	0	110.5	S1754 L1755 T1792 S1812 E1814	S1754-K1790 CarbonylContact C-O 3.53Å; S1754-K1790 WeakPolarHBondContact CA-O 3.39Å; S1754-K1790 VanDerWaalsContact CB-O 3.27Å; S1754-K1790 WeakPolarHBondContact CB-O 3.32Å; S1754-K1790 WeakPolarHBondContact OG-CB 3.48Å; S1754-K1790 PolarHBondContact OG-N 3.04Å; L1755-K1790 PolarHBondContact N-O 3.07Å; K1790-T1792 HydrophobicContact CD-CG2 4.1Å; K1790-T1792 HydrophobicContact CG-CG2 4.12Å; K1790-S1812 CarbonylContact C-O 3.55Å; K1790-S1812 VanDerWaalsContact CA-O 3.3Å; K1790-S1812 WeakPolarHBondContact CA-O 3.34Å; K1790-E1814 WeakPolarHBondContact CE-OE2 3.37Å; K1790-E1814 IonicContact NZ-OE2 3.67Å; K1790-E1814 PolarHBondContact NZ-OE2 2.92Å
1791	L	93	Very high	90.6	Very high	5.4 Å²	5.4	27.3 Å²	27.3	3%	0.028	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.6	169.6	-173.2	64.3	0	0	0	109	L1751 L1755 L1757 L1783 I1785 I1793 S1812 L1813 E1814	L1751-L1791 HydrophobicContact CD2-CB 4.47Å; L1751-L1791 HydrophobicContact CD2-CD1 4.33Å; L1755-L1791 HydrophobicContact CB-CD1 3.96Å; L1755-L1791 WeakPolarHBondContact O-CA 3.23Å; L1757-L1791 HydrophobicContact CD1-CD1 4.38Å; L1757-L1791 HydrophobicContact CD2-CD1 4.46Å; L1757-L1791 HydrophobicContact CG-CD1 4.17Å; L1783-L1791 HydrophobicContact CD2-CD2 4.12Å; I1785-L1791 HydrophobicContact CD1-CB 3.51Å; I1785-L1791 VanDerWaalsContact CD1-CB 3.46Å; I1785-L1791 HydrophobicContact CD1-CD2 3.85Å; I1785-L1791 HydrophobicContact CD1-CG 4.34Å; I1785-L1791 HydrophobicContact CG1-CB 4.27Å; I1785-L1791 HydrophobicContact CG1-CD2 4.46Å; L1791-I1793 HydrophobicContact CG-CG1 4.46Å; L1791-S1812 PolarHBondContact N-O 3.14Å; L1791-L1813 HydrophobicContact CB-CD1 3.95Å; L1791-L1813 HydrophobicContact CD2-CD1 3.94Å; L1791-L1813 HydrophobicContact CG-CD1 4.07Å; L1791-E1814 PolarHBondContact O-N 2.89Å
1792	T	93.1	Very high	90.7	Very high	27 Å²	27	26.5 Å²	26.5	17%	0.166	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.2	177.8	41.1	0	0	0	0	109.6	L1755 T1756 L1757 K1790 E1814	L1755-T1792 PolarHBondContact O-N 3.04Å; L1755-T1792 PolarHBondContact O-OG1 3.09Å; T1756-T1792 CarbonylContact C-O 3.53Å; T1756-T1792 WeakPolarHBondContact CA-O 3.27Å; T1756-T1792 VanDerWaalsContact CA-OG1 3.25Å; T1756-T1792 WeakPolarHBondContact CA-OG1 3.41Å; T1756-T1792 VanDerWaalsContact CB-OG1 3.26Å; T1756-T1792 WeakPolarHBondContact CB-OG1 3.29Å; T1756-T1792 WeakPolarHBondContact CG2-OG1 3.3Å; T1756-T1792 PolarHBondContact OG1-OG1 3.12Å; L1757-T1792 PolarHBondContact N-O 3.09Å; K1790-T1792 HydrophobicContact CD-CG2 4.1Å; K1790-T1792 HydrophobicContact CG-CG2 4.12Å; T1792-E1814 CarbonylContact C-O 3.52Å; T1792-E1814 WeakPolarHBondContact CA-O 3.32Å; T1792-E1814 HydrophobicContact CG2-CB 4.26Å
1793	I	93.2	Very high	90.4	Very high	10.8 Å²	10.8	27.2 Å²	27.2	6%	0.055	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	113.8	177.7	-50.3	178.8	0	0	0	107.8	L1757 L1791 V1797 I1799 L1813 E1814 A1815 Q1816 I1823	L1757-I1793 HydrophobicContact CB-CG2 4.5Å; L1757-I1793 HydrophobicContact CD1-CG1 4.23Å; L1791-I1793 HydrophobicContact CG-CG1 4.46Å; I1793-V1797 HydrophobicContact CG2-CB 3.74Å; I1793-V1797 HydrophobicContact CG2-CG1 3.86Å; I1793-V1797 HydrophobicContact CG2-CG2 4.29Å; I1793-I1799 HydrophobicContact CD1-CD1 3.86Å; I1793-I1799 HydrophobicContact CG1-CD1 4.44Å; I1793-I1799 HydrophobicContact CG2-CD1 4.25Å; I1793-L1813 HydrophobicContact CD1-CD1 3.98Å; I1793-L1813 HydrophobicContact CG1-CD1 4.29Å; I1793-E1814 PolarHBondContact N-O 3.22Å; I1793-A1815 HydrophobicContact CB-CB 4.34Å; I1793-Q1816 PolarHBondContact O-N 3.12Å; I1793-Q1816 VanDerWaalsContact O-N 3.14Å; I1793-I1823 HydrophobicContact CB-CD1 4.05Å; I1793-I1823 HydrophobicContact CG2-CD1 3.83Å; I1793-I1823 HydrophobicContact CG2-CG1 4.09Å; I1793-I1823 HydrophobicContact CG2-CG2 3.71Å; I1793-I1823 VanDerWaalsContact O-CD1 3.31Å; I1793-I1823 WeakPolarHBondContact O-CD1 3.44Å
1794	E	92.3	Very high	90.1	Very high	81 Å²	81	28 Å²	28	38%	0.379	16%	0.158	S	C	.	.			trans	-73.7	160.1	177.2	-66.9	-176.3	176.6	0	0	111.6	T1756 L1757 K1758 V1797 I1823	T1756-E1794 HydrophobicContact CG2-CG 4.04Å; L1757-E1794 WeakPolarHBondContact O-CB 3.42Å; L1757-E1794 PolarHBondContact O-N 3.19Å; L1757-E1794 VanDerWaalsContact O-N 3.08Å; K1758-E1794 WeakPolarHBondContact CA-OE2 2.98Å; K1758-E1794 WeakPolarHBondContact CE-OE1 3.31Å; K1758-E1794 WeakPolarHBondContact CG-OE2 3.26Å; E1794-V1797 HydrophobicContact CB-CG2 4.35Å; E1794-V1797 WeakPolarHBondContact O-CB 3.33Å; E1794-V1797 VanDerWaalsContact O-CG2 3.23Å; E1794-V1797 WeakPolarHBondContact O-CG2 3.3Å; E1794-V1797 PolarHBondContact O-N 2.94Å; E1794-I1823 WeakPolarHBondContact O-CG1 3.42Å
1795	K	90.9	Very high	90	Very high	104.2 Å²	104.2	28 Å²	28	45%	0.453	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	143.1	178.5	63.5	-177	-175.9	169.8	0	113.3	V1797 Q1816 T1818 E1821	K1795-V1797 VanDerWaalsContact C-N 3.27Å; K1795-V1797 PolarHBondContact O-N 2.89Å; K1795-Q1816 PolarHBondContact N-O 3.01Å; K1795-T1818 HydrophobicContact CB-CG2 4.38Å; K1795-T1818 HydrophobicContact CD-CG2 3.91Å; K1795-E1821 HydrophobicContact CB-CB 4.25Å; K1795-E1821 VanDerWaalsContact CD-OE2 3.3Å; K1795-E1821 WeakPolarHBondContact CD-OE2 3.36Å; K1795-E1821 VanDerWaalsContact CE-OE2 3.26Å; K1795-E1821 WeakPolarHBondContact CE-OE2 3.36Å; K1795-E1821 HydrophobicContact CG-CB 4.49Å; K1795-E1821 IonicContact NZ-OE2 3.31Å; K1795-E1821 PolarHBondContact NZ-OE2 2.92Å
1796	G	88.3	Confident	89.9	Confident	15.4 Å²	15.4	28.5 Å²	28.5	16%	0.159	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	11.5	178	0	0	0	0	0	115.4	R1759 E1821 P1822	R1759-G1796 WeakPolarHBondContact CD-O 3.15Å; G1796-E1821 PolarHBondContact N-O 2.88Å; G1796-P1822 WeakPolarHBondContact CA-O 3.34Å
1797	V	91	Very high	90.1	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.018	16%	0.16	C	C	.	.			trans	-76.3	135.6	172.1	172.5	0	0	0	0	110	L1757 R1759 Y1777 I1793 E1794 K1795 I1799 I1823 R1824	L1757-V1797 HydrophobicContact CB-CG1 4.35Å; R1759-V1797 HydrophobicContact CB-CG2 4.38Å; Y1777-V1797 HydrophobicContact CD2-CG1 3.62Å; Y1777-V1797 HydrophobicContact CE2-CG1 3.82Å; I1793-V1797 HydrophobicContact CG2-CB 3.74Å; I1793-V1797 HydrophobicContact CG2-CG1 3.86Å; I1793-V1797 HydrophobicContact CG2-CG2 4.29Å; E1794-V1797 HydrophobicContact CB-CG2 4.35Å; E1794-V1797 WeakPolarHBondContact O-CB 3.33Å; E1794-V1797 VanDerWaalsContact O-CG2 3.23Å; E1794-V1797 WeakPolarHBondContact O-CG2 3.3Å; E1794-V1797 PolarHBondContact O-N 2.94Å; K1795-V1797 VanDerWaalsContact C-N 3.27Å; K1795-V1797 PolarHBondContact O-N 2.89Å; V1797-I1799 HydrophobicContact CG1-CD1 4.45Å; V1797-I1799 HydrophobicContact CG1-CG1 4Å; V1797-I1823 WeakPolarHBondContact O-CA 3.36Å; V1797-R1824 PolarHBondContact O-N 2.73Å
1798	E	89.3	Confident	90.4	Very high	44.4 Å²	44.4	25.6 Å²	25.6	21%	0.207	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.5	175.1	-173.4	159.5	-162.1	0	0	109.5	P1776 Y1777 H1800 R1824 K1826	P1776-E1798 CarbonylContact C-O 3.46Å; P1776-E1798 VanDerWaalsContact CA-O 3.28Å; P1776-E1798 WeakPolarHBondContact CA-O 3.35Å; P1776-E1798 HydrophobicContact CB-CB 4.41Å; P1776-E1798 HydrophobicContact CB-CG 4.33Å; Y1777-E1798 PolarHBondContact N-O 3.17Å; E1798-H1800 IonicContact OE1-CD2 2.73Å; E1798-H1800 IonicContact OE1-CE1 3.05Å; E1798-H1800 IonicContact OE1-NE2 3.03Å; E1798-H1800 PolarHBondContact OE1-NE2 2.88Å; E1798-R1824 WeakPolarHBondContact CA-O 3.27Å; E1798-R1824 HydrophobicContact CB-CB 4.4Å; E1798-R1824 HydrophobicContact CG-CB 4.09Å; E1798-K1826 VanDerWaalsContact OE1-CD 3.3Å; E1798-K1826 WeakPolarHBondContact OE1-CD 3.34Å; E1798-K1826 VanDerWaalsContact OE1-CE 3.28Å; E1798-K1826 WeakPolarHBondContact OE1-CE 3.27Å; E1798-K1826 IonicContact OE1-NZ 3.37Å; E1798-K1826 PolarHBondContact OE1-NZ 2.98Å
1799	I	91	Very high	90.7	Very high	2.8 Å²	2.8	22.4 Å²	22.4	1%	0.014	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122	-178.9	-53.5	179.9	0	0	0	108.1	L1757 Y1777 I1779 I1793 V1797 I1801 R1824 L1825 K1826	L1757-I1799 HydrophobicContact CD1-CD1 3.79Å; L1757-I1799 HydrophobicContact CD1-CG1 4.42Å; Y1777-I1799 CarbonylContact O-C 3.49Å; Y1777-I1799 WeakPolarHBondContact O-CA 3.44Å; I1779-I1799 HydrophobicContact CD1-CG2 3.67Å; I1779-I1799 HydrophobicContact CG1-CG2 3.88Å; I1793-I1799 HydrophobicContact CD1-CD1 3.86Å; I1793-I1799 HydrophobicContact CG1-CD1 4.44Å; I1793-I1799 HydrophobicContact CG2-CD1 4.25Å; V1797-I1799 HydrophobicContact CG1-CD1 4.45Å; V1797-I1799 HydrophobicContact CG1-CG1 4Å; I1799-I1801 HydrophobicContact CG2-CD1 4.48Å; I1799-I1801 HydrophobicContact CG2-CG1 3.94Å; I1799-R1824 PolarHBondContact N-O 2.95Å; I1799-L1825 HydrophobicContact CB-CD2 3.71Å; I1799-L1825 HydrophobicContact CD1-CD2 3.69Å; I1799-L1825 HydrophobicContact CG1-CD2 3.93Å; I1799-L1825 HydrophobicContact CG2-CD2 4.46Å; I1799-K1826 PolarHBondContact O-N 3.3Å
1800	H	88.8	Confident	90.6	Very high	10.8 Å²	10.8	22.5 Å²	22.5	5%	0.05	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119	176.1	-69.4	-169.2	0	0	0	109.2	P1776 Y1777 Y1778 I1779 E1798 K1826 V1828 D1832	P1776-H1800 HydrophobicContact CB-CB 4.42Å; Y1777-H1800 PolarHBondContact O-N 3.18Å; Y1778-H1800 WeakPolarHBondContact CA-O 3.33Å; Y1778-H1800 HydrophobicContact CD1-CB 3.86Å; Y1778-H1800 HydrophobicContact CE1-CB 3.92Å; Y1778-H1800 AromaticContact CE1-ND1 3.8Å; I1779-H1800 PolarHBondContact N-O 3.28Å; I1779-H1800 VanDerWaalsContact N-O 3.11Å; E1798-H1800 IonicContact OE1-CD2 2.73Å; E1798-H1800 IonicContact OE1-CE1 3.05Å; E1798-H1800 IonicContact OE1-NE2 3.03Å; E1798-H1800 PolarHBondContact OE1-NE2 2.88Å; H1800-K1826 CarbonylContact C-O 3.57Å; H1800-K1826 WeakPolarHBondContact CA-O 3.34Å; H1800-V1828 HydrophobicContact CB-CG2 4.01Å; H1800-D1832 IonicContact CE1-OD2 3.13Å; H1800-D1832 PolarHBondContact CE1-OD2 3.04Å; H1800-D1832 IonicContact CG-OD2 2.8Å; H1800-D1832 IonicContact ND1-OD2 3.34Å; H1800-D1832 PolarHBondContact ND1-OD2 2.9Å
1801	I	91	Very high	90.5	Very high	0.4 Å²	0.4	18.6 Å²	18.6	0%	0.002	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.3	-172.2	-54	171.6	0	0	0	109.1	I1779 I1799 V1805 I1807 L1825 K1826 P1827 V1828 W2004	I1779-I1801 HydrophobicContact CB-CG1 4.39Å; I1779-I1801 HydrophobicContact CB-CG2 4.42Å; I1779-I1801 HydrophobicContact CD1-CG1 4.36Å; I1799-I1801 HydrophobicContact CG2-CD1 4.48Å; I1799-I1801 HydrophobicContact CG2-CG1 3.94Å; I1801-V1805 HydrophobicContact CG2-CB 3.84Å; I1801-V1805 HydrophobicContact CG2-CG1 3.89Å; I1801-I1807 HydrophobicContact CD1-CD1 3.84Å; I1801-L1825 HydrophobicContact CD1-CB 4.49Å; I1801-K1826 PolarHBondContact N-O 2.95Å; I1801-P1827 CarbonylContact O-C 3.53Å; I1801-P1827 WeakPolarHBondContact O-CA 3.38Å; I1801-V1828 PolarHBondContact O-N 3.12Å; I1801-V1828 VanDerWaalsContact O-N 3.13Å; I1801-W2004 HydrophobicContact CB-CB 4.12Å; I1801-W2004 HydrophobicContact CB-CD2 4.07Å; I1801-W2004 HydrophobicContact CB-CE3 4.27Å; I1801-W2004 HydrophobicContact CB-CG 4Å; I1801-W2004 HydrophobicContact CD1-CD2 3.74Å; I1801-W2004 HydrophobicContact CD1-CE3 3.51Å; I1801-W2004 VanDerWaalsContact CD1-CE3 3.46Å; I1801-W2004 HydrophobicContact CD1-CG 4.5Å; I1801-W2004 HydrophobicContact CD1-CH2 3.69Å; I1801-W2004 HydrophobicContact CD1-CZ2 3.88Å; I1801-W2004 HydrophobicContact CD1-CZ3 3.47Å; I1801-W2004 VanDerWaalsContact CD1-CZ3 3.46Å; I1801-W2004 HydrophobicContact CG1-CD2 4.49Å; I1801-W2004 HydrophobicContact CG1-CE3 4.46Å; I1801-W2004 HydrophobicContact CG2-CB 3.76Å; I1801-W2004 HydrophobicContact CG2-CD2 4.05Å; I1801-W2004 HydrophobicContact CG2-CE3 3.87Å; I1801-W2004 HydrophobicContact CG2-CG 4.02Å
1802	Y	87.5	Confident	90.5	Very high	30.2 Å²	30.2	19.4 Å²	19.4	12%	0.118	10%	0.099	C	C	.	.			trans	-70.6	155.8	179.4	-83.8	-114.3	0	0	0	111.7	Y1632 N1635 Y1778 I1779 R1780 V1805 V1828 W2004	Y1632-Y1802 AromaticContact CD1-CD1 3.92Å; Y1632-Y1802 HydrophobicContact CD1-CD1 4.16Å; Y1632-Y1802 HydrophobicContact CD1-CE1 4.32Å; Y1632-Y1802 AromaticContact CE1-CD1 3.97Å; Y1632-Y1802 HydrophobicContact CE1-CD1 4.13Å; Y1632-Y1802 HydrophobicContact CE1-CE1 4.47Å; Y1632-Y1802 AromaticContact CE2-CD1 3.9Å; Y1632-Y1802 HydrophobicContact CE2-CD1 3.9Å; Y1632-Y1802 HydrophobicContact CE2-CE1 4.03Å; Y1632-Y1802 AromaticContact CZ-CD1 3.98Å; Y1632-Y1802 WeakPolarHBondContact OH-CD1 3.38Å; N1635-Y1802 WeakPolarHBondContact ND2-CB 3.41Å; Y1778-Y1802 HydrophobicContact CD1-CE2 4.32Å; I1779-Y1802 WeakPolarHBondContact O-CD2 3.36Å; I1779-Y1802 PolarHBondContact O-N 2.85Å; I1779-Y1802 VanDerWaalsContact O-N 3.07Å; R1780-Y1802 HydrophobicContact CB-CD2 4.4Å; R1780-Y1802 HydrophobicContact CG-CD1 4.42Å; R1780-Y1802 HydrophobicContact CG-CD2 3.87Å; R1780-Y1802 HydrophobicContact CG-CE1 4.29Å; R1780-Y1802 HydrophobicContact CG-CE2 3.7Å; R1780-Y1802 HydrophobicContact CG-CG 4.41Å; Y1802-V1805 VanDerWaalsContact O-CB 3.29Å; Y1802-V1805 WeakPolarHBondContact O-CB 3.36Å; Y1802-V1805 WeakPolarHBondContact O-CG2 3.4Å; Y1802-V1805 PolarHBondContact O-N 3.01Å; Y1802-V1828 HydrophobicContact CD2-CB 4.48Å; Y1802-V1828 HydrophobicContact CD2-CG2 3.6Å; Y1802-V1828 VanDerWaalsContact CD2-CG2 3.46Å; Y1802-V1828 HydrophobicContact CE2-CG2 3.79Å; Y1802-V1828 HydrophobicContact CG-CG1 4.47Å; Y1802-V1828 HydrophobicContact CG-CG2 4.21Å; Y1802-W2004 WeakPolarHBondContact O-CB 3.4Å
1803	P	84.9	Confident	90.5	Very high	15.6 Å²	15.6	18.4 Å²	18.4	10%	0.101	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	150.3	178.6	16	-23.2	0	0	0	112.2	Y1632 N1635 V1805 V2001 H2003	Y1632-P1803 HydrophobicContact CD1-CG 3.75Å; Y1632-P1803 HydrophobicContact CD2-CG 4.23Å; Y1632-P1803 HydrophobicContact CE1-CG 3.64Å; Y1632-P1803 HydrophobicContact CE2-CG 4.18Å; Y1632-P1803 HydrophobicContact CG-CG 4.07Å; Y1632-P1803 WeakPolarHBondContact OH-CD 3.39Å; Y1632-P1803 WeakPolarHBondContact OH-CG 3.44Å; N1635-P1803 PolarHBondContact ND2-O 3.01Å; P1803-V1805 PolarHBondContact O-N 3.06Å; P1803-V1805 VanDerWaalsContact O-N 3.12Å; P1803-V2001 WeakPolarHBondContact CB-O 3.2Å; P1803-V2001 HydrophobicContact CG-CG1 4.41Å; P1803-V2001 WeakPolarHBondContact CG-O 3.32Å; P1803-H2003 VanDerWaalsContact CA-O 3.3Å; P1803-H2003 WeakPolarHBondContact CA-O 3.37Å
1804	N	85.1	Confident	90.6	Very high	15.8 Å²	15.8	20 Å²	20	8%	0.084	10%	0.1	C	C	.	.	B	Isolated β-bridge	trans	62.4	3.1	-175.8	-67.4	-47.2	0	0	0	116.6	N1635 W1636 H2003 L2034 H2036 N2037	N1635-N1804 HydrophobicContact CB-CB 4.28Å; W1636-N1804 VanDerWaalsContact CE3-ND2 3.28Å; W1636-N1804 WeakPolarHBondContact CZ3-ND2 3.27Å; N1804-H2003 PolarHBondContact N-O 3Å; N1804-H2003 VanDerWaalsContact N-O 3.12Å; N1804-L2034 WeakPolarHBondContact CA-O 3.37Å; N1804-L2034 WeakPolarHBondContact OD1-CD2 3.48Å; N1804-H2036 PolarHBondContact O-N 2.88Å; N1804-N2037 PolarHBondContact ND2-OD1 3.04Å; N1804-N2037 PolarHBondContact OD1-N 2.96Å; N1804-N2037 VanDerWaalsContact OD1-N 3.13Å; N1804-N2037 PolarHBondContact OD1-OD1 2.8Å
1805	V	89.6	Confident	90.7	Very high	1.8 Å²	1.8	16.3 Å²	16.3	1%	0.011	8%	0.082	C	C	.	.			trans	-90	128.5	-179.2	176.2	0	0	0	0	111.7	N1635 I1779 R1780 K1781 D1782 I1801 Y1802 P1803 G2005	N1635-V1805 HydrophobicContact CB-CG2 4.5Å; N1635-V1805 VanDerWaalsContact ND2-CG2 3.27Å; N1635-V1805 WeakPolarHBondContact ND2-CG2 3.23Å; I1779-V1805 HydrophobicContact CG2-CG1 3.78Å; R1780-V1805 VanDerWaalsContact O-CG2 3.28Å; R1780-V1805 WeakPolarHBondContact O-CG2 3.4Å; K1781-V1805 VanDerWaalsContact C-CG1 3.44Å; K1781-V1805 WeakPolarHBondContact O-CG1 3.25Å; D1782-V1805 VanDerWaalsContact OD1-CA 3.32Å; D1782-V1805 WeakPolarHBondContact OD1-CA 3.37Å; I1801-V1805 HydrophobicContact CG2-CB 3.84Å; I1801-V1805 HydrophobicContact CG2-CG1 3.89Å; Y1802-V1805 VanDerWaalsContact O-CB 3.29Å; Y1802-V1805 WeakPolarHBondContact O-CB 3.36Å; Y1802-V1805 WeakPolarHBondContact O-CG2 3.4Å; Y1802-V1805 PolarHBondContact O-N 3.01Å; P1803-V1805 PolarHBondContact O-N 3.06Å; P1803-V1805 VanDerWaalsContact O-N 3.12Å; V1805-G2005 VanDerWaalsContact O-CA 3.32Å; V1805-G2005 WeakPolarHBondContact O-CA 3.33Å; V1805-G2005 PolarHBondContact O-N 3.11Å
1806	R	91.3	Very high	90.7	Very high	10.6 Å²	10.6	15.9 Å²	15.9	4%	0.04	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	146.3	179.1	167.9	170.8	84.2	-178.7	7.5	112	N1705 I1706 D1782 L1783 F2008 S2035	N1705-R1806 PolarHBondContact ND2-O 2.77Å; N1705-R1806 PolarHBondContact OD1-NE 3.21Å; N1705-R1806 PolarHBondContact OD1-NH2 3.22Å; I1706-R1806 VanDerWaalsContact CG2-NH2 3.27Å; D1782-R1806 WeakPolarHBondContact CA-O 3.29Å; D1782-R1806 WeakPolarHBondContact CB-O 3.33Å; D1782-R1806 PolarHBondContact OD1-N 3.1Å; L1783-R1806 PolarHBondContact N-O 3.14Å; L1783-R1806 VanDerWaalsContact N-O 3.16Å; R1806-F2008 HydrophobicContact CG-CB 4.25Å; R1806-S2035 VanDerWaalsContact CD-OG 3.31Å; R1806-S2035 WeakPolarHBondContact CD-OG 3.33Å
1807	I	94.2	Very high	90.9	Very high	8.4 Å²	8.4	15.6 Å²	15.6	4%	0.043	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.2	171.3	-56.3	173.9	0	0	0	108.7	I1779 L1783 I1801 V1809 W2004 G2006 L2007 F2008	I1779-I1807 HydrophobicContact CD1-CD1 3.72Å; I1779-I1807 HydrophobicContact CD1-CG1 4.29Å; L1783-I1807 HydrophobicContact CB-CG1 4.41Å; L1783-I1807 HydrophobicContact CB-CG2 4.44Å; L1783-I1807 HydrophobicContact CD2-CG2 4.35Å; L1783-I1807 CarbonylContact O-C 3.58Å; L1783-I1807 WeakPolarHBondContact O-CA 3.26Å; I1801-I1807 HydrophobicContact CD1-CD1 3.84Å; I1807-V1809 HydrophobicContact CG2-CG2 4.26Å; I1807-W2004 HydrophobicContact CD1-CZ3 4.39Å; I1807-W2004 HydrophobicContact CG1-CZ3 4.42Å; I1807-G2006 PolarHBondContact N-O 3.04Å; I1807-G2006 VanDerWaalsContact N-O 3.1Å; I1807-L2007 HydrophobicContact CB-CD2 3.91Å; I1807-L2007 HydrophobicContact CD1-CD2 3.87Å; I1807-L2007 HydrophobicContact CG1-CD2 4.37Å; I1807-L2007 HydrophobicContact CG2-CD2 4.3Å; I1807-F2008 PolarHBondContact O-N 3.02Å
1808	L	93	Very high	91	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.1	175.8	176.6	62.3	0	0	0	110.4	F1675 F1701 N1705 L1783 T1784 I1785 L1810 F2008 A2010 Y2117	F1675-L1808 HydrophobicContact CZ-CD2 4.5Å; F1701-L1808 HydrophobicContact CZ-CD2 4.36Å; N1705-L1808 HydrophobicContact CB-CB 4.44Å; N1705-L1808 HydrophobicContact CB-CD2 4.06Å; N1705-L1808 VanDerWaalsContact ND2-CB 3.3Å; N1705-L1808 WeakPolarHBondContact ND2-CB 3.29Å; L1783-L1808 PolarHBondContact O-N 2.95Å; T1784-L1808 CarbonylContact C-O 3.39Å; T1784-L1808 WeakPolarHBondContact CA-O 3.42Å; T1784-L1808 HydrophobicContact CG2-CB 4.36Å; T1784-L1808 HydrophobicContact CG2-CD2 3.95Å; T1784-L1808 HydrophobicContact CG2-CG 4.19Å; I1785-L1808 PolarHBondContact N-O 3.25Å; L1808-L1810 HydrophobicContact CD1-CD2 4.1Å; L1808-L1810 HydrophobicContact CD2-CD1 4.46Å; L1808-L1810 HydrophobicContact CD2-CD2 4.35Å; L1808-L1810 HydrophobicContact CD2-CG 4.41Å; L1808-L1810 HydrophobicContact CG-CD2 4.15Å; L1808-L1810 HydrophobicContact CG-CG 4.19Å; L1808-F2008 CarbonylContact C-O 3.56Å; L1808-F2008 WeakPolarHBondContact CA-O 3.38Å; L1808-F2008 HydrophobicContact CD1-CB 4.13Å; L1808-F2008 HydrophobicContact CD1-CD1 3.51Å; L1808-F2008 VanDerWaalsContact CD1-CD1 3.44Å; L1808-F2008 HydrophobicContact CD1-CE1 4.34Å; L1808-F2008 HydrophobicContact CD1-CG 4.13Å; L1808-A2010 HydrophobicContact CD1-CB 4.24Å; L1808-Y2117 HydrophobicContact CD1-CD1 4.38Å; L1808-Y2117 HydrophobicContact CD1-CG 4.4Å; L1808-Y2117 HydrophobicContact CD2-CD1 4.42Å; L1808-Y2117 HydrophobicContact CD2-CD2 4.21Å; L1808-Y2117 HydrophobicContact CD2-CE2 4.33Å; L1808-Y2117 HydrophobicContact CD2-CG 4.3Å
1809	V	93.4	Very high	90.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	97.7	-177.1	-171.3	0	0	0	0	109.6	I1785 I1807 L1813 F2008 F2009 A2010 R2048	I1785-V1809 HydrophobicContact CD1-CG1 4.19Å; I1785-V1809 HydrophobicContact CD1-CG2 4.07Å; I1807-V1809 HydrophobicContact CG2-CG2 4.26Å; V1809-L1813 HydrophobicContact CG1-CB 3.86Å; V1809-L1813 HydrophobicContact CG2-CB 4.25Å; V1809-L1813 HydrophobicContact CG2-CD2 4.16Å; V1809-F2008 PolarHBondContact N-O 3.07Å; V1809-F2009 HydrophobicContact CB-CD1 3.7Å; V1809-F2009 HydrophobicContact CB-CE1 4.05Å; V1809-F2009 HydrophobicContact CB-CG 4.39Å; V1809-F2009 HydrophobicContact CG1-CD1 3.89Å; V1809-F2009 HydrophobicContact CG1-CE1 4.05Å; V1809-F2009 HydrophobicContact CG2-CD1 4.03Å; V1809-F2009 HydrophobicContact CG2-CE1 3.95Å; V1809-F2009 HydrophobicContact CG2-CZ 4.48Å; V1809-A2010 PolarHBondContact O-N 2.98Å; V1809-A2010 VanDerWaalsContact O-N 3.1Å; V1809-R2048 PolarHBondContact O-NH1 3.05Å; V1809-R2048 VanDerWaalsContact O-NH1 3.1Å
1810	L	89.8	Confident	90.7	Very high	2.4 Å²	2.4	32.3 Å²	32.3	1%	0.013	15%	0.15	C	C	.	.	S	Bend	trans	-94	-34.8	170.3	-51.9	174.3	0	0	0	111	F1675 T1784 I1785 M1786 P1787 L1808 A2010 M2020 R2048 Y2117	F1675-L1810 HydrophobicContact CD2-CD1 4.35Å; F1675-L1810 HydrophobicContact CE1-CD1 4.18Å; F1675-L1810 HydrophobicContact CE2-CD1 3.17Å; F1675-L1810 HydrophobicContact CE2-CD2 3.78Å; F1675-L1810 HydrophobicContact CE2-CG 4.03Å; F1675-L1810 HydrophobicContact CZ-CD1 3.12Å; F1675-L1810 HydrophobicContact CZ-CD2 4.24Å; F1675-L1810 HydrophobicContact CZ-CG 4.22Å; T1784-L1810 HydrophobicContact CG2-CD1 4Å; T1784-L1810 HydrophobicContact CG2-CG 4.43Å; I1785-L1810 CarbonylContact O-C 3.39Å; I1785-L1810 WeakPolarHBondContact O-CA 3.42Å; I1785-L1810 WeakPolarHBondContact O-CB 3.33Å; I1785-L1810 PolarHBondContact O-N 2.99Å; M1786-L1810 HydrophobicContact SD-CD1 4.1Å; P1787-L1810 HydrophobicContact CG-CB 4.08Å; L1808-L1810 HydrophobicContact CD1-CD2 4.1Å; L1808-L1810 HydrophobicContact CD2-CD1 4.46Å; L1808-L1810 HydrophobicContact CD2-CD2 4.35Å; L1808-L1810 HydrophobicContact CD2-CG 4.41Å; L1808-L1810 HydrophobicContact CG-CD2 4.15Å; L1808-L1810 HydrophobicContact CG-CG 4.19Å; L1810-A2010 HydrophobicContact CD2-CB 3.85Å; L1810-M2020 VanDerWaalsContact O-SD 3.37Å; L1810-R2048 PolarHBondContact O-NH1 2.95Å; L1810-Y2117 HydrophobicContact CD1-CE1 3.98Å; L1810-Y2117 HydrophobicContact CD2-CD1 3.65Å; L1810-Y2117 HydrophobicContact CD2-CE1 3.51Å; L1810-Y2117 VanDerWaalsContact CD2-CE1 3.47Å; L1810-Y2117 HydrophobicContact CG-CE1 4.39Å
1811	G	89.8	Confident	90.8	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	-78.3	-137.1	170	0	0	0	0	0	112.9	I1785 M1786 A1789 R2048	I1785-G1811 PolarHBondContact O-N 2.83Å; M1786-G1811 VanDerWaalsContact O-CA 3.28Å; M1786-G1811 WeakPolarHBondContact O-CA 3.37Å; M1786-G1811 PolarHBondContact O-N 2.83Å; A1789-G1811 WeakPolarHBondContact O-CA 3.26Å; G1811-R2048 VanDerWaalsContact O-CZ 3.24Å; G1811-R2048 PolarHBondContact O-NH1 2.85Å; G1811-R2048 PolarHBondContact O-NH2 2.95Å
1812	S	92.2	Very high	90.9	Very high	23.2 Å²	23.2	34.8 Å²	34.8	16%	0.162	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.4	179.7	-70.9	0	0	0	0	112.3	A1789 K1790 L1791 Q2021	A1789-S1812 PolarHBondContact O-N 2.78Å; K1790-S1812 CarbonylContact C-O 3.55Å; K1790-S1812 VanDerWaalsContact CA-O 3.3Å; K1790-S1812 WeakPolarHBondContact CA-O 3.34Å; L1791-S1812 PolarHBondContact N-O 3.14Å; S1812-Q2021 PolarHBondContact OG-O 2.93Å; S1812-Q2021 VanDerWaalsContact OG-O 3.07Å
1813	L	94.4	Very high	91.2	Very high	5.4 Å²	5.4	33.4 Å²	33.4	3%	0.028	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.8	170.4	179.2	64.8	0	0	0	109.3	I1785 L1791 I1793 V1809 L2007 F2009 S2022 S2023 L2024	I1785-L1813 HydrophobicContact CD1-CB 4.33Å; I1785-L1813 HydrophobicContact CD1-CD1 4.21Å; L1791-L1813 HydrophobicContact CB-CD1 3.95Å; L1791-L1813 HydrophobicContact CD2-CD1 3.94Å; L1791-L1813 HydrophobicContact CG-CD1 4.07Å; I1793-L1813 HydrophobicContact CD1-CD1 3.98Å; I1793-L1813 HydrophobicContact CG1-CD1 4.29Å; V1809-L1813 HydrophobicContact CG1-CB 3.86Å; V1809-L1813 HydrophobicContact CG2-CB 4.25Å; V1809-L1813 HydrophobicContact CG2-CD2 4.16Å; L1813-L2007 HydrophobicContact CD2-CD1 4.49Å; L1813-F2009 HydrophobicContact CB-CE1 4.08Å; L1813-F2009 HydrophobicContact CD2-CE1 4.15Å; L1813-F2009 HydrophobicContact CD2-CZ 3.95Å; L1813-S2022 PolarHBondContact N-OG 3.04Å; L1813-S2022 VanDerWaalsContact N-OG 3.1Å; L1813-S2022 VanDerWaalsContact O-CA 3.26Å; L1813-S2022 WeakPolarHBondContact O-CA 3.41Å; L1813-S2022 VanDerWaalsContact O-CB 3.28Å; L1813-S2022 WeakPolarHBondContact O-CB 3.34Å; L1813-S2023 PolarHBondContact O-N 2.95Å; L1813-S2023 VanDerWaalsContact O-N 3.08Å; L1813-L2024 HydrophobicContact CD2-CD2 4.2Å; L1813-L2024 HydrophobicContact CG-CD2 4.39Å
1814	E	94.9	Very high	91.6	Very high	45.2 Å²	45.2	36.9 Å²	36.9	21%	0.211	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	106	177.2	177.1	169.8	-141.1	0	0	109.5	K1790 L1791 T1792 I1793 Q1816	K1790-E1814 WeakPolarHBondContact CE-OE2 3.37Å; K1790-E1814 IonicContact NZ-OE2 3.67Å; K1790-E1814 PolarHBondContact NZ-OE2 2.92Å; L1791-E1814 PolarHBondContact O-N 2.89Å; T1792-E1814 CarbonylContact C-O 3.52Å; T1792-E1814 WeakPolarHBondContact CA-O 3.32Å; T1792-E1814 HydrophobicContact CG2-CB 4.26Å; I1793-E1814 PolarHBondContact N-O 3.22Å; E1814-Q1816 HydrophobicContact CG-CG 3.87Å; E1814-Q1816 PolarHBondContact OE1-NE2 2.69Å
1815	A	94.3	Very high	92	Very high	1.8 Å²	1.8	36.4 Å²	36.4	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	106.9	175.8	0	0	0	0	0	108.9	I1793 I1823 S2023 L2024 R2025 V2027	I1793-A1815 HydrophobicContact CB-CB 4.34Å; A1815-I1823 HydrophobicContact CB-CD1 3.71Å; A1815-S2023 PolarHBondContact N-O 2.98Å; A1815-L2024 HydrophobicContact CB-CD2 3.79Å; A1815-R2025 PolarHBondContact O-N 3.11Å; A1815-V2027 HydrophobicContact CB-CG2 3.79Å
1816	Q	91.5	Very high	92.1	Very high	96.6 Å²	96.6	38 Å²	38	45%	0.451	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	82.9	-179.2	-66.5	-170.2	3.5	0	0	110.6	I1793 K1795 E1814	I1793-Q1816 PolarHBondContact O-N 3.12Å; I1793-Q1816 VanDerWaalsContact O-N 3.14Å; K1795-Q1816 PolarHBondContact N-O 3.01Å; E1814-Q1816 HydrophobicContact CG-CG 3.87Å; E1814-Q1816 PolarHBondContact OE1-NE2 2.69Å
1817	G	92.3	Very high	92	Very high	9.4 Å²	9.4	37.6 Å²	37.6	10%	0.097	17%	0.171	C	C	.	.			trans	-81.4	173.7	170.6	0	0	0	0	0	112.7	R2025 H2026	G1817-R2025 WeakPolarHBondContact CA-O 3.39Å; G1817-R2025 PolarHBondContact N-O 3.06Å; G1817-H2026 PolarHBondContact O-ND1 3.01Å
1818	T	92.2	Very high	91.6	Very high	50.2 Å²	50.2	37.2 Å²	37.2	31%	0.308	17%	0.169	S	C	.	.			trans	-127.2	161.9	167.1	65.7	0	0	0	0	109.5	K1795 W1820 E1821 P1822	K1795-T1818 HydrophobicContact CB-CG2 4.38Å; K1795-T1818 HydrophobicContact CD-CG2 3.91Å; T1818-W1820 PolarHBondContact O-N 2.95Å; T1818-W1820 VanDerWaalsContact O-N 3.16Å; T1818-E1821 PolarHBondContact N-O 3.05Å; T1818-E1821 VanDerWaalsContact N-O 3.14Å; T1818-E1821 CarbonylContact O-C 3.38Å; T1818-E1821 PolarHBondContact O-N 3.04Å; T1818-E1821 VanDerWaalsContact O-N 3.1Å; T1818-E1821 PolarHBondContact OG1-N 2.99Å; T1818-P1822 WeakPolarHBondContact O-CA 3.35Å; T1818-P1822 VanDerWaalsContact O-N 3.1Å
1819	F	86.4	Confident	91.1	Very high	129.8 Å²	129.8	38.6 Å²	38.6	57%	0.569	18%	0.177	S	C	*	.	S	Bend	trans	-52.9	-37.7	178.2	-177.3	-97	0	0	0	113.9	H2026	F1819-H2026 PolarHBondContact N-CD2 3Å; F1819-H2026 VanDerWaalsContact N-CD2 3.28Å
1820	W	88	Confident	90.1	Very high	220.6 Å²	220.6	42.9 Å²	42.9	84%	0.836	20%	0.199	S	C	*	.	S	Bend	trans	-86.5	-21.8	180	-54.8	110.9	0	0	0	113.9	T1818	T1818-W1820 PolarHBondContact O-N 2.95Å; T1818-W1820 VanDerWaalsContact O-N 3.16Å
1821	E	90.1	Very high	89.1	Confident	46.8 Å²	46.8	46.7 Å²	46.7	22%	0.219	22%	0.223	C	C	.	.	S	Bend	trans	-133.3	69	-179.4	-59.5	-175.4	136	0	0	108.7	R1759 R1761 K1795 G1796 T1818	R1759-E1821 IonicContact CZ-OE1 3.3Å; R1759-E1821 VanDerWaalsContact CZ-OE1 3.22Å; R1759-E1821 IonicContact NH1-OE1 3.15Å; R1759-E1821 PolarHBondContact NH1-OE1 2.95Å; R1759-E1821 IonicContact NH2-OE1 3.9Å; R1759-E1821 PolarHBondContact NH2-OE1 3.05Å; R1761-E1821 IonicContact NH2-OE1 2.97Å; R1761-E1821 PolarHBondContact NH2-OE1 2.95Å; K1795-E1821 HydrophobicContact CB-CB 4.25Å; K1795-E1821 VanDerWaalsContact CD-OE2 3.3Å; K1795-E1821 WeakPolarHBondContact CD-OE2 3.36Å; K1795-E1821 VanDerWaalsContact CE-OE2 3.26Å; K1795-E1821 WeakPolarHBondContact CE-OE2 3.36Å; K1795-E1821 HydrophobicContact CG-CB 4.49Å; K1795-E1821 IonicContact NZ-OE2 3.31Å; K1795-E1821 PolarHBondContact NZ-OE2 2.92Å; G1796-E1821 PolarHBondContact N-O 2.88Å; T1818-E1821 PolarHBondContact N-O 3.05Å; T1818-E1821 VanDerWaalsContact N-O 3.14Å; T1818-E1821 CarbonylContact O-C 3.38Å; T1818-E1821 PolarHBondContact O-N 3.04Å; T1818-E1821 VanDerWaalsContact O-N 3.1Å; T1818-E1821 PolarHBondContact OG1-N 2.99Å
1822	P	92.8	Very high	88	Confident	17.2 Å²	17.2	48.1 Å²	48.1	11%	0.112	23%	0.23	C	C	.	.			trans	-69.1	155.8	178.9	29.7	-35.1	0	0	0	110.5	G1796 T1818 H2026 E2028	G1796-P1822 WeakPolarHBondContact CA-O 3.34Å; T1818-P1822 WeakPolarHBondContact O-CA 3.35Å; T1818-P1822 VanDerWaalsContact O-N 3.1Å; P1822-H2026 WeakPolarHBondContact CA-O 3.31Å; P1822-H2026 WeakPolarHBondContact CB-O 3.37Å; P1822-E2028 HydrophobicContact CB-CG 4.29Å; P1822-E2028 WeakPolarHBondContact CG-OE1 3.37Å
1823	I	95.1	Very high	86.6	Confident	0.6 Å²	0.6	48 Å²	48	0%	0.003	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	132.8	171.7	-66.5	165.4	0	0	0	107.9	I1793 E1794 V1797 A1815 H2026 V2027 E2028	I1793-I1823 HydrophobicContact CB-CD1 4.05Å; I1793-I1823 HydrophobicContact CG2-CD1 3.83Å; I1793-I1823 HydrophobicContact CG2-CG1 4.09Å; I1793-I1823 HydrophobicContact CG2-CG2 3.71Å; I1793-I1823 VanDerWaalsContact O-CD1 3.31Å; I1793-I1823 WeakPolarHBondContact O-CD1 3.44Å; E1794-I1823 WeakPolarHBondContact O-CG1 3.42Å; V1797-I1823 WeakPolarHBondContact O-CA 3.36Å; A1815-I1823 HydrophobicContact CB-CD1 3.71Å; I1823-H2026 PolarHBondContact N-O 3.05Å; I1823-H2026 VanDerWaalsContact N-O 3.07Å; I1823-V2027 HydrophobicContact CB-CG2 4.35Å; I1823-V2027 HydrophobicContact CG2-CG1 4.44Å; I1823-V2027 CarbonylContact O-C 3.46Å; I1823-V2027 WeakPolarHBondContact O-CA 3.38Å; I1823-E2028 PolarHBondContact O-N 3.11Å
1824	R	93.1	Very high	84.8	Confident	88.6 Å²	88.6	50.3 Å²	50.3	33%	0.334	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	120	-174.4	-66.7	-179	170.8	144	5.6	111.5	V1797 E1798 I1799 E2028	V1797-R1824 PolarHBondContact O-N 2.73Å; E1798-R1824 WeakPolarHBondContact CA-O 3.27Å; E1798-R1824 HydrophobicContact CB-CB 4.4Å; E1798-R1824 HydrophobicContact CG-CB 4.09Å; I1799-R1824 PolarHBondContact N-O 2.95Å; R1824-E2028 WeakPolarHBondContact CD-OE2 3.21Å; R1824-E2028 HydrophobicContact CG-CB 4.25Å; R1824-E2028 VanDerWaalsContact CG-OE2 3.31Å; R1824-E2028 WeakPolarHBondContact CG-OE2 3.4Å; R1824-E2028 IonicContact CZ-OE2 3.41Å; R1824-E2028 IonicContact NE-OE1 3.22Å; R1824-E2028 IonicContact NE-OE2 3.51Å; R1824-E2028 PolarHBondContact NE-OE2 3.04Å; R1824-E2028 IonicContact NH2-OE1 2.81Å; R1824-E2028 IonicContact NH2-OE2 3.77Å
1825	L	94.3	Very high	82.7	Confident	6.6 Å²	6.6	55.8 Å²	55.8	4%	0.035	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112.6	170.6	-55.6	-176.3	0	0	0	108.3	I1799 I1801 W2004 L2007 E2028 I2029 V2030	I1799-L1825 HydrophobicContact CB-CD2 3.71Å; I1799-L1825 HydrophobicContact CD1-CD2 3.69Å; I1799-L1825 HydrophobicContact CG1-CD2 3.93Å; I1799-L1825 HydrophobicContact CG2-CD2 4.46Å; I1801-L1825 HydrophobicContact CD1-CB 4.49Å; L1825-W2004 HydrophobicContact CB-CH2 4.38Å; L1825-W2004 HydrophobicContact CB-CZ2 3.97Å; L1825-W2004 HydrophobicContact CD1-CH2 4.21Å; L1825-W2004 HydrophobicContact CD1-CZ2 4.49Å; L1825-L2007 HydrophobicContact CD1-CD1 3.97Å; L1825-L2007 HydrophobicContact CD1-CD2 4.02Å; L1825-L2007 HydrophobicContact CD1-CG 4.27Å; L1825-E2028 PolarHBondContact N-O 2.92Å; L1825-I2029 HydrophobicContact CB-CG1 4.34Å; L1825-I2029 HydrophobicContact CD1-CD1 4.38Å; L1825-I2029 HydrophobicContact CD1-CG1 4.16Å; L1825-I2029 HydrophobicContact CG-CG1 4.44Å; L1825-V2030 PolarHBondContact O-N 3.12Å
1826	K	91.1	Very high	80.7	Confident	34.4 Å²	34.4	61.4 Å²	61.4	15%	0.15	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.7	-173.7	-67	178.9	-177.5	166.8	0	111.3	E1798 I1799 H1800 I1801 Y2000 V2030	E1798-K1826 VanDerWaalsContact OE1-CD 3.3Å; E1798-K1826 WeakPolarHBondContact OE1-CD 3.34Å; E1798-K1826 VanDerWaalsContact OE1-CE 3.28Å; E1798-K1826 WeakPolarHBondContact OE1-CE 3.27Å; E1798-K1826 IonicContact OE1-NZ 3.37Å; E1798-K1826 PolarHBondContact OE1-NZ 2.98Å; I1799-K1826 PolarHBondContact O-N 3.3Å; H1800-K1826 CarbonylContact C-O 3.57Å; H1800-K1826 WeakPolarHBondContact CA-O 3.34Å; I1801-K1826 PolarHBondContact N-O 2.95Å; K1826-Y2000 HydrophobicContact CB-CE1 4.36Å; K1826-Y2000 HydrophobicContact CD-CE1 4.44Å; K1826-V2030 HydrophobicContact CG-CB 4.36Å; K1826-V2030 HydrophobicContact CG-CG2 4.4Å
1827	P	89.6	Confident	78.4	Confident	1.4 Å²	1.4	59.7 Å²	59.7	1%	0.009	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	158.4	163.9	31.1	-36.4	0	0	0	110.4	I1801 V1996 Y2000 G2002 V2030	I1801-P1827 CarbonylContact O-C 3.53Å; I1801-P1827 WeakPolarHBondContact O-CA 3.38Å; P1827-V1996 HydrophobicContact CG-CG1 4.43Å; P1827-Y2000 HydrophobicContact CB-CD1 4.35Å; P1827-Y2000 HydrophobicContact CB-CG 4.45Å; P1827-Y2000 HydrophobicContact CG-CD1 3.62Å; P1827-Y2000 HydrophobicContact CG-CD2 3.79Å; P1827-Y2000 HydrophobicContact CG-CE1 4.19Å; P1827-Y2000 HydrophobicContact CG-CE2 4.26Å; P1827-Y2000 HydrophobicContact CG-CG 3.4Å; P1827-Y2000 VanDerWaalsContact CG-CG 3.4Å; P1827-Y2000 WeakPolarHBondContact O-CD1 3.25Å; P1827-G2002 WeakPolarHBondContact CB-O 3.02Å; P1827-V2030 VanDerWaalsContact CD-O 3.28Å; P1827-V2030 WeakPolarHBondContact CD-O 3.4Å
1828	V	85.5	Confident	75.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-66.8	141.9	175.2	150.1	0	0	0	0	111.3	Y1632 Y1778 H1800 I1801 Y1802 D1832 I1833 V2001	Y1632-V1828 HydrophobicContact CE1-CG1 4.45Å; Y1778-V1828 HydrophobicContact CD1-CG2 4.19Å; Y1778-V1828 HydrophobicContact CE1-CG2 4.33Å; H1800-V1828 HydrophobicContact CB-CG2 4.01Å; I1801-V1828 PolarHBondContact O-N 3.12Å; I1801-V1828 VanDerWaalsContact O-N 3.13Å; Y1802-V1828 HydrophobicContact CD2-CB 4.48Å; Y1802-V1828 HydrophobicContact CD2-CG2 3.6Å; Y1802-V1828 VanDerWaalsContact CD2-CG2 3.46Å; Y1802-V1828 HydrophobicContact CE2-CG2 3.79Å; Y1802-V1828 HydrophobicContact CG-CG1 4.47Å; Y1802-V1828 HydrophobicContact CG-CG2 4.21Å; V1828-D1832 HydrophobicContact CG1-CB 3.97Å; V1828-D1832 HydrophobicContact CG2-CB 3.83Å; V1828-I1833 HydrophobicContact CB-CD1 4.4Å; V1828-I1833 HydrophobicContact CG1-CD1 3.89Å; V1828-I1833 HydrophobicContact CG1-CG1 3.74Å; V1828-I1833 VanDerWaalsContact CG1-CG1 3.46Å; V1828-I1833 HydrophobicContact CG2-CD1 4.27Å; V1828-I1833 HydrophobicContact CG2-CG1 3.91Å; V1828-V2001 HydrophobicContact CG1-CB 4.34Å; V1828-V2001 PolarHBondContact O-N 3.14Å
1829	N	81.9	Confident	73.1	Confident	29.6 Å²	29.6	66.3 Å²	66.3	16%	0.158	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-82.6	148.5	175.2	-63.3	-25	0	0	0	111.7	T1831 D1832 I1833 E1999 Y2000	N1829-T1831 WeakPolarHBondContact CB-OG1 3.48Å; N1829-T1831 PolarHBondContact O-N 3.19Å; N1829-D1832 HydrophobicContact CB-CB 4.36Å; N1829-D1832 PolarHBondContact N-OD2 2.93Å; N1829-D1832 WeakPolarHBondContact O-CB 3.38Å; N1829-D1832 PolarHBondContact O-N 3.12Å; N1829-D1832 VanDerWaalsContact O-N 3.15Å; N1829-I1833 PolarHBondContact O-N 3.08Å; N1829-I1833 VanDerWaalsContact O-N 3.13Å; N1829-E1999 CarbonylContact C-O 3.57Å; N1829-E1999 WeakPolarHBondContact CA-O 3.36Å; N1829-Y2000 VanDerWaalsContact OD1-CD1 3.28Å; N1829-Y2000 WeakPolarHBondContact OD1-CD1 3.31Å; N1829-Y2000 VanDerWaalsContact OD1-CE1 3.25Å; N1829-Y2000 WeakPolarHBondContact OD1-CE1 3.39Å
1830	L	73.1	Confident	70.7	Confident	91.2 Å²	91.2	68 Å²	68	48%	0.477	35%	0.349	S	S	.	.	H	α-helix	trans	-54.9	-35.6	171.9	-95.3	156	0	0	0	112.4	D1832 I1833 A1834 F1843 P1998 E1999 V2001	L1830-D1832 VanDerWaalsContact C-N 3.31Å; L1830-D1832 PolarHBondContact O-N 2.94Å; L1830-I1833 PolarHBondContact O-N 3.11Å; L1830-A1834 WeakPolarHBondContact O-CB 3.37Å; L1830-A1834 PolarHBondContact O-N 2.98Å; L1830-A1834 VanDerWaalsContact O-N 3.16Å; L1830-F1843 HydrophobicContact CD1-CB 4.32Å; L1830-P1998 WeakPolarHBondContact CD1-O 3.31Å; L1830-E1999 WeakPolarHBondContact CB-O 3.37Å; L1830-E1999 WeakPolarHBondContact CG-O 3.41Å; L1830-E1999 PolarHBondContact N-O 3.08Å; L1830-V2001 HydrophobicContact CB-CG2 4.25Å; L1830-V2001 HydrophobicContact CD1-CG2 4.2Å; L1830-V2001 HydrophobicContact CD2-CG2 3.52Å; L1830-V2001 VanDerWaalsContact CD2-CG2 3.42Å; L1830-V2001 HydrophobicContact CG-CG2 3.79Å
1831	T	68	Low	68.1	Low	81.8 Å²	81.8	65.5 Å²	65.5	50%	0.502	34%	0.344	S	S	.	.	H	α-helix	trans	-67.2	-35.3	176.9	51.8	0	0	0	0	113	N1829 I1833 A1834 H1835	N1829-T1831 WeakPolarHBondContact CB-OG1 3.48Å; N1829-T1831 PolarHBondContact O-N 3.19Å; T1831-I1833 VanDerWaalsContact C-N 3.32Å; T1831-I1833 PolarHBondContact O-N 3.4Å; T1831-A1834 PolarHBondContact O-N 3.15Å; T1831-H1835 PolarHBondContact O-CD2 2.84Å; T1831-H1835 VanDerWaalsContact O-CD2 3.32Å; T1831-H1835 PolarHBondContact O-N 3.06Å; T1831-H1835 VanDerWaalsContact O-N 3.13Å
1832	D	67.4	Low	65.4	Low	30.6 Å²	30.6	68.4 Å²	68.4	16%	0.164	36%	0.36	C	S	.	.	H	α-helix	trans	-69	-39.4	179	-64.4	-16.2	0	0	0	109.9	Y1778 H1800 V1828 N1829 L1830 A1834 H1835 F1836	Y1778-D1832 HydrophobicContact CE1-CB 4.32Å; Y1778-D1832 PolarHBondContact OH-OD1 2.72Å; Y1778-D1832 VanDerWaalsContact OH-OD1 3.07Å; Y1778-D1832 PolarHBondContact OH-OD2 2.83Å; H1800-D1832 IonicContact CE1-OD2 3.13Å; H1800-D1832 PolarHBondContact CE1-OD2 3.04Å; H1800-D1832 IonicContact CG-OD2 2.8Å; H1800-D1832 IonicContact ND1-OD2 3.34Å; H1800-D1832 PolarHBondContact ND1-OD2 2.9Å; V1828-D1832 HydrophobicContact CG1-CB 3.97Å; V1828-D1832 HydrophobicContact CG2-CB 3.83Å; N1829-D1832 HydrophobicContact CB-CB 4.36Å; N1829-D1832 PolarHBondContact N-OD2 2.93Å; N1829-D1832 WeakPolarHBondContact O-CB 3.38Å; N1829-D1832 PolarHBondContact O-N 3.12Å; N1829-D1832 VanDerWaalsContact O-N 3.15Å; L1830-D1832 VanDerWaalsContact C-N 3.31Å; L1830-D1832 PolarHBondContact O-N 2.94Å; D1832-A1834 PolarHBondContact O-N 2.85Å; D1832-H1835 VanDerWaalsContact O-CB 3.3Å; D1832-H1835 WeakPolarHBondContact O-CB 3.39Å; D1832-H1835 PolarHBondContact O-N 3Å; D1832-F1836 VanDerWaalsContact O-CD2 3.27Å; D1832-F1836 WeakPolarHBondContact O-CD2 3.4Å; D1832-F1836 PolarHBondContact O-N 3.22Å; D1832-F1836 VanDerWaalsContact O-N 3.14Å
1833	I	63.3	Low	62.6	Low	19.4 Å²	19.4	75.3 Å²	75.3	10%	0.099	39%	0.389	C	S	.	.	H	α-helix	trans	-67.4	-43.7	176.1	-60	174.1	0	0	0	110.7	Y1632 V1828 N1829 L1830 T1831 H1835 F1836 D1837 F1843 V2001	Y1632-I1833 HydrophobicContact CD2-CD1 4.47Å; Y1632-I1833 HydrophobicContact CE1-CD1 3.53Å; Y1632-I1833 HydrophobicContact CE1-CG1 4.34Å; Y1632-I1833 HydrophobicContact CE2-CD1 4.26Å; Y1632-I1833 WeakPolarHBondContact OH-CD1 3.34Å; V1828-I1833 HydrophobicContact CB-CD1 4.4Å; V1828-I1833 HydrophobicContact CG1-CD1 3.89Å; V1828-I1833 HydrophobicContact CG1-CG1 3.74Å; V1828-I1833 VanDerWaalsContact CG1-CG1 3.46Å; V1828-I1833 HydrophobicContact CG2-CD1 4.27Å; V1828-I1833 HydrophobicContact CG2-CG1 3.91Å; N1829-I1833 PolarHBondContact O-N 3.08Å; N1829-I1833 VanDerWaalsContact O-N 3.13Å; L1830-I1833 PolarHBondContact O-N 3.11Å; T1831-I1833 VanDerWaalsContact C-N 3.32Å; T1831-I1833 PolarHBondContact O-N 3.4Å; I1833-H1835 PolarHBondContact O-N 3.15Å; I1833-H1835 VanDerWaalsContact O-N 3.11Å; I1833-F1836 PolarHBondContact O-N 3.13Å; I1833-F1836 VanDerWaalsContact O-N 3.13Å; I1833-D1837 WeakPolarHBondContact CG2-OD2 3.21Å; I1833-D1837 VanDerWaalsContact O-CB 3.22Å; I1833-D1837 WeakPolarHBondContact O-CB 3.24Å; I1833-D1837 PolarHBondContact O-N 3.03Å; I1833-F1843 HydrophobicContact CD1-CD2 4.36Å; I1833-F1843 HydrophobicContact CD1-CE2 4.12Å; I1833-F1843 HydrophobicContact CG2-CD2 4.16Å; I1833-F1843 HydrophobicContact CG2-CE2 4.11Å; I1833-V2001 HydrophobicContact CD1-CB 4.08Å; I1833-V2001 HydrophobicContact CD1-CG1 4.17Å; I1833-V2001 HydrophobicContact CD1-CG2 3.63Å; I1833-V2001 VanDerWaalsContact CD1-CG2 3.41Å; I1833-V2001 HydrophobicContact CG1-CG2 4.41Å
1834	A	56.3	Low	59.7	Low	55.2 Å²	55.2	79.4 Å²	79.4	46%	0.456	42%	0.423	S	S	.	.	H	α-helix	trans	-59.7	-22.3	179.2	0	0	0	0	0	113.8	L1830 T1831 D1832 F1836 D1837 V1838	L1830-A1834 WeakPolarHBondContact O-CB 3.37Å; L1830-A1834 PolarHBondContact O-N 2.98Å; L1830-A1834 VanDerWaalsContact O-N 3.16Å; T1831-A1834 PolarHBondContact O-N 3.15Å; D1832-A1834 PolarHBondContact O-N 2.85Å; A1834-F1836 PolarHBondContact O-N 2.71Å; A1834-D1837 CarbonylContact O-C 3.57Å; A1834-D1837 PolarHBondContact O-N 2.84Å; A1834-V1838 VanDerWaalsContact O-CG2 3.31Å; A1834-V1838 WeakPolarHBondContact O-CG2 3.49Å; A1834-V1838 PolarHBondContact O-N 2.84Å
1835	H	51	Low	56.6	Low	160.8 Å²	160.8	80 Å²	80	74%	0.744	44%	0.44	S	S	*	.	H	α-helix	trans	-75.3	-22.4	174.5	-105.1	29.7	0	0	0	114	T1831 D1832 I1833 V1838	T1831-H1835 PolarHBondContact O-CD2 2.84Å; T1831-H1835 VanDerWaalsContact O-CD2 3.32Å; T1831-H1835 PolarHBondContact O-N 3.06Å; T1831-H1835 VanDerWaalsContact O-N 3.13Å; D1832-H1835 VanDerWaalsContact O-CB 3.3Å; D1832-H1835 WeakPolarHBondContact O-CB 3.39Å; D1832-H1835 PolarHBondContact O-N 3Å; I1833-H1835 PolarHBondContact O-N 3.15Å; I1833-H1835 VanDerWaalsContact O-N 3.11Å; H1835-V1838 WeakPolarHBondContact O-CG2 3.46Å
1836	F	50.6	Low	53.6	Low	118.2 Å²	118.2	89.2 Å²	89.2	52%	0.518	48%	0.483	S	S	.	.	H	α-helix	trans	-93.6	-19.6	174.3	-69.3	-74.5	0	0	0	113.2	Y1778 D1832 I1833 A1834 V1838	Y1778-F1836 HydrophobicContact CE1-CE2 4.35Å; Y1778-F1836 HydrophobicContact CE2-CE2 4.25Å; Y1778-F1836 HydrophobicContact CE2-CZ 4.29Å; D1832-F1836 VanDerWaalsContact O-CD2 3.27Å; D1832-F1836 WeakPolarHBondContact O-CD2 3.4Å; D1832-F1836 PolarHBondContact O-N 3.22Å; D1832-F1836 VanDerWaalsContact O-N 3.14Å; I1833-F1836 PolarHBondContact O-N 3.13Å; I1833-F1836 VanDerWaalsContact O-N 3.13Å; A1834-F1836 PolarHBondContact O-N 2.71Å; F1836-V1838 VanDerWaalsContact C-N 3.33Å; F1836-V1838 PolarHBondContact O-N 3.18Å; F1836-V1838 VanDerWaalsContact O-N 3.17Å
1837	D	44.6	Very low	50.6	Low	62 Å²	62	91.2 Å²	91.2	33%	0.332	51%	0.514	S	S	.	.			trans	-92	38.4	-178	-83.2	-20.3	0	0	0	114.2	I1833 A1834 G1839 K1840 K1841 I1842	I1833-D1837 WeakPolarHBondContact CG2-OD2 3.21Å; I1833-D1837 VanDerWaalsContact O-CB 3.22Å; I1833-D1837 WeakPolarHBondContact O-CB 3.24Å; I1833-D1837 PolarHBondContact O-N 3.03Å; A1834-D1837 CarbonylContact O-C 3.57Å; A1834-D1837 PolarHBondContact O-N 2.84Å; D1837-G1839 PolarHBondContact O-N 2.96Å; D1837-K1840 WeakPolarHBondContact CB-O 2.93Å; D1837-K1840 CarbonylContact O-C 3.58Å; D1837-K1840 PolarHBondContact O-N 2.79Å; D1837-K1841 HydrophobicContact CB-CD 4.07Å; D1837-K1841 HydrophobicContact CB-CG 4.19Å; D1837-K1841 PolarHBondContact O-N 2.8Å; D1837-K1841 IonicContact OD2-NZ 3.68Å; D1837-I1842 VanDerWaalsContact OD2-CD1 3.32Å; D1837-I1842 WeakPolarHBondContact OD2-CD1 3.44Å
1838	V	36.2	Very low	47.7	Very low	132.8 Å²	132.8	94.5 Å²	94.5	81%	0.805	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-74	19.8	172.3	-177	0	0	0	0	110.7	A1834 H1835 F1836	A1834-V1838 VanDerWaalsContact O-CG2 3.31Å; A1834-V1838 WeakPolarHBondContact O-CG2 3.49Å; A1834-V1838 PolarHBondContact O-N 2.84Å; H1835-V1838 WeakPolarHBondContact O-CG2 3.46Å; F1836-V1838 VanDerWaalsContact C-N 3.33Å; F1836-V1838 PolarHBondContact O-N 3.18Å; F1836-V1838 VanDerWaalsContact O-N 3.17Å
1839	G	36.9	Very low	45	Very low	64 Å²	64	102 Å²	102	66%	0.66	59%	0.588	S	S	*	*			trans	-126.8	17.4	176.5	0	0	0	0	0	116.4	D1837 K1841	D1837-G1839 PolarHBondContact O-N 2.96Å; G1839-K1841 PolarHBondContact O-N 2.76Å
1840	K	35.8	Very low	42.5	Very low	165.6 Å²	165.6	105.5 Å²	105.5	72%	0.72	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	37.8	-174.4	-87.5	-179.6	175.9	-177.5	0	115	D1837 I1842	D1837-K1840 WeakPolarHBondContact CB-O 2.93Å; D1837-K1840 CarbonylContact O-C 3.58Å; D1837-K1840 PolarHBondContact O-N 2.79Å; K1840-I1842 VanDerWaalsContact C-N 3.29Å; K1840-I1842 HydrophobicContact CB-CD1 3.64Å; K1840-I1842 HydrophobicContact CB-CG1 4.05Å; K1840-I1842 HydrophobicContact CD-CD1 4.4Å; K1840-I1842 VanDerWaalsContact O-CG1 3.3Å; K1840-I1842 WeakPolarHBondContact O-CG1 3.49Å; K1840-I1842 PolarHBondContact O-N 3.24Å; K1840-I1842 VanDerWaalsContact O-N 3.1Å
1841	K	32.2	Very low	40.5	Very low	168.6 Å²	168.6	106 Å²	106	73%	0.733	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	38.9	175.4	-72.8	-178	177.5	177.4	0	116.5	D1837 G1839 F1843	D1837-K1841 HydrophobicContact CB-CD 4.07Å; D1837-K1841 HydrophobicContact CB-CG 4.19Å; D1837-K1841 PolarHBondContact O-N 2.8Å; D1837-K1841 IonicContact OD2-NZ 3.68Å; G1839-K1841 PolarHBondContact O-N 2.76Å; K1841-F1843 PolarHBondContact O-N 2.89Å
1842	I	34.9	Very low	38.6	Very low	107.8 Å²	107.8	110.9 Å²	110.9	55%	0.553	64%	0.641	S	S	*	*			trans	-101.5	-7.5	178.6	-59.4	173.1	0	0	0	112.3	N1631 D1837 K1840	N1631-I1842 HydrophobicContact CB-CD1 3.78Å; D1837-I1842 VanDerWaalsContact OD2-CD1 3.32Å; D1837-I1842 WeakPolarHBondContact OD2-CD1 3.44Å; K1840-I1842 VanDerWaalsContact C-N 3.29Å; K1840-I1842 HydrophobicContact CB-CD1 3.64Å; K1840-I1842 HydrophobicContact CB-CG1 4.05Å; K1840-I1842 HydrophobicContact CD-CD1 4.4Å; K1840-I1842 VanDerWaalsContact O-CG1 3.3Å; K1840-I1842 WeakPolarHBondContact O-CG1 3.49Å; K1840-I1842 PolarHBondContact O-N 3.24Å; K1840-I1842 VanDerWaalsContact O-N 3.1Å
1843	F	34.4	Very low	36.8	Very low	162.6 Å²	162.6	120.9 Å²	120.9	71%	0.713	68%	0.676	S	S	*	*	S	Bend	trans	-126.6	21.7	170.5	-68.6	-73.9	0	0	0	114.9	L1830 I1833 K1841 V2001	L1830-F1843 HydrophobicContact CD1-CB 4.32Å; I1833-F1843 HydrophobicContact CD1-CD2 4.36Å; I1833-F1843 HydrophobicContact CD1-CE2 4.12Å; I1833-F1843 HydrophobicContact CG2-CD2 4.16Å; I1833-F1843 HydrophobicContact CG2-CE2 4.11Å; K1841-F1843 PolarHBondContact O-N 2.89Å; F1843-V2001 HydrophobicContact CD1-CG1 3.48Å; F1843-V2001 VanDerWaalsContact CD1-CG1 3.48Å; F1843-V2001 HydrophobicContact CD2-CG1 4.31Å; F1843-V2001 HydrophobicContact CE1-CG1 3.61Å; F1843-V2001 HydrophobicContact CE2-CG1 4.42Å; F1843-V2001 HydrophobicContact CG-CG1 3.86Å; F1843-V2001 HydrophobicContact CZ-CG1 4.09Å
1844	A	32.6	Very low	35.3	Very low	87.2 Å²	87.2	130.6 Å²	130.6	72%	0.721	71%	0.711	S	S	*	*	S	Bend	trans	-101.1	31.6	-177.3	0	0	0	0	0	114.3
1845	S	29.8	Very low	34.2	Very low	100.2 Å²	100.2	137.2 Å²	137.2	70%	0.701	73%	0.73	S	S	*	*			trans	-133.6	64.1	177.1	139.5	0	0	0	0	114.8
1846	H	30.7	Very low	33.5	Very low	198.8 Å²	198.8	137.2 Å²	137.2	92%	0.92	73%	0.73	S	S	*	*			trans	-142.9	50.6	154.3	-87.1	0.5	0	0	0	111.4	G1848	H1846-G1848 PolarHBondContact O-N 3.03Å
1847	G	28.5	Very low	32.8	Very low	78.2 Å²	78.2	140.3 Å²	140.3	81%	0.806	74%	0.743	S	S	*	*			trans	-110.8	91.4	165.4	0	0	0	0	0	109.5
1848	G	27.3	Very low	32.6	Very low	70.4 Å²	70.4	146 Å²	146	73%	0.726	76%	0.76	S	S	*	*			trans	-99.4	113.8	176.1	0	0	0	0	0	113.6	H1846 S1850	H1846-G1848 PolarHBondContact O-N 3.03Å; G1848-S1850 PolarHBondContact O-N 2.86Å; G1848-S1850 VanDerWaalsContact O-N 3.08Å
1849	D	29.3	Very low	32.9	Very low	158 Å²	158	143.8 Å²	143.8	85%	0.845	74%	0.744	S	S	*	*			trans	-49.9	95.3	155.3	-119.4	-20.6	0	0	0	112.4	S1851	D1849-S1851 PolarHBondContact O-N 3.11Å; D1849-S1851 WeakPolarHBondContact OD1-CB 2.93Å; D1849-S1851 PolarHBondContact OD1-OG 2.78Å
1850	S	30.6	Very low	33.5	Very low	102 Å²	102	143.4 Å²	143.4	71%	0.713	73%	0.734	S	S	*	*			trans	-104.2	79.6	160.9	61.6	0	0	0	0	110.1	G1848 F1852	G1848-S1850 PolarHBondContact O-N 2.86Å; G1848-S1850 VanDerWaalsContact O-N 3.08Å; S1850-F1852 VanDerWaalsContact C-N 3.28Å; S1850-F1852 PolarHBondContact O-N 2.89Å
1851	S	29.2	Very low	33.9	Very low	101 Å²	101	139.1 Å²	139.1	71%	0.706	72%	0.722	S	S	*	*			trans	-88.1	57	170.9	62.1	0	0	0	0	112.3	D1849 R1853	D1849-S1851 PolarHBondContact O-N 3.11Å; D1849-S1851 WeakPolarHBondContact OD1-CB 2.93Å; D1849-S1851 PolarHBondContact OD1-OG 2.78Å; S1851-R1853 PolarHBondContact O-N 3.06Å; S1851-R1853 VanDerWaalsContact O-N 3.14Å
1852	F	29.6	Very low	34.7	Very low	186.2 Å²	186.2	135.8 Å²	135.8	82%	0.817	71%	0.705	S	S	*	*			trans	-86.6	78.2	166	-89.8	-82.5	0	0	0	110.6	S1850 R1854	S1850-F1852 VanDerWaalsContact C-N 3.28Å; S1850-F1852 PolarHBondContact O-N 2.89Å; F1852-R1854 VanDerWaalsContact C-N 3.33Å; F1852-R1854 PolarHBondContact O-N 3.05Å
1853	R	29.8	Very low	35.4	Very low	239.2 Å²	239.2	137.2 Å²	137.2	90%	0.903	71%	0.71	S	S	*	*			trans	-57.5	89.9	157.6	-87.5	-179.5	166.7	173	-3.7	109.1	S1851 K1855	S1851-R1853 PolarHBondContact O-N 3.06Å; S1851-R1853 VanDerWaalsContact O-N 3.14Å; R1853-K1855 VanDerWaalsContact C-N 3.29Å; R1853-K1855 PolarHBondContact O-N 3.16Å
1854	R	31.2	Very low	35.9	Very low	223.2 Å²	223.2	135.6 Å²	135.6	84%	0.842	71%	0.706	S	S	*	*			trans	-60.3	99	158.8	-98.2	-179.3	173.9	168	-1.2	107	F1852 E1856	F1852-R1854 VanDerWaalsContact C-N 3.33Å; F1852-R1854 PolarHBondContact O-N 3.05Å; R1854-E1856 VanDerWaalsContact C-N 3.29Å; R1854-E1856 PolarHBondContact O-N 3.21Å
1855	K	32.8	Very low	36.4	Very low	194.8 Å²	194.8	136.9 Å²	136.9	85%	0.847	70%	0.696	S	S	*	*			trans	-62.3	103.8	158	-79.5	-178.7	174	179	0	106.6	R1853 K1857	R1853-K1855 VanDerWaalsContact C-N 3.29Å; R1853-K1855 PolarHBondContact O-N 3.16Å; K1855-K1857 VanDerWaalsContact C-N 3.35Å; K1855-K1857 PolarHBondContact O-N 3.28Å
1856	E	36.6	Very low	37.1	Very low	159.4 Å²	159.4	135.6 Å²	135.6	75%	0.745	68%	0.684	S	S	*	*			trans	-52.1	113.5	163.9	-75.2	178.4	160.6	0	0	107.5	R1854 R1858 K1877	R1854-E1856 VanDerWaalsContact C-N 3.29Å; R1854-E1856 PolarHBondContact O-N 3.21Å; E1856-R1858 VanDerWaalsContact C-N 3.26Å; E1856-R1858 PolarHBondContact O-N 2.99Å; E1856-R1858 VanDerWaalsContact O-N 3.1Å; E1856-K1877 IonicContact OE1-NZ 2.77Å; E1856-K1877 PolarHBondContact OE1-NZ 3.29Å; E1856-K1877 IonicContact OE2-NZ 3.36Å; E1856-K1877 PolarHBondContact OE2-NZ 2.79Å
1857	K	36	Very low	37.9	Very low	184 Å²	184	131.5 Å²	131.5	80%	0.8	67%	0.669	S	S	*	*			trans	-60.2	109.9	174.8	-80.4	-178.5	174.3	-180	0	107.3	D1010 K1855 D1859	D1010-K1857 IonicContact OD1-NZ 3.66Å; D1010-K1857 PolarHBondContact OD1-NZ 3.29Å; D1010-K1857 IonicContact OD2-NZ 2.84Å; D1010-K1857 PolarHBondContact OD2-NZ 3.28Å; K1855-K1857 VanDerWaalsContact C-N 3.35Å; K1855-K1857 PolarHBondContact O-N 3.28Å; K1857-D1859 PolarHBondContact O-N 3.13Å
1858	R	39.9	Very low	38.6	Very low	181.2 Å²	181.2	131.5 Å²	131.5	68%	0.684	65%	0.65	S	S	*	*			trans	-64.1	137.7	166.6	-68.3	-178.9	177.1	-179	-2.1	108.1	G1225 E1856 A1860 E1863	G1225-R1858 PolarHBondContact O-NH1 2.97Å; E1856-R1858 VanDerWaalsContact C-N 3.26Å; E1856-R1858 PolarHBondContact O-N 2.99Å; E1856-R1858 VanDerWaalsContact O-N 3.1Å; R1858-A1860 PolarHBondContact O-N 3Å; R1858-E1863 HydrophobicContact CB-CG 3.73Å; R1858-E1863 VanDerWaalsContact CD-OE1 3.32Å; R1858-E1863 WeakPolarHBondContact CD-OE1 3.5Å; R1858-E1863 IonicContact CZ-OE1 3.55Å; R1858-E1863 IonicContact NH1-OE1 3.75Å; R1858-E1863 PolarHBondContact NH1-OE1 3.27Å
1859	D	43.6	Very low	39.6	Very low	87.6 Å²	87.6	130.9 Å²	130.9	47%	0.468	63%	0.628	S	S	.	*			trans	-65.2	125.2	175.8	-140	-16.3	0	0	0	109.1	R1113 R1205 E1227 K1857 V1861 Y1862 E1863	R1113-D1859 WeakPolarHBondContact CD-OD1 3.46Å; R1113-D1859 IonicContact CZ-OD1 2.66Å; R1113-D1859 IonicContact NE-OD1 3.45Å; R1113-D1859 PolarHBondContact NE-OD1 3.24Å; R1205-D1859 IonicContact CZ-OD2 3.22Å; R1205-D1859 IonicContact NE-OD2 2.65Å; R1205-D1859 PolarHBondContact NE-OD2 3.34Å; R1205-D1859 IonicContact NH2-OD2 3.62Å; R1205-D1859 PolarHBondContact NH2-OD2 2.87Å; E1227-D1859 PolarHBondContact OE1-N 3.06Å; E1227-D1859 WeakPolarHBondContact OE2-CB 3.48Å; K1857-D1859 PolarHBondContact O-N 3.13Å; D1859-V1861 VanDerWaalsContact C-N 3.29Å; D1859-V1861 PolarHBondContact O-N 3.35Å; D1859-V1861 VanDerWaalsContact O-N 3.09Å; D1859-V1861 WeakPolarHBondContact OD1-CG2 3.4Å; D1859-V1861 PolarHBondContact OD1-N 3.21Å; D1859-Y1862 HydrophobicContact CB-CD2 3.79Å; D1859-Y1862 HydrophobicContact CB-CE2 3.5Å; D1859-Y1862 WeakPolarHBondContact O-CA 3.37Å; D1859-Y1862 WeakPolarHBondContact O-CB 3.39Å; D1859-Y1862 PolarHBondContact O-N 2.98Å; D1859-E1863 PolarHBondContact O-N 2.98Å
1860	A	47.9	Very low	40.4	Very low	54.6 Å²	54.6	130.7 Å²	130.7	45%	0.451	62%	0.615	S	S	.	*	H	α-helix	trans	-64	-18	-173	0	0	0	0	0	112.9	R1858 Y1862 E1863 M1864	R1858-A1860 PolarHBondContact O-N 3Å; A1860-Y1862 VanDerWaalsContact C-N 3.35Å; A1860-Y1862 PolarHBondContact O-N 2.92Å; A1860-E1863 WeakPolarHBondContact O-CB 3.03Å; A1860-E1863 PolarHBondContact O-N 3.08Å; A1860-M1864 HydrophobicContact CB-CE 3.6Å; A1860-M1864 HydrophobicContact CB-CG 4.09Å; A1860-M1864 HydrophobicContact CB-SD 3.59Å; A1860-M1864 VanDerWaalsContact CB-SD 3.59Å; A1860-M1864 WeakPolarHBondContact O-CB 3.34Å; A1860-M1864 WeakPolarHBondContact O-CG 3.29Å; A1860-M1864 PolarHBondContact O-N 3.14Å
1861	V	45	Very low	41.2	Very low	75.8 Å²	75.8	130.2 Å²	130.2	46%	0.459	60%	0.602	S	S	.	*	H	α-helix	trans	-70.7	-32.3	178.3	-178.7	0	0	0	0	111.9	F1059 N1062 D1859 E1863 M1864 F1865	F1059-V1861 HydrophobicContact CB-CG1 3.95Å; F1059-V1861 HydrophobicContact CD1-CG1 4.12Å; F1059-V1861 HydrophobicContact CD2-CG1 3.88Å; F1059-V1861 HydrophobicContact CG-CG1 3.68Å; N1062-V1861 WeakPolarHBondContact OD1-CG2 3.36Å; D1859-V1861 VanDerWaalsContact C-N 3.29Å; D1859-V1861 PolarHBondContact O-N 3.35Å; D1859-V1861 VanDerWaalsContact O-N 3.09Å; D1859-V1861 WeakPolarHBondContact OD1-CG2 3.4Å; D1859-V1861 PolarHBondContact OD1-N 3.21Å; V1861-E1863 VanDerWaalsContact C-N 3.28Å; V1861-E1863 PolarHBondContact O-N 3.06Å; V1861-M1864 PolarHBondContact O-N 2.95Å; V1861-F1865 WeakPolarHBondContact O-CA 3.44Å; V1861-F1865 WeakPolarHBondContact O-CB 3.44Å; V1861-F1865 WeakPolarHBondContact O-CD2 3.5Å; V1861-F1865 PolarHBondContact O-N 3.31Å
1862	Y	48.7	Very low	42.1	Very low	100 Å²	100	127.4 Å²	127.4	39%	0.392	58%	0.576	S	S	.	*	H	α-helix	trans	-77.1	-19.2	176.8	-81.2	-72.9	0	0	0	113.2	F1059 R1205 E1227 N1228 Q1404 D1859 A1860 M1864 F1865 P1866 L1867 H1869 Y1872	F1059-Y1862 HydrophobicContact CE1-CE1 4.32Å; F1059-Y1862 AromaticContact CE2-CE1 3.75Å; F1059-Y1862 HydrophobicContact CE2-CE1 3.75Å; F1059-Y1862 AromaticContact CE2-CZ 3.68Å; F1059-Y1862 WeakPolarHBondContact CE2-OH 3.15Å; F1059-Y1862 HydrophobicContact CZ-CD1 4.34Å; F1059-Y1862 AromaticContact CZ-CE1 3.42Å; F1059-Y1862 HydrophobicContact CZ-CE1 3.42Å; F1059-Y1862 VanDerWaalsContact CZ-CE1 3.42Å; F1059-Y1862 AromaticContact CZ-CZ 3.85Å; R1205-Y1862 HydrophobicContact CG-CE2 4.36Å; R1205-Y1862 VanDerWaalsContact O-CE2 3.26Å; R1205-Y1862 WeakPolarHBondContact O-CE2 3.35Å; E1227-Y1862 HydrophobicContact CB-CD2 3.87Å; E1227-Y1862 HydrophobicContact CB-CG 4.45Å; E1227-Y1862 WeakPolarHBondContact O-CB 3.42Å; N1228-Y1862 HydrophobicContact CB-CD1 4.45Å; N1228-Y1862 HydrophobicContact CB-CE1 4.35Å; Q1404-Y1862 PolarHBondContact NE2-O 2.96Å; Q1404-Y1862 VanDerWaalsContact NE2-O 3.1Å; D1859-Y1862 HydrophobicContact CB-CD2 3.79Å; D1859-Y1862 HydrophobicContact CB-CE2 3.5Å; D1859-Y1862 WeakPolarHBondContact O-CA 3.37Å; D1859-Y1862 WeakPolarHBondContact O-CB 3.39Å; D1859-Y1862 PolarHBondContact O-N 2.98Å; A1860-Y1862 VanDerWaalsContact C-N 3.35Å; A1860-Y1862 PolarHBondContact O-N 2.92Å; Y1862-M1864 VanDerWaalsContact C-N 3.28Å; Y1862-M1864 PolarHBondContact O-N 3.03Å; Y1862-F1865 CarbonylContact O-C 3.52Å; Y1862-P1866 HydrophobicContact CD1-CG 3.99Å; Y1862-P1866 HydrophobicContact CE1-CG 4.18Å; Y1862-L1867 HydrophobicContact CE1-CB 4.37Å; Y1862-L1867 HydrophobicContact CE2-CD1 4.31Å; Y1862-L1867 WeakPolarHBondContact OH-CD1 3.49Å; Y1862-H1869 AromaticContact CD1-NE2 3.95Å; Y1862-Y1872 HydrophobicContact CE1-CE1 4.45Å; Y1862-Y1872 HydrophobicContact CE1-CE2 4.44Å; Y1862-Y1872 PolarHBondContact OH-OH 3.26Å
1863	E	49.8	Very low	43	Very low	137.6 Å²	137.6	119.4 Å²	119.4	64%	0.643	54%	0.543	S	S	*	.	H	α-helix	trans	-73.6	-26.4	174.9	-94.8	-176.4	160.5	0	0	112.7	R1442 R1858 D1859 A1860 V1861	R1442-E1863 IonicContact CZ-OE2 3.78Å; R1442-E1863 IonicContact NH1-OE2 3.75Å; R1442-E1863 PolarHBondContact NH1-OE2 3.09Å; R1858-E1863 HydrophobicContact CB-CG 3.73Å; R1858-E1863 VanDerWaalsContact CD-OE1 3.32Å; R1858-E1863 WeakPolarHBondContact CD-OE1 3.5Å; R1858-E1863 IonicContact CZ-OE1 3.55Å; R1858-E1863 IonicContact NH1-OE1 3.75Å; R1858-E1863 PolarHBondContact NH1-OE1 3.27Å; D1859-E1863 PolarHBondContact O-N 2.98Å; A1860-E1863 WeakPolarHBondContact O-CB 3.03Å; A1860-E1863 PolarHBondContact O-N 3.08Å; V1861-E1863 VanDerWaalsContact C-N 3.28Å; V1861-E1863 PolarHBondContact O-N 3.06Å
1864	M	46.1	Very low	43.8	Very low	129 Å²	129	112.7 Å²	112.7	64%	0.635	52%	0.521	S	S	*	.	H	α-helix	trans	-91.9	-16.2	-178.4	-65.7	179.4	-179.3	0	0	113.7	A1860 V1861 Y1862 P1866	A1860-M1864 HydrophobicContact CB-CE 3.6Å; A1860-M1864 HydrophobicContact CB-CG 4.09Å; A1860-M1864 HydrophobicContact CB-SD 3.59Å; A1860-M1864 VanDerWaalsContact CB-SD 3.59Å; A1860-M1864 WeakPolarHBondContact O-CB 3.34Å; A1860-M1864 WeakPolarHBondContact O-CG 3.29Å; A1860-M1864 PolarHBondContact O-N 3.14Å; V1861-M1864 PolarHBondContact O-N 2.95Å; Y1862-M1864 VanDerWaalsContact C-N 3.28Å; Y1862-M1864 PolarHBondContact O-N 3.03Å; M1864-P1866 VanDerWaalsContact C-CD 3.44Å; M1864-P1866 WeakPolarHBondContact O-CD 3.22Å
1865	F	43	Very low	44.8	Very low	114.6 Å²	114.6	105.6 Å²	105.6	50%	0.503	50%	0.495	S	S	.	.			trans	-151	81.7	-176.2	-55.9	-78	0	0	0	114.1	E1061 V1861 Y1862 L1867 L1868 H1869	E1061-F1865 HydrophobicContact CB-CD2 3.73Å; E1061-F1865 HydrophobicContact CB-CE2 3.62Å; E1061-F1865 HydrophobicContact CB-CG 4.4Å; E1061-F1865 HydrophobicContact CB-CZ 4.2Å; E1061-F1865 HydrophobicContact CG-CD1 3.93Å; E1061-F1865 HydrophobicContact CG-CD2 3.59Å; E1061-F1865 HydrophobicContact CG-CE1 3.89Å; E1061-F1865 HydrophobicContact CG-CE2 3.55Å; E1061-F1865 HydrophobicContact CG-CG 3.79Å; E1061-F1865 HydrophobicContact CG-CZ 3.7Å; E1061-F1865 WeakPolarHBondContact OE1-CD1 3.3Å; E1061-F1865 WeakPolarHBondContact OE1-CG 3.34Å; V1861-F1865 WeakPolarHBondContact O-CA 3.44Å; V1861-F1865 WeakPolarHBondContact O-CB 3.44Å; V1861-F1865 WeakPolarHBondContact O-CD2 3.5Å; V1861-F1865 PolarHBondContact O-N 3.31Å; Y1862-F1865 CarbonylContact O-C 3.52Å; F1865-L1867 HydrophobicContact CB-CD1 3.99Å; F1865-L1867 HydrophobicContact CB-CG 4.12Å; F1865-L1867 HydrophobicContact CD1-CD1 3.87Å; F1865-L1867 HydrophobicContact CD1-CG 4.31Å; F1865-L1867 HydrophobicContact CG-CD1 4.23Å; F1865-L1867 PolarHBondContact O-N 3.05Å; F1865-L1868 HydrophobicContact CB-CD1 3.81Å; F1865-L1868 HydrophobicContact CB-CG 4.43Å; F1865-L1868 HydrophobicContact CG-CD1 4.36Å; F1865-L1868 PolarHBondContact O-N 2.82Å; F1865-H1869 PolarHBondContact O-CE1 3.01Å; F1865-H1869 VanDerWaalsContact O-CE1 3.26Å; F1865-H1869 PolarHBondContact O-ND1 3.23Å
1866	P	44.5	Very low	46.2	Very low	71.8 Å²	71.8	98.4 Å²	98.4	47%	0.466	46%	0.464	S	S	.	.			trans	-72.1	93	169.4	27.6	-30.4	0	0	0	111.7	Q1404 Y1862 M1864 L1868 H1869	Q1404-P1866 VanDerWaalsContact NE2-CB 3.31Å; Y1862-P1866 HydrophobicContact CD1-CG 3.99Å; Y1862-P1866 HydrophobicContact CE1-CG 4.18Å; M1864-P1866 VanDerWaalsContact C-CD 3.44Å; M1864-P1866 WeakPolarHBondContact O-CD 3.22Å; P1866-L1868 VanDerWaalsContact C-N 3.33Å; P1866-L1868 PolarHBondContact O-N 3.14Å; P1866-L1868 VanDerWaalsContact O-N 3.11Å; P1866-H1869 VanDerWaalsContact C-ND1 3.35Å; P1866-H1869 WeakPolarHBondContact CA-ND1 3.49Å; P1866-H1869 HydrophobicContact CG-CB 3.85Å; P1866-H1869 VanDerWaalsContact CG-CD2 3.46Å; P1866-H1869 WeakPolarHBondContact CG-CD2 3.4Å; P1866-H1869 WeakPolarHBondContact O-CB 3.48Å; P1866-H1869 PolarHBondContact O-N 2.79Å; P1866-H1869 VanDerWaalsContact O-N 3.09Å; P1866-H1869 PolarHBondContact O-ND1 2.65Å
1867	L	46.3	Very low	47.7	Very low	112 Å²	112	97.1 Å²	97.1	59%	0.586	46%	0.456	S	S	*	.	H	α-helix	trans	-63.1	68.2	176.6	-73.3	166.9	0	0	0	111.6	F1059 Y1405 W1447 Y1862 F1865 H1869 R1870 Q1871	F1059-L1867 HydrophobicContact CE1-CD2 4.1Å; Y1405-L1867 PolarHBondContact OH-N 2.77Å; W1447-L1867 HydrophobicContact CH2-CB 4.1Å; W1447-L1867 HydrophobicContact CZ3-CB 4.16Å; Y1862-L1867 HydrophobicContact CE1-CB 4.37Å; Y1862-L1867 HydrophobicContact CE2-CD1 4.31Å; Y1862-L1867 WeakPolarHBondContact OH-CD1 3.49Å; F1865-L1867 HydrophobicContact CB-CD1 3.99Å; F1865-L1867 HydrophobicContact CB-CG 4.12Å; F1865-L1867 HydrophobicContact CD1-CD1 3.87Å; F1865-L1867 HydrophobicContact CD1-CG 4.31Å; F1865-L1867 HydrophobicContact CG-CD1 4.23Å; F1865-L1867 PolarHBondContact O-N 3.05Å; L1867-H1869 PolarHBondContact O-N 3.09Å; L1867-R1870 WeakPolarHBondContact O-CB 3.36Å; L1867-R1870 PolarHBondContact O-N 2.94Å; L1867-Q1871 PolarHBondContact O-N 3.12Å
1868	L	43.6	Very low	49.8	Very low	78.8 Å²	78.8	89.9 Å²	89.9	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-34.8	30.3	166.2	-90.1	138.6	0	0	0	114	Y1405 W1447 I1481 F1865 P1866 R1870 Q1871 Y1872 Y1875 A1898 T1899	Y1405-L1868 HydrophobicContact CE1-CB 3.82Å; Y1405-L1868 HydrophobicContact CE1-CD2 4.29Å; Y1405-L1868 WeakPolarHBondContact OH-CB 3.46Å; Y1405-L1868 PolarHBondContact OH-N 2.93Å; W1447-L1868 HydrophobicContact CD2-CD1 4.02Å; W1447-L1868 HydrophobicContact CG-CD1 4.09Å; W1447-L1868 HydrophobicContact CZ2-CD1 4.07Å; I1481-L1868 HydrophobicContact CD1-CD1 4.39Å; I1481-L1868 HydrophobicContact CD1-CD2 3.73Å; F1865-L1868 HydrophobicContact CB-CD1 3.81Å; F1865-L1868 HydrophobicContact CB-CG 4.43Å; F1865-L1868 HydrophobicContact CG-CD1 4.36Å; F1865-L1868 PolarHBondContact O-N 2.82Å; P1866-L1868 VanDerWaalsContact C-N 3.33Å; P1866-L1868 PolarHBondContact O-N 3.14Å; P1866-L1868 VanDerWaalsContact O-N 3.11Å; L1868-R1870 VanDerWaalsContact C-N 3.26Å; L1868-R1870 HydrophobicContact CB-CG 4.37Å; L1868-R1870 HydrophobicContact CD2-CG 3.85Å; L1868-R1870 PolarHBondContact O-N 3.05Å; L1868-R1870 VanDerWaalsContact O-N 3.13Å; L1868-Q1871 PolarHBondContact O-N 2.8Å; L1868-Q1871 VanDerWaalsContact O-N 3.12Å; L1868-Y1872 PolarHBondContact O-N 2.81Å; L1868-Y1875 HydrophobicContact CD2-CD2 4.08Å; L1868-Y1875 HydrophobicContact CD2-CE2 3.56Å; L1868-Y1875 HydrophobicContact CG-CD2 3.93Å; L1868-Y1875 HydrophobicContact CG-CE2 3.9Å; L1868-A1898 HydrophobicContact CD2-CB 3.92Å; L1868-T1899 HydrophobicContact CD1-CG2 4.02Å; L1868-T1899 WeakPolarHBondContact CD2-OG1 3.2Å
1869	H	47.9	Very low	51.8	Low	58.8 Å²	58.8	87.2 Å²	87.2	27%	0.272	42%	0.42	S	S	.	.			trans	-80.7	27.7	-179.5	-68.7	-9.8	0	0	0	114	Q1443 Y1862 F1865 P1866 L1867 Q1871 Y1872 Y1875 Q1876	Q1443-H1869 PolarHBondContact NE2-CE1 3.35Å; Q1443-H1869 VanDerWaalsContact NE2-CE1 3.27Å; Y1862-H1869 AromaticContact CD1-NE2 3.95Å; F1865-H1869 PolarHBondContact O-CE1 3.01Å; F1865-H1869 VanDerWaalsContact O-CE1 3.26Å; F1865-H1869 PolarHBondContact O-ND1 3.23Å; P1866-H1869 VanDerWaalsContact C-ND1 3.35Å; P1866-H1869 WeakPolarHBondContact CA-ND1 3.49Å; P1866-H1869 HydrophobicContact CG-CB 3.85Å; P1866-H1869 VanDerWaalsContact CG-CD2 3.46Å; P1866-H1869 WeakPolarHBondContact CG-CD2 3.4Å; P1866-H1869 WeakPolarHBondContact O-CB 3.48Å; P1866-H1869 PolarHBondContact O-N 2.79Å; P1866-H1869 VanDerWaalsContact O-N 3.09Å; P1866-H1869 PolarHBondContact O-ND1 2.65Å; L1867-H1869 PolarHBondContact O-N 3.09Å; H1869-Q1871 VanDerWaalsContact C-N 3.3Å; H1869-Q1871 PolarHBondContact O-N 3.19Å; H1869-Y1872 PolarHBondContact O-N 3.39Å; H1869-Y1872 VanDerWaalsContact O-N 3.09Å; H1869-Y1875 VanDerWaalsContact CA-CB 3.49Å; H1869-Y1875 HydrophobicContact CB-CD2 4.18Å; H1869-Y1875 HydrophobicContact CB-CE2 3.93Å; H1869-Y1875 HydrophobicContact CB-CG 4.49Å; H1869-Y1875 AromaticContact CD2-CE2 3.62Å; H1869-Y1875 PolarHBondContact CD2-O 3.41Å; H1869-Y1875 AromaticContact CE1-CD1 3.33Å; H1869-Y1875 WeakPolarHBondContact CE1-CD1 3.38Å; H1869-Y1875 AromaticContact CE1-CE1 3.76Å; H1869-Y1875 AromaticContact CE1-CG 3.74Å; H1869-Y1875 AromaticContact CG-CE2 3.97Å; H1869-Y1875 AromaticContact CG-CG 3.92Å; H1869-Y1875 AromaticContact ND1-CD1 3.6Å; H1869-Y1875 AromaticContact ND1-CG 3.48Å; H1869-Y1875 AromaticContact NE2-CD1 3.74Å; H1869-Q1876 WeakPolarHBondContact O-CG 3.33Å
1870	R	46.9	Very low	54	Low	152.4 Å²	152.4	83.2 Å²	83.2	58%	0.575	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-20.7	-174.8	-82.9	-174.3	-176.9	175.6	3.4	114.6	E1061 R1485 L1867 L1868 Y1872 Q1876 Y1950	E1061-R1870 IonicContact OE1-CZ 2.8Å; E1061-R1870 IonicContact OE1-NH2 2.85Å; E1061-R1870 PolarHBondContact OE1-NH2 3.17Å; E1061-R1870 IonicContact OE2-NH2 3.97Å; E1061-R1870 PolarHBondContact OE2-NH2 3.02Å; R1485-R1870 PolarHBondContact NH2-O 3.22Å; R1485-R1870 VanDerWaalsContact NH2-O 3.13Å; L1867-R1870 WeakPolarHBondContact O-CB 3.36Å; L1867-R1870 PolarHBondContact O-N 2.94Å; L1868-R1870 VanDerWaalsContact C-N 3.26Å; L1868-R1870 HydrophobicContact CB-CG 4.37Å; L1868-R1870 HydrophobicContact CD2-CG 3.85Å; L1868-R1870 PolarHBondContact O-N 3.05Å; L1868-R1870 VanDerWaalsContact O-N 3.13Å; R1870-Y1872 VanDerWaalsContact C-N 3.27Å; R1870-Y1872 PolarHBondContact O-N 2.78Å; R1870-Q1876 PolarHBondContact O-NE2 3.06Å; R1870-Q1876 VanDerWaalsContact O-NE2 3.15Å; R1870-Y1950 PolarHBondContact NE-OH 3.45Å; R1870-Y1950 VanDerWaalsContact NE-OH 3.15Å
1871	Q	46	Very low	56	Low	92.2 Å²	92.2	83 Å²	83	43%	0.431	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-13.3	-170.6	-14.6	-155.7	6.6	0	0	114.4	Y1405 W1447 N1449 L1867 L1868 H1869	Y1405-Q1871 PolarHBondContact OH-NE2 2.82Å; W1447-Q1871 HydrophobicContact CH2-CB 3.67Å; W1447-Q1871 HydrophobicContact CH2-CG 3.3Å; W1447-Q1871 HydrophobicContact CZ2-CB 4.27Å; W1447-Q1871 HydrophobicContact CZ2-CG 3.85Å; W1447-Q1871 HydrophobicContact CZ3-CG 4.07Å; N1449-Q1871 PolarHBondContact ND2-NE2 2.75Å; N1449-Q1871 PolarHBondContact ND2-OE1 3.12Å; L1867-Q1871 PolarHBondContact O-N 3.12Å; L1868-Q1871 PolarHBondContact O-N 2.8Å; L1868-Q1871 VanDerWaalsContact O-N 3.12Å; H1869-Q1871 VanDerWaalsContact C-N 3.3Å; H1869-Q1871 PolarHBondContact O-N 3.19Å
1872	Y	48.1	Very low	58.2	Low	43.2 Å²	43.2	80.9 Å²	80.9	17%	0.169	37%	0.374	C	S	.	.			trans	-111.7	125.7	-177	-106.4	-87.2	0	0	0	111.3	Y1405 W1447 I1481 T1483 S1512 Y1862 L1868 H1869 R1870 F1874 Y1875 Q1876	Y1405-Y1872 HydrophobicContact CE1-CE2 4.29Å; W1447-Y1872 VanDerWaalsContact CB-OH 3.27Å; W1447-Y1872 WeakPolarHBondContact CB-OH 3.49Å; W1447-Y1872 AromaticContact CD1-CE1 3.46Å; W1447-Y1872 VanDerWaalsContact CD1-CE1 3.46Å; W1447-Y1872 AromaticContact CD1-CZ 3.54Å; W1447-Y1872 AromaticContact CD2-CE1 3.93Å; W1447-Y1872 HydrophobicContact CD2-CE1 3.93Å; W1447-Y1872 AromaticContact CD2-CE2 3.56Å; W1447-Y1872 HydrophobicContact CD2-CE2 3.79Å; W1447-Y1872 AromaticContact CD2-CZ 3.13Å; W1447-Y1872 AromaticContact CE2-CE1 3.23Å; W1447-Y1872 AromaticContact CE2-CE2 3.37Å; W1447-Y1872 AromaticContact CE2-CZ 3.14Å; W1447-Y1872 VanDerWaalsContact CE2-CZ 3.4Å; W1447-Y1872 AromaticContact CE3-CE2 3.64Å; W1447-Y1872 HydrophobicContact CE3-CE2 3.64Å; W1447-Y1872 AromaticContact CE3-CZ 3.73Å; W1447-Y1872 HydrophobicContact CG-CE1 4.07Å; W1447-Y1872 HydrophobicContact CG-CE2 4.27Å; W1447-Y1872 AromaticContact CG-CZ 3.43Å; W1447-Y1872 VanDerWaalsContact CG-CZ 3.43Å; W1447-Y1872 HydrophobicContact CH2-CD2 4.15Å; W1447-Y1872 AromaticContact CH2-CE2 3.71Å; W1447-Y1872 HydrophobicContact CH2-CE2 3.71Å; W1447-Y1872 HydrophobicContact CZ2-CD1 4.1Å; W1447-Y1872 AromaticContact CZ2-CD2 3.92Å; W1447-Y1872 HydrophobicContact CZ2-CD2 4.01Å; W1447-Y1872 AromaticContact CZ2-CE1 3.66Å; W1447-Y1872 HydrophobicContact CZ2-CE1 3.66Å; W1447-Y1872 AromaticContact CZ2-CE2 3.3Å; W1447-Y1872 HydrophobicContact CZ2-CE2 3.3Å; W1447-Y1872 HydrophobicContact CZ2-CG 4.28Å; W1447-Y1872 AromaticContact CZ2-CZ 3.56Å; W1447-Y1872 AromaticContact CZ3-CE2 3.69Å; W1447-Y1872 HydrophobicContact CZ3-CE2 4.06Å; W1447-Y1872 AromaticContact NE1-CD1 3.98Å; W1447-Y1872 AromaticContact NE1-CE1 2.93Å; W1447-Y1872 AromaticContact NE1-CE2 3.87Å; W1447-Y1872 AromaticContact NE1-CZ 3.14Å; W1447-Y1872 VanDerWaalsContact NE1-CZ 3.25Å; W1447-Y1872 PolarHBondContact NE1-OH 3.07Å; W1447-Y1872 VanDerWaalsContact NE1-OH 3.12Å; I1481-Y1872 HydrophobicContact CG2-CE1 4.18Å; T1483-Y1872 HydrophobicContact CG2-CD1 3.99Å; T1483-Y1872 HydrophobicContact CG2-CD2 3.34Å; T1483-Y1872 HydrophobicContact CG2-CE1 3.66Å; T1483-Y1872 HydrophobicContact CG2-CE2 3.96Å; T1483-Y1872 HydrophobicContact CG2-CG 3.91Å; S1512-Y1872 PolarHBondContact OG-OH 2.88Å; Y1862-Y1872 HydrophobicContact CE1-CE1 4.45Å; Y1862-Y1872 HydrophobicContact CE1-CE2 4.44Å; Y1862-Y1872 PolarHBondContact OH-OH 3.26Å; L1868-Y1872 PolarHBondContact O-N 2.81Å; H1869-Y1872 PolarHBondContact O-N 3.39Å; H1869-Y1872 VanDerWaalsContact O-N 3.09Å; R1870-Y1872 VanDerWaalsContact C-N 3.27Å; R1870-Y1872 PolarHBondContact O-N 2.78Å; Y1872-F1874 VanDerWaalsContact C-N 3.31Å; Y1872-F1874 HydrophobicContact CD1-CB 3.33Å; Y1872-F1874 VanDerWaalsContact CD1-CB 3.46Å; Y1872-F1874 HydrophobicContact CD1-CG 4.39Å; Y1872-F1874 HydrophobicContact CE1-CB 3.46Å; Y1872-F1874 HydrophobicContact CE1-CG 4.27Å; Y1872-F1874 HydrophobicContact CG-CB 4.15Å; Y1872-F1874 PolarHBondContact O-N 2.95Å; Y1872-Y1875 AromaticContact CD1-CD2 3.72Å; Y1872-Y1875 HydrophobicContact CD1-CD2 3.72Å; Y1872-Y1875 AromaticContact CD1-CE2 3.87Å; Y1872-Y1875 HydrophobicContact CD1-CE2 3.87Å; Y1872-Y1875 AromaticContact CD2-CD2 3.84Å; Y1872-Y1875 HydrophobicContact CD2-CD2 3.96Å; Y1872-Y1875 HydrophobicContact CD2-CE2 4.3Å; Y1872-Y1875 HydrophobicContact CE2-CD2 4.31Å; Y1872-Y1875 HydrophobicContact CE2-CE2 4.31Å; Y1872-Y1875 AromaticContact CG-CD2 3.91Å; Y1872-Y1875 HydrophobicContact CG-CD2 4.09Å; Y1872-Y1875 HydrophobicContact CG-CE2 4.37Å; Y1872-Y1875 PolarHBondContact O-N 3.13Å; Y1872-Q1876 WeakPolarHBondContact O-CG 3.48Å; Y1872-Q1876 PolarHBondContact O-N 3.13Å
1873	S	48.4	Very low	60.1	Low	17.4 Å²	17.4	77.7 Å²	77.7	12%	0.122	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-50.7	-42.1	172.9	62.9	0	0	0	0	112.8	Y1875 Q1876 K1877 R1954 A1964 D1965 C1966 D1967 L1968	S1873-Y1875 VanDerWaalsContact C-N 3.26Å; S1873-Y1875 PolarHBondContact O-N 2.97Å; S1873-Y1875 VanDerWaalsContact O-N 3.1Å; S1873-Q1876 CarbonylContact O-C 3.58Å; S1873-Q1876 PolarHBondContact O-N 3.06Å; S1873-Q1876 VanDerWaalsContact O-N 3.1Å; S1873-K1877 VanDerWaalsContact O-CG 3.29Å; S1873-K1877 WeakPolarHBondContact O-CG 3.32Å; S1873-K1877 PolarHBondContact O-N 2.72Å; S1873-K1877 VanDerWaalsContact O-N 3.12Å; S1873-R1954 VanDerWaalsContact CB-NH1 3.25Å; S1873-R1954 PolarHBondContact O-NH1 3.46Å; S1873-A1964 CarbonylContact C-O 3.59Å; S1873-A1964 WeakPolarHBondContact CB-O 3.46Å; S1873-D1965 VanDerWaalsContact CB-OD1 3.27Å; S1873-D1965 WeakPolarHBondContact CB-OD1 3.32Å; S1873-D1965 PolarHBondContact OG-OD1 2.93Å; S1873-C1966 VanDerWaalsContact CB-O 3.27Å; S1873-C1966 WeakPolarHBondContact CB-O 3.41Å; S1873-D1967 PolarHBondContact OG-OD1 2.8Å; S1873-L1968 VanDerWaalsContact CB-CG 3.45Å
1874	F	47.7	Very low	61.6	Low	97.8 Å²	97.8	74.3 Å²	74.3	43%	0.429	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-55.1	-29.6	-177.1	-158.7	-93.8	0	0	0	114.9	Y1872	Y1872-F1874 VanDerWaalsContact C-N 3.31Å; Y1872-F1874 HydrophobicContact CD1-CB 3.33Å; Y1872-F1874 VanDerWaalsContact CD1-CB 3.46Å; Y1872-F1874 HydrophobicContact CD1-CG 4.39Å; Y1872-F1874 HydrophobicContact CE1-CB 3.46Å; Y1872-F1874 HydrophobicContact CE1-CG 4.27Å; Y1872-F1874 HydrophobicContact CG-CB 4.15Å; Y1872-F1874 PolarHBondContact O-N 2.95Å
1875	Y	52.2	Low	63.3	Low	74.8 Å²	74.8	69.4 Å²	69.4	29%	0.293	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-104.2	-6.9	-179.2	-63.8	-68.9	0	0	0	113.7	Q1443 I1481 L1868 H1869 Y1872 S1873 K1877	Q1443-Y1875 PolarHBondContact O-OH 3.06Å; I1481-Y1875 HydrophobicContact CD1-CE2 4.36Å; L1868-Y1875 HydrophobicContact CD2-CD2 4.08Å; L1868-Y1875 HydrophobicContact CD2-CE2 3.56Å; L1868-Y1875 HydrophobicContact CG-CD2 3.93Å; L1868-Y1875 HydrophobicContact CG-CE2 3.9Å; H1869-Y1875 VanDerWaalsContact CA-CB 3.49Å; H1869-Y1875 HydrophobicContact CB-CD2 4.18Å; H1869-Y1875 HydrophobicContact CB-CE2 3.93Å; H1869-Y1875 HydrophobicContact CB-CG 4.49Å; H1869-Y1875 AromaticContact CD2-CE2 3.62Å; H1869-Y1875 PolarHBondContact CD2-O 3.41Å; H1869-Y1875 AromaticContact CE1-CD1 3.33Å; H1869-Y1875 WeakPolarHBondContact CE1-CD1 3.38Å; H1869-Y1875 AromaticContact CE1-CE1 3.76Å; H1869-Y1875 AromaticContact CE1-CG 3.74Å; H1869-Y1875 AromaticContact CG-CE2 3.97Å; H1869-Y1875 AromaticContact CG-CG 3.92Å; H1869-Y1875 AromaticContact ND1-CD1 3.6Å; H1869-Y1875 AromaticContact ND1-CG 3.48Å; H1869-Y1875 AromaticContact NE2-CD1 3.74Å; Y1872-Y1875 AromaticContact CD1-CD2 3.72Å; Y1872-Y1875 HydrophobicContact CD1-CD2 3.72Å; Y1872-Y1875 AromaticContact CD1-CE2 3.87Å; Y1872-Y1875 HydrophobicContact CD1-CE2 3.87Å; Y1872-Y1875 AromaticContact CD2-CD2 3.84Å; Y1872-Y1875 HydrophobicContact CD2-CD2 3.96Å; Y1872-Y1875 HydrophobicContact CD2-CE2 4.3Å; Y1872-Y1875 HydrophobicContact CE2-CD2 4.31Å; Y1872-Y1875 HydrophobicContact CE2-CE2 4.31Å; Y1872-Y1875 AromaticContact CG-CD2 3.91Å; Y1872-Y1875 HydrophobicContact CG-CD2 4.09Å; Y1872-Y1875 HydrophobicContact CG-CE2 4.37Å; Y1872-Y1875 PolarHBondContact O-N 3.13Å; S1873-Y1875 VanDerWaalsContact C-N 3.26Å; S1873-Y1875 PolarHBondContact O-N 2.97Å; S1873-Y1875 VanDerWaalsContact O-N 3.1Å; Y1875-K1877 VanDerWaalsContact C-N 3.32Å; Y1875-K1877 PolarHBondContact O-N 3.14Å; Y1875-K1877 VanDerWaalsContact O-N 3.11Å
1876	Q	61.2	Low	65.2	Low	44.4 Å²	44.4	67.9 Å²	67.9	21%	0.207	34%	0.335	C	S	.	.			trans	-87.4	69.3	172.9	-68.8	-179.3	0.5	0	0	110	H1869 R1870 Y1872 S1873 F1878 E1952 R1954 A1964	H1869-Q1876 WeakPolarHBondContact O-CG 3.33Å; R1870-Q1876 PolarHBondContact O-NE2 3.06Å; R1870-Q1876 VanDerWaalsContact O-NE2 3.15Å; Y1872-Q1876 WeakPolarHBondContact O-CG 3.48Å; Y1872-Q1876 PolarHBondContact O-N 3.13Å; S1873-Q1876 CarbonylContact O-C 3.58Å; S1873-Q1876 PolarHBondContact O-N 3.06Å; S1873-Q1876 VanDerWaalsContact O-N 3.1Å; Q1876-F1878 VanDerWaalsContact O-CD1 3.23Å; Q1876-F1878 WeakPolarHBondContact O-CD1 3.32Å; Q1876-F1878 PolarHBondContact O-N 3.11Å; Q1876-F1878 VanDerWaalsContact O-N 3.07Å; Q1876-E1952 PolarHBondContact NE2-OE2 3.28Å; Q1876-R1954 VanDerWaalsContact OE1-NH1 3.08Å; Q1876-A1964 WeakPolarHBondContact O-CB 3.39Å
1877	K	67.9	Low	67	Low	131.8 Å²	131.8	68.9 Å²	68.9	57%	0.573	34%	0.336	S	S	*	.			trans	-76.9	122.4	175.1	-62.6	-177.2	-175.5	178.2	0	109.6	E1856 S1873 Y1875	E1856-K1877 IonicContact OE1-NZ 2.77Å; E1856-K1877 PolarHBondContact OE1-NZ 3.29Å; E1856-K1877 IonicContact OE2-NZ 3.36Å; E1856-K1877 PolarHBondContact OE2-NZ 2.79Å; S1873-K1877 VanDerWaalsContact O-CG 3.29Å; S1873-K1877 WeakPolarHBondContact O-CG 3.32Å; S1873-K1877 PolarHBondContact O-N 2.72Å; S1873-K1877 VanDerWaalsContact O-N 3.12Å; Y1875-K1877 VanDerWaalsContact C-N 3.32Å; Y1875-K1877 PolarHBondContact O-N 3.14Å; Y1875-K1877 VanDerWaalsContact O-N 3.11Å
1878	F	80	Confident	68.9	Low	33 Å²	33	67.6 Å²	67.6	15%	0.145	34%	0.342	C	S	.	.			trans	-134.9	161.2	171.2	57.1	-95.6	0	0	0	109.4	Q1876 T1880 I1895 R1954 L1963 A1964	Q1876-F1878 VanDerWaalsContact O-CD1 3.23Å; Q1876-F1878 WeakPolarHBondContact O-CD1 3.32Å; Q1876-F1878 PolarHBondContact O-N 3.11Å; Q1876-F1878 VanDerWaalsContact O-N 3.07Å; F1878-T1880 HydrophobicContact CD2-CG2 4.38Å; F1878-T1880 HydrophobicContact CE2-CG2 4.19Å; F1878-I1895 HydrophobicContact CB-CG2 3.73Å; F1878-I1895 HydrophobicContact CD2-CB 4.29Å; F1878-I1895 HydrophobicContact CD2-CD1 4.03Å; F1878-I1895 HydrophobicContact CD2-CG1 3.96Å; F1878-I1895 HydrophobicContact CD2-CG2 3.6Å; F1878-I1895 VanDerWaalsContact CD2-CG2 3.47Å; F1878-I1895 HydrophobicContact CE2-CD1 3.71Å; F1878-I1895 HydrophobicContact CE2-CG1 4.02Å; F1878-I1895 HydrophobicContact CE2-CG2 4.15Å; F1878-I1895 HydrophobicContact CG-CG2 3.71Å; F1878-I1895 HydrophobicContact CZ-CD1 4.29Å; F1878-R1954 HydrophobicContact CZ-CG 4.33Å; F1878-L1963 HydrophobicContact CE2-CB 4.07Å; F1878-L1963 HydrophobicContact CE2-CD2 4.08Å; F1878-L1963 HydrophobicContact CE2-CG 4.07Å; F1878-L1963 HydrophobicContact CZ-CB 4.32Å; F1878-L1963 HydrophobicContact CZ-CD2 4.4Å; F1878-L1963 HydrophobicContact CZ-CG 4.09Å; F1878-A1964 HydrophobicContact CD1-CB 3.92Å; F1878-A1964 HydrophobicContact CD2-CB 4.43Å; F1878-A1964 VanDerWaalsContact CE1-CA 3.46Å; F1878-A1964 HydrophobicContact CE1-CB 3.68Å; F1878-A1964 HydrophobicContact CE2-CB 4.3Å; F1878-A1964 HydrophobicContact CG-CB 4.33Å; F1878-A1964 VanDerWaalsContact CZ-CA 3.49Å; F1878-A1964 HydrophobicContact CZ-CB 3.9Å
1879	E	83.4	Confident	71	Confident	123.2 Å²	123.2	66.8 Å²	66.8	58%	0.576	33%	0.333	S	S	*	.			trans	-108.6	141.6	176.3	-66	-179.9	173.3	0	0	109.6	F1881 I1895 Y1896	E1879-F1881 HydrophobicContact CB-CE2 3.79Å; E1879-F1881 HydrophobicContact CB-CZ 4.01Å; E1879-F1881 WeakPolarHBondContact O-CD2 3.45Å; E1879-F1881 VanDerWaalsContact O-CE2 3.32Å; E1879-F1881 WeakPolarHBondContact O-CE2 3.32Å; E1879-I1895 WeakPolarHBondContact O-CA 3.43Å; E1879-Y1896 PolarHBondContact O-N 3.23Å; E1879-Y1896 VanDerWaalsContact O-N 3.17Å
1880	T	89.5	Confident	73	Confident	4.4 Å²	4.4	64.3 Å²	64.3	3%	0.027	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	150.7	176	59.1	0	0	0	0	111.9	F1878 L1893 E1894 I1895 V1919 E1922 H1923 L1963	F1878-T1880 HydrophobicContact CD2-CG2 4.38Å; F1878-T1880 HydrophobicContact CE2-CG2 4.19Å; T1880-L1893 HydrophobicContact CG2-CD1 4.34Å; T1880-E1894 CarbonylContact C-O 3.54Å; T1880-E1894 WeakPolarHBondContact CA-O 3.33Å; T1880-I1895 HydrophobicContact CG2-CG1 4.41Å; T1880-I1895 HydrophobicContact CG2-CG2 4.27Å; T1880-V1919 HydrophobicContact CG2-CG2 4.44Å; T1880-E1922 PolarHBondContact N-OE1 3.24Å; T1880-E1922 PolarHBondContact OG1-OE1 3.08Å; T1880-H1923 PolarHBondContact O-CE1 2.99Å; T1880-H1923 PolarHBondContact O-NE2 3.2Å; T1880-H1923 PolarHBondContact OG1-NE2 3Å; T1880-L1963 HydrophobicContact CG2-CB 4.09Å; T1880-L1963 HydrophobicContact CG2-CD2 3.93Å
1881	F	90.3	Very high	75.1	Confident	50.2 Å²	50.2	57.1 Å²	57.1	22%	0.22	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142.3	178.1	-60.7	-89.3	0	0	0	110.5	E1879 V1883 L1893 E1894	E1879-F1881 HydrophobicContact CB-CE2 3.79Å; E1879-F1881 HydrophobicContact CB-CZ 4.01Å; E1879-F1881 WeakPolarHBondContact O-CD2 3.45Å; E1879-F1881 VanDerWaalsContact O-CE2 3.32Å; E1879-F1881 WeakPolarHBondContact O-CE2 3.32Å; F1881-V1883 HydrophobicContact CB-CG2 4.36Å; F1881-L1893 WeakPolarHBondContact O-CA 3.46Å; F1881-E1894 HydrophobicContact CB-CB 4.47Å; F1881-E1894 PolarHBondContact N-O 3.11Å; F1881-E1894 PolarHBondContact O-N 3.11Å
1882	L	90.3	Very high	77.2	Confident	32.2 Å²	32.2	53.2 Å²	53.2	17%	0.169	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.3	170	-61.7	177.5	0	0	0	109.2	F1892 L1893 F1925 L1988	L1882-F1892 WeakPolarHBondContact CA-O 3.31Å; L1882-L1893 HydrophobicContact CD2-CD1 4.14Å; L1882-F1925 HydrophobicContact CD1-CE2 4.5Å; L1882-L1988 HydrophobicContact CD1-CD2 4.01Å; L1882-L1988 HydrophobicContact CD2-CB 3.99Å; L1882-L1988 HydrophobicContact CD2-CD1 4.04Å; L1882-L1988 HydrophobicContact CD2-CD2 3.91Å; L1882-L1988 HydrophobicContact CD2-CG 4.43Å; L1882-L1988 HydrophobicContact CG-CD2 4.39Å
1883	V	88	Confident	79.3	Confident	33 Å²	33	51.2 Å²	51.2	20%	0.2	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153.5	-172.6	-171.6	0	0	0	0	110.8	F1881 G1885 G1891 F1892 E1894	F1881-V1883 HydrophobicContact CB-CG2 4.36Å; V1883-G1885 VanDerWaalsContact C-N 3.29Å; V1883-G1885 PolarHBondContact O-N 3.16Å; V1883-G1885 VanDerWaalsContact O-N 3.17Å; V1883-G1891 CarbonylContact O-C 3.55Å; V1883-G1891 VanDerWaalsContact O-CA 3.23Å; V1883-G1891 WeakPolarHBondContact O-CA 3.34Å; V1883-F1892 PolarHBondContact N-O 2.96Å; V1883-F1892 PolarHBondContact O-N 2.97Å; V1883-E1894 HydrophobicContact CG2-CG 4.24Å
1884	D	82.8	Confident	81.3	Confident	66.2 Å²	66.2	51.3 Å²	51.3	35%	0.354	27%	0.267	S	S	.	.	S	Bend	trans	57.4	27.6	178.4	-56.8	-22.8	0	0	0	115.6	F1892 R1937 W2296	D1884-F1892 HydrophobicContact CB-CD2 4.08Å; D1884-F1892 HydrophobicContact CB-CE2 4.43Å; D1884-R1937 IonicContact OD2-CZ 3.11Å; D1884-R1937 VanDerWaalsContact OD2-CZ 3.26Å; D1884-R1937 IonicContact OD2-NE 3.36Å; D1884-R1937 PolarHBondContact OD2-NE 2.97Å; D1884-R1937 IonicContact OD2-NH2 3.41Å; D1884-R1937 PolarHBondContact OD2-NH2 2.94Å; D1884-W2296 WeakPolarHBondContact O-CZ2 2.94Å; D1884-W2296 PolarHBondContact O-NE1 3.36Å
1885	G	81.4	Confident	83.3	Confident	25.4 Å²	25.4	47.1 Å²	47.1	26%	0.262	25%	0.249	S	C	.	.	S	Bend	trans	-97.6	162.8	168.8	0	0	0	0	0	113.1	V1883 D1887 T1890	V1883-G1885 VanDerWaalsContact C-N 3.29Å; V1883-G1885 PolarHBondContact O-N 3.16Å; V1883-G1885 VanDerWaalsContact O-N 3.17Å; G1885-D1887 VanDerWaalsContact C-N 3.29Å; G1885-D1887 PolarHBondContact O-N 2.97Å; G1885-T1890 WeakPolarHBondContact CA-O 3.38Å
1886	P	82	Confident	84.8	Confident	83 Å²	83	48.2 Å²	48.2	54%	0.539	25%	0.253	S	S	.	.	S	Bend	trans	-65.7	-30.8	175.6	27.4	-35.1	0	0	0	112.9	T1890 L2295 W2296	P1886-T1890 WeakPolarHBondContact CD-OG1 3.35Å; P1886-T1890 HydrophobicContact CG-CG2 4.48Å; P1886-T1890 WeakPolarHBondContact CG-OG1 3.43Å; P1886-L2295 WeakPolarHBondContact CG-O 3.23Å; P1886-W2296 HydrophobicContact CB-CE3 4.31Å; P1886-W2296 HydrophobicContact CB-CZ3 4.29Å; P1886-W2296 HydrophobicContact CG-CE3 4.29Å
1887	D	83.3	Confident	85.5	Confident	93.6 Å²	93.6	47.4 Å²	47.4	50%	0.501	25%	0.25	S	S	.	.	S	Bend	trans	-128.9	162.2	-178.5	-76.4	-16.4	0	0	0	110.4	G1885 R1889 T1890	G1885-D1887 VanDerWaalsContact C-N 3.29Å; G1885-D1887 PolarHBondContact O-N 2.97Å; D1887-R1889 PolarHBondContact O-N 3.1Å; D1887-R1889 IonicContact OD2-CZ 2.77Å; D1887-R1889 IonicContact OD2-NE 3.44Å; D1887-R1889 IonicContact OD2-NH2 3.24Å; D1887-R1889 PolarHBondContact OD2-NH2 3.22Å; D1887-T1890 PolarHBondContact N-OG1 3.18Å; D1887-T1890 VanDerWaalsContact N-OG1 3.12Å; D1887-T1890 PolarHBondContact O-N 3.25Å; D1887-T1890 VanDerWaalsContact O-N 3.1Å; D1887-T1890 VanDerWaalsContact O-O 3.11Å; D1887-T1890 PolarHBondContact O-OG1 2.89Å; D1887-T1890 VanDerWaalsContact O-OG1 3.13Å
1888	A	85.6	Confident	85.5	Confident	84.2 Å²	84.2	44.6 Å²	44.6	70%	0.696	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-7.3	173.1	0	0	0	0	0	115.1	F1925	A1888-F1925 HydrophobicContact CB-CZ 4.44Å; A1888-F1925 VanDerWaalsContact O-CE2 3.3Å; A1888-F1925 WeakPolarHBondContact O-CE2 3.31Å; A1888-F1925 WeakPolarHBondContact O-CZ 3.39Å
1889	R	87.5	Confident	84.8	Confident	62.4 Å²	62.4	47.6 Å²	47.6	24%	0.235	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-6.7	178.6	-69.2	177.9	-101.6	-133.7	1	113.5	D1887 F1925 H1989 C1990 R1992	D1887-R1889 PolarHBondContact O-N 3.1Å; D1887-R1889 IonicContact OD2-CZ 2.77Å; D1887-R1889 IonicContact OD2-NE 3.44Å; D1887-R1889 IonicContact OD2-NH2 3.24Å; D1887-R1889 PolarHBondContact OD2-NH2 3.22Å; R1889-F1925 HydrophobicContact CB-CE2 4.38Å; R1889-F1925 HydrophobicContact CB-CZ 4.46Å; R1889-F1925 HydrophobicContact CG-CD1 3.79Å; R1889-F1925 HydrophobicContact CG-CD2 4.23Å; R1889-F1925 HydrophobicContact CG-CE1 3.51Å; R1889-F1925 HydrophobicContact CG-CE2 3.97Å; R1889-F1925 HydrophobicContact CG-CG 4.15Å; R1889-F1925 HydrophobicContact CG-CZ 3.61Å; R1889-H1989 WeakPolarHBondContact O-CA 3.3Å; R1889-C1990 HydrophobicContact CB-CB 4.36Å; R1889-C1990 WeakPolarHBondContact CB-O 3.43Å; R1889-C1990 WeakPolarHBondContact CD-O 3.25Å; R1889-C1990 PolarHBondContact O-N 3.05Å; R1889-R1992 VanDerWaalsContact NH1-CZ 3.33Å; R1889-R1992 VanDerWaalsContact NH1-NH2 3.14Å
1890	T	89.6	Confident	84.1	Confident	6.2 Å²	6.2	43.8 Å²	43.8	4%	0.038	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.4	-175	39.8	0	0	0	0	109	G1885 P1886 D1887 L1988 H1989	G1885-T1890 WeakPolarHBondContact CA-O 3.38Å; P1886-T1890 WeakPolarHBondContact CD-OG1 3.35Å; P1886-T1890 HydrophobicContact CG-CG2 4.48Å; P1886-T1890 WeakPolarHBondContact CG-OG1 3.43Å; D1887-T1890 PolarHBondContact N-OG1 3.18Å; D1887-T1890 VanDerWaalsContact N-OG1 3.12Å; D1887-T1890 PolarHBondContact O-N 3.25Å; D1887-T1890 VanDerWaalsContact O-N 3.1Å; D1887-T1890 VanDerWaalsContact O-O 3.11Å; D1887-T1890 PolarHBondContact O-OG1 2.89Å; D1887-T1890 VanDerWaalsContact O-OG1 3.13Å; T1890-L1988 CarbonylContact C-O 3.55Å; T1890-L1988 VanDerWaalsContact CA-O 3.29Å; T1890-L1988 WeakPolarHBondContact CA-O 3.24Å; T1890-H1989 HydrophobicContact CG2-CB 3.96Å; T1890-H1989 WeakPolarHBondContact CG2-ND1 3.38Å
1891	G	91.3	Very high	83.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.3	175.3	171.7	0	0	0	0	0	113.3	V1883 L1988	V1883-G1891 CarbonylContact O-C 3.55Å; V1883-G1891 VanDerWaalsContact O-CA 3.23Å; V1883-G1891 WeakPolarHBondContact O-CA 3.34Å; G1891-L1988 PolarHBondContact N-O 3.06Å; G1891-L1988 VanDerWaalsContact N-O 3.1Å; G1891-L1988 PolarHBondContact O-N 3.12Å
1892	F	91.3	Very high	82.8	Confident	11.2 Å²	11.2	46.5 Å²	46.5	5%	0.049	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	138.6	169.2	-64.9	-82.6	0	0	0	110.3	L1882 V1883 D1884 R1937 F1985 V1986 F1987 W2296 F2299	L1882-F1892 WeakPolarHBondContact CA-O 3.31Å; V1883-F1892 PolarHBondContact N-O 2.96Å; V1883-F1892 PolarHBondContact O-N 2.97Å; D1884-F1892 HydrophobicContact CB-CD2 4.08Å; D1884-F1892 HydrophobicContact CB-CE2 4.43Å; F1892-R1937 HydrophobicContact CD1-CB 4.37Å; F1892-R1937 HydrophobicContact CD1-CG 4.49Å; F1892-R1937 HydrophobicContact CD2-CG 4.21Å; F1892-R1937 HydrophobicContact CE1-CB 3.96Å; F1892-R1937 HydrophobicContact CE1-CG 4.33Å; F1892-R1937 HydrophobicContact CE2-CB 4.38Å; F1892-R1937 HydrophobicContact CE2-CG 4.01Å; F1892-R1937 HydrophobicContact CG-CG 4.41Å; F1892-R1937 HydrophobicContact CZ-CB 3.98Å; F1892-R1937 HydrophobicContact CZ-CG 4.09Å; F1892-F1985 HydrophobicContact CD1-CB 3.71Å; F1892-F1985 HydrophobicContact CE1-CB 3.95Å; F1892-V1986 WeakPolarHBondContact CA-O 3.25Å; F1892-F1987 HydrophobicContact CD1-CB 4.18Å; F1892-F1987 HydrophobicContact CD1-CD2 4.19Å; F1892-F1987 AromaticContact CD2-CD2 3.95Å; F1892-F1987 HydrophobicContact CD2-CD2 4.11Å; F1892-F1987 HydrophobicContact CD2-CE2 4.35Å; F1892-F1987 HydrophobicContact CE1-CB 4.12Å; F1892-F1987 AromaticContact CE1-CD2 3.97Å; F1892-F1987 HydrophobicContact CE1-CD2 4.09Å; F1892-F1987 AromaticContact CE2-CD2 3.93Å; F1892-F1987 HydrophobicContact CE2-CD2 4Å; F1892-F1987 HydrophobicContact CE2-CE2 4.4Å; F1892-F1987 HydrophobicContact CG-CD2 4.22Å; F1892-F1987 AromaticContact CZ-CD2 3.9Å; F1892-F1987 HydrophobicContact CZ-CD2 4.01Å; F1892-W2296 HydrophobicContact CE2-CE3 4.11Å; F1892-W2296 HydrophobicContact CE2-CH2 4.07Å; F1892-W2296 HydrophobicContact CE2-CZ2 4.4Å; F1892-W2296 AromaticContact CE2-CZ3 3.89Å; F1892-W2296 HydrophobicContact CE2-CZ3 3.89Å; F1892-W2296 HydrophobicContact CZ-CE3 4.07Å; F1892-W2296 HydrophobicContact CZ-CH2 4.22Å; F1892-W2296 AromaticContact CZ-CZ3 3.71Å; F1892-W2296 HydrophobicContact CZ-CZ3 3.71Å; F1892-F2299 HydrophobicContact CE1-CE2 4.37Å; F1892-F2299 HydrophobicContact CE1-CZ 4.21Å; F1892-F2299 AromaticContact CZ-CE2 3.89Å; F1892-F2299 HydrophobicContact CZ-CE2 3.89Å; F1892-F2299 HydrophobicContact CZ-CZ 4.18Å
1893	L	92.4	Very high	82.5	Confident	1.6 Å²	1.6	51.3 Å²	51.3	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	123.7	-177.3	-176.4	59.4	0	0	0	111.2	T1880 F1881 L1882 I1906 F1911 V1919 L1963 V1986 L1988	T1880-L1893 HydrophobicContact CG2-CD1 4.34Å; F1881-L1893 WeakPolarHBondContact O-CA 3.46Å; L1882-L1893 HydrophobicContact CD2-CD1 4.14Å; L1893-I1906 HydrophobicContact CB-CD1 4.46Å; L1893-I1906 HydrophobicContact CD2-CB 4.24Å; L1893-I1906 HydrophobicContact CD2-CD1 3.5Å; L1893-I1906 VanDerWaalsContact CD2-CD1 3.46Å; L1893-I1906 HydrophobicContact CD2-CG1 4.4Å; L1893-I1906 HydrophobicContact CD2-CG2 4.5Å; L1893-I1906 HydrophobicContact CG-CB 4.42Å; L1893-I1906 HydrophobicContact CG-CD1 3.64Å; L1893-I1906 HydrophobicContact CG-CG1 4.17Å; L1893-I1906 PolarHBondContact O-N 3.1Å; L1893-F1911 HydrophobicContact CD2-CE1 4.39Å; L1893-F1911 HydrophobicContact CD2-CE2 3.86Å; L1893-F1911 HydrophobicContact CD2-CZ 3.62Å; L1893-V1919 HydrophobicContact CD1-CG1 3.87Å; L1893-V1919 HydrophobicContact CD1-CG2 4.44Å; L1893-V1919 HydrophobicContact CD2-CG2 4.13Å; L1893-L1963 HydrophobicContact CD2-CD2 4.45Å; L1893-V1986 HydrophobicContact CB-CB 4.43Å; L1893-V1986 HydrophobicContact CB-CG1 4.38Å; L1893-V1986 HydrophobicContact CD2-CG1 4.41Å; L1893-V1986 PolarHBondContact N-O 2.86Å; L1893-L1988 HydrophobicContact CB-CD1 4.18Å; L1893-L1988 HydrophobicContact CB-CG 4.5Å; L1893-L1988 HydrophobicContact CD1-CD1 4.25Å; L1893-L1988 HydrophobicContact CD2-CD1 3.89Å; L1893-L1988 HydrophobicContact CG-CD1 4.34Å
1894	E	90.4	Very high	82.3	Confident	17.8 Å²	17.8	49.9 Å²	49.9	8%	0.083	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	149.1	174.3	-62.3	-177.6	178.8	0	0	110.6	T1880 F1881 V1883 R1903 V1904 R1937	T1880-E1894 CarbonylContact C-O 3.54Å; T1880-E1894 WeakPolarHBondContact CA-O 3.33Å; F1881-E1894 HydrophobicContact CB-CB 4.47Å; F1881-E1894 PolarHBondContact N-O 3.11Å; F1881-E1894 PolarHBondContact O-N 3.11Å; V1883-E1894 HydrophobicContact CG2-CG 4.24Å; E1894-R1903 HydrophobicContact CB-CB 4.41Å; E1894-R1903 WeakPolarHBondContact OE2-CB 3.31Å; E1894-R1903 WeakPolarHBondContact OE2-CD 3.4Å; E1894-V1904 CarbonylContact C-O 3.55Å; E1894-V1904 WeakPolarHBondContact CA-O 3.4Å; E1894-R1937 IonicContact OE1-CZ 3.28Å; E1894-R1937 IonicContact OE1-NH1 2.96Å; E1894-R1937 PolarHBondContact OE1-NH1 2.99Å; E1894-R1937 IonicContact OE1-NH2 3.03Å; E1894-R1937 PolarHBondContact OE1-NH2 3.06Å; E1894-R1937 VanDerWaalsContact OE1-NH2 3.12Å
1895	I	88.6	Confident	82.6	Confident	11 Å²	11	47.2 Å²	47.2	6%	0.056	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	139.8	173.8	-29.1	166.9	0	0	0	109.8	F1878 E1879 T1880 N1897 R1903 V1904 I1906 L1963	F1878-I1895 HydrophobicContact CB-CG2 3.73Å; F1878-I1895 HydrophobicContact CD2-CB 4.29Å; F1878-I1895 HydrophobicContact CD2-CD1 4.03Å; F1878-I1895 HydrophobicContact CD2-CG1 3.96Å; F1878-I1895 HydrophobicContact CD2-CG2 3.6Å; F1878-I1895 VanDerWaalsContact CD2-CG2 3.47Å; F1878-I1895 HydrophobicContact CE2-CD1 3.71Å; F1878-I1895 HydrophobicContact CE2-CG1 4.02Å; F1878-I1895 HydrophobicContact CE2-CG2 4.15Å; F1878-I1895 HydrophobicContact CG-CG2 3.71Å; F1878-I1895 HydrophobicContact CZ-CD1 4.29Å; E1879-I1895 WeakPolarHBondContact O-CA 3.43Å; T1880-I1895 HydrophobicContact CG2-CG1 4.41Å; T1880-I1895 HydrophobicContact CG2-CG2 4.27Å; I1895-N1897 PolarHBondContact O-N 3.28Å; I1895-R1903 CarbonylContact O-C 3.53Å; I1895-R1903 WeakPolarHBondContact O-CA 3.34Å; I1895-V1904 HydrophobicContact CG1-CB 4.2Å; I1895-V1904 HydrophobicContact CG1-CG1 4.48Å; I1895-V1904 WeakPolarHBondContact CG1-O 3.26Å; I1895-V1904 PolarHBondContact N-O 2.88Å; I1895-V1904 PolarHBondContact O-N 2.97Å; I1895-I1906 HydrophobicContact CD1-CD1 3.28Å; I1895-I1906 HydrophobicContact CD1-CG1 3.82Å; I1895-I1906 HydrophobicContact CG1-CD1 3.66Å; I1895-I1906 HydrophobicContact CG1-CG1 4.13Å; I1895-I1906 HydrophobicContact CG2-CD1 3.64Å; I1895-I1906 HydrophobicContact CG2-CG1 4.11Å; I1895-L1963 HydrophobicContact CD1-CD2 4.4Å
1896	Y	82.9	Confident	83	Confident	97.6 Å²	97.6	46.6 Å²	46.6	38%	0.383	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	115.4	171.1	-178.7	-107.6	0	0	0	111.2	E1879 A1898 R1903	E1879-Y1896 PolarHBondContact O-N 3.23Å; E1879-Y1896 VanDerWaalsContact O-N 3.17Å; Y1896-A1898 HydrophobicContact CE1-CB 4.36Å; Y1896-A1898 PolarHBondContact O-N 2.93Å; Y1896-R1903 HydrophobicContact CD2-CG 4.35Å
1897	N	75.9	Confident	83.2	Confident	27.4 Å²	27.4	42.8 Å²	42.8	15%	0.147	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	104	174.9	-176	-8.1	0	0	0	110	I1895 T1899 T1900 G1901 E1902 V1904 S1949	I1895-N1897 PolarHBondContact O-N 3.28Å; N1897-T1899 PolarHBondContact ND2-OG1 2.72Å; N1897-T1899 PolarHBondContact O-N 2.84Å; N1897-T1899 VanDerWaalsContact O-N 3.14Å; N1897-T1899 WeakPolarHBondContact OD1-CA 3.3Å; N1897-T1899 VanDerWaalsContact OD1-CB 3.3Å; N1897-T1899 WeakPolarHBondContact OD1-CB 3.41Å; N1897-T1899 PolarHBondContact OD1-N 3Å; N1897-T1899 PolarHBondContact OD1-OG1 3.16Å; N1897-T1900 WeakPolarHBondContact CB-OG1 3.46Å; N1897-T1900 PolarHBondContact ND2-OG1 3.15Å; N1897-T1900 PolarHBondContact O-N 2.93Å; N1897-G1901 WeakPolarHBondContact O-CA 3.26Å; N1897-G1901 PolarHBondContact O-N 3.12Å; N1897-E1902 PolarHBondContact N-O 3.07Å; N1897-V1904 HydrophobicContact CB-CG2 4.03Å; N1897-S1949 WeakPolarHBondContact ND2-CB 3.34Å; N1897-S1949 PolarHBondContact ND2-OG 3.15Å
1898	A	68.3	Low	83.3	Confident	72.2 Å²	72.2	38.5 Å²	38.5	60%	0.597	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.2	178.3	0	0	0	0	0	113.9	L1868 Y1896	L1868-A1898 HydrophobicContact CD2-CB 3.92Å; Y1896-A1898 HydrophobicContact CE1-CB 4.36Å; Y1896-A1898 PolarHBondContact O-N 2.93Å
1899	T	64.9	Low	83.2	Confident	97 Å²	97	38.9 Å²	38.9	60%	0.595	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-38.6	-179.7	-31	0	0	0	0	112.2	L1060 L1868 N1897	L1060-T1899 HydrophobicContact CD2-CG2 3.76Å; L1868-T1899 HydrophobicContact CD1-CG2 4.02Å; L1868-T1899 WeakPolarHBondContact CD2-OG1 3.2Å; N1897-T1899 PolarHBondContact ND2-OG1 2.72Å; N1897-T1899 PolarHBondContact O-N 2.84Å; N1897-T1899 VanDerWaalsContact O-N 3.14Å; N1897-T1899 WeakPolarHBondContact OD1-CA 3.3Å; N1897-T1899 VanDerWaalsContact OD1-CB 3.3Å; N1897-T1899 WeakPolarHBondContact OD1-CB 3.41Å; N1897-T1899 PolarHBondContact OD1-N 3Å; N1897-T1899 PolarHBondContact OD1-OG1 3.16Å
1900	T	69.7	Low	82.9	Confident	43.6 Å²	43.6	37.4 Å²	37.4	27%	0.267	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-16.9	178.9	56.7	0	0	0	0	112.8	N1897 E1902 V1947 K1948 S1949	N1897-T1900 WeakPolarHBondContact CB-OG1 3.46Å; N1897-T1900 PolarHBondContact ND2-OG1 3.15Å; N1897-T1900 PolarHBondContact O-N 2.93Å; T1900-E1902 PolarHBondContact O-N 3.14Å; T1900-E1902 PolarHBondContact OG1-N 3.07Å; T1900-V1947 HydrophobicContact CG2-CG1 4.15Å; T1900-V1947 HydrophobicContact CG2-CG2 3.87Å; T1900-K1948 HydrophobicContact CG2-CB 4.43Å; T1900-S1949 VanDerWaalsContact CG2-OG 3.27Å; T1900-S1949 WeakPolarHBondContact CG2-OG 3.21Å
1901	G	73.8	Confident	82.8	Confident	39 Å²	39	37.8 Å²	37.8	40%	0.402	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	12.5	-172.4	0	0	0	0	0	113.6	N1897	N1897-G1901 WeakPolarHBondContact O-CA 3.26Å; N1897-G1901 PolarHBondContact O-N 3.12Å
1902	E	78.3	Confident	82.7	Confident	72.2 Å²	72.2	38.5 Å²	38.5	34%	0.337	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	151.5	-175.2	-67	170.9	178.2	0	0	110.7	N1897 T1900 V1947 K1948	N1897-E1902 PolarHBondContact N-O 3.07Å; T1900-E1902 PolarHBondContact O-N 3.14Å; T1900-E1902 PolarHBondContact OG1-N 3.07Å; E1902-V1947 WeakPolarHBondContact OE2-CG2 3.05Å; E1902-K1948 IonicContact OE1-NZ 3.7Å; E1902-K1948 PolarHBondContact OE1-NZ 2.77Å
1903	R	83.8	Confident	82.5	Confident	133.4 Å²	133.4	40.2 Å²	40.2	50%	0.503	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	127.8	167.5	-67.6	-177.1	-177.2	171.2	0.4	109	E1894 I1895 Y1896	E1894-R1903 HydrophobicContact CB-CB 4.41Å; E1894-R1903 WeakPolarHBondContact OE2-CB 3.31Å; E1894-R1903 WeakPolarHBondContact OE2-CD 3.4Å; I1895-R1903 CarbonylContact O-C 3.53Å; I1895-R1903 WeakPolarHBondContact O-CA 3.34Å; Y1896-R1903 HydrophobicContact CD2-CG 4.35Å
1904	V	85.1	Confident	82.4	Confident	2.8 Å²	2.8	41.4 Å²	41.4	2%	0.017	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.7	-175.9	177.7	0	0	0	0	108.9	E1894 I1895 N1897 V1947 S1949 Y1950	E1894-V1904 CarbonylContact C-O 3.55Å; E1894-V1904 WeakPolarHBondContact CA-O 3.4Å; I1895-V1904 HydrophobicContact CG1-CB 4.2Å; I1895-V1904 HydrophobicContact CG1-CG1 4.48Å; I1895-V1904 WeakPolarHBondContact CG1-O 3.26Å; I1895-V1904 PolarHBondContact N-O 2.88Å; I1895-V1904 PolarHBondContact O-N 2.97Å; N1897-V1904 HydrophobicContact CB-CG2 4.03Å; V1904-V1947 HydrophobicContact CB-CG1 4.41Å; V1904-V1947 HydrophobicContact CG1-CG1 3.97Å; V1904-V1947 HydrophobicContact CG2-CG1 3.89Å; V1904-S1949 WeakPolarHBondContact CG1-O 3.09Å; V1904-S1949 WeakPolarHBondContact CG2-O 3.43Å; V1904-S1949 WeakPolarHBondContact CG2-OG 3.44Å; V1904-Y1950 HydrophobicContact CG1-CD1 4.04Å; V1904-Y1950 HydrophobicContact CG1-CE1 4.35Å
1905	P	88.3	Confident	82.5	Confident	10.6 Å²	10.6	40.6 Å²	40.6	7%	0.069	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	147.9	174.7	28	-33.9	0	0	0	111.7	V1947 C1979 F1985	P1905-V1947 HydrophobicContact CG-CG2 4.3Å; P1905-C1979 HydrophobicContact CG-CB 4.5Å; P1905-C1979 PolarHBondContact O-SG 2.87Å; P1905-C1979 VanDerWaalsContact O-SG 3.32Å; P1905-F1985 HydrophobicContact CB-CD1 3.88Å; P1905-F1985 HydrophobicContact CB-CE1 3.79Å; P1905-F1985 HydrophobicContact CG-CD1 4.44Å; P1905-F1985 HydrophobicContact CG-CE1 3.96Å
1906	I	89	Confident	82.7	Confident	12.6 Å²	12.6	40.1 Å²	40.1	7%	0.065	21%	0.208	C	C	.	.			trans	-93.1	121.9	171.5	-57.2	-171.3	0	0	0	109.6	L1893 I1895 D1908 F1911 L1963 V1986	L1893-I1906 HydrophobicContact CB-CD1 4.46Å; L1893-I1906 HydrophobicContact CD2-CB 4.24Å; L1893-I1906 HydrophobicContact CD2-CD1 3.5Å; L1893-I1906 VanDerWaalsContact CD2-CD1 3.46Å; L1893-I1906 HydrophobicContact CD2-CG1 4.4Å; L1893-I1906 HydrophobicContact CD2-CG2 4.5Å; L1893-I1906 HydrophobicContact CG-CB 4.42Å; L1893-I1906 HydrophobicContact CG-CD1 3.64Å; L1893-I1906 HydrophobicContact CG-CG1 4.17Å; L1893-I1906 PolarHBondContact O-N 3.1Å; I1895-I1906 HydrophobicContact CD1-CD1 3.28Å; I1895-I1906 HydrophobicContact CD1-CG1 3.82Å; I1895-I1906 HydrophobicContact CG1-CD1 3.66Å; I1895-I1906 HydrophobicContact CG1-CG1 4.13Å; I1895-I1906 HydrophobicContact CG2-CD1 3.64Å; I1895-I1906 HydrophobicContact CG2-CG1 4.11Å; I1906-D1908 HydrophobicContact CG2-CB 3.94Å; I1906-F1911 HydrophobicContact CG2-CD2 4.38Å; I1906-L1963 HydrophobicContact CD1-CD2 4.3Å; I1906-V1986 HydrophobicContact CB-CG2 4.47Å; I1906-V1986 HydrophobicContact CG2-CG2 3.97Å; I1906-V1986 PolarHBondContact O-N 3.12Å; I1906-V1986 VanDerWaalsContact O-N 3.11Å
1907	C	86.8	Confident	83.1	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.014	19%	0.192	C	C	.	.			trans	-117.8	33.5	174.7	-54	0	0	0	0	112.8	R1909 C1979 H1984 F1985	C1907-R1909 PolarHBondContact O-N 3.08Å; C1907-R1909 VanDerWaalsContact O-N 3.12Å; C1907-C1979 HydrophobicContact CB-CB 3.86Å; C1907-C1979 WeakPolarHBondContact CB-SG 3.3Å; C1907-C1979 VanDerWaalsContact SG-CA 3.53Å; C1907-C1979 WeakPolarHBondContact SG-CA 3.17Å; C1907-C1979 WeakPolarHBondContact SG-CB 3.35Å; C1907-C1979 CovalentContact SG-SG 2.02Å; C1907-C1979 PolarHBondContact SG-SG 3.06Å; C1907-H1984 CarbonylContact C-O 3.53Å; C1907-H1984 WeakPolarHBondContact CA-O 3.27Å; C1907-H1984 VanDerWaalsContact CB-O 3.29Å; C1907-H1984 WeakPolarHBondContact CB-O 3.33Å; C1907-F1985 WeakPolarHBondContact SG-CD1 3.24Å; C1907-F1985 VanDerWaalsContact SG-CE1 3.51Å; C1907-F1985 WeakPolarHBondContact SG-CE1 3.3Å
1908	D	86.2	Confident	83.8	Confident	3.8 Å²	3.8	34.5 Å²	34.5	2%	0.02	19%	0.185	C	C	.	.			trans	-69.4	106.8	177.3	-174.2	2.2	0	0	0	110.6	I1906 Q1910 F1911 I1934 P1953 R1969 W1977	I1906-D1908 HydrophobicContact CG2-CB 3.94Å; D1908-Q1910 PolarHBondContact O-N 2.99Å; D1908-Q1910 VanDerWaalsContact O-N 3.12Å; D1908-Q1910 WeakPolarHBondContact OD1-CA 3.44Å; D1908-Q1910 WeakPolarHBondContact OD1-CB 3.31Å; D1908-Q1910 PolarHBondContact OD1-N 3.19Å; D1908-F1911 HydrophobicContact CB-CB 4.21Å; D1908-F1911 HydrophobicContact CB-CD2 4.46Å; D1908-F1911 VanDerWaalsContact O-CB 3.32Å; D1908-F1911 WeakPolarHBondContact O-CB 3.28Å; D1908-F1911 PolarHBondContact O-N 3.01Å; D1908-F1911 VanDerWaalsContact O-N 3.09Å; D1908-I1934 WeakPolarHBondContact O-CD1 3.25Å; D1908-P1953 HydrophobicContact CB-CB 4.5Å; D1908-P1953 VanDerWaalsContact OD2-CB 3.29Å; D1908-P1953 WeakPolarHBondContact OD2-CB 3.27Å; D1908-R1969 VanDerWaalsContact CG-NH1 3.32Å; D1908-R1969 VanDerWaalsContact CG-NH2 3.28Å; D1908-R1969 IonicContact OD1-CZ 3.32Å; D1908-R1969 IonicContact OD1-NH1 2.69Å; D1908-R1969 PolarHBondContact OD1-NH1 2.96Å; D1908-R1969 VanDerWaalsContact OD1-NH1 3.09Å; D1908-R1969 IonicContact OD1-NH2 3.22Å; D1908-R1969 PolarHBondContact OD1-NH2 3.22Å; D1908-R1969 IonicContact OD2-CZ 3.24Å; D1908-R1969 IonicContact OD2-NE 3.38Å; D1908-R1969 IonicContact OD2-NH1 3.65Å; D1908-R1969 PolarHBondContact OD2-NH1 3.03Å; D1908-R1969 IonicContact OD2-NH2 3.74Å; D1908-R1969 PolarHBondContact OD2-NH2 3.16Å; D1908-W1977 HydrophobicContact CB-CB 4.35Å
1909	R	83.1	Confident	85	Confident	93.2 Å²	93.2	31 Å²	31	35%	0.352	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.8	176.6	-64.8	-176.8	-179	-175.3	0.4	113.3	C1907 I1934 L1976 D1981 H1984	C1907-R1909 PolarHBondContact O-N 3.08Å; C1907-R1909 VanDerWaalsContact O-N 3.12Å; R1909-I1934 VanDerWaalsContact C-CD1 3.49Å; R1909-I1934 VanDerWaalsContact O-CD1 3.25Å; R1909-I1934 WeakPolarHBondContact O-CD1 3.39Å; R1909-L1976 WeakPolarHBondContact CB-O 3.27Å; R1909-L1976 WeakPolarHBondContact CG-O 3.23Å; R1909-L1976 PolarHBondContact N-O 3.04Å; R1909-D1981 IonicContact CZ-OD2 3.68Å; R1909-D1981 IonicContact NH2-OD2 2.95Å; R1909-D1981 PolarHBondContact NH2-OD2 2.94Å; R1909-H1984 HydrophobicContact CG-CB 3.89Å; R1909-H1984 VanDerWaalsContact CZ-CE1 3.46Å; R1909-H1984 PolarHBondContact NE-CD2 3.05Å; R1909-H1984 VanDerWaalsContact NE-CD2 3.31Å; R1909-H1984 VanDerWaalsContact NE-CG 3.29Å; R1909-H1984 PolarHBondContact NE-ND1 3.03Å; R1909-H1984 PolarHBondContact NE-NE2 3.09Å; R1909-H1984 PolarHBondContact NH2-CE1 3.1Å; R1909-H1984 VanDerWaalsContact NH2-CE1 3.27Å; R1909-H1984 PolarHBondContact NH2-ND1 3.13Å; R1909-H1984 VanDerWaalsContact NH2-ND1 3.18Å
1910	Q	81.8	Confident	86.3	Confident	31 Å²	31	26.4 Å²	26.4	15%	0.145	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	19.2	-178.2	-59.9	178.6	-46.4	0	0	111.9	D1908 T1912 R1969 Y2171	D1908-Q1910 PolarHBondContact O-N 2.99Å; D1908-Q1910 VanDerWaalsContact O-N 3.12Å; D1908-Q1910 WeakPolarHBondContact OD1-CA 3.44Å; D1908-Q1910 WeakPolarHBondContact OD1-CB 3.31Å; D1908-Q1910 PolarHBondContact OD1-N 3.19Å; Q1910-T1912 WeakPolarHBondContact O-CG2 3.39Å; Q1910-T1912 PolarHBondContact O-N 3.02Å; Q1910-T1912 VanDerWaalsContact O-N 3.13Å; Q1910-R1969 VanDerWaalsContact CB-NH1 3.25Å; Q1910-R1969 VanDerWaalsContact CD-NH1 3.34Å; Q1910-R1969 PolarHBondContact O-NH1 2.97Å; Q1910-R1969 VanDerWaalsContact OE1-NE 3.11Å; Q1910-Y2171 WeakPolarHBondContact CB-OH 3.3Å; Q1910-Y2171 VanDerWaalsContact CD-OH 3.27Å; Q1910-Y2171 HydrophobicContact CG-CE2 4.26Å; Q1910-Y2171 WeakPolarHBondContact CG-OH 3.37Å; Q1910-Y2171 PolarHBondContact NE2-OH 3.14Å; Q1910-Y2171 PolarHBondContact OE1-OH 3.07Å
1911	F	87.3	Confident	87.3	Confident	14.8 Å²	14.8	27.8 Å²	27.8	7%	0.065	13%	0.128	C	C	.	.			trans	-65.4	119.6	177.1	-163.3	-90.5	0	0	0	111.2	L1893 I1906 D1908 N1915 A1916 V1919 V1932 L1963 V1986 L1988	L1893-F1911 HydrophobicContact CD2-CE1 4.39Å; L1893-F1911 HydrophobicContact CD2-CE2 3.86Å; L1893-F1911 HydrophobicContact CD2-CZ 3.62Å; I1906-F1911 HydrophobicContact CG2-CD2 4.38Å; D1908-F1911 HydrophobicContact CB-CB 4.21Å; D1908-F1911 HydrophobicContact CB-CD2 4.46Å; D1908-F1911 VanDerWaalsContact O-CB 3.32Å; D1908-F1911 WeakPolarHBondContact O-CB 3.28Å; D1908-F1911 PolarHBondContact O-N 3.01Å; D1908-F1911 VanDerWaalsContact O-N 3.09Å; F1911-N1915 HydrophobicContact CD1-CB 4.15Å; F1911-N1915 HydrophobicContact CD2-CB 4.15Å; F1911-N1915 HydrophobicContact CE1-CB 3.7Å; F1911-N1915 HydrophobicContact CE2-CB 3.69Å; F1911-N1915 HydrophobicContact CG-CB 4.38Å; F1911-N1915 HydrophobicContact CZ-CB 3.45Å; F1911-N1915 VanDerWaalsContact CZ-CB 3.44Å; F1911-A1916 HydrophobicContact CE1-CB 3.98Å; F1911-V1919 HydrophobicContact CZ-CG2 4.27Å; F1911-V1932 HydrophobicContact CD1-CG1 4Å; F1911-V1932 HydrophobicContact CD1-CG2 3.98Å; F1911-L1963 HydrophobicContact CE2-CD2 4.46Å; F1911-V1986 HydrophobicContact CB-CG1 4.42Å; F1911-V1986 HydrophobicContact CB-CG2 3.85Å; F1911-V1986 HydrophobicContact CD1-CG1 3.68Å; F1911-V1986 HydrophobicContact CD1-CG2 4.49Å; F1911-V1986 HydrophobicContact CD2-CG1 4.42Å; F1911-V1986 HydrophobicContact CD2-CG2 4.41Å; F1911-V1986 HydrophobicContact CE1-CG1 3.98Å; F1911-V1986 HydrophobicContact CG-CG1 3.97Å; F1911-V1986 HydrophobicContact CG-CG2 4.06Å; F1911-V1986 HydrophobicContact CZ-CG1 4.49Å; F1911-L1988 HydrophobicContact CD1-CD2 4.43Å; F1911-L1988 HydrophobicContact CE1-CD1 4.45Å; F1911-L1988 HydrophobicContact CE1-CD2 3.96Å
1912	T	87.9	Confident	88.1	Confident	13.8 Å²	13.8	28.2 Å²	28.2	9%	0.085	12%	0.12	C	C	.	.			trans	-91.9	165.5	-172.7	67.7	0	0	0	0	113.1	Q1910 R1914 N1915 A1916 S2143 D2230	Q1910-T1912 WeakPolarHBondContact O-CG2 3.39Å; Q1910-T1912 PolarHBondContact O-N 3.02Å; Q1910-T1912 VanDerWaalsContact O-N 3.13Å; T1912-R1914 VanDerWaalsContact C-N 3.27Å; T1912-R1914 PolarHBondContact O-N 3.02Å; T1912-R1914 PolarHBondContact OG1-N 2.96Å; T1912-N1915 PolarHBondContact O-N 3.11Å; T1912-N1915 PolarHBondContact OG1-N 2.85Å; T1912-N1915 PolarHBondContact OG1-OD1 3.1Å; T1912-A1916 PolarHBondContact O-N 2.67Å; T1912-S2143 WeakPolarHBondContact CB-OG 3.39Å; T1912-S2143 WeakPolarHBondContact CG2-OG 3.43Å; T1912-S2143 PolarHBondContact OG1-OG 2.82Å; T1912-D2230 HydrophobicContact CG2-CB 4.29Å
1913	K	88.8	Confident	88.7	Confident	47.8 Å²	47.8	27.9 Å²	27.9	21%	0.208	12%	0.118	C	C	.	.	H	α-helix	trans	-57	-40.5	170.3	-172.9	-169.1	175.5	-142.9	0	111.5	N1915 A1916 E1917 V1930 S2039 D2230	K1913-N1915 VanDerWaalsContact C-N 3.33Å; K1913-N1915 PolarHBondContact O-N 3.05Å; K1913-A1916 CarbonylContact O-C 3.55Å; K1913-A1916 WeakPolarHBondContact O-CA 3.3Å; K1913-A1916 VanDerWaalsContact O-CB 3.27Å; K1913-A1916 WeakPolarHBondContact O-CB 3.31Å; K1913-A1916 PolarHBondContact O-N 3.09Å; K1913-E1917 VanDerWaalsContact CE-OE1 3.32Å; K1913-E1917 WeakPolarHBondContact CE-OE1 3.42Å; K1913-E1917 HydrophobicContact CG-CG 4.46Å; K1913-E1917 IonicContact NZ-OE1 2.94Å; K1913-E1917 PolarHBondContact NZ-OE1 3.11Å; K1913-E1917 WeakPolarHBondContact O-CG 3.38Å; K1913-E1917 PolarHBondContact O-N 2.87Å; K1913-V1930 WeakPolarHBondContact CE-O 3.44Å; K1913-S2039 PolarHBondContact NZ-OG 2.76Å; K1913-S2039 VanDerWaalsContact NZ-OG 3.12Å; K1913-D2230 WeakPolarHBondContact CB-OD1 3.34Å; K1913-D2230 PolarHBondContact N-OD1 2.94Å; K1913-D2230 VanDerWaalsContact N-OD1 3.09Å
1914	R	90.1	Very high	88.8	Confident	25.6 Å²	25.6	24.8 Å²	24.8	10%	0.097	13%	0.128	C	C	.	.	H	α-helix	trans	-61	-39.4	180	-64.2	-62.7	-168.3	-168.8	1.2	112.6	T1912 A1916 E1917 V1918 C1956 F1957 D2038 D2142 S2143	T1912-R1914 VanDerWaalsContact C-N 3.27Å; T1912-R1914 PolarHBondContact O-N 3.02Å; T1912-R1914 PolarHBondContact OG1-N 2.96Å; R1914-A1916 VanDerWaalsContact C-N 3.28Å; R1914-A1916 PolarHBondContact O-N 2.97Å; R1914-E1917 VanDerWaalsContact CD-OE2 3.29Å; R1914-E1917 WeakPolarHBondContact CD-OE2 3.23Å; R1914-E1917 IonicContact CZ-OE2 3.25Å; R1914-E1917 IonicContact NH1-OE1 3.53Å; R1914-E1917 IonicContact NH1-OE2 3.47Å; R1914-E1917 PolarHBondContact NH1-OE2 3.19Å; R1914-E1917 WeakPolarHBondContact O-CB 3.3Å; R1914-E1917 PolarHBondContact O-N 2.85Å; R1914-V1918 PolarHBondContact O-N 3.16Å; R1914-C1956 VanDerWaalsContact CB-O 3.29Å; R1914-C1956 WeakPolarHBondContact CB-O 3.36Å; R1914-F1957 WeakPolarHBondContact CD-O 3.29Å; R1914-D2038 IonicContact CZ-OD1 3.31Å; R1914-D2038 VanDerWaalsContact CZ-OD1 3.28Å; R1914-D2038 IonicContact CZ-OD2 3.51Å; R1914-D2038 IonicContact NH1-OD1 3.75Å; R1914-D2038 PolarHBondContact NH1-OD1 3.07Å; R1914-D2038 VanDerWaalsContact NH2-CG 3.31Å; R1914-D2038 IonicContact NH2-OD1 3.55Å; R1914-D2038 PolarHBondContact NH2-OD1 3.19Å; R1914-D2038 IonicContact NH2-OD2 2.78Å; R1914-D2038 PolarHBondContact NH2-OD2 3.28Å; R1914-D2142 IonicContact CZ-OD1 2.8Å; R1914-D2142 IonicContact NE-OD1 3.7Å; R1914-D2142 PolarHBondContact NE-OD1 2.97Å; R1914-D2142 VanDerWaalsContact NE-OD1 3.13Å; R1914-D2142 IonicContact NH2-OD1 2.77Å; R1914-D2142 IonicContact NH2-OD2 2.76Å; R1914-S2143 VanDerWaalsContact CB-OG 3.31Å; R1914-S2143 WeakPolarHBondContact CB-OG 3.09Å; R1914-S2143 WeakPolarHBondContact CG-OG 3.28Å
1915	N	91.8	Very high	88.9	Confident	1.8 Å²	1.8	27.3 Å²	27.3	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-61.1	-41.3	173.6	-67.5	-3.6	0	0	0	111.1	F1911 T1912 K1913 E1917 V1918 V1919 R1954 C1956 L1963	F1911-N1915 HydrophobicContact CD1-CB 4.15Å; F1911-N1915 HydrophobicContact CD2-CB 4.15Å; F1911-N1915 HydrophobicContact CE1-CB 3.7Å; F1911-N1915 HydrophobicContact CE2-CB 3.69Å; F1911-N1915 HydrophobicContact CG-CB 4.38Å; F1911-N1915 HydrophobicContact CZ-CB 3.45Å; F1911-N1915 VanDerWaalsContact CZ-CB 3.44Å; T1912-N1915 PolarHBondContact O-N 3.11Å; T1912-N1915 PolarHBondContact OG1-N 2.85Å; T1912-N1915 PolarHBondContact OG1-OD1 3.1Å; K1913-N1915 VanDerWaalsContact C-N 3.33Å; K1913-N1915 PolarHBondContact O-N 3.05Å; N1915-E1917 VanDerWaalsContact C-N 3.35Å; N1915-E1917 PolarHBondContact O-N 2.81Å; N1915-V1918 PolarHBondContact O-N 3.15Å; N1915-V1919 WeakPolarHBondContact O-CG2 3.34Å; N1915-V1919 PolarHBondContact O-N 2.99Å; N1915-V1919 VanDerWaalsContact O-N 3.1Å; N1915-R1954 PolarHBondContact ND2-O 3.06Å; N1915-C1956 WeakPolarHBondContact OD1-CB 3.36Å; N1915-C1956 PolarHBondContact OD1-N 3.01Å; N1915-C1956 PolarHBondContact OD1-SG 3.04Å; N1915-L1963 HydrophobicContact CB-CD1 4.37Å
1916	A	92.1	Very high	88.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67	-36.2	177	0	0	0	0	0	113.1	F1911 T1912 K1913 R1914 V1918 V1919 C1920 V1930 V1932 L1988	F1911-A1916 HydrophobicContact CE1-CB 3.98Å; T1912-A1916 PolarHBondContact O-N 2.67Å; K1913-A1916 CarbonylContact O-C 3.55Å; K1913-A1916 WeakPolarHBondContact O-CA 3.3Å; K1913-A1916 VanDerWaalsContact O-CB 3.27Å; K1913-A1916 WeakPolarHBondContact O-CB 3.31Å; K1913-A1916 PolarHBondContact O-N 3.09Å; R1914-A1916 VanDerWaalsContact C-N 3.28Å; R1914-A1916 PolarHBondContact O-N 2.97Å; A1916-V1918 VanDerWaalsContact C-N 3.26Å; A1916-V1918 PolarHBondContact O-N 3.23Å; A1916-V1919 PolarHBondContact O-N 3.21Å; A1916-C1920 WeakPolarHBondContact O-CB 3.3Å; A1916-C1920 PolarHBondContact O-N 3.13Å; A1916-C1920 PolarHBondContact O-SG 2.97Å; A1916-C1920 VanDerWaalsContact O-SG 3.35Å; A1916-V1930 HydrophobicContact CB-CG1 3.4Å; A1916-V1930 VanDerWaalsContact CB-CG1 3.45Å; A1916-V1932 HydrophobicContact CB-CB 4.33Å; A1916-V1932 HydrophobicContact CB-CG2 3.2Å; A1916-L1988 HydrophobicContact CB-CD1 3.79Å; A1916-L1988 HydrophobicContact CB-CD2 3.54Å; A1916-L1988 HydrophobicContact CB-CG 4.34Å
1917	E	90.9	Very high	88.3	Confident	6.6 Å²	6.6	31.4 Å²	31.4	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-57.8	-40.2	173.2	-64.2	-179.6	172.9	0	0	111	K1913 R1914 N1915 R1921 S1927 V1930	K1913-E1917 VanDerWaalsContact CE-OE1 3.32Å; K1913-E1917 WeakPolarHBondContact CE-OE1 3.42Å; K1913-E1917 HydrophobicContact CG-CG 4.46Å; K1913-E1917 IonicContact NZ-OE1 2.94Å; K1913-E1917 PolarHBondContact NZ-OE1 3.11Å; K1913-E1917 WeakPolarHBondContact O-CG 3.38Å; K1913-E1917 PolarHBondContact O-N 2.87Å; R1914-E1917 VanDerWaalsContact CD-OE2 3.29Å; R1914-E1917 WeakPolarHBondContact CD-OE2 3.23Å; R1914-E1917 IonicContact CZ-OE2 3.25Å; R1914-E1917 IonicContact NH1-OE1 3.53Å; R1914-E1917 IonicContact NH1-OE2 3.47Å; R1914-E1917 PolarHBondContact NH1-OE2 3.19Å; R1914-E1917 WeakPolarHBondContact O-CB 3.3Å; R1914-E1917 PolarHBondContact O-N 2.85Å; N1915-E1917 VanDerWaalsContact C-N 3.35Å; N1915-E1917 PolarHBondContact O-N 2.81Å; E1917-R1921 WeakPolarHBondContact O-CB 3.29Å; E1917-R1921 PolarHBondContact O-N 3.07Å; E1917-R1921 VanDerWaalsContact O-N 3.11Å; E1917-S1927 WeakPolarHBondContact CB-O 3.29Å; E1917-S1927 VanDerWaalsContact CG-O 3.28Å; E1917-S1927 WeakPolarHBondContact CG-O 3.3Å; E1917-S1927 VanDerWaalsContact O-CB 3.25Å; E1917-S1927 WeakPolarHBondContact O-CB 3.31Å; E1917-V1930 HydrophobicContact CG-CB 4.42Å; E1917-V1930 HydrophobicContact CG-CG2 4.21Å
1918	V	92.3	Very high	88	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-69	-44.6	176	178.7	0	0	0	0	111.8	R1914 N1915 A1916 C1920 R1921 E1922 C1956 E1960 R1962	R1914-V1918 PolarHBondContact O-N 3.16Å; N1915-V1918 PolarHBondContact O-N 3.15Å; A1916-V1918 VanDerWaalsContact C-N 3.26Å; A1916-V1918 PolarHBondContact O-N 3.23Å; V1918-C1920 VanDerWaalsContact C-N 3.35Å; V1918-C1920 PolarHBondContact O-N 2.93Å; V1918-R1921 WeakPolarHBondContact O-CB 3.26Å; V1918-R1921 PolarHBondContact O-N 3.23Å; V1918-R1921 VanDerWaalsContact O-N 3.13Å; V1918-E1922 WeakPolarHBondContact O-CB 3.32Å; V1918-E1922 PolarHBondContact O-N 3.02Å; V1918-C1956 HydrophobicContact CB-CB 4.49Å; V1918-C1956 HydrophobicContact CG2-CB 3.74Å; V1918-E1960 HydrophobicContact CG1-CB 4.07Å; V1918-E1960 HydrophobicContact CG2-CB 4.01Å; V1918-E1960 WeakPolarHBondContact CG2-OE2 3.43Å; V1918-R1962 WeakPolarHBondContact CG1-O 3.29Å
1919	V	93.1	Very high	88	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-44.6	177.4	174	0	0	0	0	111.4	T1880 L1893 F1911 N1915 A1916 R1921 E1922 H1923 L1963 L1988	T1880-V1919 HydrophobicContact CG2-CG2 4.44Å; L1893-V1919 HydrophobicContact CD1-CG1 3.87Å; L1893-V1919 HydrophobicContact CD1-CG2 4.44Å; L1893-V1919 HydrophobicContact CD2-CG2 4.13Å; F1911-V1919 HydrophobicContact CZ-CG2 4.27Å; N1915-V1919 WeakPolarHBondContact O-CG2 3.34Å; N1915-V1919 PolarHBondContact O-N 2.99Å; N1915-V1919 VanDerWaalsContact O-N 3.1Å; A1916-V1919 PolarHBondContact O-N 3.21Å; V1919-R1921 VanDerWaalsContact C-N 3.28Å; V1919-R1921 PolarHBondContact O-N 3.18Å; V1919-E1922 WeakPolarHBondContact O-CB 3.34Å; V1919-E1922 PolarHBondContact O-N 3.14Å; V1919-H1923 PolarHBondContact O-CD2 2.99Å; V1919-H1923 VanDerWaalsContact O-CD2 3.29Å; V1919-H1923 PolarHBondContact O-N 3.3Å; V1919-H1923 VanDerWaalsContact O-N 3.15Å; V1919-L1963 HydrophobicContact CG2-CB 4.24Å; V1919-L1963 HydrophobicContact CG2-CD1 4.36Å; V1919-L1963 HydrophobicContact CG2-CD2 3.91Å; V1919-L1963 HydrophobicContact CG2-CG 4.41Å; V1919-L1988 HydrophobicContact CB-CD1 4.03Å; V1919-L1988 HydrophobicContact CB-CD2 4.24Å; V1919-L1988 HydrophobicContact CG1-CD1 3.77Å; V1919-L1988 HydrophobicContact CG1-CD2 3.7Å; V1919-L1988 HydrophobicContact CG2-CD1 4.38Å
1920	C	92.7	Very high	88.3	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-39.8	175.6	-69.1	0	0	0	0	111.7	A1916 V1918 H1923 G1924 F1925 V1930 C1990	A1916-C1920 WeakPolarHBondContact O-CB 3.3Å; A1916-C1920 PolarHBondContact O-N 3.13Å; A1916-C1920 PolarHBondContact O-SG 2.97Å; A1916-C1920 VanDerWaalsContact O-SG 3.35Å; V1918-C1920 VanDerWaalsContact C-N 3.35Å; V1918-C1920 PolarHBondContact O-N 2.93Å; C1920-H1923 PolarHBondContact O-N 3.08Å; C1920-G1924 PolarHBondContact O-N 3.01Å; C1920-F1925 HydrophobicContact CB-CB 4.39Å; C1920-F1925 WeakPolarHBondContact O-CA 3.37Å; C1920-F1925 WeakPolarHBondContact O-CB 3.3Å; C1920-F1925 PolarHBondContact O-N 3.12Å; C1920-V1930 HydrophobicContact CB-CG2 4.27Å; C1920-C1990 WeakPolarHBondContact CA-SG 3.17Å; C1920-C1990 HydrophobicContact CB-CB 3.88Å; C1920-C1990 WeakPolarHBondContact CB-SG 3.37Å; C1920-C1990 VanDerWaalsContact SG-CA 3.55Å; C1920-C1990 WeakPolarHBondContact SG-CB 3.29Å; C1920-C1990 CovalentContact SG-SG 2.04Å; C1920-C1990 PolarHBondContact SG-SG 3.02Å
1921	R	89.7	Confident	88.5	Confident	72.6 Å²	72.6	30.7 Å²	30.7	27%	0.274	16%	0.156	S	C	.	.	H	α-helix	trans	-67	-40.2	176.7	-171.8	179.1	-61.6	141.6	6.8	112.6	E1917 V1918 V1919 H1923 G1924 S1927 G1958 N1959 E1960	E1917-R1921 WeakPolarHBondContact O-CB 3.29Å; E1917-R1921 PolarHBondContact O-N 3.07Å; E1917-R1921 VanDerWaalsContact O-N 3.11Å; V1918-R1921 WeakPolarHBondContact O-CB 3.26Å; V1918-R1921 PolarHBondContact O-N 3.23Å; V1918-R1921 VanDerWaalsContact O-N 3.13Å; V1919-R1921 VanDerWaalsContact C-N 3.28Å; V1919-R1921 PolarHBondContact O-N 3.18Å; R1921-H1923 VanDerWaalsContact C-N 3.28Å; R1921-H1923 PolarHBondContact O-N 2.99Å; R1921-G1924 PolarHBondContact O-N 3.22Å; R1921-S1927 PolarHBondContact NH2-OG 3.14Å; R1921-S1927 VanDerWaalsContact NH2-OG 3.09Å; R1921-G1958 VanDerWaalsContact CZ-O 3.29Å; R1921-G1958 PolarHBondContact NH1-O 3.11Å; R1921-G1958 PolarHBondContact NH2-O 3.11Å; R1921-N1959 VanDerWaalsContact NH1-CA 3.29Å; R1921-N1959 PolarHBondContact NH1-O 3.11Å; R1921-E1960 WeakPolarHBondContact CD-O 3.24Å; R1921-E1960 PolarHBondContact NH1-O 3.08Å
1922	E	91.1	Very high	88.7	Confident	48.4 Å²	48.4	31.7 Å²	31.7	23%	0.226	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-40.8	176.6	-179.7	170.9	160	0	0	111.3	T1880 V1918 V1919 G1924 K1961 R1962 L1963	T1880-E1922 PolarHBondContact N-OE1 3.24Å; T1880-E1922 PolarHBondContact OG1-OE1 3.08Å; V1918-E1922 WeakPolarHBondContact O-CB 3.32Å; V1918-E1922 PolarHBondContact O-N 3.02Å; V1919-E1922 WeakPolarHBondContact O-CB 3.34Å; V1919-E1922 PolarHBondContact O-N 3.14Å; E1922-G1924 VanDerWaalsContact C-N 3.25Å; E1922-G1924 PolarHBondContact O-N 3.14Å; E1922-K1961 WeakPolarHBondContact CA-O 3.36Å; E1922-R1962 HydrophobicContact CG-CB 4.4Å; E1922-R1962 HydrophobicContact CG-CG 4.09Å; E1922-R1962 VanDerWaalsContact OE2-CA 3.26Å; E1922-R1962 WeakPolarHBondContact OE2-CA 3.37Å; E1922-R1962 VanDerWaalsContact OE2-CB 3.32Å; E1922-R1962 WeakPolarHBondContact OE2-CB 3.34Å; E1922-L1963 PolarHBondContact OE2-N 3.18Å
1923	H	90.3	Very high	88.6	Confident	65.6 Å²	65.6	34.9 Å²	34.9	30%	0.304	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	2.6	175.3	-74.5	-71.1	0	0	0	114.7	T1880 V1919 C1920 R1921 F1925	T1880-H1923 PolarHBondContact O-CE1 2.99Å; T1880-H1923 PolarHBondContact O-NE2 3.2Å; T1880-H1923 PolarHBondContact OG1-NE2 3Å; V1919-H1923 PolarHBondContact O-CD2 2.99Å; V1919-H1923 VanDerWaalsContact O-CD2 3.29Å; V1919-H1923 PolarHBondContact O-N 3.3Å; V1919-H1923 VanDerWaalsContact O-N 3.15Å; C1920-H1923 PolarHBondContact O-N 3.08Å; R1921-H1923 VanDerWaalsContact C-N 3.28Å; R1921-H1923 PolarHBondContact O-N 2.99Å; H1923-F1925 VanDerWaalsContact C-N 3.3Å; H1923-F1925 HydrophobicContact CB-CD2 3.58Å; H1923-F1925 HydrophobicContact CB-CE2 3.63Å; H1923-F1925 HydrophobicContact CB-CG 4.48Å; H1923-F1925 HydrophobicContact CB-CZ 4.45Å; H1923-F1925 PolarHBondContact O-N 3.09Å
1924	G	85.8	Confident	88.6	Confident	67.8 Å²	67.8	35.1 Å²	35.1	70%	0.699	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	14.4	-178.9	0	0	0	0	0	114.5	C1920 R1921 E1922	C1920-G1924 PolarHBondContact O-N 3.01Å; R1921-G1924 PolarHBondContact O-N 3.22Å; E1922-G1924 VanDerWaalsContact C-N 3.25Å; E1922-G1924 PolarHBondContact O-N 3.14Å
1925	F	88.2	Confident	88.3	Confident	55.4 Å²	55.4	34.2 Å²	34.2	24%	0.243	18%	0.176	C	C	.	.	S	Bend	trans	-89.4	162.3	173.4	-55.9	-52.7	0	0	0	111.7	L1882 A1888 R1889 C1920 H1923 S1927 C1990	L1882-F1925 HydrophobicContact CD1-CE2 4.5Å; A1888-F1925 HydrophobicContact CB-CZ 4.44Å; A1888-F1925 VanDerWaalsContact O-CE2 3.3Å; A1888-F1925 WeakPolarHBondContact O-CE2 3.31Å; A1888-F1925 WeakPolarHBondContact O-CZ 3.39Å; R1889-F1925 HydrophobicContact CB-CE2 4.38Å; R1889-F1925 HydrophobicContact CB-CZ 4.46Å; R1889-F1925 HydrophobicContact CG-CD1 3.79Å; R1889-F1925 HydrophobicContact CG-CD2 4.23Å; R1889-F1925 HydrophobicContact CG-CE1 3.51Å; R1889-F1925 HydrophobicContact CG-CE2 3.97Å; R1889-F1925 HydrophobicContact CG-CG 4.15Å; R1889-F1925 HydrophobicContact CG-CZ 3.61Å; C1920-F1925 HydrophobicContact CB-CB 4.39Å; C1920-F1925 WeakPolarHBondContact O-CA 3.37Å; C1920-F1925 WeakPolarHBondContact O-CB 3.3Å; C1920-F1925 PolarHBondContact O-N 3.12Å; H1923-F1925 VanDerWaalsContact C-N 3.3Å; H1923-F1925 HydrophobicContact CB-CD2 3.58Å; H1923-F1925 HydrophobicContact CB-CE2 3.63Å; H1923-F1925 HydrophobicContact CB-CG 4.48Å; H1923-F1925 HydrophobicContact CB-CZ 4.45Å; H1923-F1925 PolarHBondContact O-N 3.09Å; F1925-S1927 PolarHBondContact O-N 3.19Å; F1925-C1990 HydrophobicContact CB-CB 3.86Å; F1925-C1990 HydrophobicContact CD2-CB 3.99Å; F1925-C1990 HydrophobicContact CG-CB 4.15Å
1926	Q	82.2	Confident	87.9	Confident	92.8 Å²	92.8	36.3 Å²	36.3	43%	0.434	19%	0.189	S	C	.	.			trans	-67.9	132.4	175.2	-70.3	171.7	-29	0	0	110.3	K1928 A1993	Q1926-K1928 PolarHBondContact O-N 2.76Å; Q1926-A1993 HydrophobicContact CB-CB 4.33Å; Q1926-A1993 PolarHBondContact NE2-O 2.92Å; Q1926-A1993 VanDerWaalsContact OE1-CB 3.29Å
1927	S	82.7	Confident	87.4	Confident	15.8 Å²	15.8	37.2 Å²	37.2	11%	0.11	19%	0.193	C	C	.	.	S	Bend	trans	-95.9	11	-172.1	70.9	0	0	0	0	114.5	E1917 R1921 F1925 V1930	E1917-S1927 WeakPolarHBondContact CB-O 3.29Å; E1917-S1927 VanDerWaalsContact CG-O 3.28Å; E1917-S1927 WeakPolarHBondContact CG-O 3.3Å; E1917-S1927 VanDerWaalsContact O-CB 3.25Å; E1917-S1927 WeakPolarHBondContact O-CB 3.31Å; R1921-S1927 PolarHBondContact NH2-OG 3.14Å; R1921-S1927 VanDerWaalsContact NH2-OG 3.09Å; F1925-S1927 PolarHBondContact O-N 3.19Å; S1927-V1930 WeakPolarHBondContact O-CG2 3.23Å
1928	K	80.9	Confident	86.6	Confident	50.8 Å²	50.8	44.8 Å²	44.8	22%	0.221	22%	0.221	C	C	.	.	S	Bend	trans	-98.8	-42.8	-174	-63.1	-73.4	-178.6	-176.3	0	113.1	Q1926 V1930 A1993 L2034 N2037	Q1926-K1928 PolarHBondContact O-N 2.76Å; K1928-V1930 PolarHBondContact O-N 3.12Å; K1928-A1993 HydrophobicContact CB-CB 4.46Å; K1928-L2034 HydrophobicContact CD-CD1 4.23Å; K1928-L2034 HydrophobicContact CG-CD1 4.33Å; K1928-N2037 WeakPolarHBondContact CE-O 3.28Å; K1928-N2037 WeakPolarHBondContact CE-OD1 3.05Å; K1928-N2037 PolarHBondContact NZ-O 2.93Å; K1928-N2037 PolarHBondContact NZ-OD1 2.91Å
1929	N	85.5	Confident	85.7	Confident	7.8 Å²	7.8	51 Å²	51	4%	0.042	25%	0.254	C	S	.	.	S	Bend	trans	-92.2	80.5	173.2	-170.6	11.6	0	0	0	110.2	Y1931 G1991 R1992 L2085 D2265 R2266	N1929-Y1931 VanDerWaalsContact OD1-CE2 3.27Å; N1929-Y1931 WeakPolarHBondContact OD1-CE2 3.38Å; N1929-G1991 VanDerWaalsContact O-CA 3.3Å; N1929-G1991 WeakPolarHBondContact O-CA 3.33Å; N1929-G1991 PolarHBondContact O-N 3Å; N1929-R1992 PolarHBondContact ND2-O 3.17Å; N1929-R1992 VanDerWaalsContact ND2-O 3.1Å; N1929-L2085 HydrophobicContact CB-CD1 4.01Å; N1929-D2265 PolarHBondContact ND2-OD2 3.22Å; N1929-D2265 VanDerWaalsContact ND2-OD2 3.1Å; N1929-R2266 PolarHBondContact OD1-NH1 3.11Å; N1929-R2266 PolarHBondContact OD1-NH2 3.05Å
1930	V	88.4	Confident	84.7	Confident	3.4 Å²	3.4	52.2 Å²	52.2	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.4	-178.4	-174	0	0	0	0	110.2	K1913 A1916 E1917 C1920 S1927 K1928 V1932 L1988 H1989 R2266	K1913-V1930 WeakPolarHBondContact CE-O 3.44Å; A1916-V1930 HydrophobicContact CB-CG1 3.4Å; A1916-V1930 VanDerWaalsContact CB-CG1 3.45Å; E1917-V1930 HydrophobicContact CG-CB 4.42Å; E1917-V1930 HydrophobicContact CG-CG2 4.21Å; C1920-V1930 HydrophobicContact CB-CG2 4.27Å; S1927-V1930 WeakPolarHBondContact O-CG2 3.23Å; K1928-V1930 PolarHBondContact O-N 3.12Å; V1930-V1932 HydrophobicContact CG1-CG2 4.37Å; V1930-L1988 HydrophobicContact CG1-CD1 4.1Å; V1930-H1989 WeakPolarHBondContact CA-O 3.47Å; V1930-R2266 PolarHBondContact O-NH2 3.26Å
1931	Y	87.7	Confident	83.8	Confident	53.2 Å²	53.2	54.7 Å²	54.7	21%	0.209	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.2	173.3	-165.7	-87.7	0	0	0	109.7	N1929 R1933 H1989 L2295 T2300 T2301	N1929-Y1931 VanDerWaalsContact OD1-CE2 3.27Å; N1929-Y1931 WeakPolarHBondContact OD1-CE2 3.38Å; Y1931-R1933 HydrophobicContact CD1-CB 4.48Å; Y1931-R1933 HydrophobicContact CE1-CB 3.61Å; Y1931-R1933 WeakPolarHBondContact OH-CD 3.33Å; Y1931-H1989 PolarHBondContact N-O 3.18Å; Y1931-H1989 PolarHBondContact O-N 3.12Å; Y1931-L2295 HydrophobicContact CD1-CD1 3.44Å; Y1931-L2295 HydrophobicContact CE1-CD1 3.69Å; Y1931-L2295 HydrophobicContact CG-CD1 4.11Å; Y1931-T2300 VanDerWaalsContact CZ-O 3.3Å; Y1931-T2300 PolarHBondContact OH-O 3Å; Y1931-T2301 HydrophobicContact CD2-CG2 4.48Å
1932	V	89.6	Confident	82.8	Confident	37 Å²	37	52.2 Å²	52.2	22%	0.224	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.1	177.6	168.2	0	0	0	0	107.7	F1911 A1916 V1930 V1986 F1987 L1988	F1911-V1932 HydrophobicContact CD1-CG1 4Å; F1911-V1932 HydrophobicContact CD1-CG2 3.98Å; A1916-V1932 HydrophobicContact CB-CB 4.33Å; A1916-V1932 HydrophobicContact CB-CG2 3.2Å; V1930-V1932 HydrophobicContact CG1-CG2 4.37Å; V1932-V1986 HydrophobicContact CG1-CG1 4.37Å; V1932-V1986 HydrophobicContact CG2-CG1 4.1Å; V1932-F1987 WeakPolarHBondContact CA-O 3.25Å; V1932-L1988 HydrophobicContact CB-CD2 4.07Å; V1932-L1988 HydrophobicContact CG1-CD2 3.99Å; V1932-L1988 HydrophobicContact CG2-CD1 4.25Å; V1932-L1988 HydrophobicContact CG2-CD2 3.69Å
1933	R	87.7	Confident	81.8	Confident	81 Å²	81	57.5 Å²	57.5	31%	0.306	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	134.5	168.9	-176.3	163.3	163.8	-167.8	-5.1	109.3	Y1931 F1987 N2298 F2299	Y1931-R1933 HydrophobicContact CD1-CB 4.48Å; Y1931-R1933 HydrophobicContact CE1-CB 3.61Å; Y1931-R1933 WeakPolarHBondContact OH-CD 3.33Å; R1933-F1987 PolarHBondContact N-O 3.21Å; R1933-F1987 WeakPolarHBondContact O-CA 3.17Å; R1933-F1987 WeakPolarHBondContact O-CB 3.4Å; R1933-F1987 PolarHBondContact O-N 3.09Å; R1933-N2298 PolarHBondContact NH1-O 2.91Å; R1933-N2298 VanDerWaalsContact NH1-O 3.13Å; R1933-N2298 PolarHBondContact NH2-O 3.24Å; R1933-N2298 VanDerWaalsContact NH2-O 3.14Å; R1933-F2299 HydrophobicContact CB-CD1 3.95Å; R1933-F2299 HydrophobicContact CB-CE1 4.2Å; R1933-F2299 VanDerWaalsContact CD-CD1 3.44Å; R1933-F2299 HydrophobicContact CG-CD1 3.72Å; R1933-F2299 HydrophobicContact CG-CE1 3.8Å
1934	I	87.4	Confident	80.7	Confident	51.8 Å²	51.8	60.7 Å²	60.7	27%	0.266	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.7	172.7	-61.1	160.9	0	0	0	106.7	D1908 R1909 H1984 F1985 V1986	D1908-I1934 WeakPolarHBondContact O-CD1 3.25Å; R1909-I1934 VanDerWaalsContact C-CD1 3.49Å; R1909-I1934 VanDerWaalsContact O-CD1 3.25Å; R1909-I1934 WeakPolarHBondContact O-CD1 3.39Å; I1934-H1984 HydrophobicContact CG2-CB 4.02Å; I1934-F1985 WeakPolarHBondContact CA-O 3.27Å; I1934-V1986 HydrophobicContact CG1-CG2 4.39Å
1935	G	84.9	Confident	79.9	Confident	7.2 Å²	7.2	62.4 Å²	62.4	7%	0.074	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	178.4	-177.2	0	0	0	0	0	113.9	E1983 F1985	G1935-E1983 CarbonylContact C-O 3.46Å; G1935-E1983 VanDerWaalsContact CA-O 3.23Å; G1935-E1983 WeakPolarHBondContact CA-O 3.35Å; G1935-E1983 CarbonylContact O-C 3.54Å; G1935-E1983 VanDerWaalsContact O-O 3.11Å; G1935-F1985 PolarHBondContact N-O 3.06Å; G1935-F1985 WeakPolarHBondContact O-CA 3.39Å; G1935-F1985 WeakPolarHBondContact O-CB 3.32Å; G1935-F1985 PolarHBondContact O-N 3.06Å
1936	P	82.1	Confident	78.7	Confident	44.8 Å²	44.8	66.9 Å²	66.9	29%	0.291	32%	0.324	S	S	.	.			trans	-72.1	148.8	-170.8	25.5	-34	0	0	0	113.8	W1938 A1982 E1983	P1936-W1938 HydrophobicContact CB-CD2 4.19Å; P1936-W1938 HydrophobicContact CB-CE3 3.7Å; P1936-W1938 HydrophobicContact CB-CH2 3.57Å; P1936-W1938 HydrophobicContact CB-CZ2 3.68Å; P1936-W1938 VanDerWaalsContact CB-CZ2 3.43Å; P1936-W1938 HydrophobicContact CB-CZ3 3.74Å; P1936-W1938 HydrophobicContact CG-CE3 4.28Å; P1936-W1938 HydrophobicContact CG-CH2 3.52Å; P1936-W1938 VanDerWaalsContact CG-CH2 3.46Å; P1936-W1938 HydrophobicContact CG-CZ2 3.54Å; P1936-W1938 VanDerWaalsContact CG-CZ2 3.41Å; P1936-W1938 HydrophobicContact CG-CZ3 4Å; P1936-A1982 CarbonylContact C-O 3.57Å; P1936-A1982 VanDerWaalsContact CA-O 3.26Å; P1936-A1982 WeakPolarHBondContact CA-O 3.34Å; P1936-A1982 WeakPolarHBondContact CB-O 3.48Å; P1936-E1983 VanDerWaalsContact N-O 3.13Å
1937	R	81.9	Confident	78	Confident	19 Å²	19	63.7 Å²	63.7	7%	0.072	31%	0.31	C	S	.	.			trans	-127.1	95.7	170	-173.3	-179	179.3	-169	-0.4	109.1	D1884 F1892 E1894 N1939 N1940 A1982 F1985	D1884-R1937 IonicContact OD2-CZ 3.11Å; D1884-R1937 VanDerWaalsContact OD2-CZ 3.26Å; D1884-R1937 IonicContact OD2-NE 3.36Å; D1884-R1937 PolarHBondContact OD2-NE 2.97Å; D1884-R1937 IonicContact OD2-NH2 3.41Å; D1884-R1937 PolarHBondContact OD2-NH2 2.94Å; F1892-R1937 HydrophobicContact CD1-CB 4.37Å; F1892-R1937 HydrophobicContact CD1-CG 4.49Å; F1892-R1937 HydrophobicContact CD2-CG 4.21Å; F1892-R1937 HydrophobicContact CE1-CB 3.96Å; F1892-R1937 HydrophobicContact CE1-CG 4.33Å; F1892-R1937 HydrophobicContact CE2-CB 4.38Å; F1892-R1937 HydrophobicContact CE2-CG 4.01Å; F1892-R1937 HydrophobicContact CG-CG 4.41Å; F1892-R1937 HydrophobicContact CZ-CB 3.98Å; F1892-R1937 HydrophobicContact CZ-CG 4.09Å; E1894-R1937 IonicContact OE1-CZ 3.28Å; E1894-R1937 IonicContact OE1-NH1 2.96Å; E1894-R1937 PolarHBondContact OE1-NH1 2.99Å; E1894-R1937 IonicContact OE1-NH2 3.03Å; E1894-R1937 PolarHBondContact OE1-NH2 3.06Å; E1894-R1937 VanDerWaalsContact OE1-NH2 3.12Å; R1937-N1939 VanDerWaalsContact C-N 3.25Å; R1937-N1939 PolarHBondContact O-N 2.93Å; R1937-N1939 VanDerWaalsContact O-N 3.13Å; R1937-N1940 HydrophobicContact CG-CB 4.25Å; R1937-N1940 VanDerWaalsContact CZ-ND2 3.34Å; R1937-N1940 PolarHBondContact NH1-ND2 2.92Å; R1937-N1940 PolarHBondContact O-N 3.18Å; R1937-N1940 VanDerWaalsContact O-N 3.14Å; R1937-A1982 PolarHBondContact N-O 3Å; R1937-A1982 VanDerWaalsContact N-O 3.09Å; R1937-F1985 HydrophobicContact CB-CB 4.23Å; R1937-F1985 HydrophobicContact CB-CD1 4.37Å; R1937-F1985 HydrophobicContact CB-CD2 3.35Å; R1937-F1985 HydrophobicContact CB-CE2 3.65Å; R1937-F1985 HydrophobicContact CB-CG 3.77Å; R1937-F1985 HydrophobicContact CB-CZ 4.38Å
1938	W	74.1	Confident	77.1	Confident	166.4 Å²	166.4	70 Å²	70	63%	0.63	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.8	-174.2	-71.2	-128.4	0	0	0	114.9	P1936 N1940 A1982 E1983 E2297 F2888	P1936-W1938 HydrophobicContact CB-CD2 4.19Å; P1936-W1938 HydrophobicContact CB-CE3 3.7Å; P1936-W1938 HydrophobicContact CB-CH2 3.57Å; P1936-W1938 HydrophobicContact CB-CZ2 3.68Å; P1936-W1938 VanDerWaalsContact CB-CZ2 3.43Å; P1936-W1938 HydrophobicContact CB-CZ3 3.74Å; P1936-W1938 HydrophobicContact CG-CE3 4.28Å; P1936-W1938 HydrophobicContact CG-CH2 3.52Å; P1936-W1938 VanDerWaalsContact CG-CH2 3.46Å; P1936-W1938 HydrophobicContact CG-CZ2 3.54Å; P1936-W1938 VanDerWaalsContact CG-CZ2 3.41Å; P1936-W1938 HydrophobicContact CG-CZ3 4Å; W1938-N1940 VanDerWaalsContact C-N 3.29Å; W1938-N1940 PolarHBondContact O-N 3.01Å; W1938-A1982 HydrophobicContact CE3-CB 4.29Å; W1938-A1982 HydrophobicContact CZ3-CB 4.22Å; W1938-A1982 WeakPolarHBondContact CZ3-O 3.15Å; W1938-E1983 HydrophobicContact CH2-CG 4.25Å; W1938-E1983 HydrophobicContact CZ3-CG 4.23Å; W1938-E2297 WeakPolarHBondContact CZ3-OE2 3.24Å; W1938-F2888 HydrophobicContact CH2-CZ 4.33Å
1939	N	74.5	Confident	76.5	Confident	129.6 Å²	129.6	69.2 Å²	69.2	69%	0.693	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-16.5	177.8	-67.3	-11.9	0	0	0	113.5	R1937	R1937-N1939 VanDerWaalsContact C-N 3.25Å; R1937-N1939 PolarHBondContact O-N 2.93Å; R1937-N1939 VanDerWaalsContact O-N 3.13Å
1940	N	72	Confident	75.9	Confident	25.6 Å²	25.6	71.8 Å²	71.8	14%	0.137	35%	0.346	C	S	.	.			trans	-117.2	80.6	-174.7	-134.5	19.8	0	0	0	111	R1937 W1938 P1942 H1945 F1985	R1937-N1940 HydrophobicContact CG-CB 4.25Å; R1937-N1940 VanDerWaalsContact CZ-ND2 3.34Å; R1937-N1940 PolarHBondContact NH1-ND2 2.92Å; R1937-N1940 PolarHBondContact O-N 3.18Å; R1937-N1940 VanDerWaalsContact O-N 3.14Å; W1938-N1940 VanDerWaalsContact C-N 3.29Å; W1938-N1940 PolarHBondContact O-N 3.01Å; N1940-P1942 WeakPolarHBondContact O-CD 3.29Å; N1940-H1945 PolarHBondContact OD1-CD2 2.81Å; N1940-F1985 HydrophobicContact CB-CE1 4.31Å; N1940-F1985 HydrophobicContact CB-CE2 4.4Å; N1940-F1985 HydrophobicContact CB-CZ 3.98Å; N1940-F1985 VanDerWaalsContact ND2-CE1 3.27Å; N1940-F1985 WeakPolarHBondContact ND2-CE1 3.42Å; N1940-F1985 WeakPolarHBondContact ND2-CZ 3.27Å; N1940-F1985 WeakPolarHBondContact O-CZ 3.42Å
1941	D	72.6	Confident	75.3	Confident	51.8 Å²	51.8	73 Å²	73	28%	0.277	35%	0.354	S	S	.	.			trans	-81.3	117.1	171.9	-172.9	-13.9	0	0	0	109.8	K1943 L1944 H1945 S2882	D1941-K1943 PolarHBondContact O-N 3.12Å; D1941-K1943 VanDerWaalsContact O-N 3.09Å; D1941-K1943 VanDerWaalsContact OD1-CB 3.31Å; D1941-K1943 WeakPolarHBondContact OD1-CB 3.34Å; D1941-K1943 VanDerWaalsContact OD1-CG 3.29Å; D1941-K1943 WeakPolarHBondContact OD1-CG 3.46Å; D1941-K1943 PolarHBondContact OD1-N 3.1Å; D1941-K1943 IonicContact OD1-NZ 3.45Å; D1941-K1943 PolarHBondContact OD1-NZ 2.81Å; D1941-K1943 IonicContact OD2-NZ 2.67Å; D1941-K1943 PolarHBondContact OD2-NZ 2.96Å; D1941-L1944 HydrophobicContact CB-CB 4.42Å; D1941-L1944 HydrophobicContact CB-CD1 4.1Å; D1941-L1944 HydrophobicContact CB-CG 4.18Å; D1941-L1944 WeakPolarHBondContact O-CB 3.49Å; D1941-L1944 PolarHBondContact O-N 3.08Å; D1941-H1945 PolarHBondContact O-N 3.14Å; D1941-S2882 PolarHBondContact OD2-OG 3.23Å
1942	P	69.5	Low	74.8	Confident	21.2 Å²	21.2	73.6 Å²	73.6	14%	0.138	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-15	178.5	25.3	-34.1	0	0	0	113.6	N1940 L1944 C1979 V1980	N1940-P1942 WeakPolarHBondContact O-CD 3.29Å; P1942-L1944 VanDerWaalsContact C-N 3.32Å; P1942-C1979 WeakPolarHBondContact CB-O 3.37Å; P1942-V1980 WeakPolarHBondContact CG-O 3.36Å
1943	K	68.7	Low	74.5	Confident	160 Å²	160	72.4 Å²	72.4	70%	0.696	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-26	171.9	-63.4	177.9	-172.1	160.5	0	113	D1941	D1941-K1943 PolarHBondContact O-N 3.12Å; D1941-K1943 VanDerWaalsContact O-N 3.09Å; D1941-K1943 VanDerWaalsContact OD1-CB 3.31Å; D1941-K1943 WeakPolarHBondContact OD1-CB 3.34Å; D1941-K1943 VanDerWaalsContact OD1-CG 3.29Å; D1941-K1943 WeakPolarHBondContact OD1-CG 3.46Å; D1941-K1943 PolarHBondContact OD1-N 3.1Å; D1941-K1943 IonicContact OD1-NZ 3.45Å; D1941-K1943 PolarHBondContact OD1-NZ 2.81Å; D1941-K1943 IonicContact OD2-NZ 2.67Å; D1941-K1943 PolarHBondContact OD2-NZ 2.96Å
1944	L	68.3	Low	74.4	Confident	132.4 Å²	132.4	69.3 Å²	69.3	69%	0.693	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-36.6	180	-61.3	176.2	0	0	0	111.7	D1941 P1942 E2881	D1941-L1944 HydrophobicContact CB-CB 4.42Å; D1941-L1944 HydrophobicContact CB-CD1 4.1Å; D1941-L1944 HydrophobicContact CB-CG 4.18Å; D1941-L1944 WeakPolarHBondContact O-CB 3.49Å; D1941-L1944 PolarHBondContact O-N 3.08Å; P1942-L1944 VanDerWaalsContact C-N 3.32Å; L1944-E2881 HydrophobicContact CD2-CB 3.6Å; L1944-E2881 HydrophobicContact CD2-CG 4.01Å; L1944-E2881 WeakPolarHBondContact CD2-OE1 3.45Å; L1944-E2881 VanDerWaalsContact CD2-OE2 3.32Å; L1944-E2881 WeakPolarHBondContact CD2-OE2 3.39Å
1945	H	67.8	Low	74.3	Confident	104.2 Å²	104.2	68.5 Å²	68.5	48%	0.482	34%	0.336	S	S	.	.	S	Bend	trans	-110.2	94	-179.7	-131.3	-33.3	0	0	0	111.4	N1940 D1941 V1947	N1940-H1945 PolarHBondContact OD1-CD2 2.81Å; D1941-H1945 PolarHBondContact O-N 3.14Å; H1945-V1947 VanDerWaalsContact C-N 3.29Å; H1945-V1947 PolarHBondContact O-N 3Å; H1945-V1947 VanDerWaalsContact O-N 3.11Å
1946	L	65.1	Low	74.5	Confident	149 Å²	149	68.2 Å²	68.2	78%	0.78	33%	0.332	S	S	*	.			trans	-73.5	89	-178.9	-89.4	143.3	0	0	0	111.9	K1948	L1946-K1948 PolarHBondContact O-N 2.85Å
1947	V	66.2	Low	74.7	Confident	25.4 Å²	25.4	70.2 Å²	70.2	15%	0.154	34%	0.336	C	S	.	.			trans	-78.7	118.5	174.8	-179.8	0	0	0	0	109.9	T1900 E1902 V1904 P1905 H1945 S1949 Y1950	T1900-V1947 HydrophobicContact CG2-CG1 4.15Å; T1900-V1947 HydrophobicContact CG2-CG2 3.87Å; E1902-V1947 WeakPolarHBondContact OE2-CG2 3.05Å; V1904-V1947 HydrophobicContact CB-CG1 4.41Å; V1904-V1947 HydrophobicContact CG1-CG1 3.97Å; V1904-V1947 HydrophobicContact CG2-CG1 3.89Å; P1905-V1947 HydrophobicContact CG-CG2 4.3Å; H1945-V1947 VanDerWaalsContact C-N 3.29Å; H1945-V1947 PolarHBondContact O-N 3Å; H1945-V1947 VanDerWaalsContact O-N 3.11Å; V1947-S1949 VanDerWaalsContact CG1-O 3.26Å; V1947-S1949 WeakPolarHBondContact CG1-O 3.34Å; V1947-S1949 PolarHBondContact O-N 2.84Å; V1947-Y1950 HydrophobicContact CB-CE1 4.06Å; V1947-Y1950 HydrophobicContact CB-CE2 4.21Å; V1947-Y1950 HydrophobicContact CG1-CD1 4.36Å; V1947-Y1950 HydrophobicContact CG1-CE1 4.19Å; V1947-Y1950 HydrophobicContact CG1-CE2 4.42Å; V1947-Y1950 HydrophobicContact CG2-CE1 4.41Å
1948	K	64.2	Low	74.7	Confident	148 Å²	148	69.3 Å²	69.3	64%	0.643	33%	0.333	S	S	*	.	S	Bend	trans	-77	-27.2	-176.2	-67.1	178.3	-177.3	164.5	0	114.4	T1900 E1902 L1946 C1979	T1900-K1948 HydrophobicContact CG2-CB 4.43Å; E1902-K1948 IonicContact OE1-NZ 3.7Å; E1902-K1948 PolarHBondContact OE1-NZ 2.77Å; L1946-K1948 PolarHBondContact O-N 2.85Å; K1948-C1979 PolarHBondContact O-N 3.29Å
1949	S	68.1	Low	75	Confident	34 Å²	34	67.1 Å²	67.1	24%	0.238	33%	0.334	C	S	.	.			trans	-152.9	134.4	-179.7	53.7	0	0	0	0	111.1	N1897 T1900 V1904 V1947 K1978	N1897-S1949 WeakPolarHBondContact ND2-CB 3.34Å; N1897-S1949 PolarHBondContact ND2-OG 3.15Å; T1900-S1949 VanDerWaalsContact CG2-OG 3.27Å; T1900-S1949 WeakPolarHBondContact CG2-OG 3.21Å; V1904-S1949 WeakPolarHBondContact CG1-O 3.09Å; V1904-S1949 WeakPolarHBondContact CG2-O 3.43Å; V1904-S1949 WeakPolarHBondContact CG2-OG 3.44Å; V1947-S1949 VanDerWaalsContact CG1-O 3.26Å; V1947-S1949 WeakPolarHBondContact CG1-O 3.34Å; V1947-S1949 PolarHBondContact O-N 2.84Å; S1949-K1978 VanDerWaalsContact OG-CB 3.27Å; S1949-K1978 WeakPolarHBondContact OG-CB 3.38Å; S1949-K1978 WeakPolarHBondContact OG-CG 3.46Å
1950	Y	73.7	Confident	75.5	Confident	63.4 Å²	63.4	62.3 Å²	62.3	25%	0.249	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-108.7	141.5	176.9	-79.1	-86	0	0	0	111.3	R1870 V1904 V1947 E1952 W1977 K1978 C1979	R1870-Y1950 PolarHBondContact NE-OH 3.45Å; R1870-Y1950 VanDerWaalsContact NE-OH 3.15Å; V1904-Y1950 HydrophobicContact CG1-CD1 4.04Å; V1904-Y1950 HydrophobicContact CG1-CE1 4.35Å; V1947-Y1950 HydrophobicContact CB-CE1 4.06Å; V1947-Y1950 HydrophobicContact CB-CE2 4.21Å; V1947-Y1950 HydrophobicContact CG1-CD1 4.36Å; V1947-Y1950 HydrophobicContact CG1-CE1 4.19Å; V1947-Y1950 HydrophobicContact CG1-CE2 4.42Å; V1947-Y1950 HydrophobicContact CG2-CE1 4.41Å; Y1950-E1952 PolarHBondContact O-N 3.17Å; Y1950-W1977 VanDerWaalsContact CB-CZ3 3.48Å; Y1950-K1978 HydrophobicContact CD1-CB 4.21Å; Y1950-K1978 HydrophobicContact CD1-CG 4.32Å; Y1950-K1978 HydrophobicContact CD2-CB 4.08Å; Y1950-K1978 HydrophobicContact CD2-CD 4Å; Y1950-K1978 HydrophobicContact CD2-CG 3.71Å; Y1950-K1978 HydrophobicContact CE1-CB 4.18Å; Y1950-K1978 HydrophobicContact CE2-CB 4.24Å; Y1950-K1978 HydrophobicContact CE2-CD 4.15Å; Y1950-K1978 HydrophobicContact CE2-CG 4.28Å; Y1950-K1978 HydrophobicContact CG-CB 4.17Å; Y1950-K1978 HydrophobicContact CG-CD 4.46Å; Y1950-K1978 HydrophobicContact CG-CG 3.89Å; Y1950-C1979 HydrophobicContact CD1-CB 4.27Å; Y1950-C1979 HydrophobicContact CE1-CB 3.74Å; Y1950-C1979 VanDerWaalsContact CE1-N 3.3Å; Y1950-C1979 PolarHBondContact OH-O 2.94Å; Y1950-C1979 VanDerWaalsContact OH-O 3.05Å
1951	S	75	Confident	76.1	Confident	27.2 Å²	27.2	67.4 Å²	67.4	19%	0.19	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-73.4	127.5	174.4	51.1	0	0	0	0	111	W1977	S1951-W1977 VanDerWaalsContact O-CE3 3.26Å; S1951-W1977 WeakPolarHBondContact O-CZ3 3.35Å
1952	E	77.3	Confident	76.8	Confident	67.6 Å²	67.6	69.2 Å²	69.2	32%	0.316	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-63	140	168.3	-65.7	177.8	151.2	0	0	110.1	R1485 Q1876 Y1950 L1968	R1485-E1952 IonicContact CZ-OE1 3.5Å; R1485-E1952 VanDerWaalsContact CZ-OE1 3.29Å; R1485-E1952 IonicContact CZ-OE2 2.77Å; R1485-E1952 IonicContact NH1-OE1 3.22Å; R1485-E1952 PolarHBondContact NH1-OE1 2.96Å; R1485-E1952 IonicContact NH1-OE2 2.74Å; R1485-E1952 VanDerWaalsContact NH2-CD 3.34Å; R1485-E1952 IonicContact NH2-OE1 3Å; R1485-E1952 PolarHBondContact NH2-OE1 3.18Å; R1485-E1952 IonicContact NH2-OE2 3.63Å; R1485-E1952 PolarHBondContact NH2-OE2 2.89Å; Q1876-E1952 PolarHBondContact NE2-OE2 3.28Å; Y1950-E1952 PolarHBondContact O-N 3.17Å; E1952-L1968 HydrophobicContact CB-CD2 3.64Å; E1952-L1968 VanDerWaalsContact CB-CD2 3.46Å; E1952-L1968 HydrophobicContact CG-CD2 4.43Å; E1952-L1968 WeakPolarHBondContact OE2-CD1 3.48Å; E1952-L1968 WeakPolarHBondContact OE2-CD2 3.4Å
1953	P	83.8	Confident	77.7	Confident	10.6 Å²	10.6	68.3 Å²	68.3	7%	0.069	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.3	147.9	-174.8	26.3	-32.6	0	0	0	112.4	D1908 R1969 W1977	D1908-P1953 HydrophobicContact CB-CB 4.5Å; D1908-P1953 VanDerWaalsContact OD2-CB 3.29Å; D1908-P1953 WeakPolarHBondContact OD2-CB 3.27Å; P1953-R1969 HydrophobicContact CB-CB 4.22Å; P1953-R1969 VanDerWaalsContact CB-NH2 3.33Å; P1953-R1969 HydrophobicContact CG-CB 4.22Å; P1953-R1969 WeakPolarHBondContact CG-O 3.44Å; P1953-R1969 PolarHBondContact O-N 3.16Å; P1953-W1977 HydrophobicContact CB-CB 4.36Å; P1953-W1977 HydrophobicContact CB-CG 4.45Å; P1953-W1977 HydrophobicContact CG-CB 4.29Å; P1953-W1977 HydrophobicContact CG-CD2 4.44Å; P1953-W1977 HydrophobicContact CG-CG 3.98Å
1954	R	85.4	Confident	78.4	Confident	16.8 Å²	16.8	60.9 Å²	60.9	6%	0.063	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	151	-175.9	-60.3	-66.1	171.5	158.3	-2.5	111.8	S1873 Q1876 F1878 N1915 L1963 A1964 C1966 D1967 L1968	S1873-R1954 VanDerWaalsContact CB-NH1 3.25Å; S1873-R1954 PolarHBondContact O-NH1 3.46Å; Q1876-R1954 VanDerWaalsContact OE1-NH1 3.08Å; F1878-R1954 HydrophobicContact CZ-CG 4.33Å; N1915-R1954 PolarHBondContact ND2-O 3.06Å; R1954-L1963 HydrophobicContact CB-CD1 3.99Å; R1954-L1963 HydrophobicContact CB-CG 4.42Å; R1954-L1963 HydrophobicContact CG-CD1 4.42Å; R1954-L1963 HydrophobicContact CG-CG 4.4Å; R1954-A1964 PolarHBondContact NH1-O 3.13Å; R1954-C1966 HydrophobicContact CB-CB 4.32Å; R1954-C1966 PolarHBondContact NH1-O 2.83Å; R1954-C1966 VanDerWaalsContact NH1-O 3.17Å; R1954-D1967 CarbonylContact C-O 3.49Å; R1954-D1967 WeakPolarHBondContact CA-O 3.34Å; R1954-L1968 VanDerWaalsContact CZ-CD2 3.43Å; R1954-L1968 VanDerWaalsContact NH1-CD2 3.26Å
1955	Q	85.2	Confident	79	Confident	35 Å²	35	57 Å²	57	16%	0.164	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	110.4	176.7	146.7	-174.3	-15.7	0	0	110	C1966 D1967 R1969 S2143 A2228	Q1955-C1966 WeakPolarHBondContact O-CB 3.33Å; Q1955-D1967 HydrophobicContact CG-CB 3.94Å; Q1955-D1967 PolarHBondContact N-O 3.11Å; Q1955-D1967 PolarHBondContact O-N 3.15Å; Q1955-R1969 HydrophobicContact CB-CB 4.21Å; Q1955-R1969 HydrophobicContact CB-CG 4.39Å; Q1955-R1969 HydrophobicContact CG-CB 4.41Å; Q1955-S2143 WeakPolarHBondContact CB-O 3.43Å; Q1955-S2143 VanDerWaalsContact CD-O 3.25Å; Q1955-S2143 VanDerWaalsContact CG-O 3.24Å; Q1955-S2143 WeakPolarHBondContact CG-O 3.36Å; Q1955-S2143 VanDerWaalsContact NE2-C 3.34Å; Q1955-S2143 PolarHBondContact NE2-O 3.02Å; Q1955-A2228 HydrophobicContact CG-CB 4.12Å
1956	C	89.7	Confident	79.9	Confident	0.4 Å²	0.4	52.1 Å²	52.1	0%	0.003	25%	0.251	C	S	.	.			trans	-104.9	145.7	-178.3	-56.3	0	0	0	0	111.6	R1914 N1915 V1918 G1958 E1960 L1963 C1966 S2143	R1914-C1956 VanDerWaalsContact CB-O 3.29Å; R1914-C1956 WeakPolarHBondContact CB-O 3.36Å; N1915-C1956 WeakPolarHBondContact OD1-CB 3.36Å; N1915-C1956 PolarHBondContact OD1-N 3.01Å; N1915-C1956 PolarHBondContact OD1-SG 3.04Å; V1918-C1956 HydrophobicContact CB-CB 4.49Å; V1918-C1956 HydrophobicContact CG2-CB 3.74Å; C1956-G1958 VanDerWaalsContact C-N 3.28Å; C1956-G1958 PolarHBondContact O-N 3.16Å; C1956-E1960 WeakPolarHBondContact CA-OE1 3.16Å; C1956-L1963 VanDerWaalsContact SG-CD1 3.57Å; C1956-C1966 VanDerWaalsContact CA-SG 3.59Å; C1956-C1966 HydrophobicContact CB-CB 3.96Å; C1956-C1966 WeakPolarHBondContact CB-SG 3.17Å; C1956-C1966 WeakPolarHBondContact SG-CB 3.32Å; C1956-C1966 CovalentContact SG-SG 2.03Å; C1956-C1966 PolarHBondContact SG-SG 2.99Å; C1956-S2143 WeakPolarHBondContact O-CB 3.36Å; C1956-S2143 PolarHBondContact O-OG 2.91Å
1957	F	84.5	Confident	80.6	Confident	86.4 Å²	86.4	49 Å²	49	38%	0.379	24%	0.235	S	C	.	.			trans	-74.2	-19.1	168.5	-65.7	-76.2	0	0	0	113	R1914 E1960 Y2144	R1914-F1957 WeakPolarHBondContact CD-O 3.29Å; F1957-E1960 WeakPolarHBondContact CB-OE1 3.32Å; F1957-E1960 VanDerWaalsContact CD2-OE1 3.28Å; F1957-E1960 WeakPolarHBondContact CD2-OE1 3.25Å; F1957-E1960 VanDerWaalsContact N-CD 3.34Å; F1957-E1960 PolarHBondContact N-OE1 3.15Å; F1957-E1960 PolarHBondContact N-OE2 3Å; F1957-E1960 VanDerWaalsContact N-OE2 3.14Å; F1957-Y2144 AromaticContact CD1-CD1 3.89Å; F1957-Y2144 HydrophobicContact CD1-CD1 3.97Å; F1957-Y2144 AromaticContact CE1-CD1 3.89Å; F1957-Y2144 HydrophobicContact CE1-CD1 3.99Å; F1957-Y2144 HydrophobicContact CE1-CG 4.13Å
1958	G	82.4	Confident	81.1	Confident	0.4 Å²	0.4	49.7 Å²	49.7	0%	0.004	24%	0.238	C	C	.	.	S	Bend	trans	99.2	-4.8	-178.1	0	0	0	0	0	114.1	R1921 C1956 E1960	R1921-G1958 VanDerWaalsContact CZ-O 3.29Å; R1921-G1958 PolarHBondContact NH1-O 3.11Å; R1921-G1958 PolarHBondContact NH2-O 3.11Å; C1956-G1958 VanDerWaalsContact C-N 3.28Å; C1956-G1958 PolarHBondContact O-N 3.16Å; G1958-E1960 WeakPolarHBondContact CA-OE2 3.27Å; G1958-E1960 PolarHBondContact N-OE2 3.06Å
1959	N	81.4	Confident	81.8	Confident	119.8 Å²	119.8	43.9 Å²	43.9	64%	0.641	21%	0.212	S	C	*	.			trans	-103	-7.3	-178.9	-70.7	-19.4	0	0	0	113.1	R1921 N2037	R1921-N1959 VanDerWaalsContact NH1-CA 3.29Å; R1921-N1959 PolarHBondContact NH1-O 3.11Å; N1959-N2037 PolarHBondContact OD1-ND2 3.07Å
1960	E	84.5	Confident	81.8	Confident	29.4 Å²	29.4	45.4 Å²	45.4	14%	0.137	22%	0.217	C	C	.	.			trans	-67	158.4	177.9	-58.9	85.5	167.3	0	0	111.7	V1918 R1921 C1956 F1957 G1958	V1918-E1960 HydrophobicContact CG1-CB 4.07Å; V1918-E1960 HydrophobicContact CG2-CB 4.01Å; V1918-E1960 WeakPolarHBondContact CG2-OE2 3.43Å; R1921-E1960 WeakPolarHBondContact CD-O 3.24Å; R1921-E1960 PolarHBondContact NH1-O 3.08Å; C1956-E1960 WeakPolarHBondContact CA-OE1 3.16Å; F1957-E1960 WeakPolarHBondContact CB-OE1 3.32Å; F1957-E1960 VanDerWaalsContact CD2-OE1 3.28Å; F1957-E1960 WeakPolarHBondContact CD2-OE1 3.25Å; F1957-E1960 VanDerWaalsContact N-CD 3.34Å; F1957-E1960 PolarHBondContact N-OE1 3.15Å; F1957-E1960 PolarHBondContact N-OE2 3Å; F1957-E1960 VanDerWaalsContact N-OE2 3.14Å; G1958-E1960 WeakPolarHBondContact CA-OE2 3.27Å; G1958-E1960 PolarHBondContact N-OE2 3.06Å
1961	K	84.2	Confident	81.4	Confident	131.8 Å²	131.8	43.6 Å²	43.6	57%	0.573	21%	0.214	S	C	*	.	S	Bend	trans	-88.1	-29.9	179.2	-68.2	-178.5	179.5	176	0	112.9	E1922	E1922-K1961 WeakPolarHBondContact CA-O 3.36Å
1962	R	87.7	Confident	80.8	Confident	90.8 Å²	90.8	45.1 Å²	45.1	34%	0.343	22%	0.219	S	C	.	.	S	Bend	trans	-143.1	151.8	-176.4	-59.4	174.6	-65.6	-177.8	5.2	110.6	V1918 E1922 A1964 D1965	V1918-R1962 WeakPolarHBondContact CG1-O 3.29Å; E1922-R1962 HydrophobicContact CG-CB 4.4Å; E1922-R1962 HydrophobicContact CG-CG 4.09Å; E1922-R1962 VanDerWaalsContact OE2-CA 3.26Å; E1922-R1962 WeakPolarHBondContact OE2-CA 3.37Å; E1922-R1962 VanDerWaalsContact OE2-CB 3.32Å; E1922-R1962 WeakPolarHBondContact OE2-CB 3.34Å; R1962-A1964 PolarHBondContact O-N 2.93Å; R1962-D1965 WeakPolarHBondContact CB-OD2 3.41Å; R1962-D1965 IonicContact CZ-OD1 3.32Å; R1962-D1965 IonicContact CZ-OD2 3.56Å; R1962-D1965 IonicContact NE-OD1 3.12Å; R1962-D1965 IonicContact NE-OD2 3.15Å; R1962-D1965 PolarHBondContact NE-OD2 3.17Å; R1962-D1965 VanDerWaalsContact NE-OD2 3.11Å; R1962-D1965 IonicContact NH2-OD1 3.35Å; R1962-D1965 PolarHBondContact NH2-OD1 3.15Å; R1962-D1965 IonicContact NH2-OD2 3.19Å; R1962-D1965 PolarHBondContact NH2-OD2 2.95Å; R1962-D1965 VanDerWaalsContact NH2-OD2 3.13Å; R1962-D1965 WeakPolarHBondContact O-CB 3.36Å; R1962-D1965 PolarHBondContact O-N 3.09Å; R1962-D1965 VanDerWaalsContact O-N 3.08Å
1963	L	88.1	Confident	80.5	Confident	2.4 Å²	2.4	43.3 Å²	43.3	1%	0.013	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-63.3	-28.7	179.1	-174.9	61.6	0	0	0	112.1	F1878 T1880 L1893 I1895 I1906 F1911 N1915 V1919 E1922 R1954 C1956 D1965 C1966	F1878-L1963 HydrophobicContact CE2-CB 4.07Å; F1878-L1963 HydrophobicContact CE2-CD2 4.08Å; F1878-L1963 HydrophobicContact CE2-CG 4.07Å; F1878-L1963 HydrophobicContact CZ-CB 4.32Å; F1878-L1963 HydrophobicContact CZ-CD2 4.4Å; F1878-L1963 HydrophobicContact CZ-CG 4.09Å; T1880-L1963 HydrophobicContact CG2-CB 4.09Å; T1880-L1963 HydrophobicContact CG2-CD2 3.93Å; L1893-L1963 HydrophobicContact CD2-CD2 4.45Å; I1895-L1963 HydrophobicContact CD1-CD2 4.4Å; I1906-L1963 HydrophobicContact CD1-CD2 4.3Å; F1911-L1963 HydrophobicContact CE2-CD2 4.46Å; N1915-L1963 HydrophobicContact CB-CD1 4.37Å; V1919-L1963 HydrophobicContact CG2-CB 4.24Å; V1919-L1963 HydrophobicContact CG2-CD1 4.36Å; V1919-L1963 HydrophobicContact CG2-CD2 3.91Å; V1919-L1963 HydrophobicContact CG2-CG 4.41Å; E1922-L1963 PolarHBondContact OE2-N 3.18Å; R1954-L1963 HydrophobicContact CB-CD1 3.99Å; R1954-L1963 HydrophobicContact CB-CG 4.42Å; R1954-L1963 HydrophobicContact CG-CD1 4.42Å; R1954-L1963 HydrophobicContact CG-CG 4.4Å; C1956-L1963 VanDerWaalsContact SG-CD1 3.57Å; L1963-D1965 VanDerWaalsContact C-N 3.28Å; L1963-D1965 PolarHBondContact O-N 3Å; L1963-C1966 WeakPolarHBondContact O-CB 3.32Å; L1963-C1966 PolarHBondContact O-N 3Å
1964	A	83.4	Confident	79.9	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.025	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-68.8	-22.7	175.7	0	0	0	0	0	114.1	S1873 Q1876 F1878 R1954 R1962 C1966	S1873-A1964 CarbonylContact C-O 3.59Å; S1873-A1964 WeakPolarHBondContact CB-O 3.46Å; Q1876-A1964 WeakPolarHBondContact O-CB 3.39Å; F1878-A1964 HydrophobicContact CD1-CB 3.92Å; F1878-A1964 HydrophobicContact CD2-CB 4.43Å; F1878-A1964 VanDerWaalsContact CE1-CA 3.46Å; F1878-A1964 HydrophobicContact CE1-CB 3.68Å; F1878-A1964 HydrophobicContact CE2-CB 4.3Å; F1878-A1964 HydrophobicContact CG-CB 4.33Å; F1878-A1964 VanDerWaalsContact CZ-CA 3.49Å; F1878-A1964 HydrophobicContact CZ-CB 3.9Å; R1954-A1964 PolarHBondContact NH1-O 3.13Å; R1962-A1964 PolarHBondContact O-N 2.93Å; A1964-C1966 VanDerWaalsContact C-N 3.31Å; A1964-C1966 PolarHBondContact O-N 3.14Å
1965	D	81.6	Confident	79.4	Confident	50.4 Å²	50.4	47.9 Å²	47.9	27%	0.27	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-81.3	-4.7	178.6	-59.5	-36.2	0	0	0	112	S1873 R1962 L1963	S1873-D1965 VanDerWaalsContact CB-OD1 3.27Å; S1873-D1965 WeakPolarHBondContact CB-OD1 3.32Å; S1873-D1965 PolarHBondContact OG-OD1 2.93Å; R1962-D1965 WeakPolarHBondContact CB-OD2 3.41Å; R1962-D1965 IonicContact CZ-OD1 3.32Å; R1962-D1965 IonicContact CZ-OD2 3.56Å; R1962-D1965 IonicContact NE-OD1 3.12Å; R1962-D1965 IonicContact NE-OD2 3.15Å; R1962-D1965 PolarHBondContact NE-OD2 3.17Å; R1962-D1965 VanDerWaalsContact NE-OD2 3.11Å; R1962-D1965 IonicContact NH2-OD1 3.35Å; R1962-D1965 PolarHBondContact NH2-OD1 3.15Å; R1962-D1965 IonicContact NH2-OD2 3.19Å; R1962-D1965 PolarHBondContact NH2-OD2 2.95Å; R1962-D1965 VanDerWaalsContact NH2-OD2 3.13Å; R1962-D1965 WeakPolarHBondContact O-CB 3.36Å; R1962-D1965 PolarHBondContact O-N 3.09Å; R1962-D1965 VanDerWaalsContact O-N 3.08Å; L1963-D1965 VanDerWaalsContact C-N 3.28Å; L1963-D1965 PolarHBondContact O-N 3Å
1966	C	86.4	Confident	78.9	Confident	1.8 Å²	1.8	47.3 Å²	47.3	1%	0.012	24%	0.239	C	C	.	.	S	Bend	trans	-86.3	152.4	179.7	-54.9	0	0	0	0	113	S1873 R1954 Q1955 C1956 L1963 A1964	S1873-C1966 VanDerWaalsContact CB-O 3.27Å; S1873-C1966 WeakPolarHBondContact CB-O 3.41Å; R1954-C1966 HydrophobicContact CB-CB 4.32Å; R1954-C1966 PolarHBondContact NH1-O 2.83Å; R1954-C1966 VanDerWaalsContact NH1-O 3.17Å; Q1955-C1966 WeakPolarHBondContact O-CB 3.33Å; C1956-C1966 VanDerWaalsContact CA-SG 3.59Å; C1956-C1966 HydrophobicContact CB-CB 3.96Å; C1956-C1966 WeakPolarHBondContact CB-SG 3.17Å; C1956-C1966 WeakPolarHBondContact SG-CB 3.32Å; C1956-C1966 CovalentContact SG-SG 2.03Å; C1956-C1966 PolarHBondContact SG-SG 2.99Å; L1963-C1966 WeakPolarHBondContact O-CB 3.32Å; L1963-C1966 PolarHBondContact O-N 3Å; A1964-C1966 VanDerWaalsContact C-N 3.31Å; A1964-C1966 PolarHBondContact O-N 3.14Å
1967	D	79.6	Confident	78.5	Confident	85 Å²	85	49.1 Å²	49.1	46%	0.455	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	153.7	179.2	-71.1	-32.1	0	0	0	112.1	S1873 R1954 Q1955	S1873-D1967 PolarHBondContact OG-OD1 2.8Å; R1954-D1967 CarbonylContact C-O 3.49Å; R1954-D1967 WeakPolarHBondContact CA-O 3.34Å; Q1955-D1967 HydrophobicContact CG-CB 3.94Å; Q1955-D1967 PolarHBondContact N-O 3.11Å; Q1955-D1967 PolarHBondContact O-N 3.15Å
1968	L	77.6	Confident	78.3	Confident	40.2 Å²	40.2	48.6 Å²	48.6	21%	0.21	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.1	173.2	-75	168.2	0	0	0	110.1	S1873 E1952 R1954 L1970	S1873-L1968 VanDerWaalsContact CB-CG 3.45Å; E1952-L1968 HydrophobicContact CB-CD2 3.64Å; E1952-L1968 VanDerWaalsContact CB-CD2 3.46Å; E1952-L1968 HydrophobicContact CG-CD2 4.43Å; E1952-L1968 WeakPolarHBondContact OE2-CD1 3.48Å; E1952-L1968 WeakPolarHBondContact OE2-CD2 3.4Å; R1954-L1968 VanDerWaalsContact CZ-CD2 3.43Å; R1954-L1968 VanDerWaalsContact NH1-CD2 3.26Å; L1968-L1970 PolarHBondContact O-N 2.91Å
1969	R	78	Confident	78.2	Confident	26 Å²	26	48.9 Å²	48.9	10%	0.098	25%	0.245	C	C	.	.			trans	-84.6	107.1	171.9	-169.2	171.7	63.8	83.9	0.8	108.9	D1908 Q1910 P1953 Q1955 S1971	D1908-R1969 VanDerWaalsContact CG-NH1 3.32Å; D1908-R1969 VanDerWaalsContact CG-NH2 3.28Å; D1908-R1969 IonicContact OD1-CZ 3.32Å; D1908-R1969 IonicContact OD1-NH1 2.69Å; D1908-R1969 PolarHBondContact OD1-NH1 2.96Å; D1908-R1969 VanDerWaalsContact OD1-NH1 3.09Å; D1908-R1969 IonicContact OD1-NH2 3.22Å; D1908-R1969 PolarHBondContact OD1-NH2 3.22Å; D1908-R1969 IonicContact OD2-CZ 3.24Å; D1908-R1969 IonicContact OD2-NE 3.38Å; D1908-R1969 IonicContact OD2-NH1 3.65Å; D1908-R1969 PolarHBondContact OD2-NH1 3.03Å; D1908-R1969 IonicContact OD2-NH2 3.74Å; D1908-R1969 PolarHBondContact OD2-NH2 3.16Å; Q1910-R1969 VanDerWaalsContact CB-NH1 3.25Å; Q1910-R1969 VanDerWaalsContact CD-NH1 3.34Å; Q1910-R1969 PolarHBondContact O-NH1 2.97Å; Q1910-R1969 VanDerWaalsContact OE1-NE 3.11Å; P1953-R1969 HydrophobicContact CB-CB 4.22Å; P1953-R1969 VanDerWaalsContact CB-NH2 3.33Å; P1953-R1969 HydrophobicContact CG-CB 4.22Å; P1953-R1969 WeakPolarHBondContact CG-O 3.44Å; P1953-R1969 PolarHBondContact O-N 3.16Å; Q1955-R1969 HydrophobicContact CB-CB 4.21Å; Q1955-R1969 HydrophobicContact CB-CG 4.39Å; Q1955-R1969 HydrophobicContact CG-CB 4.41Å; R1969-S1971 PolarHBondContact O-N 3Å
1970	L	68.5	Low	78.1	Confident	65.8 Å²	65.8	46.7 Å²	46.7	35%	0.345	24%	0.236	S	C	.	.			trans	-75.1	101.7	-179.3	-61.8	173.1	0	0	0	110.4	M1453 R1485 L1487 Q1488 L1968	M1453-L1970 HydrophobicContact SD-CD2 4.19Å; R1485-L1970 HydrophobicContact CB-CD2 4.35Å; R1485-L1970 HydrophobicContact CG-CD2 4.41Å; R1485-L1970 VanDerWaalsContact O-CD1 3.3Å; R1485-L1970 WeakPolarHBondContact O-CD1 3.29Å; R1485-L1970 WeakPolarHBondContact O-CD2 3.44Å; L1487-L1970 HydrophobicContact CB-CD1 3.92Å; L1487-L1970 HydrophobicContact CD2-CD1 4.47Å; Q1488-L1970 HydrophobicContact CG-CD1 4.21Å; L1968-L1970 PolarHBondContact O-N 2.91Å
1971	S	66	Low	77.7	Confident	25.2 Å²	25.2	47.2 Å²	47.2	18%	0.176	24%	0.24	C	C	.	.			trans	-128.3	131.7	174.7	-172.8	0	0	0	0	110	R1969 D1973 L1976	R1969-S1971 PolarHBondContact O-N 3Å; S1971-D1973 VanDerWaalsContact C-N 3.3Å; S1971-D1973 PolarHBondContact O-N 2.97Å; S1971-L1976 WeakPolarHBondContact OG-CD1 3.15Å
1972	N	61.7	Low	77.4	Confident	58.6 Å²	58.6	42.3 Å²	42.3	31%	0.313	22%	0.223	S	C	.	.	S	Bend	trans	-74.4	-24.8	-179	-71.3	-3.6	0	0	0	112.8	M1453 A1974 Q2176 I2178	M1453-N1972 HydrophobicContact CE-CB 3.74Å; M1453-N1972 WeakPolarHBondContact CE-OD1 3.41Å; M1453-N1972 WeakPolarHBondContact CG-OD1 3.15Å; M1453-N1972 HydrophobicContact SD-CB 4.47Å; M1453-N1972 PolarHBondContact SD-OD1 3.04Å; N1972-A1974 PolarHBondContact O-N 2.95Å; N1972-Q2176 HydrophobicContact CB-CB 4.16Å; N1972-Q2176 VanDerWaalsContact CB-O 3.28Å; N1972-Q2176 WeakPolarHBondContact CB-O 3.44Å; N1972-Q2176 PolarHBondContact ND2-O 3.15Å; N1972-I2178 WeakPolarHBondContact ND2-CG1 3.21Å
1973	D	70.9	Confident	77	Confident	28.8 Å²	28.8	43 Å²	43	15%	0.154	23%	0.231	C	C	.	.			trans	-87.6	104.7	-174.4	-171.2	-8.2	0	0	0	111.1	S1971 N1975 L1976 W1977 S2174	S1971-D1973 VanDerWaalsContact C-N 3.3Å; S1971-D1973 PolarHBondContact O-N 2.97Å; D1973-N1975 VanDerWaalsContact C-N 3.26Å; D1973-N1975 PolarHBondContact O-N 3.1Å; D1973-N1975 VanDerWaalsContact OD1-CB 3.27Å; D1973-N1975 WeakPolarHBondContact OD1-CB 3.38Å; D1973-N1975 PolarHBondContact OD1-N 3.08Å; D1973-N1975 PolarHBondContact OD1-ND2 2.86Å; D1973-L1976 HydrophobicContact CB-CD1 3.82Å; D1973-L1976 HydrophobicContact CB-CG 3.95Å; D1973-L1976 PolarHBondContact O-N 3.19Å; D1973-W1977 PolarHBondContact O-NE1 2.89Å; D1973-S2174 PolarHBondContact OD2-OG 3.36Å
1974	A	70.8	Confident	76.9	Confident	29.2 Å²	29.2	45.1 Å²	45.1	24%	0.241	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-63.9	-23.2	178.1	0	0	0	0	0	113.3	N1972 L1976 W1977 K1978	N1972-A1974 PolarHBondContact O-N 2.95Å; A1974-L1976 VanDerWaalsContact C-N 3.26Å; A1974-L1976 PolarHBondContact O-N 3.04Å; A1974-W1977 HydrophobicContact CB-CZ2 4.34Å; A1974-W1977 PolarHBondContact O-N 3.31Å; A1974-K1978 HydrophobicContact CB-CD 3.95Å; A1974-K1978 HydrophobicContact CB-CG 4.42Å; A1974-K1978 VanDerWaalsContact O-CB 3.23Å; A1974-K1978 WeakPolarHBondContact O-CB 3.43Å; A1974-K1978 WeakPolarHBondContact O-CD 3.5Å; A1974-K1978 VanDerWaalsContact O-CG 3.25Å; A1974-K1978 WeakPolarHBondContact O-CG 3.37Å; A1974-K1978 PolarHBondContact O-N 3.05Å
1975	N	74.7	Confident	77.1	Confident	96 Å²	96	45.1 Å²	45.1	51%	0.513	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-74.9	-15.8	-178.1	-62.6	-28.5	0	0	0	112.8	D1973 W1977	D1973-N1975 VanDerWaalsContact C-N 3.26Å; D1973-N1975 PolarHBondContact O-N 3.1Å; D1973-N1975 VanDerWaalsContact OD1-CB 3.27Å; D1973-N1975 WeakPolarHBondContact OD1-CB 3.38Å; D1973-N1975 PolarHBondContact OD1-N 3.08Å; D1973-N1975 PolarHBondContact OD1-ND2 2.86Å; N1975-W1977 VanDerWaalsContact C-N 3.3Å; N1975-W1977 PolarHBondContact O-N 3.12Å
1976	L	75.3	Confident	77.6	Confident	21.8 Å²	21.8	42.7 Å²	42.7	11%	0.114	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-74.5	-19.5	-179.2	-67.6	175.8	0	0	0	113.8	R1909 S1971 D1973 A1974	R1909-L1976 WeakPolarHBondContact CB-O 3.27Å; R1909-L1976 WeakPolarHBondContact CG-O 3.23Å; R1909-L1976 PolarHBondContact N-O 3.04Å; S1971-L1976 WeakPolarHBondContact OG-CD1 3.15Å; D1973-L1976 HydrophobicContact CB-CD1 3.82Å; D1973-L1976 HydrophobicContact CB-CG 3.95Å; D1973-L1976 PolarHBondContact O-N 3.19Å; A1974-L1976 VanDerWaalsContact C-N 3.26Å; A1974-L1976 PolarHBondContact O-N 3.04Å
1977	W	80.4	Confident	77.9	Confident	37.8 Å²	37.8	43.2 Å²	43.2	14%	0.143	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.2	-17	-173.3	56.5	-92.1	0	0	0	114.6	D1908 Y1950 S1951 P1953 D1973 A1974 N1975	D1908-W1977 HydrophobicContact CB-CB 4.35Å; Y1950-W1977 VanDerWaalsContact CB-CZ3 3.48Å; S1951-W1977 VanDerWaalsContact O-CE3 3.26Å; S1951-W1977 WeakPolarHBondContact O-CZ3 3.35Å; P1953-W1977 HydrophobicContact CB-CB 4.36Å; P1953-W1977 HydrophobicContact CB-CG 4.45Å; P1953-W1977 HydrophobicContact CG-CB 4.29Å; P1953-W1977 HydrophobicContact CG-CD2 4.44Å; P1953-W1977 HydrophobicContact CG-CG 3.98Å; D1973-W1977 PolarHBondContact O-NE1 2.89Å; A1974-W1977 HydrophobicContact CB-CZ2 4.34Å; A1974-W1977 PolarHBondContact O-N 3.31Å; N1975-W1977 VanDerWaalsContact C-N 3.3Å; N1975-W1977 PolarHBondContact O-N 3.12Å
1978	K	80.9	Confident	78.5	Confident	77.2 Å²	77.2	39.1 Å²	39.1	34%	0.336	21%	0.207	S	C	.	.	S	Bend	trans	-74.9	135.7	170.2	-67.8	-177.7	179.2	172.1	0	109.9	S1949 Y1950 A1974 V1980	S1949-K1978 VanDerWaalsContact OG-CB 3.27Å; S1949-K1978 WeakPolarHBondContact OG-CB 3.38Å; S1949-K1978 WeakPolarHBondContact OG-CG 3.46Å; Y1950-K1978 HydrophobicContact CD1-CB 4.21Å; Y1950-K1978 HydrophobicContact CD1-CG 4.32Å; Y1950-K1978 HydrophobicContact CD2-CB 4.08Å; Y1950-K1978 HydrophobicContact CD2-CD 4Å; Y1950-K1978 HydrophobicContact CD2-CG 3.71Å; Y1950-K1978 HydrophobicContact CE1-CB 4.18Å; Y1950-K1978 HydrophobicContact CE2-CB 4.24Å; Y1950-K1978 HydrophobicContact CE2-CD 4.15Å; Y1950-K1978 HydrophobicContact CE2-CG 4.28Å; Y1950-K1978 HydrophobicContact CG-CB 4.17Å; Y1950-K1978 HydrophobicContact CG-CD 4.46Å; Y1950-K1978 HydrophobicContact CG-CG 3.89Å; A1974-K1978 HydrophobicContact CB-CD 3.95Å; A1974-K1978 HydrophobicContact CB-CG 4.42Å; A1974-K1978 VanDerWaalsContact O-CB 3.23Å; A1974-K1978 WeakPolarHBondContact O-CB 3.43Å; A1974-K1978 WeakPolarHBondContact O-CD 3.5Å; A1974-K1978 VanDerWaalsContact O-CG 3.25Å; A1974-K1978 WeakPolarHBondContact O-CG 3.37Å; A1974-K1978 PolarHBondContact O-N 3.05Å; K1978-V1980 VanDerWaalsContact C-N 3.26Å; K1978-V1980 HydrophobicContact CB-CG1 4.19Å; K1978-V1980 HydrophobicContact CB-CG2 3.75Å; K1978-V1980 PolarHBondContact O-N 2.97Å
1979	C	81	Confident	79.1	Confident	5.8 Å²	5.8	38.9 Å²	38.9	4%	0.039	21%	0.205	C	C	.	.			trans	-73.8	74.4	173.6	-57	0	0	0	0	110.8	P1905 C1907 P1942 K1948 Y1950 F1985	P1905-C1979 HydrophobicContact CG-CB 4.5Å; P1905-C1979 PolarHBondContact O-SG 2.87Å; P1905-C1979 VanDerWaalsContact O-SG 3.32Å; C1907-C1979 HydrophobicContact CB-CB 3.86Å; C1907-C1979 WeakPolarHBondContact CB-SG 3.3Å; C1907-C1979 VanDerWaalsContact SG-CA 3.53Å; C1907-C1979 WeakPolarHBondContact SG-CA 3.17Å; C1907-C1979 WeakPolarHBondContact SG-CB 3.35Å; C1907-C1979 CovalentContact SG-SG 2.02Å; C1907-C1979 PolarHBondContact SG-SG 3.06Å; P1942-C1979 WeakPolarHBondContact CB-O 3.37Å; K1948-C1979 PolarHBondContact O-N 3.29Å; Y1950-C1979 HydrophobicContact CD1-CB 4.27Å; Y1950-C1979 HydrophobicContact CE1-CB 3.74Å; Y1950-C1979 VanDerWaalsContact CE1-N 3.3Å; Y1950-C1979 PolarHBondContact OH-O 2.94Å; Y1950-C1979 VanDerWaalsContact OH-O 3.05Å; C1979-F1985 HydrophobicContact CB-CE1 4.35Å
1980	V	78.4	Confident	79.7	Confident	74 Å²	74	37.6 Å²	37.6	45%	0.448	20%	0.2	S	C	.	.			trans	-86.9	-24.7	177.2	-103.8	0	0	0	0	112.1	P1942 K1978	P1942-V1980 WeakPolarHBondContact CG-O 3.36Å; K1978-V1980 VanDerWaalsContact C-N 3.26Å; K1978-V1980 HydrophobicContact CB-CG1 4.19Å; K1978-V1980 HydrophobicContact CB-CG2 3.75Å; K1978-V1980 PolarHBondContact O-N 2.97Å
1981	D	77.4	Confident	80.4	Confident	39.6 Å²	39.6	34.6 Å²	34.6	21%	0.212	19%	0.185	C	C	.	.	S	Bend	trans	-122	169.4	178.6	62.5	49	0	0	0	111.3	R1909 E1983 H1984	R1909-D1981 IonicContact CZ-OD2 3.68Å; R1909-D1981 IonicContact NH2-OD2 2.95Å; R1909-D1981 PolarHBondContact NH2-OD2 2.94Å; D1981-E1983 VanDerWaalsContact C-N 3.3Å; D1981-E1983 PolarHBondContact OD1-N 3.13Å; D1981-H1984 IonicContact OD1-CE1 3.34Å; D1981-H1984 IonicContact OD1-CG 3.27Å; D1981-H1984 PolarHBondContact OD1-N 3.2Å; D1981-H1984 VanDerWaalsContact OD1-N 3.15Å; D1981-H1984 IonicContact OD1-ND1 3.29Å; D1981-H1984 PolarHBondContact OD1-ND1 3.02Å; D1981-H1984 IonicContact OD2-CE1 3.21Å; D1981-H1984 PolarHBondContact OD2-CE1 2.94Å; D1981-H1984 VanDerWaalsContact OD2-CE1 3.31Å; D1981-H1984 IonicContact OD2-CG 3.7Å; D1981-H1984 IonicContact OD2-ND1 3.19Å; D1981-H1984 PolarHBondContact OD2-ND1 3.1Å
1982	A	77.2	Confident	81	Confident	28 Å²	28	40 Å²	40	23%	0.231	20%	0.202	C	C	.	.	S	Bend	trans	-92.2	11.5	179.5	0	0	0	0	0	113.4	P1936 R1937 W1938 F1985	P1936-A1982 CarbonylContact C-O 3.57Å; P1936-A1982 VanDerWaalsContact CA-O 3.26Å; P1936-A1982 WeakPolarHBondContact CA-O 3.34Å; P1936-A1982 WeakPolarHBondContact CB-O 3.48Å; R1937-A1982 PolarHBondContact N-O 3Å; R1937-A1982 VanDerWaalsContact N-O 3.09Å; W1938-A1982 HydrophobicContact CE3-CB 4.29Å; W1938-A1982 HydrophobicContact CZ3-CB 4.22Å; W1938-A1982 WeakPolarHBondContact CZ3-O 3.15Å; A1982-F1985 VanDerWaalsContact C-CE2 3.41Å; A1982-F1985 HydrophobicContact CB-CE2 4.38Å; A1982-F1985 VanDerWaalsContact O-CE2 3.32Å; A1982-F1985 WeakPolarHBondContact O-CE2 3.21Å
1983	E	79.6	Confident	81.3	Confident	107 Å²	107	38.1 Å²	38.1	50%	0.5	19%	0.194	S	C	.	.	S	Bend	trans	-109.4	-21.6	-164.2	-67.3	-176.3	174.3	0	0	114.4	G1935 P1936 W1938 D1981	G1935-E1983 CarbonylContact C-O 3.46Å; G1935-E1983 VanDerWaalsContact CA-O 3.23Å; G1935-E1983 WeakPolarHBondContact CA-O 3.35Å; G1935-E1983 CarbonylContact O-C 3.54Å; G1935-E1983 VanDerWaalsContact O-O 3.11Å; P1936-E1983 VanDerWaalsContact N-O 3.13Å; W1938-E1983 HydrophobicContact CH2-CG 4.25Å; W1938-E1983 HydrophobicContact CZ3-CG 4.23Å; D1981-E1983 VanDerWaalsContact C-N 3.3Å; D1981-E1983 PolarHBondContact OD1-N 3.13Å
1984	H	85.5	Confident	81	Confident	46.2 Å²	46.2	43 Å²	43	21%	0.214	22%	0.216	C	C	.	.			trans	-114.2	41.5	-168.2	-60.6	89.1	0	0	0	114.2	C1907 R1909 I1934 D1981	C1907-H1984 CarbonylContact C-O 3.53Å; C1907-H1984 WeakPolarHBondContact CA-O 3.27Å; C1907-H1984 VanDerWaalsContact CB-O 3.29Å; C1907-H1984 WeakPolarHBondContact CB-O 3.33Å; R1909-H1984 HydrophobicContact CG-CB 3.89Å; R1909-H1984 VanDerWaalsContact CZ-CE1 3.46Å; R1909-H1984 PolarHBondContact NE-CD2 3.05Å; R1909-H1984 VanDerWaalsContact NE-CD2 3.31Å; R1909-H1984 VanDerWaalsContact NE-CG 3.29Å; R1909-H1984 PolarHBondContact NE-ND1 3.03Å; R1909-H1984 PolarHBondContact NE-NE2 3.09Å; R1909-H1984 PolarHBondContact NH2-CE1 3.1Å; R1909-H1984 VanDerWaalsContact NH2-CE1 3.27Å; R1909-H1984 PolarHBondContact NH2-ND1 3.13Å; R1909-H1984 VanDerWaalsContact NH2-ND1 3.18Å; I1934-H1984 HydrophobicContact CG2-CB 4.02Å; D1981-H1984 IonicContact OD1-CE1 3.34Å; D1981-H1984 IonicContact OD1-CG 3.27Å; D1981-H1984 PolarHBondContact OD1-N 3.2Å; D1981-H1984 VanDerWaalsContact OD1-N 3.15Å; D1981-H1984 IonicContact OD1-ND1 3.29Å; D1981-H1984 PolarHBondContact OD1-ND1 3.02Å; D1981-H1984 IonicContact OD2-CE1 3.21Å; D1981-H1984 PolarHBondContact OD2-CE1 2.94Å; D1981-H1984 VanDerWaalsContact OD2-CE1 3.31Å; D1981-H1984 IonicContact OD2-CG 3.7Å; D1981-H1984 IonicContact OD2-ND1 3.19Å; D1981-H1984 PolarHBondContact OD2-ND1 3.1Å
1985	F	88.4	Confident	80.6	Confident	2.8 Å²	2.8	43 Å²	43	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	142.6	176.6	-62.9	-86.4	0	0	0	112	F1892 P1905 C1907 I1934 G1935 R1937 N1940 C1979 A1982 F1987	F1892-F1985 HydrophobicContact CD1-CB 3.71Å; F1892-F1985 HydrophobicContact CE1-CB 3.95Å; P1905-F1985 HydrophobicContact CB-CD1 3.88Å; P1905-F1985 HydrophobicContact CB-CE1 3.79Å; P1905-F1985 HydrophobicContact CG-CD1 4.44Å; P1905-F1985 HydrophobicContact CG-CE1 3.96Å; C1907-F1985 WeakPolarHBondContact SG-CD1 3.24Å; C1907-F1985 VanDerWaalsContact SG-CE1 3.51Å; C1907-F1985 WeakPolarHBondContact SG-CE1 3.3Å; I1934-F1985 WeakPolarHBondContact CA-O 3.27Å; G1935-F1985 PolarHBondContact N-O 3.06Å; G1935-F1985 WeakPolarHBondContact O-CA 3.39Å; G1935-F1985 WeakPolarHBondContact O-CB 3.32Å; G1935-F1985 PolarHBondContact O-N 3.06Å; R1937-F1985 HydrophobicContact CB-CB 4.23Å; R1937-F1985 HydrophobicContact CB-CD1 4.37Å; R1937-F1985 HydrophobicContact CB-CD2 3.35Å; R1937-F1985 HydrophobicContact CB-CE2 3.65Å; R1937-F1985 HydrophobicContact CB-CG 3.77Å; R1937-F1985 HydrophobicContact CB-CZ 4.38Å; N1940-F1985 HydrophobicContact CB-CE1 4.31Å; N1940-F1985 HydrophobicContact CB-CE2 4.4Å; N1940-F1985 HydrophobicContact CB-CZ 3.98Å; N1940-F1985 VanDerWaalsContact ND2-CE1 3.27Å; N1940-F1985 WeakPolarHBondContact ND2-CE1 3.42Å; N1940-F1985 WeakPolarHBondContact ND2-CZ 3.27Å; N1940-F1985 WeakPolarHBondContact O-CZ 3.42Å; C1979-F1985 HydrophobicContact CB-CE1 4.35Å; A1982-F1985 VanDerWaalsContact C-CE2 3.41Å; A1982-F1985 HydrophobicContact CB-CE2 4.38Å; A1982-F1985 VanDerWaalsContact O-CE2 3.32Å; A1982-F1985 WeakPolarHBondContact O-CE2 3.21Å; F1985-F1987 PolarHBondContact O-N 3.02Å
1986	V	91.3	Very high	80.2	Confident	0.6 Å²	0.6	42.4 Å²	42.4	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	114.4	177.8	179.4	0	0	0	0	110.2	F1892 L1893 I1906 F1911 V1932 I1934 L1988	F1892-V1986 WeakPolarHBondContact CA-O 3.25Å; L1893-V1986 HydrophobicContact CB-CB 4.43Å; L1893-V1986 HydrophobicContact CB-CG1 4.38Å; L1893-V1986 HydrophobicContact CD2-CG1 4.41Å; L1893-V1986 PolarHBondContact N-O 2.86Å; I1906-V1986 HydrophobicContact CB-CG2 4.47Å; I1906-V1986 HydrophobicContact CG2-CG2 3.97Å; I1906-V1986 PolarHBondContact O-N 3.12Å; I1906-V1986 VanDerWaalsContact O-N 3.11Å; F1911-V1986 HydrophobicContact CB-CG1 4.42Å; F1911-V1986 HydrophobicContact CB-CG2 3.85Å; F1911-V1986 HydrophobicContact CD1-CG1 3.68Å; F1911-V1986 HydrophobicContact CD1-CG2 4.49Å; F1911-V1986 HydrophobicContact CD2-CG1 4.42Å; F1911-V1986 HydrophobicContact CD2-CG2 4.41Å; F1911-V1986 HydrophobicContact CE1-CG1 3.98Å; F1911-V1986 HydrophobicContact CG-CG1 3.97Å; F1911-V1986 HydrophobicContact CG-CG2 4.06Å; F1911-V1986 HydrophobicContact CZ-CG1 4.49Å; V1932-V1986 HydrophobicContact CG1-CG1 4.37Å; V1932-V1986 HydrophobicContact CG2-CG1 4.1Å; I1934-V1986 HydrophobicContact CG1-CG2 4.39Å; V1986-L1988 HydrophobicContact CG1-CD2 3.93Å; V1986-L1988 HydrophobicContact CG1-CG 4.1Å
1987	F	91.7	Very high	80.2	Confident	11 Å²	11	43.6 Å²	43.6	5%	0.048	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.4	170.9	-173.4	-90.3	0	0	0	110.3	F1892 V1932 R1933 F1985 L2295 W2296 F2299	F1892-F1987 HydrophobicContact CD1-CB 4.18Å; F1892-F1987 HydrophobicContact CD1-CD2 4.19Å; F1892-F1987 AromaticContact CD2-CD2 3.95Å; F1892-F1987 HydrophobicContact CD2-CD2 4.11Å; F1892-F1987 HydrophobicContact CD2-CE2 4.35Å; F1892-F1987 HydrophobicContact CE1-CB 4.12Å; F1892-F1987 AromaticContact CE1-CD2 3.97Å; F1892-F1987 HydrophobicContact CE1-CD2 4.09Å; F1892-F1987 AromaticContact CE2-CD2 3.93Å; F1892-F1987 HydrophobicContact CE2-CD2 4Å; F1892-F1987 HydrophobicContact CE2-CE2 4.4Å; F1892-F1987 HydrophobicContact CG-CD2 4.22Å; F1892-F1987 AromaticContact CZ-CD2 3.9Å; F1892-F1987 HydrophobicContact CZ-CD2 4.01Å; V1932-F1987 WeakPolarHBondContact CA-O 3.25Å; R1933-F1987 PolarHBondContact N-O 3.21Å; R1933-F1987 WeakPolarHBondContact O-CA 3.17Å; R1933-F1987 WeakPolarHBondContact O-CB 3.4Å; R1933-F1987 PolarHBondContact O-N 3.09Å; F1985-F1987 PolarHBondContact O-N 3.02Å; F1987-L2295 HydrophobicContact CE1-CB 4.04Å; F1987-L2295 HydrophobicContact CE1-CD1 4.2Å; F1987-L2295 HydrophobicContact CZ-CB 4.35Å; F1987-W2296 HydrophobicContact CE2-CB 3.96Å; F1987-W2296 HydrophobicContact CE2-CG 4.33Å; F1987-W2296 HydrophobicContact CZ-CB 3.81Å; F1987-W2296 HydrophobicContact CZ-CG 4.46Å; F1987-F2299 HydrophobicContact CB-CD1 4.33Å; F1987-F2299 HydrophobicContact CB-CE1 4.14Å; F1987-F2299 HydrophobicContact CB-CZ 4.38Å; F1987-F2299 HydrophobicContact CD1-CB 4.41Å; F1987-F2299 HydrophobicContact CD1-CD1 4.34Å; F1987-F2299 HydrophobicContact CD1-CG 4.35Å; F1987-F2299 HydrophobicContact CE1-CB 4.34Å; F1987-F2299 HydrophobicContact CG-CD1 4.35Å; F1987-F2299 HydrophobicContact CG-CE1 4.49Å; F1987-F2299 HydrophobicContact CG-CG 4.4Å
1988	L	92.7	Very high	79.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.4	-176.5	-102	161.6	0	0	0	111.2	L1882 T1890 G1891 L1893 F1911 A1916 V1919 V1930 V1932 V1986 C1990	L1882-L1988 HydrophobicContact CD1-CD2 4.01Å; L1882-L1988 HydrophobicContact CD2-CB 3.99Å; L1882-L1988 HydrophobicContact CD2-CD1 4.04Å; L1882-L1988 HydrophobicContact CD2-CD2 3.91Å; L1882-L1988 HydrophobicContact CD2-CG 4.43Å; L1882-L1988 HydrophobicContact CG-CD2 4.39Å; T1890-L1988 CarbonylContact C-O 3.55Å; T1890-L1988 VanDerWaalsContact CA-O 3.29Å; T1890-L1988 WeakPolarHBondContact CA-O 3.24Å; G1891-L1988 PolarHBondContact N-O 3.06Å; G1891-L1988 VanDerWaalsContact N-O 3.1Å; G1891-L1988 PolarHBondContact O-N 3.12Å; L1893-L1988 HydrophobicContact CB-CD1 4.18Å; L1893-L1988 HydrophobicContact CB-CG 4.5Å; L1893-L1988 HydrophobicContact CD1-CD1 4.25Å; L1893-L1988 HydrophobicContact CD2-CD1 3.89Å; L1893-L1988 HydrophobicContact CG-CD1 4.34Å; F1911-L1988 HydrophobicContact CD1-CD2 4.43Å; F1911-L1988 HydrophobicContact CE1-CD1 4.45Å; F1911-L1988 HydrophobicContact CE1-CD2 3.96Å; A1916-L1988 HydrophobicContact CB-CD1 3.79Å; A1916-L1988 HydrophobicContact CB-CD2 3.54Å; A1916-L1988 HydrophobicContact CB-CG 4.34Å; V1919-L1988 HydrophobicContact CB-CD1 4.03Å; V1919-L1988 HydrophobicContact CB-CD2 4.24Å; V1919-L1988 HydrophobicContact CG1-CD1 3.77Å; V1919-L1988 HydrophobicContact CG1-CD2 3.7Å; V1919-L1988 HydrophobicContact CG2-CD1 4.38Å; V1930-L1988 HydrophobicContact CG1-CD1 4.1Å; V1932-L1988 HydrophobicContact CB-CD2 4.07Å; V1932-L1988 HydrophobicContact CG1-CD2 3.99Å; V1932-L1988 HydrophobicContact CG2-CD1 4.25Å; V1932-L1988 HydrophobicContact CG2-CD2 3.69Å; V1986-L1988 HydrophobicContact CG1-CD2 3.93Å; V1986-L1988 HydrophobicContact CG1-CG 4.1Å; L1988-C1990 VanDerWaalsContact CD2-SG 3.56Å; L1988-C1990 WeakPolarHBondContact CD2-SG 3.43Å
1989	H	90.9	Very high	79.5	Confident	35.2 Å²	35.2	48.3 Å²	48.3	16%	0.163	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	115.5	168.7	172.1	70.6	0	0	0	110.2	R1889 T1890 V1930 Y1931 G1991 Y2293 L2295	R1889-H1989 WeakPolarHBondContact O-CA 3.3Å; T1890-H1989 HydrophobicContact CG2-CB 3.96Å; T1890-H1989 WeakPolarHBondContact CG2-ND1 3.38Å; V1930-H1989 WeakPolarHBondContact CA-O 3.47Å; Y1931-H1989 PolarHBondContact N-O 3.18Å; Y1931-H1989 PolarHBondContact O-N 3.12Å; H1989-G1991 WeakPolarHBondContact NE2-CA 3.25Å; H1989-G1991 PolarHBondContact O-N 3.04Å; H1989-Y2293 PolarHBondContact CD2-OH 3.5Å; H1989-Y2293 AromaticContact NE2-CE2 3.88Å; H1989-Y2293 AromaticContact NE2-CZ 3.74Å; H1989-Y2293 PolarHBondContact NE2-OH 3.13Å; H1989-L2295 HydrophobicContact CB-CD1 4.05Å; H1989-L2295 HydrophobicContact CB-CD2 4.18Å; H1989-L2295 VanDerWaalsContact CD2-CD2 3.48Å; H1989-L2295 WeakPolarHBondContact CD2-CD2 3.19Å
1990	C	91.1	Very high	79.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	92.9	171.2	-53.8	0	0	0	0	109	R1889 C1920 F1925 L1988	R1889-C1990 HydrophobicContact CB-CB 4.36Å; R1889-C1990 WeakPolarHBondContact CB-O 3.43Å; R1889-C1990 WeakPolarHBondContact CD-O 3.25Å; R1889-C1990 PolarHBondContact O-N 3.05Å; C1920-C1990 WeakPolarHBondContact CA-SG 3.17Å; C1920-C1990 HydrophobicContact CB-CB 3.88Å; C1920-C1990 WeakPolarHBondContact CB-SG 3.37Å; C1920-C1990 VanDerWaalsContact SG-CA 3.55Å; C1920-C1990 WeakPolarHBondContact SG-CB 3.29Å; C1920-C1990 CovalentContact SG-SG 2.04Å; C1920-C1990 PolarHBondContact SG-SG 3.02Å; F1925-C1990 HydrophobicContact CB-CB 3.86Å; F1925-C1990 HydrophobicContact CD2-CB 3.99Å; F1925-C1990 HydrophobicContact CG-CB 4.15Å; L1988-C1990 VanDerWaalsContact CD2-SG 3.56Å; L1988-C1990 WeakPolarHBondContact CD2-SG 3.43Å
1991	G	82.3	Confident	79.4	Confident	2.8 Å²	2.8	47.5 Å²	47.5	3%	0.029	25%	0.248	C	C	.	.			trans	-67.6	157.9	-179.2	0	0	0	0	0	113	N1929 H1989	N1929-G1991 VanDerWaalsContact O-CA 3.3Å; N1929-G1991 WeakPolarHBondContact O-CA 3.33Å; N1929-G1991 PolarHBondContact O-N 3Å; H1989-G1991 WeakPolarHBondContact NE2-CA 3.25Å; H1989-G1991 PolarHBondContact O-N 3.04Å
1992	R	78.2	Confident	79.5	Confident	137.2 Å²	137.2	47.5 Å²	47.5	52%	0.518	26%	0.258	S	S	.	.			trans	-74.6	141.6	168.7	-65.7	179.3	178.6	171.7	5.2	108.9	R1889 N1929 E1994	R1889-R1992 VanDerWaalsContact NH1-CZ 3.33Å; R1889-R1992 VanDerWaalsContact NH1-NH2 3.14Å; N1929-R1992 PolarHBondContact ND2-O 3.17Å; N1929-R1992 VanDerWaalsContact ND2-O 3.1Å; R1992-E1994 HydrophobicContact CB-CG 4.35Å; R1992-E1994 WeakPolarHBondContact CD-OE1 3.32Å; R1992-E1994 IonicContact CZ-OE1 3.36Å; R1992-E1994 IonicContact NE-OE1 2.93Å; R1992-E1994 IonicContact NH1-OE1 3.21Å; R1992-E1994 PolarHBondContact NH1-OE1 3.39Å; R1992-E1994 VanDerWaalsContact NH1-OE1 3.15Å; R1992-E1994 IonicContact NH1-OE2 2.87Å
1993	A	67.7	Low	79.9	Confident	19.2 Å²	19.2	47 Å²	47	16%	0.159	25%	0.25	C	S	.	.			trans	-117.3	46.1	165.6	0	0	0	0	0	109	Q1926 K1928 A1995 L2085	Q1926-A1993 HydrophobicContact CB-CB 4.33Å; Q1926-A1993 PolarHBondContact NE2-O 2.92Å; Q1926-A1993 VanDerWaalsContact OE1-CB 3.29Å; K1928-A1993 HydrophobicContact CB-CB 4.46Å; A1993-A1995 PolarHBondContact O-N 2.9Å; A1993-L2085 HydrophobicContact CB-CD1 4.01Å
1994	E	65.3	Low	80.5	Confident	131.4 Å²	131.4	41.9 Å²	41.9	61%	0.614	23%	0.227	S	C	*	.			trans	-73.4	115.1	171.5	-71.3	172.5	-166.1	0	0	108.7	R1992 V1996 N2059	R1992-E1994 HydrophobicContact CB-CG 4.35Å; R1992-E1994 WeakPolarHBondContact CD-OE1 3.32Å; R1992-E1994 IonicContact CZ-OE1 3.36Å; R1992-E1994 IonicContact NE-OE1 2.93Å; R1992-E1994 IonicContact NH1-OE1 3.21Å; R1992-E1994 PolarHBondContact NH1-OE1 3.39Å; R1992-E1994 VanDerWaalsContact NH1-OE1 3.15Å; R1992-E1994 IonicContact NH1-OE2 2.87Å; E1994-V1996 VanDerWaalsContact C-N 3.27Å; E1994-N2059 PolarHBondContact O-OD1 3.06Å
1995	A	62.1	Low	80.5	Confident	30.2 Å²	30.2	39.8 Å²	39.8	25%	0.25	22%	0.217	C	C	.	.			trans	-72.9	134.2	172.2	0	0	0	0	0	110.1	A1993 N1997 Y2000 N2059	A1993-A1995 PolarHBondContact O-N 2.9Å; A1995-N1997 WeakPolarHBondContact CB-O 3.46Å; A1995-N1997 PolarHBondContact O-N 3.08Å; A1995-N1997 VanDerWaalsContact O-N 3.14Å; A1995-Y2000 HydrophobicContact CB-CD2 4.37Å; A1995-N2059 WeakPolarHBondContact CA-ND2 3.44Å; A1995-N2059 HydrophobicContact CB-CB 4.03Å; A1995-N2059 WeakPolarHBondContact O-CB 3.47Å; A1995-N2059 PolarHBondContact O-ND2 3.06Å; A1995-N2059 VanDerWaalsContact O-ND2 3.11Å; A1995-N2059 PolarHBondContact O-OD1 2.99Å
1996	V	67.2	Low	80.8	Confident	82.8 Å²	82.8	39.8 Å²	39.8	50%	0.502	22%	0.218	S	C	.	.	S	Bend	trans	-63.7	-32.2	179.3	174.9	0	0	0	0	111.5	P1827 E1994 Y2000 H2003 N2059 D2083	P1827-V1996 HydrophobicContact CG-CG1 4.43Å; E1994-V1996 VanDerWaalsContact C-N 3.27Å; V1996-Y2000 HydrophobicContact CG1-CD2 3.27Å; V1996-Y2000 HydrophobicContact CG1-CE2 4.32Å; V1996-Y2000 HydrophobicContact CG1-CG 3.72Å; V1996-H2003 WeakPolarHBondContact CG2-CE1 3.31Å; V1996-H2003 WeakPolarHBondContact CG2-ND1 3.37Å; V1996-N2059 HydrophobicContact CB-CB 4.38Å; V1996-N2059 HydrophobicContact CG2-CB 3.53Å; V1996-N2059 PolarHBondContact N-ND2 3.13Å; V1996-N2059 VanDerWaalsContact N-ND2 3.12Å; V1996-D2083 HydrophobicContact CG2-CB 4.47Å
1997	N	74.3	Confident	80.9	Confident	47 Å²	47	39.8 Å²	39.8	25%	0.251	22%	0.218	S	C	.	.	S	Bend	trans	-103.6	124.1	168.9	-175.8	-2.7	0	0	0	109.3	A1995 E1999 Y2000	A1995-N1997 WeakPolarHBondContact CB-O 3.46Å; A1995-N1997 PolarHBondContact O-N 3.08Å; A1995-N1997 VanDerWaalsContact O-N 3.14Å; N1997-E1999 PolarHBondContact ND2-OE2 2.89Å; N1997-E1999 VanDerWaalsContact ND2-OE2 3.09Å; N1997-E1999 PolarHBondContact O-N 3.11Å; N1997-E1999 VanDerWaalsContact O-N 3.14Å; N1997-E1999 WeakPolarHBondContact OD1-CB 3.36Å; N1997-E1999 WeakPolarHBondContact OD1-CG 3.34Å; N1997-E1999 PolarHBondContact OD1-N 3.09Å; N1997-E1999 VanDerWaalsContact OD1-N 3.08Å; N1997-Y2000 HydrophobicContact CB-CD1 4.28Å; N1997-Y2000 HydrophobicContact CB-CD2 3.68Å; N1997-Y2000 HydrophobicContact CB-CE1 4.21Å; N1997-Y2000 HydrophobicContact CB-CE2 3.64Å; N1997-Y2000 VanDerWaalsContact CB-CE2 3.49Å; N1997-Y2000 HydrophobicContact CB-CG 4.09Å; N1997-Y2000 WeakPolarHBondContact O-CB 3.27Å; N1997-Y2000 PolarHBondContact O-N 2.97Å; N1997-Y2000 VanDerWaalsContact O-N 3.12Å
1998	P	71.4	Confident	81	Confident	114.4 Å²	114.4	39.6 Å²	39.6	74%	0.743	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.2	176.4	25.7	-36.5	0	0	0	114.2	L1830 Y2000	L1830-P1998 WeakPolarHBondContact CD1-O 3.31Å; P1998-Y2000 VanDerWaalsContact C-N 3.3Å; P1998-Y2000 PolarHBondContact O-N 3.42Å
1999	E	75.9	Confident	81.1	Confident	99 Å²	99	39.6 Å²	39.6	46%	0.463	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.3	174.5	-63.2	175.9	155.4	0	0	113.7	N1829 L1830 N1997	N1829-E1999 CarbonylContact C-O 3.57Å; N1829-E1999 WeakPolarHBondContact CA-O 3.36Å; L1830-E1999 WeakPolarHBondContact CB-O 3.37Å; L1830-E1999 WeakPolarHBondContact CG-O 3.41Å; L1830-E1999 PolarHBondContact N-O 3.08Å; N1997-E1999 PolarHBondContact ND2-OE2 2.89Å; N1997-E1999 VanDerWaalsContact ND2-OE2 3.09Å; N1997-E1999 PolarHBondContact O-N 3.11Å; N1997-E1999 VanDerWaalsContact O-N 3.14Å; N1997-E1999 WeakPolarHBondContact OD1-CB 3.36Å; N1997-E1999 WeakPolarHBondContact OD1-CG 3.34Å; N1997-E1999 PolarHBondContact OD1-N 3.09Å; N1997-E1999 VanDerWaalsContact OD1-N 3.08Å
2000	Y	79.5	Confident	81	Confident	40.6 Å²	40.6	38 Å²	38	16%	0.159	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-80.2	134.9	-178.1	-64.8	-37.8	0	0	0	112.2	K1826 P1827 N1829 A1995 V1996 N1997 P1998 G2002 V2030	K1826-Y2000 HydrophobicContact CB-CE1 4.36Å; K1826-Y2000 HydrophobicContact CD-CE1 4.44Å; P1827-Y2000 HydrophobicContact CB-CD1 4.35Å; P1827-Y2000 HydrophobicContact CB-CG 4.45Å; P1827-Y2000 HydrophobicContact CG-CD1 3.62Å; P1827-Y2000 HydrophobicContact CG-CD2 3.79Å; P1827-Y2000 HydrophobicContact CG-CE1 4.19Å; P1827-Y2000 HydrophobicContact CG-CE2 4.26Å; P1827-Y2000 HydrophobicContact CG-CG 3.4Å; P1827-Y2000 VanDerWaalsContact CG-CG 3.4Å; P1827-Y2000 WeakPolarHBondContact O-CD1 3.25Å; N1829-Y2000 VanDerWaalsContact OD1-CD1 3.28Å; N1829-Y2000 WeakPolarHBondContact OD1-CD1 3.31Å; N1829-Y2000 VanDerWaalsContact OD1-CE1 3.25Å; N1829-Y2000 WeakPolarHBondContact OD1-CE1 3.39Å; A1995-Y2000 HydrophobicContact CB-CD2 4.37Å; V1996-Y2000 HydrophobicContact CG1-CD2 3.27Å; V1996-Y2000 HydrophobicContact CG1-CE2 4.32Å; V1996-Y2000 HydrophobicContact CG1-CG 3.72Å; N1997-Y2000 HydrophobicContact CB-CD1 4.28Å; N1997-Y2000 HydrophobicContact CB-CD2 3.68Å; N1997-Y2000 HydrophobicContact CB-CE1 4.21Å; N1997-Y2000 HydrophobicContact CB-CE2 3.64Å; N1997-Y2000 VanDerWaalsContact CB-CE2 3.49Å; N1997-Y2000 HydrophobicContact CB-CG 4.09Å; N1997-Y2000 WeakPolarHBondContact O-CB 3.27Å; N1997-Y2000 PolarHBondContact O-N 2.97Å; N1997-Y2000 VanDerWaalsContact O-N 3.12Å; P1998-Y2000 VanDerWaalsContact C-N 3.3Å; P1998-Y2000 PolarHBondContact O-N 3.42Å; Y2000-G2002 VanDerWaalsContact C-N 3.28Å; Y2000-G2002 PolarHBondContact O-N 2.74Å; Y2000-V2030 HydrophobicContact CE2-CG1 3.79Å
2001	V	76.7	Confident	80.7	Confident	22.75 Å²	22.75	38.2 Å²	38.2	14%	0.138	21%	0.212	C	C	.	.			trans	-93.1	90.2	179.9	-168.6	0	0	0	0	111.2	Y1632 P1803 V1828 L1830 I1833 F1843	Y1632-V2001 HydrophobicContact CD2-CG1 4.38Å; Y1632-V2001 HydrophobicContact CE1-CG1 4.33Å; Y1632-V2001 HydrophobicContact CE2-CB 4.31Å; Y1632-V2001 HydrophobicContact CE2-CG1 3.46Å; Y1632-V2001 WeakPolarHBondContact OH-CB 3.2Å; Y1632-V2001 WeakPolarHBondContact OH-CG1 3.39Å; Y1632-V2001 WeakPolarHBondContact OH-CG2 3.38Å; P1803-V2001 WeakPolarHBondContact CB-O 3.2Å; P1803-V2001 HydrophobicContact CG-CG1 4.41Å; P1803-V2001 WeakPolarHBondContact CG-O 3.32Å; V1828-V2001 HydrophobicContact CG1-CB 4.34Å; V1828-V2001 PolarHBondContact O-N 3.14Å; L1830-V2001 HydrophobicContact CB-CG2 4.25Å; L1830-V2001 HydrophobicContact CD1-CG2 4.2Å; L1830-V2001 HydrophobicContact CD2-CG2 3.52Å; L1830-V2001 VanDerWaalsContact CD2-CG2 3.42Å; L1830-V2001 HydrophobicContact CG-CG2 3.79Å; I1833-V2001 HydrophobicContact CD1-CB 4.08Å; I1833-V2001 HydrophobicContact CD1-CG1 4.17Å; I1833-V2001 HydrophobicContact CD1-CG2 3.63Å; I1833-V2001 VanDerWaalsContact CD1-CG2 3.41Å; I1833-V2001 HydrophobicContact CG1-CG2 4.41Å; F1843-V2001 HydrophobicContact CD1-CG1 3.48Å; F1843-V2001 VanDerWaalsContact CD1-CG1 3.48Å; F1843-V2001 HydrophobicContact CD2-CG1 4.31Å; F1843-V2001 HydrophobicContact CE1-CG1 3.61Å; F1843-V2001 HydrophobicContact CE2-CG1 4.42Å; F1843-V2001 HydrophobicContact CG-CG1 3.86Å; F1843-V2001 HydrophobicContact CZ-CG1 4.09Å
2002	G	79.4	Confident	80.5	Confident	40 Å²	40	39.9 Å²	39.9	41%	0.412	22%	0.22	S	C	.	.	S	Bend	trans	66.9	-171.1	175.7	0	0	0	0	0	113.9	P1827 Y2000	P1827-G2002 WeakPolarHBondContact CB-O 3.02Å; Y2000-G2002 VanDerWaalsContact C-N 3.28Å; Y2000-G2002 PolarHBondContact O-N 2.74Å
2003	H	87.2	Confident	80.6	Confident	17.25 Å²	17.25	35.4 Å²	35.4	8%	0.08	21%	0.209	C	C	.	.			trans	-103.6	146.4	176.6	-64.8	0.3	0	0	0	110.3	P1803 N1804 V1996 G2031 L2034 N2059 S2061	P1803-H2003 VanDerWaalsContact CA-O 3.3Å; P1803-H2003 WeakPolarHBondContact CA-O 3.37Å; N1804-H2003 PolarHBondContact N-O 3Å; N1804-H2003 VanDerWaalsContact N-O 3.12Å; V1996-H2003 WeakPolarHBondContact CG2-CE1 3.31Å; V1996-H2003 WeakPolarHBondContact CG2-ND1 3.37Å; H2003-G2031 CarbonylContact C-O 3.56Å; H2003-G2031 WeakPolarHBondContact CA-O 3.31Å; H2003-G2031 WeakPolarHBondContact CB-O 3.26Å; H2003-G2031 PolarHBondContact ND1-O 2.81Å; H2003-G2031 VanDerWaalsContact ND1-O 3.16Å; H2003-L2034 HydrophobicContact CB-CB 3.57Å; H2003-L2034 HydrophobicContact CB-CD2 4.25Å; H2003-N2059 PolarHBondContact CD2-O 3.04Å; H2003-N2059 PolarHBondContact CE1-O 3.01Å; H2003-N2059 PolarHBondContact ND1-O 3.15Å; H2003-N2059 PolarHBondContact NE2-ND2 3.44Å; H2003-N2059 PolarHBondContact NE2-O 2.8Å; H2003-S2061 VanDerWaalsContact CD2-CB 3.5Å; H2003-S2061 WeakPolarHBondContact CD2-CB 3.36Å
2004	W	91.1	Very high	80.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-96.6	169.2	171.9	64.9	-80.5	0	0	0	111.1	I1801 Y1802 I1807 L1825 G2006 L2007 I2029 V2030 G2031 A2032 G2033 L2034	I1801-W2004 HydrophobicContact CB-CB 4.12Å; I1801-W2004 HydrophobicContact CB-CD2 4.07Å; I1801-W2004 HydrophobicContact CB-CE3 4.27Å; I1801-W2004 HydrophobicContact CB-CG 4Å; I1801-W2004 HydrophobicContact CD1-CD2 3.74Å; I1801-W2004 HydrophobicContact CD1-CE3 3.51Å; I1801-W2004 VanDerWaalsContact CD1-CE3 3.46Å; I1801-W2004 HydrophobicContact CD1-CG 4.5Å; I1801-W2004 HydrophobicContact CD1-CH2 3.69Å; I1801-W2004 HydrophobicContact CD1-CZ2 3.88Å; I1801-W2004 HydrophobicContact CD1-CZ3 3.47Å; I1801-W2004 VanDerWaalsContact CD1-CZ3 3.46Å; I1801-W2004 HydrophobicContact CG1-CD2 4.49Å; I1801-W2004 HydrophobicContact CG1-CE3 4.46Å; I1801-W2004 HydrophobicContact CG2-CB 3.76Å; I1801-W2004 HydrophobicContact CG2-CD2 4.05Å; I1801-W2004 HydrophobicContact CG2-CE3 3.87Å; I1801-W2004 HydrophobicContact CG2-CG 4.02Å; Y1802-W2004 WeakPolarHBondContact O-CB 3.4Å; I1807-W2004 HydrophobicContact CD1-CZ3 4.39Å; I1807-W2004 HydrophobicContact CG1-CZ3 4.42Å; L1825-W2004 HydrophobicContact CB-CH2 4.38Å; L1825-W2004 HydrophobicContact CB-CZ2 3.97Å; L1825-W2004 HydrophobicContact CD1-CH2 4.21Å; L1825-W2004 HydrophobicContact CD1-CZ2 4.49Å; W2004-G2006 WeakPolarHBondContact CZ3-O 3.29Å; W2004-G2006 PolarHBondContact O-N 3.01Å; W2004-L2007 HydrophobicContact CH2-CD2 4.06Å; W2004-L2007 HydrophobicContact CH2-CG 4.12Å; W2004-L2007 HydrophobicContact CZ3-CD2 4.24Å; W2004-I2029 HydrophobicContact CH2-CG2 4.37Å; W2004-I2029 HydrophobicContact CZ2-CG2 3.95Å; W2004-V2030 PolarHBondContact NE1-O 2.99Å; W2004-G2031 PolarHBondContact N-O 3.05Å; W2004-G2031 VanDerWaalsContact N-O 3.17Å; W2004-G2031 PolarHBondContact NE1-O 2.96Å; W2004-A2032 HydrophobicContact CD2-CB 4.1Å; W2004-A2032 VanDerWaalsContact CE2-CB 3.47Å; W2004-A2032 HydrophobicContact CH2-CB 4.35Å; W2004-A2032 HydrophobicContact CZ2-CB 3.68Å; W2004-A2032 CarbonylContact O-C 3.53Å; W2004-A2032 VanDerWaalsContact O-C 3.3Å; W2004-A2032 WeakPolarHBondContact O-CA 3.35Å; W2004-G2033 PolarHBondContact O-N 2.85Å; W2004-L2034 CarbonylContact C-O 3.56Å; W2004-L2034 PolarHBondContact O-N 2.99Å
2005	G	86.5	Confident	81.3	Confident	2 Å²	2	30.6 Å²	30.6	2%	0.021	18%	0.184	C	C	.	.			trans	-65.5	-31.9	-168.8	0	0	0	0	0	116.3	V1805 L2034 S2040	V1805-G2005 VanDerWaalsContact O-CA 3.32Å; V1805-G2005 WeakPolarHBondContact O-CA 3.33Å; V1805-G2005 PolarHBondContact O-N 3.11Å; G2005-L2034 VanDerWaalsContact CA-O 3.26Å; G2005-L2034 WeakPolarHBondContact CA-O 3.34Å; G2005-L2034 PolarHBondContact N-O 3.03Å; G2005-S2040 PolarHBondContact O-OG 2.9Å; G2005-S2040 VanDerWaalsContact O-OG 3.09Å
2006	G	93.2	Very high	81.5	Confident	1.5 Å²	1.5	32.2 Å²	32.2	2%	0.015	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	100.3	-180	-173.6	0	0	0	0	0	113.9	I1807 W2004 A2042	I1807-G2006 PolarHBondContact N-O 3.04Å; I1807-G2006 VanDerWaalsContact N-O 3.1Å; W2004-G2006 WeakPolarHBondContact CZ3-O 3.29Å; W2004-G2006 PolarHBondContact O-N 3.01Å; G2006-A2042 CarbonylContact C-O 3.51Å; G2006-A2042 WeakPolarHBondContact CA-O 3.36Å
2007	L	95.1	Very high	81.2	Confident	2.25 Å²	2.25	29.9 Å²	29.9	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	126	174.6	-59.9	-178.3	0	0	0	109.7	I1807 L1813 L1825 W2004 F2009 L2024 I2029 A2042 I2043 T2044	I1807-L2007 HydrophobicContact CB-CD2 3.91Å; I1807-L2007 HydrophobicContact CD1-CD2 3.87Å; I1807-L2007 HydrophobicContact CG1-CD2 4.37Å; I1807-L2007 HydrophobicContact CG2-CD2 4.3Å; L1813-L2007 HydrophobicContact CD2-CD1 4.49Å; L1825-L2007 HydrophobicContact CD1-CD1 3.97Å; L1825-L2007 HydrophobicContact CD1-CD2 4.02Å; L1825-L2007 HydrophobicContact CD1-CG 4.27Å; W2004-L2007 HydrophobicContact CH2-CD2 4.06Å; W2004-L2007 HydrophobicContact CH2-CG 4.12Å; W2004-L2007 HydrophobicContact CZ3-CD2 4.24Å; L2007-F2009 HydrophobicContact CB-CD2 4.47Å; L2007-F2009 HydrophobicContact CB-CE2 3.89Å; L2007-F2009 HydrophobicContact CB-CZ 4.46Å; L2007-F2009 HydrophobicContact CD1-CE2 4.31Å; L2007-F2009 HydrophobicContact CD1-CZ 4.41Å; L2007-L2024 HydrophobicContact CD1-CD1 4.13Å; L2007-I2029 HydrophobicContact CD1-CD1 3.8Å; L2007-I2029 HydrophobicContact CG-CD1 4.44Å; L2007-A2042 PolarHBondContact N-O 2.75Å; L2007-I2043 HydrophobicContact CB-CG1 4.47Å; L2007-I2043 HydrophobicContact CB-CG2 4.49Å; L2007-I2043 CarbonylContact O-C 3.4Å; L2007-I2043 WeakPolarHBondContact O-CA 3.27Å; L2007-T2044 PolarHBondContact O-N 2.98Å; L2007-T2044 PolarHBondContact O-OG1 2.77Å
2008	F	94.1	Very high	80.8	Confident	7 Å²	7	35.6 Å²	35.6	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	110.6	178	-160.9	-71.8	0	0	0	109.9	R1806 I1807 L1808 V1809 A2010 T2044 V2046 L2116	R1806-F2008 HydrophobicContact CG-CB 4.25Å; I1807-F2008 PolarHBondContact O-N 3.02Å; L1808-F2008 CarbonylContact C-O 3.56Å; L1808-F2008 WeakPolarHBondContact CA-O 3.38Å; L1808-F2008 HydrophobicContact CD1-CB 4.13Å; L1808-F2008 HydrophobicContact CD1-CD1 3.51Å; L1808-F2008 VanDerWaalsContact CD1-CD1 3.44Å; L1808-F2008 HydrophobicContact CD1-CE1 4.34Å; L1808-F2008 HydrophobicContact CD1-CG 4.13Å; V1809-F2008 PolarHBondContact N-O 3.07Å; F2008-A2010 HydrophobicContact CD1-CB 4.14Å; F2008-A2010 HydrophobicContact CE1-CB 3.92Å; F2008-T2044 CarbonylContact C-O 3.59Å; F2008-T2044 WeakPolarHBondContact CA-O 3.23Å; F2008-T2044 WeakPolarHBondContact CA-OG1 3.4Å; F2008-T2044 WeakPolarHBondContact CB-OG1 3.26Å; F2008-T2044 HydrophobicContact CD2-CG2 4.12Å; F2008-T2044 WeakPolarHBondContact CD2-OG1 3.19Å; F2008-T2044 HydrophobicContact CE2-CG2 3.61Å; F2008-T2044 VanDerWaalsContact CG-OG1 3.31Å; F2008-T2044 WeakPolarHBondContact CG-OG1 3.18Å; F2008-T2044 HydrophobicContact CZ-CG2 4.05Å; F2008-V2046 HydrophobicContact CE1-CB 4.39Å; F2008-V2046 HydrophobicContact CE1-CG2 3.79Å; F2008-V2046 HydrophobicContact CE2-CG2 4.46Å; F2008-V2046 HydrophobicContact CZ-CB 4.47Å; F2008-V2046 HydrophobicContact CZ-CG2 3.57Å; F2008-L2116 HydrophobicContact CZ-CD2 4.44Å
2009	F	93.2	Very high	80.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.3	174.8	-62.7	-91.7	0	0	0	109.1	V1809 L1813 L2007 L2024 I2043 T2044 V2045 V2046 R2048 V2050	V1809-F2009 HydrophobicContact CB-CD1 3.7Å; V1809-F2009 HydrophobicContact CB-CE1 4.05Å; V1809-F2009 HydrophobicContact CB-CG 4.39Å; V1809-F2009 HydrophobicContact CG1-CD1 3.89Å; V1809-F2009 HydrophobicContact CG1-CE1 4.05Å; V1809-F2009 HydrophobicContact CG2-CD1 4.03Å; V1809-F2009 HydrophobicContact CG2-CE1 3.95Å; V1809-F2009 HydrophobicContact CG2-CZ 4.48Å; L1813-F2009 HydrophobicContact CB-CE1 4.08Å; L1813-F2009 HydrophobicContact CD2-CE1 4.15Å; L1813-F2009 HydrophobicContact CD2-CZ 3.95Å; L2007-F2009 HydrophobicContact CB-CD2 4.47Å; L2007-F2009 HydrophobicContact CB-CE2 3.89Å; L2007-F2009 HydrophobicContact CB-CZ 4.46Å; L2007-F2009 HydrophobicContact CD1-CE2 4.31Å; L2007-F2009 HydrophobicContact CD1-CZ 4.41Å; F2009-L2024 HydrophobicContact CE2-CD1 4.38Å; F2009-L2024 HydrophobicContact CZ-CD1 4.24Å; F2009-L2024 HydrophobicContact CZ-CD2 4.41Å; F2009-L2024 HydrophobicContact CZ-CG 4.38Å; F2009-I2043 HydrophobicContact CD2-CG2 4.13Å; F2009-I2043 HydrophobicContact CE2-CG2 3.97Å; F2009-T2044 PolarHBondContact N-O 3.11Å; F2009-V2045 HydrophobicContact CB-CB 4.43Å; F2009-V2045 HydrophobicContact CB-CG1 4.19Å; F2009-V2045 HydrophobicContact CB-CG2 4.23Å; F2009-V2045 HydrophobicContact CD2-CG2 3.97Å; F2009-V2045 HydrophobicContact CG-CG2 4.43Å; F2009-V2045 CarbonylContact O-C 3.5Å; F2009-V2045 WeakPolarHBondContact O-CA 3.45Å; F2009-V2046 PolarHBondContact O-N 3.15Å; F2009-R2048 HydrophobicContact CB-CG 4.46Å; F2009-V2050 HydrophobicContact CB-CG2 4.2Å; F2009-V2050 HydrophobicContact CD1-CG2 3.83Å; F2009-V2050 HydrophobicContact CD2-CG2 4.13Å; F2009-V2050 HydrophobicContact CE1-CG1 4.41Å; F2009-V2050 HydrophobicContact CE1-CG2 4.17Å; F2009-V2050 HydrophobicContact CE2-CG2 4.4Å; F2009-V2050 HydrophobicContact CG-CG2 3.8Å; F2009-V2050 HydrophobicContact CZ-CG1 4.41Å; F2009-V2050 HydrophobicContact CZ-CG2 4.43Å
2010	A	89.5	Confident	80.2	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.			trans	-129.5	162.4	175.9	0	0	0	0	0	110.8	L1808 V1809 L1810 F2008 V2046 R2048 Y2117	L1808-A2010 HydrophobicContact CD1-CB 4.24Å; V1809-A2010 PolarHBondContact O-N 2.98Å; V1809-A2010 VanDerWaalsContact O-N 3.1Å; L1810-A2010 HydrophobicContact CD2-CB 3.85Å; F2008-A2010 HydrophobicContact CD1-CB 4.14Å; F2008-A2010 HydrophobicContact CE1-CB 3.92Å; A2010-V2046 WeakPolarHBondContact CA-O 3.47Å; A2010-R2048 VanDerWaalsContact C-CD 3.43Å; A2010-R2048 WeakPolarHBondContact O-CD 3.28Å; A2010-R2048 PolarHBondContact O-NH1 3.01Å; A2010-Y2117 HydrophobicContact CB-CD1 3.87Å; A2010-Y2117 HydrophobicContact CB-CG 4.42Å; A2010-Y2117 WeakPolarHBondContact CB-O 3.37Å
2011	A	84.9	Confident	80.2	Confident	5.75 Å²	5.75	39.7 Å²	39.7	5%	0.048	22%	0.215	C	C	.	.			trans	-70.1	151.8	165.3	0	0	0	0	0	111	A2017 V2046 Y2047	A2011-A2017 HydrophobicContact CB-CB 4.45Å; A2011-V2046 PolarHBondContact N-O 3.34Å; A2011-Y2047 HydrophobicContact CB-CD1 3.82Å; A2011-Y2047 HydrophobicContact CB-CG 4.47Å
2012	D	78.6	Confident	80.9	Confident	38 Å²	38	38.7 Å²	38.7	20%	0.203	21%	0.209	C	C	.	.	S	Bend	trans	-76	-33	177.8	61.2	-30.9	0	0	0	113	P1787 R2018 M2020	P1787-D2012 HydrophobicContact CB-CB 3.9Å; P1787-D2012 HydrophobicContact CG-CB 3.57Å; D2012-R2018 PolarHBondContact OD1-N 2.82Å; D2012-R2018 VanDerWaalsContact OD2-CD 3.28Å; D2012-R2018 WeakPolarHBondContact OD2-CD 3.31Å; D2012-R2018 IonicContact OD2-CZ 3.56Å; D2012-R2018 IonicContact OD2-NE 3.24Å; D2012-R2018 PolarHBondContact OD2-NE 3.4Å; D2012-R2018 IonicContact OD2-NH1 3.52Å; D2012-M2020 HydrophobicContact CB-CE 4.08Å; D2012-M2020 VanDerWaalsContact OD2-CE 3.24Å; D2012-M2020 WeakPolarHBondContact OD2-CE 3.39Å
2013	S	79.1	Confident	81.6	Confident	41.5 Å²	41.5	37.4 Å²	37.4	29%	0.29	19%	0.194	S	C	.	.	S	Bend	trans	-123	146	175	154.4	0	0	0	0	110.5	E2015 T2016	S2013-E2015 VanDerWaalsContact C-N 3.28Å; S2013-E2015 PolarHBondContact O-N 2.9Å; S2013-E2015 PolarHBondContact OG-N 3.23Å; S2013-T2016 WeakPolarHBondContact CB-O 3.36Å; S2013-T2016 WeakPolarHBondContact OG-CA 3.19Å; S2013-T2016 WeakPolarHBondContact OG-CB 3.48Å; S2013-T2016 PolarHBondContact OG-N 3Å; S2013-T2016 PolarHBondContact OG-O 2.94Å; S2013-T2016 PolarHBondContact OG-OG1 2.83Å
2014	V	75	Confident	82	Confident	16.5 Å²	16.5	36.7 Å²	36.7	10%	0.1	19%	0.191	C	C	.	.	S	Bend	trans	-68.2	-25.9	177.2	-173.4	0	0	0	0	111.9	M1674 Y2047 G2118 I2120 V2135	M1674-V2014 HydrophobicContact CE-CB 3.83Å; M1674-V2014 HydrophobicContact CE-CG2 3.32Å; M1674-V2014 HydrophobicContact CG-CG2 4.13Å; M1674-V2014 HydrophobicContact SD-CG2 4.09Å; V2014-Y2047 WeakPolarHBondContact O-CE1 3.41Å; V2014-G2118 WeakPolarHBondContact CG1-O 3.35Å; V2014-I2120 HydrophobicContact CG1-CD1 4.14Å; V2014-I2120 HydrophobicContact CG1-CG1 3.8Å; V2014-I2120 HydrophobicContact CG2-CG1 4.38Å; V2014-V2135 HydrophobicContact CB-CG1 4.09Å; V2014-V2135 HydrophobicContact CG1-CB 4.33Å; V2014-V2135 HydrophobicContact CG1-CG1 3.56Å; V2014-V2135 HydrophobicContact CG1-CG2 4.04Å
2015	E	73.3	Confident	82.2	Confident	33.25 Å²	33.25	41.7 Å²	41.7	16%	0.155	21%	0.209	C	C	.	.	S	Bend	trans	-102.6	-31.3	-176.4	-59.6	-158	115.4	0	0	114	S2013 V2131 E2132 K2133 R2134 V2135	S2013-E2015 VanDerWaalsContact C-N 3.28Å; S2013-E2015 PolarHBondContact O-N 2.9Å; S2013-E2015 PolarHBondContact OG-N 3.23Å; E2015-V2131 WeakPolarHBondContact OE1-CA 3.24Å; E2015-E2132 VanDerWaalsContact CD-N 3.32Å; E2015-E2132 PolarHBondContact OE1-N 3.2Å; E2015-E2132 WeakPolarHBondContact OE2-CB 3.39Å; E2015-E2132 PolarHBondContact OE2-N 2.9Å; E2015-K2133 PolarHBondContact OE1-N 2.96Å; E2015-K2133 VanDerWaalsContact OE1-N 3.08Å; E2015-R2134 WeakPolarHBondContact CG-O 3.32Å; E2015-R2134 PolarHBondContact OE1-N 3.36Å; E2015-R2134 VanDerWaalsContact OE1-N 3.14Å; E2015-V2135 HydrophobicContact CG-CG2 3.97Å
2016	T	65.9	Low	82.6	Confident	65 Å²	65	43.4 Å²	43.4	40%	0.399	22%	0.217	S	C	.	.			trans	-125.7	103.9	-174.7	-18	0	0	0	0	110.6	S2013 R2018	S2013-T2016 WeakPolarHBondContact CB-O 3.36Å; S2013-T2016 WeakPolarHBondContact OG-CA 3.19Å; S2013-T2016 WeakPolarHBondContact OG-CB 3.48Å; S2013-T2016 PolarHBondContact OG-N 3Å; S2013-T2016 PolarHBondContact OG-O 2.94Å; S2013-T2016 PolarHBondContact OG-OG1 2.83Å; T2016-R2018 PolarHBondContact O-N 3.19Å; T2016-R2018 VanDerWaalsContact O-N 3.15Å
2017	A	62	Low	82.8	Confident	34.5 Å²	34.5	43.4 Å²	43.4	29%	0.285	22%	0.216	S	C	.	.			trans	-72.3	101.9	166.6	0	0	0	0	0	108.9	A2011 N2019 Y2047	A2011-A2017 HydrophobicContact CB-CB 4.45Å; A2017-N2019 PolarHBondContact O-N 2.83Å; A2017-Y2047 HydrophobicContact CB-CD1 4.33Å; A2017-Y2047 HydrophobicContact CB-CE1 4.29Å
2018	R	65.3	Low	82.8	Confident	166.5 Å²	166.5	45.6 Å²	45.6	63%	0.628	23%	0.227	S	C	*	.			trans	-64.2	138.1	167.4	-67.3	-173	-179.8	-176	-0.3	108.5	D2012 T2016 M2020	D2012-R2018 PolarHBondContact OD1-N 2.82Å; D2012-R2018 VanDerWaalsContact OD2-CD 3.28Å; D2012-R2018 WeakPolarHBondContact OD2-CD 3.31Å; D2012-R2018 IonicContact OD2-CZ 3.56Å; D2012-R2018 IonicContact OD2-NE 3.24Å; D2012-R2018 PolarHBondContact OD2-NE 3.4Å; D2012-R2018 IonicContact OD2-NH1 3.52Å; T2016-R2018 PolarHBondContact O-N 3.19Å; T2016-R2018 VanDerWaalsContact O-N 3.15Å; R2018-M2020 HydrophobicContact CB-CE 3.93Å; R2018-M2020 HydrophobicContact CB-CG 4.15Å; R2018-M2020 HydrophobicContact CG-CE 4.44Å; R2018-M2020 PolarHBondContact O-N 3.05Å
2019	N	63	Low	82.8	Confident	148.75 Å²	148.75	45.3 Å²	45.3	80%	0.795	23%	0.225	S	C	*	.			trans	-69.7	74.8	177.2	-107.7	-8.6	0	0	0	110.9	A2017 Q2021	A2017-N2019 PolarHBondContact O-N 2.83Å; N2019-Q2021 PolarHBondContact O-N 3.13Å
2020	M	71.3	Confident	82.8	Confident	31.75 Å²	31.75	46.1 Å²	46.1	16%	0.156	23%	0.23	C	C	.	.			trans	-96.2	102.9	175.3	-62.4	-164.8	-161.4	0	0	108.7	P1787 L1810 D2012 R2018 S2022 R2048	P1787-M2020 HydrophobicContact CB-CE 4.28Å; L1810-M2020 VanDerWaalsContact O-SD 3.37Å; D2012-M2020 HydrophobicContact CB-CE 4.08Å; D2012-M2020 VanDerWaalsContact OD2-CE 3.24Å; D2012-M2020 WeakPolarHBondContact OD2-CE 3.39Å; R2018-M2020 HydrophobicContact CB-CE 3.93Å; R2018-M2020 HydrophobicContact CB-CG 4.15Å; R2018-M2020 HydrophobicContact CG-CE 4.44Å; R2018-M2020 PolarHBondContact O-N 3.05Å; M2020-S2022 PolarHBondContact O-N 3.17Å; M2020-S2022 VanDerWaalsContact O-N 3.12Å; M2020-R2048 VanDerWaalsContact CB-NH2 3.31Å; M2020-R2048 PolarHBondContact O-NE 3.1Å; M2020-R2048 VanDerWaalsContact O-NE 3.13Å; M2020-R2048 PolarHBondContact O-NH2 3.1Å
2021	Q	80.1	Confident	82.8	Confident	159.5 Å²	159.5	46.2 Å²	46.2	75%	0.745	23%	0.231	S	C	*	.			trans	-73.6	120.6	177.5	-67.7	-179.2	-12.3	0	0	110.2	S1812 N2019	S1812-Q2021 PolarHBondContact OG-O 2.93Å; S1812-Q2021 VanDerWaalsContact OG-O 3.07Å; N2019-Q2021 PolarHBondContact O-N 3.13Å
2022	S	91.8	Very high	83.1	Confident	1.75 Å²	1.75	45.9 Å²	45.9	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	144.1	165.8	-68.8	0	0	0	0	108.8	L1813 M2020 R2048 I2051	L1813-S2022 PolarHBondContact N-OG 3.04Å; L1813-S2022 VanDerWaalsContact N-OG 3.1Å; L1813-S2022 VanDerWaalsContact O-CA 3.26Å; L1813-S2022 WeakPolarHBondContact O-CA 3.41Å; L1813-S2022 VanDerWaalsContact O-CB 3.28Å; L1813-S2022 WeakPolarHBondContact O-CB 3.34Å; M2020-S2022 PolarHBondContact O-N 3.17Å; M2020-S2022 VanDerWaalsContact O-N 3.12Å; S2022-R2048 PolarHBondContact OG-NH2 2.83Å; S2022-R2048 VanDerWaalsContact OG-NH2 3.15Å; S2022-I2051 PolarHBondContact O-N 3.25Å; S2022-I2051 VanDerWaalsContact O-N 3.15Å
2023	S	93.4	Very high	83.6	Confident	13.5 Å²	13.5	44.1 Å²	44.1	9%	0.094	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	135.1	-178.5	65.9	0	0	0	0	111.5	L1813 A1815 I2051	L1813-S2023 PolarHBondContact O-N 2.95Å; L1813-S2023 VanDerWaalsContact O-N 3.08Å; A1815-S2023 PolarHBondContact N-O 2.98Å; S2023-I2051 WeakPolarHBondContact CA-O 3.43Å
2024	L	95	Very high	84	Confident	2 Å²	2	43 Å²	43	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	110	174.4	-59.4	-179.6	0	0	0	108.2	L1813 A1815 L2007 F2009 V2027 I2043 V2050 I2051 F2052 D2053 V2055	L1813-L2024 HydrophobicContact CD2-CD2 4.2Å; L1813-L2024 HydrophobicContact CG-CD2 4.39Å; A1815-L2024 HydrophobicContact CB-CD2 3.79Å; L2007-L2024 HydrophobicContact CD1-CD1 4.13Å; F2009-L2024 HydrophobicContact CE2-CD1 4.38Å; F2009-L2024 HydrophobicContact CZ-CD1 4.24Å; F2009-L2024 HydrophobicContact CZ-CD2 4.41Å; F2009-L2024 HydrophobicContact CZ-CG 4.38Å; L2024-V2027 HydrophobicContact CB-CG2 4.06Å; L2024-V2027 HydrophobicContact CD2-CG2 4.43Å; L2024-I2043 HydrophobicContact CD1-CD1 4.33Å; L2024-V2050 HydrophobicContact CG-CG1 4.35Å; L2024-I2051 PolarHBondContact N-O 3Å; L2024-F2052 HydrophobicContact CB-CD1 4.44Å; L2024-F2052 HydrophobicContact CD1-CD1 4.07Å; L2024-F2052 HydrophobicContact CD1-CE1 3.79Å; L2024-D2053 PolarHBondContact O-N 3.21Å; L2024-V2055 HydrophobicContact CB-CG2 3.87Å; L2024-V2055 WeakPolarHBondContact O-CG2 3.33Å
2025	R	95.4	Very high	84.4	Confident	103.75 Å²	103.75	42.6 Å²	42.6	39%	0.392	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.4	177.9	-57.3	-163.8	174.8	146.9	-1.2	111	A1815 G1817 D2053	A1815-R2025 PolarHBondContact O-N 3.11Å; G1817-R2025 WeakPolarHBondContact CA-O 3.39Å; G1817-R2025 PolarHBondContact N-O 3.06Å; R2025-D2053 CarbonylContact C-O 3.46Å; R2025-D2053 VanDerWaalsContact CA-O 3.26Å; R2025-D2053 WeakPolarHBondContact CA-O 3.37Å; R2025-D2053 HydrophobicContact CG-CB 4.1Å; R2025-D2053 IonicContact NE-OD2 3.41Å
2026	H	95.8	Very high	84.9	Confident	37.75 Å²	37.75	41.7 Å²	41.7	18%	0.175	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.6	57	-178.9	-58	83.7	0	0	0	112.3	G1817 F1819 P1822 I1823 D2053 H2054	G1817-H2026 PolarHBondContact O-ND1 3.01Å; F1819-H2026 PolarHBondContact N-CD2 3Å; F1819-H2026 VanDerWaalsContact N-CD2 3.28Å; P1822-H2026 WeakPolarHBondContact CA-O 3.31Å; P1822-H2026 WeakPolarHBondContact CB-O 3.37Å; I1823-H2026 PolarHBondContact N-O 3.05Å; I1823-H2026 VanDerWaalsContact N-O 3.07Å; H2026-D2053 PolarHBondContact N-O 3.1Å; H2026-H2054 WeakPolarHBondContact CA-O 3.29Å; H2026-H2054 AromaticContact CD2-CD2 3.99Å; H2026-H2054 AromaticContact CD2-CG 3.85Å; H2026-H2054 AromaticContact CE1-CG 3.9Å; H2026-H2054 AromaticContact CE1-ND1 3.7Å; H2026-H2054 PolarHBondContact N-O 3.15Å; H2026-H2054 AromaticContact NE2-CD2 3.7Å; H2026-H2054 PolarHBondContact NE2-CD2 2.94Å; H2026-H2054 AromaticContact NE2-CE1 3.89Å; H2026-H2054 AromaticContact NE2-CG 3.59Å; H2026-H2054 AromaticContact NE2-ND1 3.78Å; H2026-H2054 AromaticContact NE2-NE2 3.88Å
2027	V	96.3	Very high	85.6	Confident	1.5 Å²	1.5	41 Å²	41	1%	0.009	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.9	-177.3	-174.4	0	0	0	0	109.9	A1815 I1823 L2024 I2029 H2054 V2055 N2056	A1815-V2027 HydrophobicContact CB-CG2 3.79Å; I1823-V2027 HydrophobicContact CB-CG2 4.35Å; I1823-V2027 HydrophobicContact CG2-CG1 4.44Å; I1823-V2027 CarbonylContact O-C 3.46Å; I1823-V2027 WeakPolarHBondContact O-CA 3.38Å; L2024-V2027 HydrophobicContact CB-CG2 4.06Å; L2024-V2027 HydrophobicContact CD2-CG2 4.43Å; V2027-I2029 HydrophobicContact CG1-CD1 4.44Å; V2027-I2029 HydrophobicContact CG1-CG1 4.05Å; V2027-H2054 PolarHBondContact N-O 3.25Å; V2027-V2055 HydrophobicContact CB-CG2 4.45Å; V2027-V2055 WeakPolarHBondContact O-CA 3.29Å; V2027-N2056 PolarHBondContact O-N 3.02Å
2028	E	95	Very high	86.6	Confident	49.25 Å²	49.25	40.2 Å²	40.2	23%	0.23	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.4	173.3	-62.9	175.9	173.2	0	0	109.2	P1822 I1823 R1824 L1825 N2056	P1822-E2028 HydrophobicContact CB-CG 4.29Å; P1822-E2028 WeakPolarHBondContact CG-OE1 3.37Å; I1823-E2028 PolarHBondContact O-N 3.11Å; R1824-E2028 WeakPolarHBondContact CD-OE2 3.21Å; R1824-E2028 HydrophobicContact CG-CB 4.25Å; R1824-E2028 VanDerWaalsContact CG-OE2 3.31Å; R1824-E2028 WeakPolarHBondContact CG-OE2 3.4Å; R1824-E2028 IonicContact CZ-OE2 3.41Å; R1824-E2028 IonicContact NE-OE1 3.22Å; R1824-E2028 IonicContact NE-OE2 3.51Å; R1824-E2028 PolarHBondContact NE-OE2 3.04Å; R1824-E2028 IonicContact NH2-OE1 2.81Å; R1824-E2028 IonicContact NH2-OE2 3.77Å; L1825-E2028 PolarHBondContact N-O 2.92Å; E2028-N2056 HydrophobicContact CG-CB 4.26Å
2029	I	95.1	Very high	87.5	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.3	177.3	-63.2	177.4	0	0	0	107.7	L1825 W2004 L2007 V2027 A2032 A2042 I2043 V2055 N2056 V2057 T2058	L1825-I2029 HydrophobicContact CB-CG1 4.34Å; L1825-I2029 HydrophobicContact CD1-CD1 4.38Å; L1825-I2029 HydrophobicContact CD1-CG1 4.16Å; L1825-I2029 HydrophobicContact CG-CG1 4.44Å; W2004-I2029 HydrophobicContact CH2-CG2 4.37Å; W2004-I2029 HydrophobicContact CZ2-CG2 3.95Å; L2007-I2029 HydrophobicContact CD1-CD1 3.8Å; L2007-I2029 HydrophobicContact CG-CD1 4.44Å; V2027-I2029 HydrophobicContact CG1-CD1 4.44Å; V2027-I2029 HydrophobicContact CG1-CG1 4.05Å; I2029-A2032 HydrophobicContact CG2-CB 3.94Å; I2029-A2042 HydrophobicContact CG2-CB 4.37Å; I2029-I2043 HydrophobicContact CD1-CD1 3.55Å; I2029-I2043 VanDerWaalsContact CD1-CD1 3.47Å; I2029-I2043 HydrophobicContact CD1-CG1 3.8Å; I2029-V2055 HydrophobicContact CD1-CG1 4.47Å; I2029-N2056 PolarHBondContact N-O 2.65Å; I2029-V2057 HydrophobicContact CB-CG1 4.41Å; I2029-V2057 HydrophobicContact CB-CG2 4.42Å; I2029-V2057 HydrophobicContact CG2-CG1 4.36Å; I2029-V2057 WeakPolarHBondContact O-CA 3.33Å; I2029-T2058 PolarHBondContact O-N 3.18Å; I2029-T2058 PolarHBondContact O-OG1 2.97Å
2030	V	93.2	Very high	88.7	Confident	16.75 Å²	16.75	27.2 Å²	27.2	10%	0.102	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.3	-177.1	-172.2	0	0	0	0	109.1	L1825 K1826 P1827 Y2000 W2004 A2032 T2058	L1825-V2030 PolarHBondContact O-N 3.12Å; K1826-V2030 HydrophobicContact CG-CB 4.36Å; K1826-V2030 HydrophobicContact CG-CG2 4.4Å; P1827-V2030 VanDerWaalsContact CD-O 3.28Å; P1827-V2030 WeakPolarHBondContact CD-O 3.4Å; Y2000-V2030 HydrophobicContact CE2-CG1 3.79Å; W2004-V2030 PolarHBondContact NE1-O 2.99Å; V2030-A2032 PolarHBondContact O-N 3.02Å; V2030-T2058 WeakPolarHBondContact CA-O 3.45Å
2031	G	89.4	Confident	89.7	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.01	13%	0.127	C	C	.	.	S	Bend	trans	68.3	31.8	165.4	0	0	0	0	0	115.4	H2003 W2004 T2058 N2059	H2003-G2031 CarbonylContact C-O 3.56Å; H2003-G2031 WeakPolarHBondContact CA-O 3.31Å; H2003-G2031 WeakPolarHBondContact CB-O 3.26Å; H2003-G2031 PolarHBondContact ND1-O 2.81Å; H2003-G2031 VanDerWaalsContact ND1-O 3.16Å; W2004-G2031 PolarHBondContact N-O 3.05Å; W2004-G2031 VanDerWaalsContact N-O 3.17Å; W2004-G2031 PolarHBondContact NE1-O 2.96Å; G2031-T2058 PolarHBondContact N-O 3.18Å; G2031-T2058 VanDerWaalsContact N-O 3.12Å; G2031-N2059 VanDerWaalsContact CA-O 3.28Å; G2031-N2059 WeakPolarHBondContact CA-O 3.39Å; G2031-N2059 PolarHBondContact N-O 3.02Å
2032	A	91.8	Very high	90.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.092	C	C	.	.	B	Isolated β-bridge	trans	-99.6	177.8	-177.1	0	0	0	0	0	113.2	W2004 I2029 V2030 A2042 S2060 S2061	W2004-A2032 HydrophobicContact CD2-CB 4.1Å; W2004-A2032 VanDerWaalsContact CE2-CB 3.47Å; W2004-A2032 HydrophobicContact CH2-CB 4.35Å; W2004-A2032 HydrophobicContact CZ2-CB 3.68Å; W2004-A2032 CarbonylContact O-C 3.53Å; W2004-A2032 VanDerWaalsContact O-C 3.3Å; W2004-A2032 WeakPolarHBondContact O-CA 3.35Å; I2029-A2032 HydrophobicContact CG2-CB 3.94Å; V2030-A2032 PolarHBondContact O-N 3.02Å; A2032-A2042 HydrophobicContact CB-CB 3.48Å; A2032-A2042 VanDerWaalsContact CB-CB 3.46Å; A2032-S2060 CarbonylContact O-C 3.55Å; A2032-S2060 VanDerWaalsContact O-CA 3.22Å; A2032-S2060 WeakPolarHBondContact O-CA 3.33Å; A2032-S2061 PolarHBondContact O-N 3.16Å
2033	G	88.6	Confident	90.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.			trans	96.4	20.9	172.5	0	0	0	0	0	116.2	W2004 S2039 S2040 S2061	W2004-G2033 PolarHBondContact O-N 2.85Å; G2033-S2039 CarbonylContact O-C 3.59Å; G2033-S2040 CarbonylContact C-O 3.44Å; G2033-S2040 VanDerWaalsContact C-OG 3.3Å; G2033-S2040 VanDerWaalsContact CA-O 3.26Å; G2033-S2040 WeakPolarHBondContact CA-O 3.33Å; G2033-S2040 CarbonylContact O-C 3.52Å; G2033-S2040 PolarHBondContact O-N 3.28Å; G2033-S2040 VanDerWaalsContact O-O 3.1Å; G2033-S2040 PolarHBondContact O-OG 3.3Å; G2033-S2061 WeakPolarHBondContact O-CB 3.39Å; G2033-S2061 PolarHBondContact O-OG 2.89Å
2034	L	87.5	Confident	90.6	Very high	18.5 Å²	18.5	17.6 Å²	17.6	10%	0.097	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	89.8	171.3	-175.8	74.2	0	0	0	109.6	N1804 K1928 H2003 W2004 G2005 D2038 S2061	N1804-L2034 WeakPolarHBondContact CA-O 3.37Å; N1804-L2034 WeakPolarHBondContact OD1-CD2 3.48Å; K1928-L2034 HydrophobicContact CD-CD1 4.23Å; K1928-L2034 HydrophobicContact CG-CD1 4.33Å; H2003-L2034 HydrophobicContact CB-CB 3.57Å; H2003-L2034 HydrophobicContact CB-CD2 4.25Å; W2004-L2034 CarbonylContact C-O 3.56Å; W2004-L2034 PolarHBondContact O-N 2.99Å; G2005-L2034 VanDerWaalsContact CA-O 3.26Å; G2005-L2034 WeakPolarHBondContact CA-O 3.34Å; G2005-L2034 PolarHBondContact N-O 3.03Å; L2034-D2038 WeakPolarHBondContact CA-O 3.14Å; L2034-S2061 PolarHBondContact N-OG 2.86Å
2035	S	84.2	Confident	90.5	Very high	7.75 Å²	7.75	17.6 Å²	17.6	5%	0.054	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.7	-178.4	-170.1	0	0	0	0	109.5	R1806 N2037 D2038 S2040	R1806-S2035 VanDerWaalsContact CD-OG 3.31Å; R1806-S2035 WeakPolarHBondContact CD-OG 3.33Å; S2035-N2037 VanDerWaalsContact C-N 3.31Å; S2035-N2037 PolarHBondContact O-N 3.16Å; S2035-N2037 VanDerWaalsContact O-N 3.13Å; S2035-D2038 PolarHBondContact N-O 2.93Å; S2035-D2038 PolarHBondContact O-N 2.92Å; S2035-D2038 VanDerWaalsContact O-O 3.08Å; S2035-S2040 WeakPolarHBondContact CB-OG 3.5Å
2036	H	83.5	Confident	90.3	Very high	14.25 Å²	14.25	12.6 Å²	12.6	7%	0.066	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	43	170.9	-43.4	125.2	0	0	0	113.8	W1704 N1705 I1706 D1782 N1804 D2038	W1704-H2036 AromaticContact CD1-CD2 3.43Å; W1704-H2036 VanDerWaalsContact CD1-CD2 3.41Å; W1704-H2036 AromaticContact CD1-NE2 3.8Å; W1704-H2036 HydrophobicContact CD2-CB 4.17Å; W1704-H2036 AromaticContact CD2-CD2 3.36Å; W1704-H2036 VanDerWaalsContact CD2-CD2 3.4Å; W1704-H2036 AromaticContact CD2-CG 3.9Å; W1704-H2036 AromaticContact CE2-CD2 3.66Å; W1704-H2036 HydrophobicContact CE3-CB 3.95Å; W1704-H2036 AromaticContact CE3-CD2 3.9Å; W1704-H2036 AromaticContact CG-CD2 3.28Å; W1704-H2036 AromaticContact CG-NE2 3.66Å; W1704-H2036 HydrophobicContact CH2-CB 4.27Å; W1704-H2036 HydrophobicContact CZ2-CB 4.31Å; W1704-H2036 HydrophobicContact CZ3-CB 4Å; W1704-H2036 AromaticContact NE1-CD2 3.68Å; N1705-H2036 PolarHBondContact OD1-CE1 3.37Å; I1706-H2036 HydrophobicContact CD1-CB 3.82Å; I1706-H2036 WeakPolarHBondContact CG2-ND1 3.23Å; D1782-H2036 IonicContact OD1-NE2 3.5Å; D1782-H2036 IonicContact OD2-CD2 3.22Å; D1782-H2036 IonicContact OD2-CE1 3.27Å; D1782-H2036 PolarHBondContact OD2-CE1 3.21Å; D1782-H2036 IonicContact OD2-NE2 3.73Å; D1782-H2036 PolarHBondContact OD2-NE2 3.09Å; N1804-H2036 PolarHBondContact O-N 2.88Å; H2036-D2038 PolarHBondContact O-N 2.97Å; H2036-D2038 VanDerWaalsContact O-N 3.16Å
2037	N	80.2	Confident	89.8	Confident	50.75 Å²	50.75	11.4 Å²	11.4	27%	0.271	6%	0.063	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	5.1	-173.7	-120.5	7.3	0	0	0	116.7	W1636 N1804 K1928 N1959 S2035	W1636-N2037 HydrophobicContact CE3-CB 3.93Å; W1636-N2037 HydrophobicContact CH2-CB 4.07Å; W1636-N2037 VanDerWaalsContact CH2-CG 3.43Å; W1636-N2037 WeakPolarHBondContact CH2-ND2 3.39Å; W1636-N2037 WeakPolarHBondContact CH2-OD1 3.35Å; W1636-N2037 WeakPolarHBondContact CZ2-ND2 3.44Å; W1636-N2037 HydrophobicContact CZ3-CB 3.39Å; W1636-N2037 VanDerWaalsContact CZ3-ND2 3.27Å; W1636-N2037 WeakPolarHBondContact CZ3-ND2 3.12Å; W1636-N2037 WeakPolarHBondContact CZ3-OD1 3.43Å; N1804-N2037 PolarHBondContact ND2-OD1 3.04Å; N1804-N2037 PolarHBondContact OD1-N 2.96Å; N1804-N2037 VanDerWaalsContact OD1-N 3.13Å; N1804-N2037 PolarHBondContact OD1-OD1 2.8Å; K1928-N2037 WeakPolarHBondContact CE-O 3.28Å; K1928-N2037 WeakPolarHBondContact CE-OD1 3.05Å; K1928-N2037 PolarHBondContact NZ-O 2.93Å; K1928-N2037 PolarHBondContact NZ-OD1 2.91Å; N1959-N2037 PolarHBondContact OD1-ND2 3.07Å; S2035-N2037 VanDerWaalsContact C-N 3.31Å; S2035-N2037 PolarHBondContact O-N 3.16Å; S2035-N2037 VanDerWaalsContact O-N 3.13Å
2038	D	82.8	Confident	89.3	Confident	17.75 Å²	17.75	12 Å²	12	10%	0.095	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146.2	171.9	-138.5	1.7	0	0	0	111.4	R1914 L2034 S2035 H2036 S2040 Y2114	R1914-D2038 IonicContact CZ-OD1 3.31Å; R1914-D2038 VanDerWaalsContact CZ-OD1 3.28Å; R1914-D2038 IonicContact CZ-OD2 3.51Å; R1914-D2038 IonicContact NH1-OD1 3.75Å; R1914-D2038 PolarHBondContact NH1-OD1 3.07Å; R1914-D2038 VanDerWaalsContact NH2-CG 3.31Å; R1914-D2038 IonicContact NH2-OD1 3.55Å; R1914-D2038 PolarHBondContact NH2-OD1 3.19Å; R1914-D2038 IonicContact NH2-OD2 2.78Å; R1914-D2038 PolarHBondContact NH2-OD2 3.28Å; L2034-D2038 WeakPolarHBondContact CA-O 3.14Å; S2035-D2038 PolarHBondContact N-O 2.93Å; S2035-D2038 PolarHBondContact O-N 2.92Å; S2035-D2038 VanDerWaalsContact O-O 3.08Å; H2036-D2038 PolarHBondContact O-N 2.97Å; H2036-D2038 VanDerWaalsContact O-N 3.16Å; D2038-S2040 PolarHBondContact O-N 3.26Å; D2038-Y2114 WeakPolarHBondContact OD2-CD2 3.28Å
2039	S	84.7	Confident	89	Confident	21.75 Å²	21.75	11.3 Å²	11.3	15%	0.152	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	116.1	179.6	61.1	0	0	0	0	109.7	K1913 G2033 M2062	K1913-S2039 PolarHBondContact NZ-OG 2.76Å; K1913-S2039 VanDerWaalsContact NZ-OG 3.12Å; G2033-S2039 CarbonylContact O-C 3.59Å; S2039-M2062 VanDerWaalsContact OG-CE 3.26Å; S2039-M2062 WeakPolarHBondContact OG-CE 3.22Å
2040	S	87.4	Confident	88.8	Confident	21 Å²	21	11.6 Å²	11.6	15%	0.147	7%	0.067	C	C	.	.			trans	-120.1	173.8	-179.8	57.8	0	0	0	0	111.7	G2005 G2033 S2035 D2038 M2062	G2005-S2040 PolarHBondContact O-OG 2.9Å; G2005-S2040 VanDerWaalsContact O-OG 3.09Å; G2033-S2040 CarbonylContact C-O 3.44Å; G2033-S2040 VanDerWaalsContact C-OG 3.3Å; G2033-S2040 VanDerWaalsContact CA-O 3.26Å; G2033-S2040 WeakPolarHBondContact CA-O 3.33Å; G2033-S2040 CarbonylContact O-C 3.52Å; G2033-S2040 PolarHBondContact O-N 3.28Å; G2033-S2040 VanDerWaalsContact O-O 3.1Å; G2033-S2040 PolarHBondContact O-OG 3.3Å; S2035-S2040 WeakPolarHBondContact CB-OG 3.5Å; D2038-S2040 PolarHBondContact O-N 3.26Å; S2040-M2062 VanDerWaalsContact O-CB 3.31Å; S2040-M2062 WeakPolarHBondContact O-CB 3.37Å
2041	A	92.2	Very high	88.7	Confident	0.5 Å²	0.5	14.1 Å²	14.1	0%	0.004	8%	0.08	C	C	.	.			trans	-71	151.7	169.2	0	0	0	0	0	111.2	I2043 T2044 H2063 E2066	A2041-I2043 VanDerWaalsContact C-N 3.3Å; A2041-I2043 WeakPolarHBondContact CB-O 3.43Å; A2041-I2043 PolarHBondContact O-N 3.2Å; A2041-T2044 HydrophobicContact CB-CG2 3.66Å; A2041-H2063 CarbonylContact C-O 3.56Å; A2041-H2063 WeakPolarHBondContact CA-O 3.44Å; A2041-H2063 HydrophobicContact CB-CB 3.72Å; A2041-E2066 HydrophobicContact CB-CB 3.59Å
2042	A	94.3	Very high	89	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	-64.7	-35.7	172.1	0	0	0	0	0	112.5	G2006 L2007 I2029 A2032 V2057 S2060 H2063 A2064	G2006-A2042 CarbonylContact C-O 3.51Å; G2006-A2042 WeakPolarHBondContact CA-O 3.36Å; L2007-A2042 PolarHBondContact N-O 2.75Å; I2029-A2042 HydrophobicContact CG2-CB 4.37Å; A2032-A2042 HydrophobicContact CB-CB 3.48Å; A2032-A2042 VanDerWaalsContact CB-CB 3.46Å; A2042-V2057 HydrophobicContact CB-CG1 3.76Å; A2042-S2060 VanDerWaalsContact CB-OG 3.26Å; A2042-S2060 WeakPolarHBondContact CB-OG 3.37Å; A2042-H2063 PolarHBondContact N-O 2.84Å; A2042-A2064 WeakPolarHBondContact CB-O 3.33Å; A2042-A2064 PolarHBondContact N-O 3.04Å
2043	I	95.5	Very high	89.1	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	121.4	169.2	-51.7	175.3	0	0	0	108.3	L2007 F2009 L2024 I2029 A2041 V2045 F2052 V2055 V2057 A2064 I2065 E2066	L2007-I2043 HydrophobicContact CB-CG1 4.47Å; L2007-I2043 HydrophobicContact CB-CG2 4.49Å; L2007-I2043 CarbonylContact O-C 3.4Å; L2007-I2043 WeakPolarHBondContact O-CA 3.27Å; F2009-I2043 HydrophobicContact CD2-CG2 4.13Å; F2009-I2043 HydrophobicContact CE2-CG2 3.97Å; L2024-I2043 HydrophobicContact CD1-CD1 4.33Å; I2029-I2043 HydrophobicContact CD1-CD1 3.55Å; I2029-I2043 VanDerWaalsContact CD1-CD1 3.47Å; I2029-I2043 HydrophobicContact CD1-CG1 3.8Å; A2041-I2043 VanDerWaalsContact C-N 3.3Å; A2041-I2043 WeakPolarHBondContact CB-O 3.43Å; A2041-I2043 PolarHBondContact O-N 3.2Å; I2043-V2045 HydrophobicContact CG2-CG2 4.14Å; I2043-F2052 HydrophobicContact CD1-CD1 4.47Å; I2043-F2052 HydrophobicContact CD1-CE1 3.79Å; I2043-F2052 HydrophobicContact CG2-CE1 4.12Å; I2043-F2052 HydrophobicContact CG2-CZ 4.12Å; I2043-V2055 HydrophobicContact CD1-CG1 4.46Å; I2043-V2057 HydrophobicContact CD1-CG2 4.05Å; I2043-A2064 PolarHBondContact N-O 3.39Å; I2043-I2065 HydrophobicContact CB-CG1 4.28Å; I2043-I2065 HydrophobicContact CB-CG2 4.43Å; I2043-I2065 HydrophobicContact CD1-CD1 4.2Å; I2043-I2065 HydrophobicContact CD1-CG1 4.12Å; I2043-I2065 HydrophobicContact CG1-CG1 4.46Å; I2043-I2065 CarbonylContact O-C 3.51Å; I2043-I2065 WeakPolarHBondContact O-CA 3.38Å; I2043-E2066 PolarHBondContact O-N 3.38Å
2044	T	94.4	Very high	89.4	Confident	4.75 Å²	4.75	18.5 Å²	18.5	3%	0.029	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.2	172	-32.7	0	0	0	0	109.1	L2007 F2008 F2009 A2041 V2046 E2066 P2113	L2007-T2044 PolarHBondContact O-N 2.98Å; L2007-T2044 PolarHBondContact O-OG1 2.77Å; F2008-T2044 CarbonylContact C-O 3.59Å; F2008-T2044 WeakPolarHBondContact CA-O 3.23Å; F2008-T2044 WeakPolarHBondContact CA-OG1 3.4Å; F2008-T2044 WeakPolarHBondContact CB-OG1 3.26Å; F2008-T2044 HydrophobicContact CD2-CG2 4.12Å; F2008-T2044 WeakPolarHBondContact CD2-OG1 3.19Å; F2008-T2044 HydrophobicContact CE2-CG2 3.61Å; F2008-T2044 VanDerWaalsContact CG-OG1 3.31Å; F2008-T2044 WeakPolarHBondContact CG-OG1 3.18Å; F2008-T2044 HydrophobicContact CZ-CG2 4.05Å; F2009-T2044 PolarHBondContact N-O 3.11Å; A2041-T2044 HydrophobicContact CB-CG2 3.66Å; T2044-V2046 HydrophobicContact CG2-CG2 3.91Å; T2044-E2066 CarbonylContact C-O 3.4Å; T2044-E2066 VanDerWaalsContact CA-O 3.27Å; T2044-E2066 WeakPolarHBondContact CA-O 3.39Å; T2044-E2066 HydrophobicContact CG2-CB 4.46Å; T2044-P2113 HydrophobicContact CG2-CG 4.22Å
2045	V	93.3	Very high	89.8	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.006	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	121.5	176	-175.2	0	0	0	0	108.7	F2009 I2043 R2048 V2050 F2052 E2066 I2067 V2068	F2009-V2045 HydrophobicContact CB-CB 4.43Å; F2009-V2045 HydrophobicContact CB-CG1 4.19Å; F2009-V2045 HydrophobicContact CB-CG2 4.23Å; F2009-V2045 HydrophobicContact CD2-CG2 3.97Å; F2009-V2045 HydrophobicContact CG-CG2 4.43Å; F2009-V2045 CarbonylContact O-C 3.5Å; F2009-V2045 WeakPolarHBondContact O-CA 3.45Å; I2043-V2045 HydrophobicContact CG2-CG2 4.14Å; V2045-R2048 HydrophobicContact CG1-CB 4.2Å; V2045-R2048 HydrophobicContact CG1-CG 3.94Å; V2045-R2048 VanDerWaalsContact CG1-O 3.3Å; V2045-R2048 WeakPolarHBondContact CG1-O 3.26Å; V2045-V2050 HydrophobicContact CG1-CG2 4.15Å; V2045-V2050 HydrophobicContact CG2-CG2 4.12Å; V2045-F2052 HydrophobicContact CG2-CZ 4.21Å; V2045-E2066 PolarHBondContact N-O 3.03Å; V2045-I2067 HydrophobicContact CB-CB 4.44Å; V2045-I2067 HydrophobicContact CB-CG1 4.16Å; V2045-I2067 HydrophobicContact CB-CG2 4.14Å; V2045-I2067 HydrophobicContact CG1-CG2 4.38Å; V2045-I2067 HydrophobicContact CG2-CG1 4.34Å; V2045-I2067 CarbonylContact O-C 3.53Å; V2045-I2067 WeakPolarHBondContact O-CA 3.31Å; V2045-V2068 PolarHBondContact O-N 2.99Å
2046	V	90.4	Very high	90.3	Very high	0.25 Å²	0.25	19.5 Å²	19.5	0%	0.002	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.3	-176.1	-172	0	0	0	0	109.7	F2008 F2009 A2010 A2011 T2044 R2048 V2068 L2116 Y2117 L2119	F2008-V2046 HydrophobicContact CE1-CB 4.39Å; F2008-V2046 HydrophobicContact CE1-CG2 3.79Å; F2008-V2046 HydrophobicContact CE2-CG2 4.46Å; F2008-V2046 HydrophobicContact CZ-CB 4.47Å; F2008-V2046 HydrophobicContact CZ-CG2 3.57Å; F2009-V2046 PolarHBondContact O-N 3.15Å; A2010-V2046 WeakPolarHBondContact CA-O 3.47Å; A2011-V2046 PolarHBondContact N-O 3.34Å; T2044-V2046 HydrophobicContact CG2-CG2 3.91Å; V2046-R2048 PolarHBondContact O-N 2.76Å; V2046-R2048 VanDerWaalsContact O-N 3.11Å; V2046-V2068 WeakPolarHBondContact CA-O 3.31Å; V2046-V2068 HydrophobicContact CG2-CB 4.47Å; V2046-L2116 HydrophobicContact CB-CD2 4.43Å; V2046-L2116 HydrophobicContact CG1-CD2 4.19Å; V2046-L2116 HydrophobicContact CG2-CD2 3.49Å; V2046-L2116 VanDerWaalsContact CG2-CD2 3.46Å; V2046-Y2117 WeakPolarHBondContact CG1-O 3.4Å; V2046-L2119 HydrophobicContact CG1-CD1 4.14Å; V2046-L2119 HydrophobicContact CG1-CD2 4.35Å; V2046-L2119 HydrophobicContact CG1-CG 3.93Å
2047	Y	86.1	Confident	90.9	Very high	11 Å²	11	18.8 Å²	18.8	4%	0.043	10%	0.103	C	C	.	.	S	Bend	trans	55.7	31.5	174	-150.2	-121.2	0	0	0	114.2	A2011 V2014 A2017 V2068 A2069 H2071 L2136	A2011-Y2047 HydrophobicContact CB-CD1 3.82Å; A2011-Y2047 HydrophobicContact CB-CG 4.47Å; V2014-Y2047 WeakPolarHBondContact O-CE1 3.41Å; A2017-Y2047 HydrophobicContact CB-CD1 4.33Å; A2017-Y2047 HydrophobicContact CB-CE1 4.29Å; Y2047-V2068 PolarHBondContact N-O 3.04Å; Y2047-A2069 VanDerWaalsContact CA-O 3.27Å; Y2047-A2069 WeakPolarHBondContact CA-O 3.26Å; Y2047-A2069 HydrophobicContact CD2-CB 4.28Å; Y2047-A2069 PolarHBondContact N-O 3.26Å; Y2047-H2071 AromaticContact CD1-CD2 3.75Å; Y2047-H2071 AromaticContact CD1-NE2 3.76Å; Y2047-H2071 AromaticContact CD2-CD2 3.69Å; Y2047-H2071 AromaticContact CD2-NE2 3.41Å; Y2047-H2071 VanDerWaalsContact CD2-NE2 3.34Å; Y2047-H2071 WeakPolarHBondContact CD2-NE2 3.3Å; Y2047-H2071 AromaticContact CE1-CD2 3.77Å; Y2047-H2071 AromaticContact CE1-NE2 3.57Å; Y2047-H2071 VanDerWaalsContact CE1-NE2 3.28Å; Y2047-H2071 WeakPolarHBondContact CE1-NE2 3.14Å; Y2047-H2071 AromaticContact CE2-CD2 3.75Å; Y2047-H2071 AromaticContact CE2-CE1 3.97Å; Y2047-H2071 AromaticContact CE2-NE2 2.96Å; Y2047-H2071 WeakPolarHBondContact CE2-NE2 3.24Å; Y2047-H2071 AromaticContact CG-CD2 3.83Å; Y2047-H2071 AromaticContact CG-NE2 3.92Å; Y2047-H2071 AromaticContact CZ-CD2 3.78Å; Y2047-H2071 AromaticContact CZ-CE1 3.92Å; Y2047-H2071 AromaticContact CZ-NE2 3.17Å; Y2047-H2071 PolarHBondContact OH-NE2 3.06Å; Y2047-H2071 VanDerWaalsContact OH-NE2 3.11Å; Y2047-L2136 HydrophobicContact CD2-CD1 3.99Å; Y2047-L2136 HydrophobicContact CE2-CD1 3.83Å
2048	R	86.3	Confident	91.5	Very high	15.75 Å²	15.75	17.7 Å²	17.7	6%	0.059	10%	0.098	C	C	.	.	S	Bend	trans	-158.3	166.1	-176.9	171.1	174.3	-161.8	178.4	1.1	111.3	V1809 L1810 G1811 F2009 A2010 M2020 S2022 V2045 V2046	V1809-R2048 PolarHBondContact O-NH1 3.05Å; V1809-R2048 VanDerWaalsContact O-NH1 3.1Å; L1810-R2048 PolarHBondContact O-NH1 2.95Å; G1811-R2048 VanDerWaalsContact O-CZ 3.24Å; G1811-R2048 PolarHBondContact O-NH1 2.85Å; G1811-R2048 PolarHBondContact O-NH2 2.95Å; F2009-R2048 HydrophobicContact CB-CG 4.46Å; A2010-R2048 VanDerWaalsContact C-CD 3.43Å; A2010-R2048 WeakPolarHBondContact O-CD 3.28Å; A2010-R2048 PolarHBondContact O-NH1 3.01Å; M2020-R2048 VanDerWaalsContact CB-NH2 3.31Å; M2020-R2048 PolarHBondContact O-NE 3.1Å; M2020-R2048 VanDerWaalsContact O-NE 3.13Å; M2020-R2048 PolarHBondContact O-NH2 3.1Å; S2022-R2048 PolarHBondContact OG-NH2 2.83Å; S2022-R2048 VanDerWaalsContact OG-NH2 3.15Å; V2045-R2048 HydrophobicContact CG1-CB 4.2Å; V2045-R2048 HydrophobicContact CG1-CG 3.94Å; V2045-R2048 VanDerWaalsContact CG1-O 3.3Å; V2045-R2048 WeakPolarHBondContact CG1-O 3.26Å; V2046-R2048 PolarHBondContact O-N 2.76Å; V2046-R2048 VanDerWaalsContact O-N 3.11Å
2049	S	87.7	Confident	91.9	Very high	32.5 Å²	32.5	17.5 Å²	17.5	23%	0.227	10%	0.097	C	C	.	.			trans	-116.9	150.1	168.9	24.6	0	0	0	0	112.3	H2071 A2072	S2049-H2071 WeakPolarHBondContact CB-O 3.38Å; S2049-H2071 PolarHBondContact OG-O 3.02Å; S2049-H2071 VanDerWaalsContact OG-O 3.12Å; S2049-A2072 PolarHBondContact OG-O 3.18Å
2050	V	91.2	Very high	92.2	Very high	8.25 Å²	8.25	16.5 Å²	16.5	5%	0.05	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141	178.4	179.8	0	0	0	0	108.1	F2009 L2024 V2045 F2052	F2009-V2050 HydrophobicContact CB-CG2 4.2Å; F2009-V2050 HydrophobicContact CD1-CG2 3.83Å; F2009-V2050 HydrophobicContact CD2-CG2 4.13Å; F2009-V2050 HydrophobicContact CE1-CG1 4.41Å; F2009-V2050 HydrophobicContact CE1-CG2 4.17Å; F2009-V2050 HydrophobicContact CE2-CG2 4.4Å; F2009-V2050 HydrophobicContact CG-CG2 3.8Å; F2009-V2050 HydrophobicContact CZ-CG1 4.41Å; F2009-V2050 HydrophobicContact CZ-CG2 4.43Å; L2024-V2050 HydrophobicContact CG-CG1 4.35Å; V2045-V2050 HydrophobicContact CG1-CG2 4.15Å; V2045-V2050 HydrophobicContact CG2-CG2 4.12Å; V2050-F2052 HydrophobicContact CB-CD2 4.45Å; V2050-F2052 HydrophobicContact CB-CE2 3.76Å; V2050-F2052 HydrophobicContact CB-CZ 3.91Å; V2050-F2052 HydrophobicContact CG1-CD2 4.44Å; V2050-F2052 HydrophobicContact CG1-CE1 4.24Å; V2050-F2052 HydrophobicContact CG1-CE2 4.03Å; V2050-F2052 HydrophobicContact CG1-CZ 3.91Å; V2050-F2052 VanDerWaalsContact O-CD2 3.27Å; V2050-F2052 WeakPolarHBondContact O-CD2 3.29Å; V2050-F2052 WeakPolarHBondContact O-CE2 3.24Å
2051	I	92.1	Very high	92.3	Very high	70.25 Å²	70.25	15.7 Å²	15.7	36%	0.36	8%	0.084	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.8	176.7	-58.4	170.9	0	0	0	108.8	S2022 S2023 L2024	S2022-I2051 PolarHBondContact O-N 3.25Å; S2022-I2051 VanDerWaalsContact O-N 3.15Å; S2023-I2051 WeakPolarHBondContact CA-O 3.43Å; L2024-I2051 PolarHBondContact N-O 3Å
2052	F	94.3	Very high	92.1	Very high	1 Å²	1	16.6 Å²	16.6	0%	0.004	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.8	176.7	-56.8	-94.4	0	0	0	110.8	L2024 I2043 V2045 V2050 V2055 I2067 V2075 L2076 N2077 M2079	L2024-F2052 HydrophobicContact CB-CD1 4.44Å; L2024-F2052 HydrophobicContact CD1-CD1 4.07Å; L2024-F2052 HydrophobicContact CD1-CE1 3.79Å; I2043-F2052 HydrophobicContact CD1-CD1 4.47Å; I2043-F2052 HydrophobicContact CD1-CE1 3.79Å; I2043-F2052 HydrophobicContact CG2-CE1 4.12Å; I2043-F2052 HydrophobicContact CG2-CZ 4.12Å; V2045-F2052 HydrophobicContact CG2-CZ 4.21Å; V2050-F2052 HydrophobicContact CB-CD2 4.45Å; V2050-F2052 HydrophobicContact CB-CE2 3.76Å; V2050-F2052 HydrophobicContact CB-CZ 3.91Å; V2050-F2052 HydrophobicContact CG1-CD2 4.44Å; V2050-F2052 HydrophobicContact CG1-CE1 4.24Å; V2050-F2052 HydrophobicContact CG1-CE2 4.03Å; V2050-F2052 HydrophobicContact CG1-CZ 3.91Å; V2050-F2052 VanDerWaalsContact O-CD2 3.27Å; V2050-F2052 WeakPolarHBondContact O-CD2 3.29Å; V2050-F2052 WeakPolarHBondContact O-CE2 3.24Å; F2052-V2055 HydrophobicContact CB-CG2 4.26Å; F2052-V2055 HydrophobicContact CD1-CG2 4.26Å; F2052-I2067 HydrophobicContact CE2-CD1 4.42Å; F2052-V2075 PolarHBondContact N-O 3.11Å; F2052-L2076 HydrophobicContact CB-CD2 3.74Å; F2052-L2076 HydrophobicContact CD2-CD2 3.3Å; F2052-L2076 HydrophobicContact CE2-CD2 4.05Å; F2052-L2076 HydrophobicContact CG-CD2 3.71Å; F2052-N2077 PolarHBondContact O-N 3.09Å; F2052-N2077 VanDerWaalsContact O-N 3.13Å; F2052-M2079 HydrophobicContact CB-CE 4.12Å; F2052-M2079 HydrophobicContact CB-SD 3.58Å; F2052-M2079 VanDerWaalsContact CB-SD 3.56Å; F2052-M2079 HydrophobicContact CD1-CE 4.29Å; F2052-M2079 HydrophobicContact CG-CE 4.4Å; F2052-M2079 HydrophobicContact CG-SD 4.45Å
2053	D	94.2	Very high	92.1	Very high	39.25 Å²	39.25	17.6 Å²	17.6	21%	0.21	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	116.9	-179	-168.7	29	0	0	0	109.4	L2024 R2025 H2026 V2055 N2077	L2024-D2053 PolarHBondContact O-N 3.21Å; R2025-D2053 CarbonylContact C-O 3.46Å; R2025-D2053 VanDerWaalsContact CA-O 3.26Å; R2025-D2053 WeakPolarHBondContact CA-O 3.37Å; R2025-D2053 HydrophobicContact CG-CB 4.1Å; R2025-D2053 IonicContact NE-OD2 3.41Å; H2026-D2053 PolarHBondContact N-O 3.1Å; D2053-V2055 PolarHBondContact O-N 2.98Å; D2053-N2077 WeakPolarHBondContact CA-O 3.26Å; D2053-N2077 WeakPolarHBondContact OD1-CB 3.08Å
2054	H	95.7	Very high	92	Very high	53 Å²	53	17.6 Å²	17.6	25%	0.245	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.1	51.9	-175.2	-54.3	77.2	0	0	0	113.2	H2026 V2027 N2077 K2078	H2026-H2054 WeakPolarHBondContact CA-O 3.29Å; H2026-H2054 AromaticContact CD2-CD2 3.99Å; H2026-H2054 AromaticContact CD2-CG 3.85Å; H2026-H2054 AromaticContact CE1-CG 3.9Å; H2026-H2054 AromaticContact CE1-ND1 3.7Å; H2026-H2054 PolarHBondContact N-O 3.15Å; H2026-H2054 AromaticContact NE2-CD2 3.7Å; H2026-H2054 PolarHBondContact NE2-CD2 2.94Å; H2026-H2054 AromaticContact NE2-CE1 3.89Å; H2026-H2054 AromaticContact NE2-CG 3.59Å; H2026-H2054 AromaticContact NE2-ND1 3.78Å; H2026-H2054 AromaticContact NE2-NE2 3.88Å; V2027-H2054 PolarHBondContact N-O 3.25Å; H2054-N2077 PolarHBondContact N-O 3.21Å; H2054-K2078 VanDerWaalsContact CA-O 3.3Å; H2054-K2078 WeakPolarHBondContact CA-O 3.4Å; H2054-K2078 VanDerWaalsContact CE1-CD 3.48Å; H2054-K2078 WeakPolarHBondContact CE1-CD 3.4Å; H2054-K2078 WeakPolarHBondContact NE2-CD 3.38Å
2055	V	95.7	Very high	92.1	Very high	0.25 Å²	0.25	17.3 Å²	17.3	0%	0.002	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.5	178.9	179	0	0	0	0	110.3	L2024 V2027 I2029 I2043 F2052 D2053 V2057 M2079 N2080	L2024-V2055 HydrophobicContact CB-CG2 3.87Å; L2024-V2055 WeakPolarHBondContact O-CG2 3.33Å; V2027-V2055 HydrophobicContact CB-CG2 4.45Å; V2027-V2055 WeakPolarHBondContact O-CA 3.29Å; I2029-V2055 HydrophobicContact CD1-CG1 4.47Å; I2043-V2055 HydrophobicContact CD1-CG1 4.46Å; F2052-V2055 HydrophobicContact CB-CG2 4.26Å; F2052-V2055 HydrophobicContact CD1-CG2 4.26Å; D2053-V2055 PolarHBondContact O-N 2.98Å; V2055-V2057 HydrophobicContact CG1-CG2 4.04Å; V2055-M2079 HydrophobicContact CB-CE 3.72Å; V2055-M2079 HydrophobicContact CB-SD 3.88Å; V2055-M2079 HydrophobicContact CG1-CE 4.12Å; V2055-M2079 HydrophobicContact CG2-SD 4.47Å; V2055-M2079 WeakPolarHBondContact O-CA 3.46Å; V2055-N2080 PolarHBondContact O-N 3.07Å
2056	N	95	Very high	92.1	Very high	46.75 Å²	46.75	17.6 Å²	17.6	25%	0.25	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.6	177.6	-81.6	-2.7	0	0	0	109	V2027 E2028 I2029 T2058 N2080	V2027-N2056 PolarHBondContact O-N 3.02Å; E2028-N2056 HydrophobicContact CG-CB 4.26Å; I2029-N2056 PolarHBondContact N-O 2.65Å; N2056-T2058 VanDerWaalsContact OD1-CG2 3.3Å; N2056-T2058 WeakPolarHBondContact OD1-CG2 3.41Å; N2056-N2080 CarbonylContact C-O 3.49Å; N2056-N2080 VanDerWaalsContact CA-O 3.29Å; N2056-N2080 WeakPolarHBondContact CA-O 3.35Å; N2056-N2080 HydrophobicContact CB-CB 4.38Å; N2056-N2080 VanDerWaalsContact OD1-CB 3.26Å; N2056-N2080 WeakPolarHBondContact OD1-CB 3.34Å; N2056-N2080 PolarHBondContact OD1-ND2 3.35Å; N2056-N2080 VanDerWaalsContact OD1-ND2 3.15Å; N2056-N2080 PolarHBondContact OD1-O 2.79Å
2057	V	95.5	Very high	92.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	114.9	176.1	-171.2	0	0	0	0	109	I2029 A2042 I2043 V2055 S2060 A2064 I2065 N2080 I2081 T2082 N2084	I2029-V2057 HydrophobicContact CB-CG1 4.41Å; I2029-V2057 HydrophobicContact CB-CG2 4.42Å; I2029-V2057 HydrophobicContact CG2-CG1 4.36Å; I2029-V2057 WeakPolarHBondContact O-CA 3.33Å; A2042-V2057 HydrophobicContact CB-CG1 3.76Å; I2043-V2057 HydrophobicContact CD1-CG2 4.05Å; V2055-V2057 HydrophobicContact CG1-CG2 4.04Å; V2057-S2060 WeakPolarHBondContact CG1-OG 3.47Å; V2057-A2064 HydrophobicContact CB-CB 4.11Å; V2057-A2064 HydrophobicContact CG1-CB 3.7Å; V2057-I2065 HydrophobicContact CG2-CD1 4.36Å; V2057-I2065 HydrophobicContact CG2-CG1 4.36Å; V2057-N2080 PolarHBondContact N-O 3.21Å; V2057-I2081 HydrophobicContact CB-CG1 4.47Å; V2057-I2081 WeakPolarHBondContact O-CA 3.43Å; V2057-T2082 PolarHBondContact O-N 2.91Å; V2057-T2082 VanDerWaalsContact O-N 3.12Å; V2057-N2084 PolarHBondContact O-ND2 2.91Å
2058	T	93.4	Very high	92.5	Very high	26.75 Å²	26.75	17.3 Å²	17.3	16%	0.164	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.9	-172.9	65.8	0	0	0	0	112.7	I2029 V2030 G2031 N2056 S2060 T2082	I2029-T2058 PolarHBondContact O-N 3.18Å; I2029-T2058 PolarHBondContact O-OG1 2.97Å; V2030-T2058 WeakPolarHBondContact CA-O 3.45Å; G2031-T2058 PolarHBondContact N-O 3.18Å; G2031-T2058 VanDerWaalsContact N-O 3.12Å; N2056-T2058 VanDerWaalsContact OD1-CG2 3.3Å; N2056-T2058 WeakPolarHBondContact OD1-CG2 3.41Å; T2058-S2060 VanDerWaalsContact C-N 3.35Å; T2058-S2060 PolarHBondContact O-N 2.89Å; T2058-T2082 VanDerWaalsContact CA-O 3.27Å; T2058-T2082 WeakPolarHBondContact CA-O 3.36Å; T2058-T2082 VanDerWaalsContact CG2-OG1 3.28Å; T2058-T2082 WeakPolarHBondContact CG2-OG1 3.25Å
2059	N	91	Very high	92.5	Very high	14.5 Å²	14.5	16.8 Å²	16.8	8%	0.078	9%	0.091	C	C	.	.	S	Bend	trans	55.3	50.8	174.1	-148.7	23.1	0	0	0	114	E1994 A1995 V1996 H2003 G2031 T2082 D2083 N2084	E1994-N2059 PolarHBondContact O-OD1 3.06Å; A1995-N2059 WeakPolarHBondContact CA-ND2 3.44Å; A1995-N2059 HydrophobicContact CB-CB 4.03Å; A1995-N2059 WeakPolarHBondContact O-CB 3.47Å; A1995-N2059 PolarHBondContact O-ND2 3.06Å; A1995-N2059 VanDerWaalsContact O-ND2 3.11Å; A1995-N2059 PolarHBondContact O-OD1 2.99Å; V1996-N2059 HydrophobicContact CB-CB 4.38Å; V1996-N2059 HydrophobicContact CG2-CB 3.53Å; V1996-N2059 PolarHBondContact N-ND2 3.13Å; V1996-N2059 VanDerWaalsContact N-ND2 3.12Å; H2003-N2059 PolarHBondContact CD2-O 3.04Å; H2003-N2059 PolarHBondContact CE1-O 3.01Å; H2003-N2059 PolarHBondContact ND1-O 3.15Å; H2003-N2059 PolarHBondContact NE2-ND2 3.44Å; H2003-N2059 PolarHBondContact NE2-O 2.8Å; G2031-N2059 VanDerWaalsContact CA-O 3.28Å; G2031-N2059 WeakPolarHBondContact CA-O 3.39Å; G2031-N2059 PolarHBondContact N-O 3.02Å; N2059-T2082 PolarHBondContact N-O 3.12Å; N2059-D2083 VanDerWaalsContact CA-O 3.26Å; N2059-D2083 WeakPolarHBondContact CA-O 3.38Å; N2059-D2083 PolarHBondContact N-O 3.16Å; N2059-D2083 WeakPolarHBondContact OD1-CB 3.41Å; N2059-N2084 PolarHBondContact N-OD1 3.4Å
2060	S	91.3	Very high	92.5	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.082	C	C	.	.			trans	-81.4	140.6	175	-49.1	0	0	0	0	111.1	A2032 A2042 V2057 T2058 M2062 H2063 N2084 L2085	A2032-S2060 CarbonylContact O-C 3.55Å; A2032-S2060 VanDerWaalsContact O-CA 3.22Å; A2032-S2060 WeakPolarHBondContact O-CA 3.33Å; A2042-S2060 VanDerWaalsContact CB-OG 3.26Å; A2042-S2060 WeakPolarHBondContact CB-OG 3.37Å; V2057-S2060 WeakPolarHBondContact CG1-OG 3.47Å; T2058-S2060 VanDerWaalsContact C-N 3.35Å; T2058-S2060 PolarHBondContact O-N 2.89Å; S2060-M2062 PolarHBondContact O-N 3.17Å; S2060-M2062 VanDerWaalsContact O-N 3.16Å; S2060-H2063 WeakPolarHBondContact CB-O 3.27Å; S2060-N2084 WeakPolarHBondContact CB-OD1 3.3Å; S2060-N2084 PolarHBondContact N-OD1 2.95Å; S2060-N2084 PolarHBondContact OG-OD1 3.14Å; S2060-L2085 WeakPolarHBondContact O-CG 3.42Å; S2060-L2085 PolarHBondContact O-N 3.23Å; S2060-L2085 VanDerWaalsContact O-N 3.13Å
2061	S	88	Confident	92.1	Very high	4.5 Å²	4.5	16 Å²	16	3%	0.031	8%	0.083	C	C	.	.	S	Bend	trans	-66.2	-18.4	179.9	137.9	0	0	0	0	113.9	H2003 A2032 G2033 L2034 L2085	H2003-S2061 VanDerWaalsContact CD2-CB 3.5Å; H2003-S2061 WeakPolarHBondContact CD2-CB 3.36Å; A2032-S2061 PolarHBondContact O-N 3.16Å; G2033-S2061 WeakPolarHBondContact O-CB 3.39Å; G2033-S2061 PolarHBondContact O-OG 2.89Å; L2034-S2061 PolarHBondContact N-OG 2.86Å; S2061-L2085 WeakPolarHBondContact O-CB 3.44Å
2062	M	89.2	Confident	91.6	Very high	19.5 Å²	19.5	14.5 Å²	14.5	10%	0.096	8%	0.081	C	C	.	.	S	Bend	trans	-145.7	-117.3	171.4	-169	67.5	96.4	0	0	109	S2039 S2040 S2060 G2086 R2266	S2039-M2062 VanDerWaalsContact OG-CE 3.26Å; S2039-M2062 WeakPolarHBondContact OG-CE 3.22Å; S2040-M2062 VanDerWaalsContact O-CB 3.31Å; S2040-M2062 WeakPolarHBondContact O-CB 3.37Å; S2060-M2062 PolarHBondContact O-N 3.17Å; S2060-M2062 VanDerWaalsContact O-N 3.16Å; M2062-G2086 VanDerWaalsContact O-CA 3.23Å; M2062-G2086 WeakPolarHBondContact O-CA 3.31Å; M2062-G2086 PolarHBondContact O-N 3.22Å; M2062-R2266 PolarHBondContact SD-NH1 3.19Å; M2062-R2266 VanDerWaalsContact SD-NH1 3.45Å
2063	H	92.9	Very high	91.3	Very high	19.5 Å²	19.5	19.3 Å²	19.3	9%	0.09	10%	0.104	C	C	.	.			trans	-70.5	151.1	-179	-60.7	-57.4	0	0	0	111.1	A2041 A2042 S2060 E2066 V2087 R2090	A2041-H2063 CarbonylContact C-O 3.56Å; A2041-H2063 WeakPolarHBondContact CA-O 3.44Å; A2041-H2063 HydrophobicContact CB-CB 3.72Å; A2042-H2063 PolarHBondContact N-O 2.84Å; S2060-H2063 WeakPolarHBondContact CB-O 3.27Å; H2063-E2066 IonicContact CD2-OE2 3.3Å; H2063-V2087 VanDerWaalsContact CA-O 3.27Å; H2063-V2087 WeakPolarHBondContact CA-O 3.32Å; H2063-V2087 PolarHBondContact CE1-N 3.43Å; H2063-V2087 WeakPolarHBondContact ND1-CB 3.31Å; H2063-V2087 PolarHBondContact ND1-N 3.31Å; H2063-V2087 PolarHBondContact ND1-O 3.1Å; H2063-V2087 VanDerWaalsContact ND1-O 3.12Å; H2063-R2090 PolarHBondContact NE2-NH1 3.07Å
2064	A	94.7	Very high	91.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.095	C	C	.	.	S	Bend	trans	-81	-55.2	171.7	0	0	0	0	0	110.1	A2042 I2043 V2057 I2081 N2084 V2087 G2088	A2042-A2064 WeakPolarHBondContact CB-O 3.33Å; A2042-A2064 PolarHBondContact N-O 3.04Å; I2043-A2064 PolarHBondContact N-O 3.39Å; V2057-A2064 HydrophobicContact CB-CB 4.11Å; V2057-A2064 HydrophobicContact CG1-CB 3.7Å; A2064-I2081 HydrophobicContact CB-CG2 3.43Å; A2064-I2081 VanDerWaalsContact CB-CG2 3.48Å; A2064-N2084 HydrophobicContact CB-CB 4.38Å; A2064-V2087 PolarHBondContact N-O 2.95Å; A2064-V2087 VanDerWaalsContact N-O 3.13Å; A2064-G2088 WeakPolarHBondContact CA-O 3.38Å; A2064-G2088 VanDerWaalsContact CB-O 3.25Å; A2064-G2088 WeakPolarHBondContact CB-O 3.28Å; A2064-G2088 PolarHBondContact N-O 3.12Å
2065	I	95.5	Very high	90.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127.3	179.3	-53.6	-177.3	0	0	0	109.7	I2043 V2057 I2067 M2079 I2081 G2088 L2089 R2090	I2043-I2065 HydrophobicContact CB-CG1 4.28Å; I2043-I2065 HydrophobicContact CB-CG2 4.43Å; I2043-I2065 HydrophobicContact CD1-CD1 4.2Å; I2043-I2065 HydrophobicContact CD1-CG1 4.12Å; I2043-I2065 HydrophobicContact CG1-CG1 4.46Å; I2043-I2065 CarbonylContact O-C 3.51Å; I2043-I2065 WeakPolarHBondContact O-CA 3.38Å; V2057-I2065 HydrophobicContact CG2-CD1 4.36Å; V2057-I2065 HydrophobicContact CG2-CG1 4.36Å; I2065-I2067 HydrophobicContact CG2-CD1 4.26Å; I2065-I2067 HydrophobicContact CG2-CG1 3.97Å; I2065-M2079 HydrophobicContact CD1-CE 3.34Å; I2065-I2081 HydrophobicContact CD1-CD1 3.91Å; I2065-I2081 HydrophobicContact CG1-CD1 4.28Å; I2065-G2088 PolarHBondContact N-O 3.09Å; I2065-L2089 HydrophobicContact CB-CD1 3.8Å; I2065-L2089 HydrophobicContact CG2-CD1 3.76Å; I2065-L2089 CarbonylContact O-C 3.56Å; I2065-L2089 WeakPolarHBondContact O-CA 3.41Å; I2065-R2090 PolarHBondContact O-N 3.17Å
2066	E	94.3	Very high	90.8	Very high	6 Å²	6	16.7 Å²	16.7	3%	0.028	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	117.8	175.6	-173.2	164.2	-151.5	0	0	110.1	A2041 I2043 T2044 V2045 H2063 V2068 R2090 P2113	A2041-E2066 HydrophobicContact CB-CB 3.59Å; I2043-E2066 PolarHBondContact O-N 3.38Å; T2044-E2066 CarbonylContact C-O 3.4Å; T2044-E2066 VanDerWaalsContact CA-O 3.27Å; T2044-E2066 WeakPolarHBondContact CA-O 3.39Å; T2044-E2066 HydrophobicContact CG2-CB 4.46Å; V2045-E2066 PolarHBondContact N-O 3.03Å; H2063-E2066 IonicContact CD2-OE2 3.3Å; E2066-V2068 HydrophobicContact CG-CG2 4.32Å; E2066-R2090 CarbonylContact C-O 3.51Å; E2066-R2090 WeakPolarHBondContact CA-O 3.27Å; E2066-R2090 HydrophobicContact CG-CB 4.36Å; E2066-R2090 VanDerWaalsContact OE1-CD 3.3Å; E2066-R2090 WeakPolarHBondContact OE1-CD 3.34Å; E2066-R2090 IonicContact OE1-CZ 3Å; E2066-R2090 VanDerWaalsContact OE1-CZ 3.22Å; E2066-R2090 IonicContact OE1-NE 3.02Å; E2066-R2090 IonicContact OE1-NH1 2.74Å; E2066-R2090 PolarHBondContact OE1-NH1 3.16Å; E2066-R2090 VanDerWaalsContact OE1-NH1 3.12Å; E2066-R2090 IonicContact OE1-NH2 2.71Å; E2066-R2090 PolarHBondContact OE1-NH2 2.9Å; E2066-P2113 HydrophobicContact CG-CG 4.48Å; E2066-P2113 WeakPolarHBondContact OE1-CD 3.4Å; E2066-P2113 WeakPolarHBondContact OE2-CB 3.22Å; E2066-P2113 WeakPolarHBondContact OE2-CG 3.27Å
2067	I	93.7	Very high	90.8	Very high	5.25 Å²	5.25	16.8 Å²	16.8	3%	0.027	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123.5	-179.3	-51.7	-173.8	0	0	0	109	V2045 F2052 I2065 P2070 I2074 R2090 L2091 L2092	V2045-I2067 HydrophobicContact CB-CB 4.44Å; V2045-I2067 HydrophobicContact CB-CG1 4.16Å; V2045-I2067 HydrophobicContact CB-CG2 4.14Å; V2045-I2067 HydrophobicContact CG1-CG2 4.38Å; V2045-I2067 HydrophobicContact CG2-CG1 4.34Å; V2045-I2067 CarbonylContact O-C 3.53Å; V2045-I2067 WeakPolarHBondContact O-CA 3.31Å; F2052-I2067 HydrophobicContact CE2-CD1 4.42Å; I2065-I2067 HydrophobicContact CG2-CD1 4.26Å; I2065-I2067 HydrophobicContact CG2-CG1 3.97Å; I2067-P2070 HydrophobicContact CG2-CB 3.67Å; I2067-P2070 HydrophobicContact CG2-CG 3.94Å; I2067-I2074 HydrophobicContact CD1-CD1 4.35Å; I2067-I2074 HydrophobicContact CD1-CG2 4.33Å; I2067-I2074 HydrophobicContact CG2-CD1 4.23Å; I2067-R2090 PolarHBondContact N-O 3.07Å; I2067-L2091 HydrophobicContact CB-CD2 3.6Å; I2067-L2091 HydrophobicContact CD1-CD2 3.61Å; I2067-L2091 HydrophobicContact CG1-CD2 3.72Å; I2067-L2091 HydrophobicContact CG2-CD2 4.44Å; I2067-L2091 CarbonylContact O-C 3.55Å; I2067-L2091 WeakPolarHBondContact O-CA 3.49Å; I2067-L2092 PolarHBondContact O-N 3.12Å
2068	V	90.7	Very high	90.7	Very high	1.25 Å²	1.25	20.2 Å²	20.2	1%	0.008	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.9	-175.8	178.6	0	0	0	0	109.7	V2045 V2046 Y2047 E2066 L2092 P2113 L2116 L2119	V2045-V2068 PolarHBondContact O-N 2.99Å; V2046-V2068 WeakPolarHBondContact CA-O 3.31Å; V2046-V2068 HydrophobicContact CG2-CB 4.47Å; Y2047-V2068 PolarHBondContact N-O 3.04Å; E2066-V2068 HydrophobicContact CG-CG2 4.32Å; V2068-L2092 HydrophobicContact CG1-CD2 4.29Å; V2068-P2113 HydrophobicContact CG2-CG 4.5Å; V2068-L2116 HydrophobicContact CG2-CD2 4.39Å; V2068-L2119 HydrophobicContact CG1-CD1 4.35Å
2069	A	87.4	Confident	90.8	Very high	4.25 Å²	4.25	19.1 Å²	19.1	4%	0.035	10%	0.101	C	C	.	.	S	Bend	trans	50.3	55.6	179.4	0	0	0	0	0	113.9	Y2047 L2092 L2094 L2136	Y2047-A2069 VanDerWaalsContact CA-O 3.27Å; Y2047-A2069 WeakPolarHBondContact CA-O 3.26Å; Y2047-A2069 HydrophobicContact CD2-CB 4.28Å; Y2047-A2069 PolarHBondContact N-O 3.26Å; A2069-L2092 PolarHBondContact N-O 3.13Å; A2069-L2094 HydrophobicContact CB-CB 4.26Å; A2069-L2094 HydrophobicContact CB-CD1 4.04Å; A2069-L2094 HydrophobicContact CB-CG 4.26Å; A2069-L2136 HydrophobicContact CB-CD1 4.21Å
2070	P	87.8	Confident	91	Very high	7.5 Å²	7.5	20.1 Å²	20.1	5%	0.049	11%	0.107	C	C	.	.			trans	-67.5	142.8	-178	28.7	-34.5	0	0	0	112.6	I2067 I2074 L2092 L2251	I2067-P2070 HydrophobicContact CG2-CB 3.67Å; I2067-P2070 HydrophobicContact CG2-CG 3.94Å; P2070-I2074 HydrophobicContact CB-CD1 3.79Å; P2070-I2074 HydrophobicContact CB-CG1 4.17Å; P2070-I2074 HydrophobicContact CG-CD1 3.6Å; P2070-I2074 HydrophobicContact CG-CG1 4.43Å; P2070-L2092 WeakPolarHBondContact CD-O 3.33Å; P2070-L2251 HydrophobicContact CB-CD1 4.31Å; P2070-L2251 HydrophobicContact CG-CB 4.46Å; P2070-L2251 HydrophobicContact CG-CD1 3.97Å; P2070-L2251 HydrophobicContact CG-CD2 3.84Å; P2070-L2251 HydrophobicContact CG-CG 4.28Å
2071	H	80.9	Confident	91.2	Very high	16 Å²	16	20.2 Å²	20.2	7%	0.074	11%	0.107	C	C	.	.			trans	-102.1	136	171.7	-85.4	-81.6	0	0	0	111	Y2047 S2049 E2073 D2247 A2249	Y2047-H2071 AromaticContact CD1-CD2 3.75Å; Y2047-H2071 AromaticContact CD1-NE2 3.76Å; Y2047-H2071 AromaticContact CD2-CD2 3.69Å; Y2047-H2071 AromaticContact CD2-NE2 3.41Å; Y2047-H2071 VanDerWaalsContact CD2-NE2 3.34Å; Y2047-H2071 WeakPolarHBondContact CD2-NE2 3.3Å; Y2047-H2071 AromaticContact CE1-CD2 3.77Å; Y2047-H2071 AromaticContact CE1-NE2 3.57Å; Y2047-H2071 VanDerWaalsContact CE1-NE2 3.28Å; Y2047-H2071 WeakPolarHBondContact CE1-NE2 3.14Å; Y2047-H2071 AromaticContact CE2-CD2 3.75Å; Y2047-H2071 AromaticContact CE2-CE1 3.97Å; Y2047-H2071 AromaticContact CE2-NE2 2.96Å; Y2047-H2071 WeakPolarHBondContact CE2-NE2 3.24Å; Y2047-H2071 AromaticContact CG-CD2 3.83Å; Y2047-H2071 AromaticContact CG-NE2 3.92Å; Y2047-H2071 AromaticContact CZ-CD2 3.78Å; Y2047-H2071 AromaticContact CZ-CE1 3.92Å; Y2047-H2071 AromaticContact CZ-NE2 3.17Å; Y2047-H2071 PolarHBondContact OH-NE2 3.06Å; Y2047-H2071 VanDerWaalsContact OH-NE2 3.11Å; S2049-H2071 WeakPolarHBondContact CB-O 3.38Å; S2049-H2071 PolarHBondContact OG-O 3.02Å; S2049-H2071 VanDerWaalsContact OG-O 3.12Å; H2071-E2073 PolarHBondContact O-N 2.77Å; H2071-D2247 IonicContact CE1-OD1 2.88Å; H2071-D2247 PolarHBondContact CE1-OD1 2.93Å; H2071-D2247 VanDerWaalsContact CE1-OD1 3.29Å; H2071-D2247 IonicContact CE1-OD2 3.16Å; H2071-D2247 IonicContact ND1-OD1 3.46Å; H2071-A2249 WeakPolarHBondContact CA-O 3.48Å; H2071-A2249 HydrophobicContact CB-CB 4.37Å; H2071-A2249 PolarHBondContact ND1-O 3.21Å
2072	A	83	Confident	91.5	Very high	38.5 Å²	38.5	20.5 Å²	20.5	32%	0.318	11%	0.109	S	C	.	.	S	Bend	trans	69.9	-162.9	-174.4	0	0	0	0	0	115	S2049 A2249 L2251 K2252	S2049-A2072 PolarHBondContact OG-O 3.18Å; A2072-A2249 HydrophobicContact CB-CB 4.48Å; A2072-A2249 PolarHBondContact N-O 2.94Å; A2072-L2251 WeakPolarHBondContact O-CA 3.45Å; A2072-L2251 WeakPolarHBondContact O-CD1 3.41Å; A2072-K2252 PolarHBondContact O-N 3Å
2073	E	87.7	Confident	91.6	Very high	101.5 Å²	101.5	22 Å²	22	47%	0.474	12%	0.118	S	C	.	.			trans	-83.4	146	-173.7	83.3	-179.2	170.9	0	0	112.8	H2071 V2075 N2253 F2255	H2071-E2073 PolarHBondContact O-N 2.77Å; E2073-V2075 HydrophobicContact CG-CG2 4.26Å; E2073-V2075 WeakPolarHBondContact OE1-CG2 3.48Å; E2073-N2253 HydrophobicContact CG-CB 4.18Å; E2073-N2253 PolarHBondContact OE2-ND2 3.35Å; E2073-N2253 VanDerWaalsContact OE2-ND2 3.16Å; E2073-F2255 HydrophobicContact CG-CD2 4.17Å; E2073-F2255 HydrophobicContact CG-CE2 4.34Å; E2073-F2255 WeakPolarHBondContact OE1-CD2 3.22Å; E2073-F2255 WeakPolarHBondContact OE1-CE2 3.21Å
2074	I	90.7	Very high	91.5	Very high	4.25 Å²	4.25	21.1 Å²	21.1	2%	0.022	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	121.7	173.9	-64.2	169	0	0	0	108.3	I2067 P2070 L2076 L2091 L2251 N2253 I2254 F2255	I2067-I2074 HydrophobicContact CD1-CD1 4.35Å; I2067-I2074 HydrophobicContact CD1-CG2 4.33Å; I2067-I2074 HydrophobicContact CG2-CD1 4.23Å; P2070-I2074 HydrophobicContact CB-CD1 3.79Å; P2070-I2074 HydrophobicContact CB-CG1 4.17Å; P2070-I2074 HydrophobicContact CG-CD1 3.6Å; P2070-I2074 HydrophobicContact CG-CG1 4.43Å; I2074-L2076 HydrophobicContact CG2-CD1 4.35Å; I2074-L2076 HydrophobicContact CG2-CD2 4.38Å; I2074-L2076 HydrophobicContact CG2-CG 3.94Å; I2074-L2091 HydrophobicContact CD1-CD2 4.23Å; I2074-L2251 HydrophobicContact CD1-CD1 3.9Å; I2074-L2251 HydrophobicContact CD1-CD2 4.46Å; I2074-L2251 HydrophobicContact CG1-CD1 3.88Å; I2074-N2253 PolarHBondContact N-O 2.97Å; I2074-N2253 VanDerWaalsContact N-O 3.13Å; I2074-I2254 HydrophobicContact CB-CG1 4.5Å; I2074-I2254 HydrophobicContact CB-CG2 4.47Å; I2074-I2254 HydrophobicContact CD1-CG1 4.34Å; I2074-I2254 HydrophobicContact CG2-CG2 4.47Å; I2074-F2255 PolarHBondContact O-N 3.06Å
2075	V	91.5	Very high	91.3	Very high	33 Å²	33	21.8 Å²	21.8	20%	0.2	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	115.6	175.7	-175.8	0	0	0	0	108.6	F2052 E2073 N2077 F2255	F2052-V2075 PolarHBondContact N-O 3.11Å; E2073-V2075 HydrophobicContact CG-CG2 4.26Å; E2073-V2075 WeakPolarHBondContact OE1-CG2 3.48Å; V2075-N2077 WeakPolarHBondContact CG1-ND2 3.45Å; V2075-N2077 WeakPolarHBondContact CG1-OD1 3.42Å; V2075-F2255 HydrophobicContact CG2-CD2 4.37Å
2076	L	93.6	Very high	91.1	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	96.9	177.9	-63.3	-178.3	0	0	0	109.1	F2052 I2074 M2079 L2089 F2255 I2256 H2257	F2052-L2076 HydrophobicContact CB-CD2 3.74Å; F2052-L2076 HydrophobicContact CD2-CD2 3.3Å; F2052-L2076 HydrophobicContact CE2-CD2 4.05Å; F2052-L2076 HydrophobicContact CG-CD2 3.71Å; I2074-L2076 HydrophobicContact CG2-CD1 4.35Å; I2074-L2076 HydrophobicContact CG2-CD2 4.38Å; I2074-L2076 HydrophobicContact CG2-CG 3.94Å; L2076-M2079 HydrophobicContact CB-CG 3.87Å; L2076-M2079 HydrophobicContact CD2-CE 4.41Å; L2076-M2079 HydrophobicContact CD2-CG 4.47Å; L2076-M2079 HydrophobicContact CD2-SD 4.41Å; L2076-L2089 HydrophobicContact CD1-CD1 3.86Å; L2076-L2089 HydrophobicContact CD1-CD2 3.33Å; L2076-L2089 HydrophobicContact CD1-CG 4.23Å; L2076-F2255 PolarHBondContact N-O 2.93Å; L2076-I2256 HydrophobicContact CB-CG2 4.47Å; L2076-I2256 HydrophobicContact CD1-CD1 4.49Å; L2076-I2256 HydrophobicContact CD1-CG1 4.29Å; L2076-H2257 PolarHBondContact O-N 3.14Å
2077	N	94.2	Very high	91	Very high	49.75 Å²	49.75	22.1 Å²	22.1	27%	0.266	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	130.2	-178.6	-67.7	-18.7	0	0	0	110.9	F2052 D2053 H2054 V2075 M2079	F2052-N2077 PolarHBondContact O-N 3.09Å; F2052-N2077 VanDerWaalsContact O-N 3.13Å; D2053-N2077 WeakPolarHBondContact CA-O 3.26Å; D2053-N2077 WeakPolarHBondContact OD1-CB 3.08Å; H2054-N2077 PolarHBondContact N-O 3.21Å; V2075-N2077 WeakPolarHBondContact CG1-ND2 3.45Å; V2075-N2077 WeakPolarHBondContact CG1-OD1 3.42Å; N2077-M2079 VanDerWaalsContact C-N 3.32Å; N2077-M2079 PolarHBondContact O-N 3.26Å
2078	K	94	Very high	91	Very high	71.75 Å²	71.75	21.9 Å²	21.9	31%	0.312	12%	0.118	S	C	.	.	S	Bend	trans	54.1	46.2	173.2	-66.9	180	170.1	-167.7	0	113.3	H2054 H2257 E2258 D2709	H2054-K2078 VanDerWaalsContact CA-O 3.3Å; H2054-K2078 WeakPolarHBondContact CA-O 3.4Å; H2054-K2078 VanDerWaalsContact CE1-CD 3.48Å; H2054-K2078 WeakPolarHBondContact CE1-CD 3.4Å; H2054-K2078 WeakPolarHBondContact NE2-CD 3.38Å; K2078-H2257 PolarHBondContact N-O 3Å; K2078-E2258 WeakPolarHBondContact CA-O 3.3Å; K2078-E2258 VanDerWaalsContact CE-CD 3.42Å; K2078-E2258 WeakPolarHBondContact CE-OE2 3.35Å; K2078-E2258 HydrophobicContact CG-CB 3.86Å; K2078-E2258 WeakPolarHBondContact CG-OE2 3.49Å; K2078-E2258 IonicContact NZ-OE2 3.21Å; K2078-D2709 IonicContact NZ-OD2 3.2Å
2079	M	94.8	Very high	91.2	Very high	2.5 Å²	2.5	21.8 Å²	21.8	1%	0.012	12%	0.117	C	C	.	.			trans	-79	133.7	178.6	-60.3	-59.3	-66.4	0	0	110.5	F2052 V2055 I2065 L2076 N2077 I2081 G2259 R2260	F2052-M2079 HydrophobicContact CB-CE 4.12Å; F2052-M2079 HydrophobicContact CB-SD 3.58Å; F2052-M2079 VanDerWaalsContact CB-SD 3.56Å; F2052-M2079 HydrophobicContact CD1-CE 4.29Å; F2052-M2079 HydrophobicContact CG-CE 4.4Å; F2052-M2079 HydrophobicContact CG-SD 4.45Å; V2055-M2079 HydrophobicContact CB-CE 3.72Å; V2055-M2079 HydrophobicContact CB-SD 3.88Å; V2055-M2079 HydrophobicContact CG1-CE 4.12Å; V2055-M2079 HydrophobicContact CG2-SD 4.47Å; V2055-M2079 WeakPolarHBondContact O-CA 3.46Å; I2065-M2079 HydrophobicContact CD1-CE 3.34Å; L2076-M2079 HydrophobicContact CB-CG 3.87Å; L2076-M2079 HydrophobicContact CD2-CE 4.41Å; L2076-M2079 HydrophobicContact CD2-CG 4.47Å; L2076-M2079 HydrophobicContact CD2-SD 4.41Å; N2077-M2079 VanDerWaalsContact C-N 3.32Å; N2077-M2079 PolarHBondContact O-N 3.26Å; M2079-I2081 HydrophobicContact CB-CD1 4.34Å; M2079-I2081 HydrophobicContact CB-CG1 4.46Å; M2079-I2081 HydrophobicContact CE-CD1 4.43Å; M2079-G2259 CarbonylContact O-C 3.56Å; M2079-G2259 WeakPolarHBondContact O-CA 3.19Å; M2079-R2260 PolarHBondContact O-N 2.78Å
2080	N	94.8	Very high	91.5	Very high	37 Å²	37	22.1 Å²	22.1	20%	0.198	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	105.5	172	-170.2	23.9	0	0	0	109.7	V2055 N2056 V2057 T2082 R2260	V2055-N2080 PolarHBondContact O-N 3.07Å; N2056-N2080 CarbonylContact C-O 3.49Å; N2056-N2080 VanDerWaalsContact CA-O 3.29Å; N2056-N2080 WeakPolarHBondContact CA-O 3.35Å; N2056-N2080 HydrophobicContact CB-CB 4.38Å; N2056-N2080 VanDerWaalsContact OD1-CB 3.26Å; N2056-N2080 WeakPolarHBondContact OD1-CB 3.34Å; N2056-N2080 PolarHBondContact OD1-ND2 3.35Å; N2056-N2080 VanDerWaalsContact OD1-ND2 3.15Å; N2056-N2080 PolarHBondContact OD1-O 2.79Å; V2057-N2080 PolarHBondContact N-O 3.21Å; N2080-T2082 VanDerWaalsContact OD1-CG2 3.28Å; N2080-T2082 WeakPolarHBondContact OD1-CG2 3.4Å; N2080-R2260 WeakPolarHBondContact OD1-CD 3.4Å
2081	I	95.8	Very high	91.8	Very high	0.75 Å²	0.75	22 Å²	22	0%	0.004	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	100.3	-173.1	-64.2	175.4	0	0	0	108.4	V2057 A2064 I2065 M2079 N2084 R2260 F2261 E2262 N2264	V2057-I2081 HydrophobicContact CB-CG1 4.47Å; V2057-I2081 WeakPolarHBondContact O-CA 3.43Å; A2064-I2081 HydrophobicContact CB-CG2 3.43Å; A2064-I2081 VanDerWaalsContact CB-CG2 3.48Å; I2065-I2081 HydrophobicContact CD1-CD1 3.91Å; I2065-I2081 HydrophobicContact CG1-CD1 4.28Å; M2079-I2081 HydrophobicContact CB-CD1 4.34Å; M2079-I2081 HydrophobicContact CB-CG1 4.46Å; M2079-I2081 HydrophobicContact CE-CD1 4.43Å; I2081-N2084 VanDerWaalsContact CG2-ND2 3.28Å; I2081-N2084 WeakPolarHBondContact CG2-ND2 3.31Å; I2081-R2260 PolarHBondContact N-O 2.83Å; I2081-F2261 HydrophobicContact CB-CD1 3.99Å; I2081-F2261 HydrophobicContact CB-CE1 4.25Å; I2081-F2261 HydrophobicContact CD1-CD1 4.29Å; I2081-F2261 HydrophobicContact CD1-CE1 3.67Å; I2081-F2261 HydrophobicContact CD1-CZ 4.32Å; I2081-F2261 HydrophobicContact CG1-CE1 4.41Å; I2081-F2261 HydrophobicContact CG2-CD1 4.31Å; I2081-F2261 WeakPolarHBondContact O-CA 3.14Å; I2081-E2262 PolarHBondContact O-N 3.23Å; I2081-E2262 VanDerWaalsContact O-N 3.12Å; I2081-N2264 PolarHBondContact O-ND2 2.95Å
2082	T	93.7	Very high	92.3	Very high	11.25 Å²	11.25	21.6 Å²	21.6	7%	0.069	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.9	-170.8	64.4	0	0	0	0	114.1	V2057 T2058 N2059 N2080 N2084 E2262	V2057-T2082 PolarHBondContact O-N 2.91Å; V2057-T2082 VanDerWaalsContact O-N 3.12Å; T2058-T2082 VanDerWaalsContact CA-O 3.27Å; T2058-T2082 WeakPolarHBondContact CA-O 3.36Å; T2058-T2082 VanDerWaalsContact CG2-OG1 3.28Å; T2058-T2082 WeakPolarHBondContact CG2-OG1 3.25Å; N2059-T2082 PolarHBondContact N-O 3.12Å; N2080-T2082 VanDerWaalsContact OD1-CG2 3.28Å; N2080-T2082 WeakPolarHBondContact OD1-CG2 3.4Å; T2082-N2084 VanDerWaalsContact C-N 3.31Å; T2082-N2084 PolarHBondContact N-ND2 3.06Å; T2082-N2084 PolarHBondContact O-N 3.19Å; T2082-N2084 PolarHBondContact O-ND2 2.7Å; T2082-N2084 VanDerWaalsContact O-ND2 3.11Å; T2082-E2262 VanDerWaalsContact CA-O 3.24Å; T2082-E2262 WeakPolarHBondContact CA-O 3.41Å; T2082-E2262 HydrophobicContact CG2-CB 3.99Å; T2082-E2262 HydrophobicContact CG2-CG 4.27Å
2083	D	91.5	Very high	92.5	Very high	52 Å²	52	19.8 Å²	19.8	28%	0.278	10%	0.1	S	C	.	.	S	Bend	trans	58.4	41.3	171	-59.1	-66.1	0	0	0	113.7	V1996 N2059 E2262 R2263	V1996-D2083 HydrophobicContact CG2-CB 4.47Å; N2059-D2083 VanDerWaalsContact CA-O 3.26Å; N2059-D2083 WeakPolarHBondContact CA-O 3.38Å; N2059-D2083 PolarHBondContact N-O 3.16Å; N2059-D2083 WeakPolarHBondContact OD1-CB 3.41Å; D2083-E2262 PolarHBondContact N-O 2.95Å; D2083-E2262 VanDerWaalsContact N-O 3.09Å; D2083-R2263 VanDerWaalsContact CA-O 3.3Å; D2083-R2263 WeakPolarHBondContact CA-O 3.35Å; D2083-R2263 PolarHBondContact N-O 2.83Å; D2083-R2263 WeakPolarHBondContact OD1-CB 3.26Å; D2083-R2263 WeakPolarHBondContact OD1-CD 3.34Å; D2083-R2263 IonicContact OD1-CZ 3.13Å; D2083-R2263 IonicContact OD1-NE 3.33Å; D2083-R2263 PolarHBondContact OD1-NE 3.14Å; D2083-R2263 IonicContact OD1-NH2 3.48Å; D2083-R2263 PolarHBondContact OD1-NH2 3.06Å; D2083-R2263 IonicContact OD2-CZ 3.15Å; D2083-R2263 IonicContact OD2-NE 3.61Å; D2083-R2263 PolarHBondContact OD2-NE 2.8Å; D2083-R2263 IonicContact OD2-NH2 3.24Å; D2083-R2263 PolarHBondContact OD2-NH2 3.08Å
2084	N	92.3	Very high	92.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.081	C	C	.	.			trans	-102	139	180	-55.4	-74.5	0	0	0	111.5	V2057 N2059 S2060 A2064 I2081 T2082 G2086 N2264 D2265	V2057-N2084 PolarHBondContact O-ND2 2.91Å; N2059-N2084 PolarHBondContact N-OD1 3.4Å; S2060-N2084 WeakPolarHBondContact CB-OD1 3.3Å; S2060-N2084 PolarHBondContact N-OD1 2.95Å; S2060-N2084 PolarHBondContact OG-OD1 3.14Å; A2064-N2084 HydrophobicContact CB-CB 4.38Å; I2081-N2084 VanDerWaalsContact CG2-ND2 3.28Å; I2081-N2084 WeakPolarHBondContact CG2-ND2 3.31Å; T2082-N2084 VanDerWaalsContact C-N 3.31Å; T2082-N2084 PolarHBondContact N-ND2 3.06Å; T2082-N2084 PolarHBondContact O-N 3.19Å; T2082-N2084 PolarHBondContact O-ND2 2.7Å; T2082-N2084 VanDerWaalsContact O-ND2 3.11Å; N2084-G2086 PolarHBondContact O-N 3.13Å; N2084-G2086 VanDerWaalsContact O-N 3.11Å; N2084-N2264 WeakPolarHBondContact CB-OD1 3.38Å; N2084-N2264 PolarHBondContact ND2-OD1 2.98Å; N2084-N2264 WeakPolarHBondContact O-CA 3.25Å; N2084-D2265 PolarHBondContact O-N 3.25Å
2085	L	90.2	Very high	91.7	Very high	14.5 Å²	14.5	15.8 Å²	15.8	8%	0.076	8%	0.082	C	C	.	.	S	Bend	trans	-73.2	-9.1	-176.7	-53.9	-179.3	0	0	0	113.3	N1929 A1993 S2060 S2061 D2265 R2266	N1929-L2085 HydrophobicContact CB-CD1 4.01Å; A1993-L2085 HydrophobicContact CB-CD1 4.01Å; S2060-L2085 WeakPolarHBondContact O-CG 3.42Å; S2060-L2085 PolarHBondContact O-N 3.23Å; S2060-L2085 VanDerWaalsContact O-N 3.13Å; S2061-L2085 WeakPolarHBondContact O-CB 3.44Å; L2085-D2265 WeakPolarHBondContact CA-OD2 3.41Å; L2085-D2265 WeakPolarHBondContact CD2-OD2 3.41Å; L2085-D2265 VanDerWaalsContact O-CB 3.24Å; L2085-D2265 WeakPolarHBondContact O-CB 3.34Å; L2085-R2266 PolarHBondContact O-NE 2.76Å; L2085-R2266 PolarHBondContact O-NH1 2.99Å
2086	G	89.8	Confident	90.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.076	C	C	.	.	S	Bend	trans	-113.7	-153	178.5	0	0	0	0	0	113.4	M2062 N2084 D2265 R2266	M2062-G2086 VanDerWaalsContact O-CA 3.23Å; M2062-G2086 WeakPolarHBondContact O-CA 3.31Å; M2062-G2086 PolarHBondContact O-N 3.22Å; N2084-G2086 PolarHBondContact O-N 3.13Å; N2084-G2086 VanDerWaalsContact O-N 3.11Å; G2086-D2265 PolarHBondContact O-N 3.45Å; G2086-R2266 PolarHBondContact O-N 3.28Å
2087	V	92.7	Very high	89.1	Confident	12.25 Å²	12.25	18.2 Å²	18.2	7%	0.074	9%	0.091	C	C	.	.			trans	-78.2	137.8	167.7	-176.7	0	0	0	0	108.8	H2063 A2064 L2089 R2266 G2267 R2270	H2063-V2087 VanDerWaalsContact CA-O 3.27Å; H2063-V2087 WeakPolarHBondContact CA-O 3.32Å; H2063-V2087 PolarHBondContact CE1-N 3.43Å; H2063-V2087 WeakPolarHBondContact ND1-CB 3.31Å; H2063-V2087 PolarHBondContact ND1-N 3.31Å; H2063-V2087 PolarHBondContact ND1-O 3.1Å; H2063-V2087 VanDerWaalsContact ND1-O 3.12Å; A2064-V2087 PolarHBondContact N-O 2.95Å; A2064-V2087 VanDerWaalsContact N-O 3.13Å; V2087-L2089 WeakPolarHBondContact CG1-O 3.34Å; V2087-R2266 HydrophobicContact CG2-CB 3.94Å; V2087-R2266 WeakPolarHBondContact CG2-O 3.1Å; V2087-G2267 VanDerWaalsContact CA-O 3.29Å; V2087-G2267 WeakPolarHBondContact CA-O 3.41Å; V2087-R2270 HydrophobicContact CG1-CB 4.13Å
2088	G	93.8	Very high	87	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	-57.4	-67.9	176.8	0	0	0	0	0	112.9	A2064 I2065 G2267 A2268	A2064-G2088 WeakPolarHBondContact CA-O 3.38Å; A2064-G2088 VanDerWaalsContact CB-O 3.25Å; A2064-G2088 WeakPolarHBondContact CB-O 3.28Å; A2064-G2088 PolarHBondContact N-O 3.12Å; I2065-G2088 PolarHBondContact N-O 3.09Å; G2088-G2267 PolarHBondContact N-O 2.84Å; G2088-A2268 CarbonylContact C-O 3.57Å; G2088-A2268 VanDerWaalsContact CA-O 3.3Å; G2088-A2268 WeakPolarHBondContact CA-O 3.36Å; G2088-A2268 PolarHBondContact N-O 3.28Å
2089	L	95.2	Very high	85	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.3	176.6	174.9	68.1	0	0	0	110.7	I2065 L2076 V2087 L2091 I2256 F2261 A2268 V2269 R2270	I2065-L2089 HydrophobicContact CB-CD1 3.8Å; I2065-L2089 HydrophobicContact CG2-CD1 3.76Å; I2065-L2089 CarbonylContact O-C 3.56Å; I2065-L2089 WeakPolarHBondContact O-CA 3.41Å; L2076-L2089 HydrophobicContact CD1-CD1 3.86Å; L2076-L2089 HydrophobicContact CD1-CD2 3.33Å; L2076-L2089 HydrophobicContact CD1-CG 4.23Å; V2087-L2089 WeakPolarHBondContact CG1-O 3.34Å; L2089-L2091 HydrophobicContact CD1-CD2 3.85Å; L2089-L2091 HydrophobicContact CD1-CG 4.22Å; L2089-L2091 HydrophobicContact CD2-CD1 4.19Å; L2089-L2091 HydrophobicContact CD2-CG 4.32Å; L2089-L2091 HydrophobicContact CG-CD1 4.48Å; L2089-L2091 HydrophobicContact CG-CD2 4.26Å; L2089-L2091 HydrophobicContact CG-CG 4.08Å; L2089-I2256 HydrophobicContact CD2-CD1 3.66Å; L2089-F2261 HydrophobicContact CB-CE1 3.83Å; L2089-F2261 HydrophobicContact CB-CZ 4.35Å; L2089-F2261 HydrophobicContact CD2-CZ 4.47Å; L2089-A2268 PolarHBondContact N-O 3.18Å; L2089-V2269 HydrophobicContact CB-CG2 4.31Å; L2089-V2269 HydrophobicContact CD2-CG1 4.24Å; L2089-V2269 CarbonylContact O-C 3.57Å; L2089-V2269 VanDerWaalsContact O-CA 3.31Å; L2089-V2269 WeakPolarHBondContact O-CA 3.36Å; L2089-R2270 PolarHBondContact O-N 3.08Å
2090	R	93.9	Very high	82.7	Confident	11.25 Å²	11.25	22.7 Å²	22.7	4%	0.042	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.4	174.9	-171.1	176.6	-175.9	-177.1	1.9	111.1	H2063 I2065 E2066 I2067 T2111 R2270	H2063-R2090 PolarHBondContact NE2-NH1 3.07Å; I2065-R2090 PolarHBondContact O-N 3.17Å; E2066-R2090 CarbonylContact C-O 3.51Å; E2066-R2090 WeakPolarHBondContact CA-O 3.27Å; E2066-R2090 HydrophobicContact CG-CB 4.36Å; E2066-R2090 VanDerWaalsContact OE1-CD 3.3Å; E2066-R2090 WeakPolarHBondContact OE1-CD 3.34Å; E2066-R2090 IonicContact OE1-CZ 3Å; E2066-R2090 VanDerWaalsContact OE1-CZ 3.22Å; E2066-R2090 IonicContact OE1-NE 3.02Å; E2066-R2090 IonicContact OE1-NH1 2.74Å; E2066-R2090 PolarHBondContact OE1-NH1 3.16Å; E2066-R2090 VanDerWaalsContact OE1-NH1 3.12Å; E2066-R2090 IonicContact OE1-NH2 2.71Å; E2066-R2090 PolarHBondContact OE1-NH2 2.9Å; I2067-R2090 PolarHBondContact N-O 3.07Å; R2090-T2111 VanDerWaalsContact CZ-OG1 3.31Å; R2090-T2111 PolarHBondContact NE-O 2.99Å; R2090-T2111 PolarHBondContact NH1-O 2.91Å; R2090-T2111 VanDerWaalsContact NH1-O 3.16Å; R2090-T2111 PolarHBondContact NH1-OG1 3.13Å; R2090-T2111 VanDerWaalsContact NH2-C 3.3Å; R2090-T2111 VanDerWaalsContact NH2-CA 3.31Å; R2090-T2111 VanDerWaalsContact NH2-N 3.12Å; R2090-T2111 PolarHBondContact NH2-O 2.9Å; R2090-T2111 PolarHBondContact NH2-OG1 3.09Å; R2090-R2270 CarbonylContact C-O 3.59Å; R2090-R2270 VanDerWaalsContact CA-O 3.31Å; R2090-R2270 WeakPolarHBondContact CA-O 3.29Å; R2090-R2270 HydrophobicContact CG-CB 4.35Å
2091	L	93	Very high	80.4	Confident	5.25 Å²	5.25	27.2 Å²	27.2	3%	0.027	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.7	-176.9	-60.6	179.2	0	0	0	109.6	I2067 I2074 L2089 I2254 R2270 Y2271 D2272	I2067-L2091 HydrophobicContact CB-CD2 3.6Å; I2067-L2091 HydrophobicContact CD1-CD2 3.61Å; I2067-L2091 HydrophobicContact CG1-CD2 3.72Å; I2067-L2091 HydrophobicContact CG2-CD2 4.44Å; I2067-L2091 CarbonylContact O-C 3.55Å; I2067-L2091 WeakPolarHBondContact O-CA 3.49Å; I2074-L2091 HydrophobicContact CD1-CD2 4.23Å; L2089-L2091 HydrophobicContact CD1-CD2 3.85Å; L2089-L2091 HydrophobicContact CD1-CG 4.22Å; L2089-L2091 HydrophobicContact CD2-CD1 4.19Å; L2089-L2091 HydrophobicContact CD2-CG 4.32Å; L2089-L2091 HydrophobicContact CG-CD1 4.48Å; L2089-L2091 HydrophobicContact CG-CD2 4.26Å; L2089-L2091 HydrophobicContact CG-CG 4.08Å; L2091-I2254 HydrophobicContact CD1-CD1 4.33Å; L2091-I2254 HydrophobicContact CD1-CG2 3.9Å; L2091-R2270 PolarHBondContact N-O 3.04Å; L2091-Y2271 HydrophobicContact CB-CD2 3.65Å; L2091-Y2271 HydrophobicContact CB-CE2 4.43Å; L2091-Y2271 HydrophobicContact CB-CG 4.46Å; L2091-Y2271 HydrophobicContact CD1-CD2 4.47Å; L2091-Y2271 WeakPolarHBondContact O-CA 3.33Å; L2091-D2272 PolarHBondContact O-N 3.33Å
2092	L	91.2	Very high	78.2	Confident	7.5 Å²	7.5	29.2 Å²	29.2	4%	0.039	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	102.2	171.2	-179.5	60.7	0	0	0	109.3	I2067 V2068 A2069 P2070 L2094 L2107 A2110 F2112 L2167 I2236 D2272	I2067-L2092 PolarHBondContact O-N 3.12Å; V2068-L2092 HydrophobicContact CG1-CD2 4.29Å; A2069-L2092 PolarHBondContact N-O 3.13Å; P2070-L2092 WeakPolarHBondContact CD-O 3.33Å; L2092-L2094 HydrophobicContact CD1-CD2 4.08Å; L2092-L2094 HydrophobicContact CD2-CD2 4.3Å; L2092-L2094 HydrophobicContact CG-CD2 4.05Å; L2092-L2094 HydrophobicContact CG-CG 4.31Å; L2092-L2107 HydrophobicContact CD1-CD1 3.97Å; L2092-A2110 HydrophobicContact CD1-CB 4.06Å; L2092-F2112 HydrophobicContact CD2-CB 4.39Å; L2092-F2112 HydrophobicContact CD2-CD1 4.38Å; L2092-L2167 HydrophobicContact CD1-CD1 4.3Å; L2092-L2167 HydrophobicContact CD2-CD1 4.21Å; L2092-I2236 HydrophobicContact CD2-CD1 3.83Å; L2092-D2272 CarbonylContact C-O 3.58Å; L2092-D2272 WeakPolarHBondContact CA-O 3.4Å; L2092-D2272 HydrophobicContact CD1-CB 4.16Å
2093	G	88.9	Confident	76.1	Confident	1 Å²	1	35 Å²	35	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	118.8	179.2	0	0	0	0	0	111.9	D2272 C2273 T2274	G2093-D2272 PolarHBondContact N-O 3.01Å; G2093-C2273 CarbonylContact O-C 3.52Å; G2093-C2273 WeakPolarHBondContact O-CA 3.46Å; G2093-C2273 WeakPolarHBondContact O-CB 3.27Å; G2093-T2274 PolarHBondContact O-N 2.94Å
2094	L	84.4	Confident	74.4	Confident	13.75 Å²	13.75	33.1 Å²	33.1	7%	0.072	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	91.9	177.4	-54.8	-176.5	0	0	0	108.9	A2069 L2092 L2166 I2236 T2274	A2069-L2094 HydrophobicContact CB-CB 4.26Å; A2069-L2094 HydrophobicContact CB-CD1 4.04Å; A2069-L2094 HydrophobicContact CB-CG 4.26Å; L2092-L2094 HydrophobicContact CD1-CD2 4.08Å; L2092-L2094 HydrophobicContact CD2-CD2 4.3Å; L2092-L2094 HydrophobicContact CG-CD2 4.05Å; L2092-L2094 HydrophobicContact CG-CG 4.31Å; L2094-L2166 HydrophobicContact CB-CD1 4.37Å; L2094-L2166 HydrophobicContact CD1-CD1 4.26Å; L2094-L2166 HydrophobicContact CD2-CB 4.42Å; L2094-I2236 HydrophobicContact CD1-CD1 4.16Å; L2094-I2236 HydrophobicContact CD1-CG2 3.86Å; L2094-T2274 HydrophobicContact CD2-CG2 3.44Å; L2094-T2274 VanDerWaalsContact CD2-CG2 3.44Å; L2094-T2274 WeakPolarHBondContact CD2-OG1 3.46Å
2095	N	77.2	Confident	72.9	Confident	7.75 Å²	7.75	36.4 Å²	36.4	4%	0.041	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	116.6	179.3	-81.6	-4	0	0	0	110.8	H2097 L2251 T2274 G2275 D2276 V2277	N2095-H2097 PolarHBondContact O-N 3.37Å; N2095-L2251 PolarHBondContact ND2-O 3.02Å; N2095-L2251 VanDerWaalsContact OD1-CB 3.3Å; N2095-L2251 WeakPolarHBondContact OD1-CB 3.24Å; N2095-L2251 PolarHBondContact OD1-N 2.95Å; N2095-L2251 VanDerWaalsContact OD1-N 3.16Å; N2095-T2274 PolarHBondContact N-O 2.98Å; N2095-T2274 VanDerWaalsContact N-O 3.09Å; N2095-G2275 VanDerWaalsContact O-CA 3.25Å; N2095-G2275 WeakPolarHBondContact O-CA 3.33Å; N2095-D2276 PolarHBondContact O-N 3.24Å; N2095-V2277 VanDerWaalsContact CB-O 3.3Å; N2095-V2277 WeakPolarHBondContact CB-O 3.35Å; N2095-V2277 PolarHBondContact ND2-O 3.08Å; N2095-V2277 VanDerWaalsContact ND2-O 3.13Å
2096	M	68.1	Low	71.6	Confident	12.25 Å²	12.25	36.2 Å²	36.2	6%	0.06	20%	0.204	C	C	.	.			trans	-112.8	108.5	-175.6	-94.5	169	49.6	0	0	111.8	R2134 L2136 K2164 L2166 E2238 V2240	M2096-R2134 PolarHBondContact O-NH1 3.14Å; M2096-R2134 VanDerWaalsContact SD-CZ 3.55Å; M2096-R2134 PolarHBondContact SD-NH1 3.1Å; M2096-R2134 VanDerWaalsContact SD-NH1 3.39Å; M2096-L2136 HydrophobicContact CE-CD2 3.73Å; M2096-L2136 VanDerWaalsContact CE-CD2 3.5Å; M2096-L2136 HydrophobicContact CE-CG 4.3Å; M2096-L2136 HydrophobicContact SD-CD1 4.31Å; M2096-L2136 HydrophobicContact SD-CD2 4.02Å; M2096-L2136 HydrophobicContact SD-CG 4.4Å; M2096-K2164 HydrophobicContact CE-CB 4.47Å; M2096-K2164 HydrophobicContact CE-CD 3.36Å; M2096-K2164 VanDerWaalsContact CE-CE 3.46Å; M2096-K2164 HydrophobicContact CE-CG 4.07Å; M2096-K2164 HydrophobicContact SD-CD 3.93Å; M2096-K2164 WeakPolarHBondContact SD-CE 3.21Å; M2096-K2164 PolarHBondContact SD-NZ 3.47Å; M2096-L2166 HydrophobicContact CE-CD1 4.2Å; M2096-L2166 HydrophobicContact CE-CD2 4.22Å; M2096-L2166 HydrophobicContact CG-CD1 4.18Å; M2096-L2166 HydrophobicContact CG-CD2 4.31Å; M2096-L2166 HydrophobicContact SD-CD1 3.97Å; M2096-L2166 HydrophobicContact SD-CD2 3.29Å; M2096-L2166 WeakPolarHBondContact SD-CD2 3.5Å; M2096-E2238 HydrophobicContact CE-CB 3.62Å; M2096-E2238 HydrophobicContact CE-CG 4.34Å; M2096-E2238 WeakPolarHBondContact CE-OE2 3.41Å; M2096-E2238 VanDerWaalsContact CG-CD 3.49Å; M2096-E2238 WeakPolarHBondContact CG-OE2 3.32Å; M2096-E2238 HydrophobicContact SD-CB 3.97Å; M2096-E2238 HydrophobicContact SD-CG 4.16Å; M2096-V2240 HydrophobicContact SD-CG2 3.79Å
2097	H	61.3	Low	70.5	Confident	71.5 Å²	71.5	36.5 Å²	36.5	33%	0.331	21%	0.206	S	C	.	.			trans	-120.9	163.3	174.1	-85.4	-44.1	0	0	0	113.2	N2095 S2099 K2164 P2250 D2276	N2095-H2097 PolarHBondContact O-N 3.37Å; H2097-S2099 VanDerWaalsContact C-N 3.3Å; H2097-S2099 PolarHBondContact O-N 2.9Å; H2097-K2164 PolarHBondContact O-NZ 2.8Å; H2097-P2250 WeakPolarHBondContact CE1-CB 3.29Å; H2097-P2250 WeakPolarHBondContact NE2-CB 3.45Å; H2097-P2250 WeakPolarHBondContact NE2-CG 3.43Å; H2097-D2276 HydrophobicContact CB-CB 4.11Å; H2097-D2276 VanDerWaalsContact CB-OD2 3.25Å; H2097-D2276 WeakPolarHBondContact CB-OD2 3.12Å; H2097-D2276 PolarHBondContact N-OD2 3.15Å; H2097-D2276 VanDerWaalsContact O-OD2 3.1Å
2098	S	50.9	Low	69.2	Low	61.25 Å²	61.25	38.2 Å²	38.2	43%	0.428	21%	0.214	S	C	.	.			trans	-107.4	89.8	-157	62.3	0	0	0	0	114.3	T2100 D2276	S2098-T2100 VanDerWaalsContact C-N 3.3Å; S2098-T2100 WeakPolarHBondContact CB-OG1 3.32Å; S2098-T2100 PolarHBondContact O-N 2.95Å; S2098-T2100 PolarHBondContact OG-OG1 3.1Å; S2098-D2276 PolarHBondContact N-OD2 3.15Å; S2098-D2276 PolarHBondContact OG-OD2 3Å; S2098-D2276 VanDerWaalsContact OG-OD2 3.1Å
2099	S	50.7	Low	67.9	Low	60.5 Å²	60.5	43 Å²	43	42%	0.423	24%	0.236	S	C	.	.			trans	-62.9	68	168.5	80.8	0	0	0	0	113.2	H2097 T2101 V2102 D2276	H2097-S2099 VanDerWaalsContact C-N 3.3Å; H2097-S2099 PolarHBondContact O-N 2.9Å; S2099-T2101 PolarHBondContact O-N 2.68Å; S2099-V2102 VanDerWaalsContact OG-CB 3.28Å; S2099-V2102 WeakPolarHBondContact OG-CB 3.37Å; S2099-V2102 WeakPolarHBondContact OG-CG2 3.38Å; S2099-V2102 PolarHBondContact OG-N 3.29Å; S2099-D2276 WeakPolarHBondContact CB-OD1 3.38Å; S2099-D2276 VanDerWaalsContact CB-OD2 3.26Å; S2099-D2276 WeakPolarHBondContact CB-OD2 3.14Å; S2099-D2276 PolarHBondContact N-OD2 2.88Å; S2099-D2276 VanDerWaalsContact OG-CG 3.25Å; S2099-D2276 PolarHBondContact OG-OD1 3.13Å; S2099-D2276 PolarHBondContact OG-OD2 2.62Å
2100	T	48	Very low	66.6	Low	97.75 Å²	97.75	43 Å²	43	60%	0.6	24%	0.237	S	C	*	.	S	Bend	trans	-90.3	56.9	-177.7	40.7	0	0	0	0	112.1	S2098 V2102	S2098-T2100 VanDerWaalsContact C-N 3.3Å; S2098-T2100 WeakPolarHBondContact CB-OG1 3.32Å; S2098-T2100 PolarHBondContact O-N 2.95Å; S2098-T2100 PolarHBondContact OG-OG1 3.1Å; T2100-V2102 WeakPolarHBondContact O-CG2 3.45Å; T2100-V2102 PolarHBondContact O-N 3.14Å
2101	T	46.2	Very low	65.8	Low	131.5 Å²	131.5	44.4 Å²	44.4	81%	0.807	25%	0.247	S	C	*	.			trans	-105.5	38	175	55.1	0	0	0	0	114.2	S2099 E2103	S2099-T2101 PolarHBondContact O-N 2.68Å; T2101-E2103 PolarHBondContact O-N 3.15Å
2102	V	48.6	Very low	65.3	Low	42.25 Å²	42.25	44.4 Å²	44.4	26%	0.256	25%	0.246	S	C	.	.			trans	-97.6	115.6	175.1	-172.4	0	0	0	0	107.7	S2099 T2100 D2104 T2337	S2099-V2102 VanDerWaalsContact OG-CB 3.28Å; S2099-V2102 WeakPolarHBondContact OG-CB 3.37Å; S2099-V2102 WeakPolarHBondContact OG-CG2 3.38Å; S2099-V2102 PolarHBondContact OG-N 3.29Å; T2100-V2102 WeakPolarHBondContact O-CG2 3.45Å; T2100-V2102 PolarHBondContact O-N 3.14Å; V2102-D2104 VanDerWaalsContact C-N 3.25Å; V2102-D2104 HydrophobicContact CG1-CB 4.2Å; V2102-D2104 VanDerWaalsContact CG1-OD1 3.28Å; V2102-D2104 WeakPolarHBondContact CG1-OD1 3.39Å; V2102-D2104 WeakPolarHBondContact CG1-OD2 3.36Å; V2102-D2104 PolarHBondContact O-N 2.96Å; V2102-T2337 HydrophobicContact CG1-CG2 3.78Å
2103	E	50.8	Low	65.1	Low	133.5 Å²	133.5	44.6 Å²	44.6	62%	0.624	25%	0.248	S	C	*	.			trans	-67.8	77.2	170.1	-64.4	-173.6	173.1	0	0	109.2	T2101 E2105 H2207	T2101-E2103 PolarHBondContact O-N 3.15Å; E2103-E2105 PolarHBondContact O-N 3.01Å; E2103-H2207 IonicContact OE2-CE1 2.76Å; E2103-H2207 PolarHBondContact OE2-CE1 3.4Å; E2103-H2207 VanDerWaalsContact OE2-CE1 3.25Å; E2103-H2207 IonicContact OE2-ND1 3.73Å; E2103-H2207 PolarHBondContact OE2-ND1 2.96Å
2104	D	54.9	Low	64.9	Low	12.25 Å²	12.25	46.8 Å²	46.8	7%	0.066	26%	0.256	C	S	.	.			trans	-78.5	113.6	171.4	-73.5	-31.4	0	0	0	108.8	V2102 K2164 L2209 S2210	V2102-D2104 VanDerWaalsContact C-N 3.25Å; V2102-D2104 HydrophobicContact CG1-CB 4.2Å; V2102-D2104 VanDerWaalsContact CG1-OD1 3.28Å; V2102-D2104 WeakPolarHBondContact CG1-OD1 3.39Å; V2102-D2104 WeakPolarHBondContact CG1-OD2 3.36Å; V2102-D2104 PolarHBondContact O-N 2.96Å; D2104-K2164 IonicContact OD2-NZ 3.44Å; D2104-K2164 PolarHBondContact OD2-NZ 3.15Å; D2104-L2209 HydrophobicContact CB-CD1 4.23Å; D2104-L2209 VanDerWaalsContact O-CD1 3.27Å; D2104-L2209 WeakPolarHBondContact O-CD1 3.41Å; D2104-S2210 WeakPolarHBondContact O-CB 3.42Å
2105	E	61.6	Low	64.8	Low	68.25 Å²	68.25	48.9 Å²	48.9	32%	0.319	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-65.5	128	167.1	-83.5	-170	-177.2	0	0	109.1	E2103 L2107 R2206 R2366	E2103-E2105 PolarHBondContact O-N 3.01Å; E2105-L2107 PolarHBondContact O-N 3.4Å; E2105-R2206 WeakPolarHBondContact OE2-CD 3.48Å; E2105-R2206 IonicContact OE2-CZ 3.92Å; E2105-R2206 IonicContact OE2-NH1 2.97Å; E2105-R2206 PolarHBondContact OE2-NH1 2.95Å; E2105-R2366 IonicContact OE1-CZ 2.72Å; E2105-R2366 IonicContact OE1-NH1 3.92Å; E2105-R2366 PolarHBondContact OE1-NH1 2.85Å; E2105-R2366 IonicContact OE1-NH2 3.63Å; E2105-R2366 PolarHBondContact OE1-NH2 2.81Å; E2105-R2366 IonicContact OE2-CZ 2.92Å; E2105-R2366 IonicContact OE2-NH1 3.11Å; E2105-R2366 PolarHBondContact OE2-NH1 3.05Å; E2105-R2366 IonicContact OE2-NH2 3.64Å; E2105-R2366 PolarHBondContact OE2-NH2 2.72Å
2106	P	61.9	Low	65.1	Low	11 Å²	11	48.7 Å²	48.7	7%	0.071	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-65.4	146.6	178.8	26	-33.9	0	0	0	111.5	L2108 L2165 L2166 A2168 L2209	P2106-L2108 PolarHBondContact O-N 3.02Å; P2106-L2165 HydrophobicContact CB-CB 4.43Å; P2106-L2166 WeakPolarHBondContact CA-O 3.25Å; P2106-A2168 HydrophobicContact CB-CB 4.14Å; P2106-A2168 VanDerWaalsContact CB-O 3.26Å; P2106-A2168 WeakPolarHBondContact CB-O 3.37Å; P2106-A2168 HydrophobicContact CG-CB 4.24Å; P2106-L2209 HydrophobicContact CB-CD1 4.13Å; P2106-L2209 HydrophobicContact CG-CB 3.9Å
2107	L	67.6	Low	65.8	Low	6 Å²	6	49.1 Å²	49.1	3%	0.031	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-62.1	121	171.6	-80.4	170.1	0	0	0	110.3	L2092 E2105 H2109 A2110 L2166 L2167 A2168 D2272 C2273 T2274 Y2311	L2092-L2107 HydrophobicContact CD1-CD1 3.97Å; E2105-L2107 PolarHBondContact O-N 3.4Å; L2107-H2109 PolarHBondContact O-N 3.06Å; L2107-A2110 HydrophobicContact CB-CB 4.39Å; L2107-A2110 HydrophobicContact CD1-CB 4.45Å; L2107-L2166 PolarHBondContact N-O 3.12Å; L2107-L2167 HydrophobicContact CB-CB 4.24Å; L2107-L2167 HydrophobicContact CB-CD1 3.67Å; L2107-L2167 HydrophobicContact CB-CG 4.03Å; L2107-L2167 HydrophobicContact CD1-CD1 3.78Å; L2107-L2167 HydrophobicContact CG-CD1 4.42Å; L2107-L2167 CarbonylContact O-C 3.45Å; L2107-L2167 WeakPolarHBondContact O-CA 3.38Å; L2107-L2167 WeakPolarHBondContact O-CG 3.39Å; L2107-A2168 PolarHBondContact O-N 3.22Å; L2107-D2272 HydrophobicContact CD1-CB 4.09Å; L2107-D2272 HydrophobicContact CD2-CB 3.92Å; L2107-C2273 WeakPolarHBondContact CD2-O 3.47Å; L2107-T2274 HydrophobicContact CB-CG2 4.4Å; L2107-T2274 HydrophobicContact CD1-CG2 3.71Å; L2107-T2274 HydrophobicContact CG-CG2 4.13Å; L2107-Y2311 HydrophobicContact CD2-CD2 4.18Å; L2107-Y2311 HydrophobicContact CD2-CE2 3.53Å; L2107-Y2311 HydrophobicContact CG-CE2 4.07Å
2108	L	64.5	Low	66.7	Low	47 Å²	47	45.8 Å²	45.8	25%	0.246	25%	0.249	C	C	.	.	S	Bend	trans	-89	-20	-174.2	-93.4	137.8	0	0	0	113.9	P2106 A2168 N2169 R2206 E2893 R2894	P2106-L2108 PolarHBondContact O-N 3.02Å; L2108-A2168 VanDerWaalsContact CD2-O 3.28Å; L2108-A2168 WeakPolarHBondContact CD2-O 3.12Å; L2108-N2169 VanDerWaalsContact O-CB 3.26Å; L2108-N2169 WeakPolarHBondContact O-CB 3.27Å; L2108-N2169 PolarHBondContact O-ND2 2.85Å; L2108-N2169 PolarHBondContact O-OD1 3.01Å; L2108-R2206 VanDerWaalsContact CD1-NH2 3.26Å; L2108-E2893 WeakPolarHBondContact CD2-O 3.48Å; L2108-R2894 HydrophobicContact CD2-CG 4.21Å
2109	H	66.3	Low	68.5	Low	100.5 Å²	100.5	43 Å²	43	47%	0.465	23%	0.229	S	C	.	.	S	Bend	trans	-130	63.3	-170.8	-62.4	26.1	0	0	0	112.2	L2107 T2111 R2270 E2893	L2107-H2109 PolarHBondContact O-N 3.06Å; H2109-T2111 VanDerWaalsContact C-N 3.26Å; H2109-T2111 HydrophobicContact CB-CG2 4.38Å; H2109-T2111 PolarHBondContact O-N 3.44Å; H2109-R2270 PolarHBondContact O-NH2 3.16Å; H2109-E2893 IonicContact CD2-OE1 3.24Å; H2109-E2893 VanDerWaalsContact CE1-CD 3.44Å; H2109-E2893 IonicContact CE1-OE1 3.43Å; H2109-E2893 IonicContact CE1-OE2 3.33Å; H2109-E2893 PolarHBondContact CE1-OE2 3.16Å; H2109-E2893 VanDerWaalsContact NE2-CB 3.25Å; H2109-E2893 WeakPolarHBondContact NE2-CB 3.38Å; H2109-E2893 WeakPolarHBondContact NE2-CG 3.31Å; H2109-E2893 IonicContact NE2-OE1 3.33Å; H2109-E2893 PolarHBondContact NE2-OE1 3.47Å; H2109-E2893 IonicContact NE2-OE2 3.1Å
2110	A	67.8	Low	70.3	Confident	1.5 Å²	1.5	40.2 Å²	40.2	1%	0.012	21%	0.209	C	C	.	.			trans	-113	120.1	173.2	0	0	0	0	0	110.1	L2092 L2107 F2112 L2167 A2232 G2234 D2272	L2092-A2110 HydrophobicContact CD1-CB 4.06Å; L2107-A2110 HydrophobicContact CB-CB 4.39Å; L2107-A2110 HydrophobicContact CD1-CB 4.45Å; A2110-F2112 HydrophobicContact CB-CD1 4.45Å; A2110-F2112 HydrophobicContact CB-CE1 3.76Å; A2110-F2112 HydrophobicContact CB-CZ 4.29Å; A2110-F2112 WeakPolarHBondContact O-CD1 3.36Å; A2110-F2112 WeakPolarHBondContact O-CE1 3.29Å; A2110-F2112 PolarHBondContact O-N 3.45Å; A2110-L2167 HydrophobicContact CB-CD1 3.53Å; A2110-L2167 VanDerWaalsContact CB-CD1 3.49Å; A2110-L2167 HydrophobicContact CB-CD2 3.6Å; A2110-L2167 HydrophobicContact CB-CG 4.35Å; A2110-A2232 PolarHBondContact N-O 3.32Å; A2110-G2234 VanDerWaalsContact CB-C 3.48Å; A2110-G2234 VanDerWaalsContact CB-CA 3.48Å; A2110-G2234 WeakPolarHBondContact CB-O 3.43Å; A2110-D2272 HydrophobicContact CB-CB 4.25Å
2111	T	76.6	Confident	72.3	Confident	41 Å²	41	36.4 Å²	36.4	25%	0.252	19%	0.185	S	C	.	.			trans	-106	144.3	179.4	68.7	0	0	0	0	110.3	R2090 H2109 A2232	R2090-T2111 VanDerWaalsContact CZ-OG1 3.31Å; R2090-T2111 PolarHBondContact NE-O 2.99Å; R2090-T2111 PolarHBondContact NH1-O 2.91Å; R2090-T2111 VanDerWaalsContact NH1-O 3.16Å; R2090-T2111 PolarHBondContact NH1-OG1 3.13Å; R2090-T2111 VanDerWaalsContact NH2-C 3.3Å; R2090-T2111 VanDerWaalsContact NH2-CA 3.31Å; R2090-T2111 VanDerWaalsContact NH2-N 3.12Å; R2090-T2111 PolarHBondContact NH2-O 2.9Å; R2090-T2111 PolarHBondContact NH2-OG1 3.09Å; H2109-T2111 VanDerWaalsContact C-N 3.26Å; H2109-T2111 HydrophobicContact CB-CG2 4.38Å; H2109-T2111 PolarHBondContact O-N 3.44Å; T2111-A2232 HydrophobicContact CG2-CB 4.25Å; T2111-A2232 WeakPolarHBondContact CG2-O 3.35Å
2112	F	84.5	Confident	74.4	Confident	3.75 Å²	3.75	30.4 Å²	30.4	2%	0.016	15%	0.148	C	C	.	.			trans	-128.8	164.8	-177.6	48.5	-96.3	0	0	0	109.6	L2092 A2110 L2116 Y2138 Y2139 K2140 L2167 I2236	L2092-F2112 HydrophobicContact CD2-CB 4.39Å; L2092-F2112 HydrophobicContact CD2-CD1 4.38Å; A2110-F2112 HydrophobicContact CB-CD1 4.45Å; A2110-F2112 HydrophobicContact CB-CE1 3.76Å; A2110-F2112 HydrophobicContact CB-CZ 4.29Å; A2110-F2112 WeakPolarHBondContact O-CD1 3.36Å; A2110-F2112 WeakPolarHBondContact O-CE1 3.29Å; A2110-F2112 PolarHBondContact O-N 3.45Å; F2112-L2116 HydrophobicContact CB-CD1 4.26Å; F2112-L2116 HydrophobicContact CD2-CD1 3.69Å; F2112-L2116 HydrophobicContact CE2-CD1 4.4Å; F2112-L2116 HydrophobicContact CG-CD1 4.29Å; F2112-Y2138 HydrophobicContact CD2-CD2 4.41Å; F2112-Y2138 AromaticContact CE2-CD2 3.77Å; F2112-Y2138 HydrophobicContact CE2-CD2 3.77Å; F2112-Y2138 HydrophobicContact CE2-CE2 4.46Å; F2112-Y2138 HydrophobicContact CE2-CG 4.49Å; F2112-Y2138 HydrophobicContact CZ-CD2 4.47Å; F2112-Y2139 WeakPolarHBondContact CZ-O 3.41Å; F2112-K2140 HydrophobicContact CD2-CD 4.26Å; F2112-K2140 HydrophobicContact CE2-CB 3.79Å; F2112-K2140 HydrophobicContact CE2-CD 4.19Å; F2112-K2140 HydrophobicContact CE2-CG 4.22Å; F2112-K2140 HydrophobicContact CZ-CB 4.22Å; F2112-K2140 HydrophobicContact CZ-CG 4.47Å; F2112-K2140 VanDerWaalsContact O-CD 3.29Å; F2112-K2140 WeakPolarHBondContact O-CD 3.35Å; F2112-K2140 VanDerWaalsContact O-CE 3.24Å; F2112-K2140 WeakPolarHBondContact O-CE 3.22Å; F2112-K2140 PolarHBondContact O-NZ 2.93Å; F2112-L2167 HydrophobicContact CD1-CD1 4.08Å; F2112-L2167 HydrophobicContact CD1-CD2 4.46Å; F2112-L2167 HydrophobicContact CE1-CD1 4.24Å; F2112-L2167 HydrophobicContact CE1-CD2 4.09Å; F2112-I2236 HydrophobicContact CD1-CD1 3.82Å; F2112-I2236 HydrophobicContact CD1-CG1 4.14Å; F2112-I2236 HydrophobicContact CE1-CD1 3.98Å; F2112-I2236 HydrophobicContact CE1-CG1 3.75Å; F2112-I2236 HydrophobicContact CG-CD1 4.21Å; F2112-I2236 HydrophobicContact CZ-CG1 4.07Å
2113	P	85.2	Confident	76.4	Confident	12.5 Å²	12.5	28.6 Å²	28.6	8%	0.081	14%	0.137	C	C	.	.			trans	-70.5	161.5	-175.1	16	-15.3	0	0	0	112.1	T2044 E2066 V2068 L2116	T2044-P2113 HydrophobicContact CG2-CG 4.22Å; E2066-P2113 HydrophobicContact CG-CG 4.48Å; E2066-P2113 WeakPolarHBondContact OE1-CD 3.4Å; E2066-P2113 WeakPolarHBondContact OE2-CB 3.22Å; E2066-P2113 WeakPolarHBondContact OE2-CG 3.27Å; V2068-P2113 HydrophobicContact CG2-CG 4.5Å; P2113-L2116 HydrophobicContact CB-CD2 4.2Å; P2113-L2116 HydrophobicContact CB-CG 4.35Å; P2113-L2116 HydrophobicContact CG-CD2 3.69Å; P2113-L2116 HydrophobicContact CG-CG 4.16Å
2114	Y	84.6	Confident	78.1	Confident	46.75 Å²	46.75	22.2 Å²	22.2	18%	0.183	11%	0.107	C	C	.	.	S	Bend	trans	-74	161.7	171.2	-68	-79.1	0	0	0	110.8	D2038 Y2138 K2140 Y2141 D2142 G2231	D2038-Y2114 WeakPolarHBondContact OD2-CD2 3.28Å; Y2114-Y2138 PolarHBondContact O-OH 2.77Å; Y2114-Y2138 VanDerWaalsContact O-OH 3.11Å; Y2114-K2140 HydrophobicContact CD1-CB 4.26Å; Y2114-K2140 HydrophobicContact CD1-CD 3.58Å; Y2114-K2140 HydrophobicContact CD1-CG 4.1Å; Y2114-K2140 HydrophobicContact CD2-CD 4.33Å; Y2114-K2140 VanDerWaalsContact CD2-NZ 3.31Å; Y2114-K2140 HydrophobicContact CE1-CB 4.24Å; Y2114-K2140 HydrophobicContact CE1-CD 3.53Å; Y2114-K2140 VanDerWaalsContact CE1-CD 3.46Å; Y2114-K2140 VanDerWaalsContact CE1-CE 3.45Å; Y2114-K2140 HydrophobicContact CE1-CG 3.75Å; Y2114-K2140 HydrophobicContact CE2-CD 4.34Å; Y2114-K2140 VanDerWaalsContact CE2-NZ 3.26Å; Y2114-K2140 HydrophobicContact CG-CD 4.03Å; Y2114-K2140 VanDerWaalsContact CZ-CE 3.43Å; Y2114-Y2141 WeakPolarHBondContact CE1-O 3.49Å; Y2114-Y2141 PolarHBondContact OH-O 2.99Å; Y2114-D2142 HydrophobicContact CE1-CB 4.28Å; Y2114-G2231 VanDerWaalsContact OH-CA 3.22Å; Y2114-G2231 WeakPolarHBondContact OH-CA 3.14Å
2115	Y	83.6	Confident	79.6	Confident	59 Å²	59	22.5 Å²	22.5	23%	0.231	11%	0.109	C	C	.	.	S	Bend	trans	53.3	65.1	176.2	-47.4	-69.1	0	0	0	112.9	R1671 I1706 Y2117	R1671-Y2115 PolarHBondContact NH2-OH 3Å; I1706-Y2115 HydrophobicContact CG2-CD1 4.43Å; I1706-Y2115 HydrophobicContact CG2-CG 4.22Å; Y2115-Y2117 PolarHBondContact O-N 3.09Å
2116	L	84.2	Confident	80.7	Confident	2.75 Å²	2.75	21.2 Å²	21.2	1%	0.014	10%	0.104	C	C	.	.			trans	-81.4	99.2	176.9	-75.2	165.5	0	0	0	110.7	F2008 V2046 V2068 F2112 P2113 L2119 Y2138	F2008-L2116 HydrophobicContact CZ-CD2 4.44Å; V2046-L2116 HydrophobicContact CB-CD2 4.43Å; V2046-L2116 HydrophobicContact CG1-CD2 4.19Å; V2046-L2116 HydrophobicContact CG2-CD2 3.49Å; V2046-L2116 VanDerWaalsContact CG2-CD2 3.46Å; V2068-L2116 HydrophobicContact CG2-CD2 4.39Å; F2112-L2116 HydrophobicContact CB-CD1 4.26Å; F2112-L2116 HydrophobicContact CD2-CD1 3.69Å; F2112-L2116 HydrophobicContact CE2-CD1 4.4Å; F2112-L2116 HydrophobicContact CG-CD1 4.29Å; P2113-L2116 HydrophobicContact CB-CD2 4.2Å; P2113-L2116 HydrophobicContact CB-CG 4.35Å; P2113-L2116 HydrophobicContact CG-CD2 3.69Å; P2113-L2116 HydrophobicContact CG-CG 4.16Å; L2116-L2119 HydrophobicContact CB-CB 4.43Å; L2116-L2119 HydrophobicContact CB-CD1 4.14Å; L2116-L2119 HydrophobicContact CB-CG 4.41Å; L2116-L2119 HydrophobicContact CD1-CD1 3.89Å; L2116-L2119 HydrophobicContact CG-CD1 4.41Å; L2116-L2119 PolarHBondContact O-N 3.1Å; L2116-Y2138 HydrophobicContact CB-CD1 4.4Å; L2116-Y2138 HydrophobicContact CB-CE1 3.78Å; L2116-Y2138 HydrophobicContact CB-CE2 4.33Å; L2116-Y2138 HydrophobicContact CD1-CD2 4.33Å; L2116-Y2138 HydrophobicContact CD1-CE2 4.28Å; L2116-Y2138 HydrophobicContact CD1-CG 4.44Å; L2116-Y2138 PolarHBondContact N-OH 3.19Å; L2116-Y2138 PolarHBondContact O-OH 2.91Å
2117	Y	82.7	Confident	81.8	Confident	20.75 Å²	20.75	22.4 Å²	22.4	8%	0.081	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	137.4	170.9	-154.7	-83.2	0	0	0	110.2	F1675 F1701 L1808 L1810 A2010 V2046 Y2115	F1675-Y2117 PolarHBondContact N-OH 3.18Å; F1701-Y2117 HydrophobicContact CE2-CE2 4.5Å; L1808-Y2117 HydrophobicContact CD1-CD1 4.38Å; L1808-Y2117 HydrophobicContact CD1-CG 4.4Å; L1808-Y2117 HydrophobicContact CD2-CD1 4.42Å; L1808-Y2117 HydrophobicContact CD2-CD2 4.21Å; L1808-Y2117 HydrophobicContact CD2-CE2 4.33Å; L1808-Y2117 HydrophobicContact CD2-CG 4.3Å; L1810-Y2117 HydrophobicContact CD1-CE1 3.98Å; L1810-Y2117 HydrophobicContact CD2-CD1 3.65Å; L1810-Y2117 HydrophobicContact CD2-CE1 3.51Å; L1810-Y2117 VanDerWaalsContact CD2-CE1 3.47Å; L1810-Y2117 HydrophobicContact CG-CE1 4.39Å; A2010-Y2117 HydrophobicContact CB-CD1 3.87Å; A2010-Y2117 HydrophobicContact CB-CG 4.42Å; A2010-Y2117 WeakPolarHBondContact CB-O 3.37Å; V2046-Y2117 WeakPolarHBondContact CG1-O 3.4Å; Y2115-Y2117 PolarHBondContact O-N 3.09Å
2118	G	80.2	Confident	82.7	Confident	2.75 Å²	2.75	25.8 Å²	25.8	3%	0.028	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.9	-12.5	-174.9	0	0	0	0	0	114.7	V2014	V2014-G2118 WeakPolarHBondContact CG1-O 3.35Å
2119	L	87	Confident	83.9	Confident	1.75 Å²	1.75	23.9 Å²	23.9	1%	0.009	12%	0.12	C	C	.	.	S	Bend	trans	-116.6	156.3	170.5	-50.5	176.8	0	0	0	109.7	V2046 V2068 L2116 L2136 Y2138	V2046-L2119 HydrophobicContact CG1-CD1 4.14Å; V2046-L2119 HydrophobicContact CG1-CD2 4.35Å; V2046-L2119 HydrophobicContact CG1-CG 3.93Å; V2068-L2119 HydrophobicContact CG1-CD1 4.35Å; L2116-L2119 HydrophobicContact CB-CB 4.43Å; L2116-L2119 HydrophobicContact CB-CD1 4.14Å; L2116-L2119 HydrophobicContact CB-CG 4.41Å; L2116-L2119 HydrophobicContact CD1-CD1 3.89Å; L2116-L2119 HydrophobicContact CG-CD1 4.41Å; L2116-L2119 PolarHBondContact O-N 3.1Å; L2119-L2136 HydrophobicContact CD2-CB 3.51Å; L2119-L2136 VanDerWaalsContact CD2-CB 3.48Å; L2119-L2136 HydrophobicContact CD2-CD1 3.64Å; L2119-L2136 HydrophobicContact CD2-CG 4.22Å; L2119-Y2138 HydrophobicContact CB-CD1 3.54Å; L2119-Y2138 VanDerWaalsContact CB-CD1 3.49Å; L2119-Y2138 HydrophobicContact CB-CE1 3.89Å; L2119-Y2138 HydrophobicContact CD1-CD1 4.25Å
2120	I	89	Confident	85	Confident	0.75 Å²	0.75	25.2 Å²	25.2	0%	0.004	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	115.9	179.8	-56.9	-163.8	0	0	0	110.5	T1673 M1674 V2014 I2129 V2135 L2136 V2137 Y2138 K2150	T1673-I2120 HydrophobicContact CG2-CB 4.44Å; T1673-I2120 HydrophobicContact CG2-CG2 4.14Å; M1674-I2120 HydrophobicContact CE-CD1 4.05Å; V2014-I2120 HydrophobicContact CG1-CD1 4.14Å; V2014-I2120 HydrophobicContact CG1-CG1 3.8Å; V2014-I2120 HydrophobicContact CG2-CG1 4.38Å; I2120-I2129 HydrophobicContact CD1-CD1 3.75Å; I2120-I2129 HydrophobicContact CD1-CG1 4.26Å; I2120-I2129 HydrophobicContact CD1-CG2 3.64Å; I2120-I2129 HydrophobicContact CG2-CD1 3.48Å; I2120-I2129 VanDerWaalsContact CG2-CD1 3.42Å; I2120-V2135 HydrophobicContact CB-CG1 4.4Å; I2120-V2135 HydrophobicContact CD1-CB 4.49Å; I2120-V2135 HydrophobicContact CD1-CG1 3.35Å; I2120-V2135 VanDerWaalsContact CD1-CG1 3.49Å; I2120-V2135 HydrophobicContact CG1-CG1 3.74Å; I2120-L2136 PolarHBondContact N-O 3.05Å; I2120-V2137 HydrophobicContact CB-CG2 4.3Å; I2120-V2137 CarbonylContact O-C 3.52Å; I2120-V2137 VanDerWaalsContact O-CA 3.25Å; I2120-V2137 WeakPolarHBondContact O-CA 3.38Å; I2120-V2137 WeakPolarHBondContact O-CG1 3.02Å; I2120-Y2138 WeakPolarHBondContact O-CD1 3.38Å; I2120-Y2138 PolarHBondContact O-N 3Å; I2120-K2150 HydrophobicContact CG2-CD 4.17Å
2121	E	89.9	Confident	86	Confident	19.75 Å²	19.75	25.2 Å²	25.2	9%	0.092	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	128.3	168.5	-171.4	-177.9	168.1	0	0	110	R1671 T1673 C2123 S2124 Y2138 K2150	R1671-E2121 IonicContact CZ-OE1 3.19Å; R1671-E2121 IonicContact NH1-OE1 3.03Å; R1671-E2121 PolarHBondContact NH1-OE1 3.03Å; T1673-E2121 HydrophobicContact CG2-CB 3.89Å; E2121-C2123 PolarHBondContact O-N 3.19Å; E2121-C2123 VanDerWaalsContact O-N 3.12Å; E2121-S2124 WeakPolarHBondContact O-CB 3.23Å; E2121-S2124 PolarHBondContact O-N 2.99Å; E2121-S2124 PolarHBondContact O-OG 3.03Å; E2121-Y2138 WeakPolarHBondContact CA-O 3.33Å; E2121-Y2138 HydrophobicContact CB-CE1 3.91Å; E2121-Y2138 HydrophobicContact CB-CE2 4.42Å; E2121-Y2138 HydrophobicContact CG-CE2 4.35Å; E2121-Y2138 PolarHBondContact OE2-OH 2.8Å; E2121-K2150 WeakPolarHBondContact O-CE 3.4Å
2122	M	90.5	Very high	86.5	Confident	4.25 Å²	4.25	27.4 Å²	27.4	2%	0.021	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26.3	178.1	-125.6	0.5	-85.4	0	0	113.9	V2137 Y2138 Y2139 C2148 K2150 F2152 V2222 L2224	M2122-V2137 HydrophobicContact CB-CG1 4.43Å; M2122-V2137 HydrophobicContact CE-CG1 3.51Å; M2122-V2137 HydrophobicContact CG-CG1 3.51Å; M2122-V2137 HydrophobicContact SD-CG1 3.77Å; M2122-V2137 WeakPolarHBondContact SD-CG1 3.32Å; M2122-Y2138 PolarHBondContact N-O 2.9Å; M2122-Y2139 HydrophobicContact CB-CD2 4.48Å; M2122-C2148 HydrophobicContact CG-CB 4.44Å; M2122-K2150 VanDerWaalsContact C-CE 3.47Å; M2122-K2150 HydrophobicContact CE-CB 4.19Å; M2122-K2150 HydrophobicContact CE-CG 4.02Å; M2122-K2150 VanDerWaalsContact O-CE 3.3Å; M2122-K2150 WeakPolarHBondContact O-CE 3.38Å; M2122-K2150 WeakPolarHBondContact O-CG 3.26Å; M2122-K2150 HydrophobicContact SD-CB 4.14Å; M2122-K2150 HydrophobicContact SD-CD 4.06Å; M2122-K2150 HydrophobicContact SD-CG 3.94Å; M2122-F2152 HydrophobicContact SD-CZ 4.47Å; M2122-V2222 HydrophobicContact CE-CB 4.02Å; M2122-V2222 HydrophobicContact CE-CG1 3.67Å; M2122-V2222 HydrophobicContact SD-CB 4.44Å; M2122-V2222 HydrophobicContact SD-CG1 4.38Å; M2122-L2224 HydrophobicContact CB-CD2 3.85Å; M2122-L2224 HydrophobicContact CE-CB 4.04Å; M2122-L2224 HydrophobicContact CG-CB 3.69Å; M2122-L2224 HydrophobicContact CG-CD2 4.06Å; M2122-L2224 HydrophobicContact CG-CG 4.34Å
2123	C	90	Very high	86.5	Confident	4.25 Å²	4.25	31 Å²	31	3%	0.029	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	45.9	178	-65.2	0	0	0	0	112.6	V1647 E2121 V2146 C2148	V1647-C2123 HydrophobicContact CG1-CB 4.34Å; V1647-C2123 WeakPolarHBondContact CG1-O 3.41Å; E2121-C2123 PolarHBondContact O-N 3.19Å; E2121-C2123 VanDerWaalsContact O-N 3.12Å; C2123-V2146 HydrophobicContact CB-CG1 4.44Å; C2123-V2146 WeakPolarHBondContact SG-CG1 3.17Å; C2123-C2148 VanDerWaalsContact CA-SG 3.52Å; C2123-C2148 HydrophobicContact CB-CB 4.15Å; C2123-C2148 WeakPolarHBondContact CB-SG 3.28Å; C2123-C2148 WeakPolarHBondContact SG-CB 3.23Å; C2123-C2148 CovalentContact SG-SG 2.04Å; C2123-C2148 PolarHBondContact SG-SG 3.18Å
2124	S	87.7	Confident	86.6	Confident	0.25 Å²	0.25	31.1 Å²	31.1	0%	0.002	15%	0.147	C	C	.	.	S	Bend	trans	-94.8	165.5	167.6	66.5	0	0	0	0	111.9	E2121 D2126 K2150	E2121-S2124 WeakPolarHBondContact O-CB 3.23Å; E2121-S2124 PolarHBondContact O-N 2.99Å; E2121-S2124 PolarHBondContact O-OG 3.03Å; S2124-D2126 VanDerWaalsContact C-N 3.27Å; S2124-D2126 PolarHBondContact O-N 2.95Å; S2124-K2150 PolarHBondContact O-NZ 3.3Å; S2124-K2150 VanDerWaalsContact OG-CE 3.3Å; S2124-K2150 WeakPolarHBondContact OG-CE 3.26Å; S2124-K2150 PolarHBondContact OG-NZ 3.08Å
2125	V	86	Confident	86.8	Confident	17.5 Å²	17.5	29 Å²	29	11%	0.106	14%	0.14	C	C	.	.	S	Bend	trans	-57.8	-37.6	-177.9	176.6	0	0	0	0	113.4	V1647 N1649 L1670 R1671 T1672 K2127	V1647-V2125 WeakPolarHBondContact O-CA 3.36Å; V1647-V2125 WeakPolarHBondContact O-CG2 3.19Å; N1649-V2125 HydrophobicContact CB-CG1 4.05Å; L1670-V2125 HydrophobicContact CB-CG2 3.88Å; L1670-V2125 HydrophobicContact CD1-CG2 4.47Å; R1671-V2125 WeakPolarHBondContact O-CG2 3.24Å; R1671-V2125 PolarHBondContact O-N 3.2Å; R1671-V2125 VanDerWaalsContact O-N 3.16Å; T1672-V2125 HydrophobicContact CG2-CG2 4.39Å; V2125-K2127 PolarHBondContact O-N 3.08Å; V2125-K2127 VanDerWaalsContact O-N 3.08Å
2126	D	84.8	Confident	87	Confident	40.5 Å²	40.5	26.6 Å²	26.6	22%	0.217	13%	0.131	C	C	.	.			trans	-74.8	105.9	-172.6	-58.4	-53.3	0	0	0	111.9	S1677 S2124 V2128 K2150	S1677-D2126 PolarHBondContact OG-OD1 2.83Å; S1677-D2126 PolarHBondContact OG-OD2 3.15Å; S1677-D2126 VanDerWaalsContact OG-OD2 3.12Å; S2124-D2126 VanDerWaalsContact C-N 3.27Å; S2124-D2126 PolarHBondContact O-N 2.95Å; D2126-V2128 VanDerWaalsContact C-N 3.3Å; D2126-V2128 PolarHBondContact O-N 2.69Å; D2126-K2150 WeakPolarHBondContact O-CD 3.14Å; D2126-K2150 WeakPolarHBondContact O-CE 3.16Å; D2126-K2150 PolarHBondContact O-NZ 3.04Å
2127	K	85.3	Confident	87.4	Confident	36.75 Å²	36.75	26.5 Å²	26.5	16%	0.16	13%	0.13	C	C	.	.			trans	-73.8	-27.9	-178.3	-67.6	-175.5	173	-166.6	0	114	E1578 V2125 Y2149 K2150 T2151	E1578-K2127 VanDerWaalsContact CD-NZ 3.34Å; E1578-K2127 WeakPolarHBondContact OE1-CE 3.23Å; E1578-K2127 IonicContact OE1-NZ 3.61Å; E1578-K2127 PolarHBondContact OE1-NZ 3.05Å; E1578-K2127 VanDerWaalsContact OE1-NZ 3.14Å; E1578-K2127 WeakPolarHBondContact OE2-CE 3.19Å; E1578-K2127 IonicContact OE2-NZ 3.45Å; E1578-K2127 PolarHBondContact OE2-NZ 3.11Å; V2125-K2127 PolarHBondContact O-N 3.08Å; V2125-K2127 VanDerWaalsContact O-N 3.08Å; K2127-Y2149 HydrophobicContact CD-CE1 4.46Å; K2127-Y2149 WeakPolarHBondContact CD-OH 3.4Å; K2127-Y2149 PolarHBondContact NZ-OH 2.96Å; K2127-K2150 WeakPolarHBondContact O-CA 3.29Å; K2127-T2151 PolarHBondContact O-N 3.09Å
2128	V	87.1	Confident	87.8	Confident	77.25 Å²	77.25	25.8 Å²	25.8	47%	0.468	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.2	-176.5	-178.6	0	0	0	0	108.8	D2126 T2151 L2153	D2126-V2128 VanDerWaalsContact C-N 3.3Å; D2126-V2128 PolarHBondContact O-N 2.69Å; V2128-T2151 CarbonylContact C-O 3.55Å; V2128-T2151 VanDerWaalsContact CA-O 3.32Å; V2128-T2151 WeakPolarHBondContact CA-O 3.34Å; V2128-L2153 HydrophobicContact CG1-CD1 3.39Å; V2128-L2153 VanDerWaalsContact CG1-CD1 3.42Å; V2128-L2153 HydrophobicContact CG1-CG 3.92Å
2129	I	88.4	Confident	88.4	Confident	8 Å²	8	26.1 Å²	26.1	4%	0.041	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.5	-176.6	-61.7	169.1	0	0	0	108.9	M1674 I2120 V2131 K2150 T2151 F2152 L2153	M1674-I2129 HydrophobicContact CE-CG2 4.21Å; I2120-I2129 HydrophobicContact CD1-CD1 3.75Å; I2120-I2129 HydrophobicContact CD1-CG1 4.26Å; I2120-I2129 HydrophobicContact CD1-CG2 3.64Å; I2120-I2129 HydrophobicContact CG2-CD1 3.48Å; I2120-I2129 VanDerWaalsContact CG2-CD1 3.42Å; I2129-V2131 HydrophobicContact CG2-CG2 4.44Å; I2129-K2150 HydrophobicContact CD1-CD 3.76Å; I2129-K2150 HydrophobicContact CD1-CG 4.41Å; I2129-T2151 PolarHBondContact N-O 3.29Å; I2129-F2152 HydrophobicContact CB-CD1 3.88Å; I2129-F2152 HydrophobicContact CB-CE1 4.07Å; I2129-F2152 HydrophobicContact CD1-CD1 4.26Å; I2129-F2152 HydrophobicContact CD1-CE1 3.67Å; I2129-F2152 HydrophobicContact CD1-CZ 4.2Å; I2129-F2152 HydrophobicContact CG1-CE1 4.44Å; I2129-F2152 HydrophobicContact CG2-CD1 4.05Å; I2129-F2152 HydrophobicContact CG2-CE1 4.2Å; I2129-F2152 CarbonylContact O-C 3.48Å; I2129-F2152 WeakPolarHBondContact O-CA 3.41Å; I2129-L2153 PolarHBondContact O-N 3.23Å
2130	E	88.9	Confident	88.6	Confident	128.25 Å²	128.25	27.5 Å²	27.5	60%	0.599	13%	0.134	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.7	175.9	-62.9	-176.4	170.2	0	0	110.3	L2153 L2155	E2130-L2153 CarbonylContact C-O 3.54Å; E2130-L2153 WeakPolarHBondContact CA-O 3.34Å; E2130-L2155 HydrophobicContact CB-CD1 4.35Å; E2130-L2155 HydrophobicContact CB-CD2 4.24Å; E2130-L2155 HydrophobicContact CB-CG 4.16Å; E2130-L2155 HydrophobicContact CG-CD2 4.46Å; E2130-L2155 WeakPolarHBondContact OE2-CD2 3.15Å
2131	V	89.1	Confident	88.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	117.8	-175.5	-175.7	0	0	0	0	109.3	E2015 I2129 V2135 F2152 L2153 S2154 L2155 L2161 I2239 T2241	E2015-V2131 WeakPolarHBondContact OE1-CA 3.24Å; I2129-V2131 HydrophobicContact CG2-CG2 4.44Å; V2131-V2135 HydrophobicContact CB-CG2 4.12Å; V2131-V2135 HydrophobicContact CG1-CG2 3.89Å; V2131-V2135 HydrophobicContact CG2-CG2 3.89Å; V2131-F2152 HydrophobicContact CG2-CB 4.26Å; V2131-F2152 HydrophobicContact CG2-CD1 4.12Å; V2131-L2153 PolarHBondContact N-O 3.12Å; V2131-S2154 WeakPolarHBondContact O-CA 3.08Å; V2131-L2155 PolarHBondContact O-N 3.03Å; V2131-L2161 HydrophobicContact CB-CD2 4.19Å; V2131-L2161 HydrophobicContact CG1-CD2 4.23Å; V2131-L2161 HydrophobicContact CG2-CD2 4.5Å; V2131-I2239 HydrophobicContact CG2-CG2 4.49Å; V2131-T2241 HydrophobicContact CG1-CG2 4.05Å
2132	E	87.4	Confident	88.5	Confident	87 Å²	87	27.3 Å²	27.3	41%	0.407	13%	0.133	S	C	.	.	S	Bend	trans	-86.4	-45.4	173.4	-160.1	-159.5	134.2	0	0	111.4	E2015 L2155 K2159 T2241	E2015-E2132 VanDerWaalsContact CD-N 3.32Å; E2015-E2132 PolarHBondContact OE1-N 3.2Å; E2015-E2132 WeakPolarHBondContact OE2-CB 3.39Å; E2015-E2132 PolarHBondContact OE2-N 2.9Å; E2132-L2155 HydrophobicContact CB-CD1 3.74Å; E2132-L2155 HydrophobicContact CG-CD1 4.09Å; E2132-L2155 HydrophobicContact CG-CD2 4.3Å; E2132-K2159 PolarHBondContact O-NZ 3.1Å; E2132-T2241 VanDerWaalsContact O-CG2 3.31Å; E2132-T2241 WeakPolarHBondContact O-CG2 3.3Å; E2132-T2241 PolarHBondContact O-OG1 3.13Å
2133	K	85.5	Confident	88.3	Confident	80.75 Å²	80.75	27.1 Å²	27.1	35%	0.351	13%	0.133	S	C	.	.	S	Bend	trans	-132.6	-69.8	-169.9	-68.4	178.6	-172.3	149.9	0	112.2	E2015 V2240 T2241 P2245	E2015-K2133 PolarHBondContact OE1-N 2.96Å; E2015-K2133 VanDerWaalsContact OE1-N 3.08Å; K2133-V2240 WeakPolarHBondContact O-CA 3.34Å; K2133-V2240 WeakPolarHBondContact O-CG1 3.48Å; K2133-T2241 PolarHBondContact O-N 2.93Å; K2133-T2241 PolarHBondContact O-OG1 3.18Å; K2133-P2245 HydrophobicContact CB-CG 4Å; K2133-P2245 HydrophobicContact CG-CG 4.32Å
2134	R	86	Confident	88	Confident	14 Å²	14	28.1 Å²	28.1	5%	0.053	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	145.7	-175	63.2	170.8	63.8	-172.1	-1.8	110.5	E2015 M2096 E2238 I2239 V2240 P2245 D2247	E2015-R2134 WeakPolarHBondContact CG-O 3.32Å; E2015-R2134 PolarHBondContact OE1-N 3.36Å; E2015-R2134 VanDerWaalsContact OE1-N 3.14Å; M2096-R2134 PolarHBondContact O-NH1 3.14Å; M2096-R2134 VanDerWaalsContact SD-CZ 3.55Å; M2096-R2134 PolarHBondContact SD-NH1 3.1Å; M2096-R2134 VanDerWaalsContact SD-NH1 3.39Å; R2134-E2238 IonicContact CZ-OE1 3.94Å; R2134-E2238 IonicContact NE-OE1 3.34Å; R2134-E2238 IonicContact NH1-OE1 3.64Å; R2134-I2239 CarbonylContact C-O 3.38Å; R2134-I2239 VanDerWaalsContact CA-O 3.26Å; R2134-I2239 WeakPolarHBondContact CA-O 3.32Å; R2134-V2240 HydrophobicContact CB-CG1 4.19Å; R2134-V2240 HydrophobicContact CB-CG2 4.06Å; R2134-P2245 PolarHBondContact NH2-O 3.22Å; R2134-D2247 IonicContact CZ-OD2 2.96Å; R2134-D2247 IonicContact NH1-OD2 3.71Å; R2134-D2247 PolarHBondContact NH1-OD2 3.13Å; R2134-D2247 VanDerWaalsContact NH2-CA 3.28Å; R2134-D2247 VanDerWaalsContact NH2-N 3.11Å
2135	V	88.7	Confident	87.9	Confident	3.75 Å²	3.75	30.7 Å²	30.7	2%	0.023	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	139.8	177.4	-173.2	0	0	0	0	109.1	V2014 E2015 I2120 V2131 V2137 I2239	V2014-V2135 HydrophobicContact CB-CG1 4.09Å; V2014-V2135 HydrophobicContact CG1-CB 4.33Å; V2014-V2135 HydrophobicContact CG1-CG1 3.56Å; V2014-V2135 HydrophobicContact CG1-CG2 4.04Å; E2015-V2135 HydrophobicContact CG-CG2 3.97Å; I2120-V2135 HydrophobicContact CB-CG1 4.4Å; I2120-V2135 HydrophobicContact CD1-CB 4.49Å; I2120-V2135 HydrophobicContact CD1-CG1 3.35Å; I2120-V2135 VanDerWaalsContact CD1-CG1 3.49Å; I2120-V2135 HydrophobicContact CG1-CG1 3.74Å; V2131-V2135 HydrophobicContact CB-CG2 4.12Å; V2131-V2135 HydrophobicContact CG1-CG2 3.89Å; V2131-V2135 HydrophobicContact CG2-CG2 3.89Å; V2135-V2137 HydrophobicContact CG1-CG2 4.11Å; V2135-I2239 PolarHBondContact N-O 3.11Å; V2135-I2239 PolarHBondContact O-N 3.16Å
2136	L	89	Confident	88	Confident	7.25 Å²	7.25	30.2 Å²	30.2	4%	0.038	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.6	170.7	-70.6	175.8	0	0	0	110.3	Y2047 A2069 M2096 L2119 I2120 L2166 A2237 E2238	Y2047-L2136 HydrophobicContact CD2-CD1 3.99Å; Y2047-L2136 HydrophobicContact CE2-CD1 3.83Å; A2069-L2136 HydrophobicContact CB-CD1 4.21Å; M2096-L2136 HydrophobicContact CE-CD2 3.73Å; M2096-L2136 VanDerWaalsContact CE-CD2 3.5Å; M2096-L2136 HydrophobicContact CE-CG 4.3Å; M2096-L2136 HydrophobicContact SD-CD1 4.31Å; M2096-L2136 HydrophobicContact SD-CD2 4.02Å; M2096-L2136 HydrophobicContact SD-CG 4.4Å; L2119-L2136 HydrophobicContact CD2-CB 3.51Å; L2119-L2136 VanDerWaalsContact CD2-CB 3.48Å; L2119-L2136 HydrophobicContact CD2-CD1 3.64Å; L2119-L2136 HydrophobicContact CD2-CG 4.22Å; I2120-L2136 PolarHBondContact N-O 3.05Å; L2136-L2166 HydrophobicContact CD2-CD1 3.75Å; L2136-A2237 CarbonylContact C-O 3.59Å; L2136-A2237 WeakPolarHBondContact CA-O 3.34Å; L2136-E2238 HydrophobicContact CD2-CB 3.97Å; L2136-E2238 HydrophobicContact CD2-CG 4Å
2137	V	91.4	Very high	88.2	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.2	-179.4	-179.2	0	0	0	0	108.6	I2120 M2122 V2135 F2152 I2236 A2237 I2239	I2120-V2137 HydrophobicContact CB-CG2 4.3Å; I2120-V2137 CarbonylContact O-C 3.52Å; I2120-V2137 VanDerWaalsContact O-CA 3.25Å; I2120-V2137 WeakPolarHBondContact O-CA 3.38Å; I2120-V2137 WeakPolarHBondContact O-CG1 3.02Å; M2122-V2137 HydrophobicContact CB-CG1 4.43Å; M2122-V2137 HydrophobicContact CE-CG1 3.51Å; M2122-V2137 HydrophobicContact CG-CG1 3.51Å; M2122-V2137 HydrophobicContact SD-CG1 3.77Å; M2122-V2137 WeakPolarHBondContact SD-CG1 3.32Å; V2135-V2137 HydrophobicContact CG1-CG2 4.11Å; V2137-F2152 HydrophobicContact CG1-CZ 4.45Å; V2137-F2152 HydrophobicContact CG2-CE1 3.82Å; V2137-F2152 HydrophobicContact CG2-CZ 3.66Å; V2137-I2236 CarbonylContact O-C 3.51Å; V2137-I2236 WeakPolarHBondContact O-CA 3.24Å; V2137-A2237 PolarHBondContact N-O 2.88Å; V2137-A2237 PolarHBondContact O-N 2.9Å; V2137-I2239 HydrophobicContact CG2-CD1 3.75Å; V2137-I2239 HydrophobicContact CG2-CG1 4.2Å
2138	Y	92.4	Very high	88.5	Confident	6.5 Å²	6.5	26.8 Å²	26.8	3%	0.025	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.1	178.2	80.9	-83.9	0	0	0	112.4	F2112 Y2114 L2116 L2119 I2120 E2121 M2122 L2235	F2112-Y2138 HydrophobicContact CD2-CD2 4.41Å; F2112-Y2138 AromaticContact CE2-CD2 3.77Å; F2112-Y2138 HydrophobicContact CE2-CD2 3.77Å; F2112-Y2138 HydrophobicContact CE2-CE2 4.46Å; F2112-Y2138 HydrophobicContact CE2-CG 4.49Å; F2112-Y2138 HydrophobicContact CZ-CD2 4.47Å; Y2114-Y2138 PolarHBondContact O-OH 2.77Å; Y2114-Y2138 VanDerWaalsContact O-OH 3.11Å; L2116-Y2138 HydrophobicContact CB-CD1 4.4Å; L2116-Y2138 HydrophobicContact CB-CE1 3.78Å; L2116-Y2138 HydrophobicContact CB-CE2 4.33Å; L2116-Y2138 HydrophobicContact CD1-CD2 4.33Å; L2116-Y2138 HydrophobicContact CD1-CE2 4.28Å; L2116-Y2138 HydrophobicContact CD1-CG 4.44Å; L2116-Y2138 PolarHBondContact N-OH 3.19Å; L2116-Y2138 PolarHBondContact O-OH 2.91Å; L2119-Y2138 HydrophobicContact CB-CD1 3.54Å; L2119-Y2138 VanDerWaalsContact CB-CD1 3.49Å; L2119-Y2138 HydrophobicContact CB-CE1 3.89Å; L2119-Y2138 HydrophobicContact CD1-CD1 4.25Å; I2120-Y2138 WeakPolarHBondContact O-CD1 3.38Å; I2120-Y2138 PolarHBondContact O-N 3Å; E2121-Y2138 WeakPolarHBondContact CA-O 3.33Å; E2121-Y2138 HydrophobicContact CB-CE1 3.91Å; E2121-Y2138 HydrophobicContact CB-CE2 4.42Å; E2121-Y2138 HydrophobicContact CG-CE2 4.35Å; E2121-Y2138 PolarHBondContact OE2-OH 2.8Å; M2122-Y2138 PolarHBondContact N-O 2.9Å; Y2138-L2235 VanDerWaalsContact CA-O 3.3Å; Y2138-L2235 WeakPolarHBondContact CA-O 3.3Å
2139	Y	92.3	Very high	88.6	Confident	7.75 Å²	7.75	23.8 Å²	23.8	3%	0.03	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	135.6	165.9	175.9	-101.8	0	0	0	109.7	F2112 M2122 Y2141 V2146 L2224 A2226 G2234 L2235	F2112-Y2139 WeakPolarHBondContact CZ-O 3.41Å; M2122-Y2139 HydrophobicContact CB-CD2 4.48Å; Y2139-Y2141 AromaticContact CD1-CD2 3.96Å; Y2139-Y2141 HydrophobicContact CD1-CD2 4.02Å; Y2139-Y2141 AromaticContact CD1-CE2 3.94Å; Y2139-Y2141 HydrophobicContact CD1-CE2 4.02Å; Y2139-Y2141 HydrophobicContact CE1-CD1 4.28Å; Y2139-Y2141 AromaticContact CE1-CD2 3.73Å; Y2139-Y2141 HydrophobicContact CE1-CD2 3.73Å; Y2139-Y2141 HydrophobicContact CE1-CE1 4.41Å; Y2139-Y2141 AromaticContact CE1-CE2 3.86Å; Y2139-Y2141 HydrophobicContact CE1-CE2 3.86Å; Y2139-Y2141 AromaticContact CE1-CG 3.94Å; Y2139-Y2141 HydrophobicContact CE1-CG 3.96Å; Y2139-V2146 HydrophobicContact CE2-CG2 3.7Å; Y2139-V2146 WeakPolarHBondContact OH-CB 3.43Å; Y2139-V2146 WeakPolarHBondContact OH-CG2 3.25Å; Y2139-L2224 HydrophobicContact CD1-CD1 4.47Å; Y2139-L2224 HydrophobicContact CD1-CD2 3.62Å; Y2139-L2224 HydrophobicContact CD2-CD2 3.46Å; Y2139-L2224 VanDerWaalsContact CD2-CD2 3.46Å; Y2139-L2224 HydrophobicContact CE1-CD2 4.05Å; Y2139-L2224 HydrophobicContact CE2-CD2 3.91Å; Y2139-L2224 HydrophobicContact CG-CD2 3.28Å; Y2139-A2226 HydrophobicContact CD1-CB 4.49Å; Y2139-A2226 HydrophobicContact CE1-CB 3.55Å; Y2139-A2226 VanDerWaalsContact CE1-CB 3.48Å; Y2139-A2226 WeakPolarHBondContact OH-CB 3.4Å; Y2139-G2234 CarbonylContact O-C 3.56Å; Y2139-G2234 WeakPolarHBondContact O-CA 3.37Å; Y2139-L2235 PolarHBondContact N-O 3.2Å; Y2139-L2235 PolarHBondContact O-N 3.1Å
2140	K	91	Very high	88.8	Confident	31.25 Å²	31.25	23.4 Å²	23.4	14%	0.136	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133	175.3	-168.1	169.8	170.6	-169.3	0	109.1	F2112 Y2114 G2231	F2112-K2140 HydrophobicContact CD2-CD 4.26Å; F2112-K2140 HydrophobicContact CE2-CB 3.79Å; F2112-K2140 HydrophobicContact CE2-CD 4.19Å; F2112-K2140 HydrophobicContact CE2-CG 4.22Å; F2112-K2140 HydrophobicContact CZ-CB 4.22Å; F2112-K2140 HydrophobicContact CZ-CG 4.47Å; F2112-K2140 VanDerWaalsContact O-CD 3.29Å; F2112-K2140 WeakPolarHBondContact O-CD 3.35Å; F2112-K2140 VanDerWaalsContact O-CE 3.24Å; F2112-K2140 WeakPolarHBondContact O-CE 3.22Å; F2112-K2140 PolarHBondContact O-NZ 2.93Å; Y2114-K2140 HydrophobicContact CD1-CB 4.26Å; Y2114-K2140 HydrophobicContact CD1-CD 3.58Å; Y2114-K2140 HydrophobicContact CD1-CG 4.1Å; Y2114-K2140 HydrophobicContact CD2-CD 4.33Å; Y2114-K2140 VanDerWaalsContact CD2-NZ 3.31Å; Y2114-K2140 HydrophobicContact CE1-CB 4.24Å; Y2114-K2140 HydrophobicContact CE1-CD 3.53Å; Y2114-K2140 VanDerWaalsContact CE1-CD 3.46Å; Y2114-K2140 VanDerWaalsContact CE1-CE 3.45Å; Y2114-K2140 HydrophobicContact CE1-CG 3.75Å; Y2114-K2140 HydrophobicContact CE2-CD 4.34Å; Y2114-K2140 VanDerWaalsContact CE2-NZ 3.26Å; Y2114-K2140 HydrophobicContact CG-CD 4.03Å; Y2114-K2140 VanDerWaalsContact CZ-CE 3.43Å; K2140-G2231 WeakPolarHBondContact CE-O 3.23Å
2141	Y	90.1	Very high	88.9	Confident	2.75 Å²	2.75	17.6 Å²	17.6	1%	0.011	9%	0.085	C	C	.	.			trans	-70	152.9	176.9	-75.9	-107.9	0	0	0	110.7	Y2114 Y2139 D2181 A2226 N2227 A2229 G2231 Y2233	Y2114-Y2141 WeakPolarHBondContact CE1-O 3.49Å; Y2114-Y2141 PolarHBondContact OH-O 2.99Å; Y2139-Y2141 AromaticContact CD1-CD2 3.96Å; Y2139-Y2141 HydrophobicContact CD1-CD2 4.02Å; Y2139-Y2141 AromaticContact CD1-CE2 3.94Å; Y2139-Y2141 HydrophobicContact CD1-CE2 4.02Å; Y2139-Y2141 HydrophobicContact CE1-CD1 4.28Å; Y2139-Y2141 AromaticContact CE1-CD2 3.73Å; Y2139-Y2141 HydrophobicContact CE1-CD2 3.73Å; Y2139-Y2141 HydrophobicContact CE1-CE1 4.41Å; Y2139-Y2141 AromaticContact CE1-CE2 3.86Å; Y2139-Y2141 HydrophobicContact CE1-CE2 3.86Å; Y2139-Y2141 AromaticContact CE1-CG 3.94Å; Y2139-Y2141 HydrophobicContact CE1-CG 3.96Å; Y2141-D2181 WeakPolarHBondContact CE1-OD2 3.29Å; Y2141-D2181 VanDerWaalsContact CZ-OD2 3.28Å; Y2141-D2181 PolarHBondContact OH-OD2 2.85Å; Y2141-A2226 HydrophobicContact CD1-CB 4.09Å; Y2141-A2226 HydrophobicContact CE1-CB 3.5Å; Y2141-A2226 VanDerWaalsContact CE1-CB 3.45Å; Y2141-N2227 WeakPolarHBondContact CD1-O 3.4Å; Y2141-A2229 HydrophobicContact CD1-CB 3.71Å; Y2141-A2229 HydrophobicContact CE1-CB 4.5Å; Y2141-A2229 HydrophobicContact CG-CB 4.2Å; Y2141-G2231 WeakPolarHBondContact O-CA 3.2Å; Y2141-Y2233 VanDerWaalsContact CD2-C 3.47Å; Y2141-Y2233 WeakPolarHBondContact CD2-O 3.39Å; Y2141-Y2233 PolarHBondContact N-O 2.87Å; Y2141-Y2233 VanDerWaalsContact N-O 3.12Å
2142	D	87.6	Confident	89	Confident	13.5 Å²	13.5	17.6 Å²	17.6	7%	0.072	9%	0.085	C	C	.	.			trans	-143.7	176.8	171.8	-157.1	-6.4	0	0	0	108.1	R1914 Y2114 Y2144 A2228 A2229	R1914-D2142 IonicContact CZ-OD1 2.8Å; R1914-D2142 IonicContact NE-OD1 3.7Å; R1914-D2142 PolarHBondContact NE-OD1 2.97Å; R1914-D2142 VanDerWaalsContact NE-OD1 3.13Å; R1914-D2142 IonicContact NH2-OD1 2.77Å; R1914-D2142 IonicContact NH2-OD2 2.76Å; Y2114-D2142 HydrophobicContact CE1-CB 4.28Å; D2142-Y2144 HydrophobicContact CB-CD1 4.1Å; D2142-Y2144 HydrophobicContact CB-CE1 3.62Å; D2142-Y2144 VanDerWaalsContact CG-CE1 3.47Å; D2142-Y2144 PolarHBondContact O-N 3.05Å; D2142-Y2144 VanDerWaalsContact OD2-CE1 3.31Å; D2142-Y2144 WeakPolarHBondContact OD2-CE1 3.33Å; D2142-Y2144 PolarHBondContact OD2-OH 2.91Å; D2142-A2228 WeakPolarHBondContact O-CA 3.34Å; D2142-A2229 CarbonylContact C-O 3.5Å; D2142-A2229 WeakPolarHBondContact CA-O 3.46Å; D2142-A2229 PolarHBondContact O-N 2.96Å; D2142-A2229 VanDerWaalsContact O-N 3.16Å
2143	S	85.4	Confident	89.3	Confident	1.75 Å²	1.75	14.2 Å²	14.2	1%	0.012	7%	0.07	C	C	.	.	S	Bend	trans	-72.8	29	-176.4	-0.1	0	0	0	0	114.5	T1912 R1914 Q1955 C1956 A2228	T1912-S2143 WeakPolarHBondContact CB-OG 3.39Å; T1912-S2143 WeakPolarHBondContact CG2-OG 3.43Å; T1912-S2143 PolarHBondContact OG1-OG 2.82Å; R1914-S2143 VanDerWaalsContact CB-OG 3.31Å; R1914-S2143 WeakPolarHBondContact CB-OG 3.09Å; R1914-S2143 WeakPolarHBondContact CG-OG 3.28Å; Q1955-S2143 WeakPolarHBondContact CB-O 3.43Å; Q1955-S2143 VanDerWaalsContact CD-O 3.25Å; Q1955-S2143 VanDerWaalsContact CG-O 3.24Å; Q1955-S2143 WeakPolarHBondContact CG-O 3.36Å; Q1955-S2143 VanDerWaalsContact NE2-C 3.34Å; Q1955-S2143 PolarHBondContact NE2-O 3.02Å; C1956-S2143 WeakPolarHBondContact O-CB 3.36Å; C1956-S2143 PolarHBondContact O-OG 2.91Å; S2143-A2228 WeakPolarHBondContact O-CB 3.47Å
2144	Y	84	Confident	89.6	Confident	23.75 Å²	23.75	10.7 Å²	10.7	9%	0.093	6%	0.055	C	C	.	.	S	Bend	trans	-142.5	146.1	173.4	54.1	-91.7	0	0	0	111.9	K1602 R1671 F1957 D2142 V2146	K1602-Y2144 HydrophobicContact CB-CD2 4.33Å; K1602-Y2144 HydrophobicContact CB-CE2 4.22Å; K1602-Y2144 HydrophobicContact CD-CE2 4.21Å; K1602-Y2144 HydrophobicContact CG-CD2 4.21Å; K1602-Y2144 HydrophobicContact CG-CE2 4.08Å; R1671-Y2144 PolarHBondContact NH2-OH 3.29Å; R1671-Y2144 VanDerWaalsContact NH2-OH 3.09Å; F1957-Y2144 AromaticContact CD1-CD1 3.89Å; F1957-Y2144 HydrophobicContact CD1-CD1 3.97Å; F1957-Y2144 AromaticContact CE1-CD1 3.89Å; F1957-Y2144 HydrophobicContact CE1-CD1 3.99Å; F1957-Y2144 HydrophobicContact CE1-CG 4.13Å; D2142-Y2144 HydrophobicContact CB-CD1 4.1Å; D2142-Y2144 HydrophobicContact CB-CE1 3.62Å; D2142-Y2144 VanDerWaalsContact CG-CE1 3.47Å; D2142-Y2144 PolarHBondContact O-N 3.05Å; D2142-Y2144 VanDerWaalsContact OD2-CE1 3.31Å; D2142-Y2144 WeakPolarHBondContact OD2-CE1 3.33Å; D2142-Y2144 PolarHBondContact OD2-OH 2.91Å; Y2144-V2146 HydrophobicContact CD2-CG1 3.71Å; Y2144-V2146 HydrophobicContact CD2-CG2 3.5Å; Y2144-V2146 VanDerWaalsContact CD2-CG2 3.45Å; Y2144-V2146 HydrophobicContact CE2-CG1 3.73Å; Y2144-V2146 HydrophobicContact CE2-CG2 3.45Å; Y2144-V2146 VanDerWaalsContact CE2-CG2 3.47Å
2145	P	85.3	Confident	89.7	Confident	55 Å²	55	14.8 Å²	14.8	36%	0.357	8%	0.077	S	C	.	.			trans	-73.6	147.5	176.6	31.9	-35.6	0	0	0	111.1	A2226	P2145-A2226 CarbonylContact C-O 3.54Å; P2145-A2226 WeakPolarHBondContact CA-O 3.38Å
2146	V	88.5	Confident	89.7	Confident	6.75 Å²	6.75	18.3 Å²	18.3	4%	0.041	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.2	-178.8	-154	0	0	0	0	111.5	K1602 S1603 C2123 Y2139 Y2144 C2148 R2179 A2226	K1602-V2146 HydrophobicContact CB-CG1 4.46Å; K1602-V2146 WeakPolarHBondContact O-CG1 3.28Å; S1603-V2146 WeakPolarHBondContact OG-CA 3.28Å; C2123-V2146 HydrophobicContact CB-CG1 4.44Å; C2123-V2146 WeakPolarHBondContact SG-CG1 3.17Å; Y2139-V2146 HydrophobicContact CE2-CG2 3.7Å; Y2139-V2146 WeakPolarHBondContact OH-CB 3.43Å; Y2139-V2146 WeakPolarHBondContact OH-CG2 3.25Å; Y2144-V2146 HydrophobicContact CD2-CG1 3.71Å; Y2144-V2146 HydrophobicContact CD2-CG2 3.5Å; Y2144-V2146 VanDerWaalsContact CD2-CG2 3.45Å; Y2144-V2146 HydrophobicContact CE2-CG1 3.73Å; Y2144-V2146 HydrophobicContact CE2-CG2 3.45Å; Y2144-V2146 VanDerWaalsContact CE2-CG2 3.47Å; V2146-C2148 HydrophobicContact CG1-CB 4.47Å; V2146-C2148 WeakPolarHBondContact CG1-SG 3.37Å; V2146-R2179 PolarHBondContact O-NH1 2.89Å; V2146-R2179 PolarHBondContact O-NH2 2.72Å; V2146-A2226 PolarHBondContact N-O 3.12Å; V2146-A2226 PolarHBondContact O-N 3.01Å
2147	D	88.7	Confident	89.5	Confident	6.25 Å²	6.25	22.4 Å²	22.4	3%	0.033	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	106.5	172.7	-151.1	-36.6	0	0	0	108.4	M1577 S1603 N1604 R2179 H2223 R2225	M1577-D2147 HydrophobicContact CE-CB 3.74Å; S1603-D2147 CarbonylContact C-O 3.54Å; S1603-D2147 VanDerWaalsContact CA-O 3.28Å; S1603-D2147 WeakPolarHBondContact CA-O 3.22Å; S1603-D2147 VanDerWaalsContact CB-O 3.24Å; S1603-D2147 WeakPolarHBondContact CB-O 3.33Å; S1603-D2147 PolarHBondContact OG-N 3.05Å; N1604-D2147 PolarHBondContact N-O 3.13Å; D2147-R2179 IonicContact OD2-CZ 2.99Å; D2147-R2179 IonicContact OD2-NH1 3.56Å; D2147-R2179 PolarHBondContact OD2-NH1 3.4Å; D2147-R2179 IonicContact OD2-NH2 3.24Å; D2147-R2179 PolarHBondContact OD2-NH2 3.03Å; D2147-H2223 IonicContact OD1-CD2 2.76Å; D2147-H2223 IonicContact OD1-CE1 3.09Å; D2147-H2223 IonicContact OD1-NE2 3.49Å; D2147-H2223 PolarHBondContact OD1-NE2 3.24Å; D2147-H2223 IonicContact OD2-NE2 3.63Å; D2147-R2225 IonicContact OD1-NH2 2.79Å; D2147-R2225 IonicContact OD2-CZ 3.42Å; D2147-R2225 VanDerWaalsContact OD2-CZ 3.24Å; D2147-R2225 IonicContact OD2-NE 3.62Å; D2147-R2225 PolarHBondContact OD2-NE 3.05Å; D2147-R2225 IonicContact OD2-NH2 2.92Å; D2147-R2225 PolarHBondContact OD2-NH2 3.01Å
2148	C	91.2	Very high	89.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.1	-172.9	-67.6	0	0	0	0	110.8	M2122 C2123 V2146 H2223 L2224	M2122-C2148 HydrophobicContact CG-CB 4.44Å; C2123-C2148 VanDerWaalsContact CA-SG 3.52Å; C2123-C2148 HydrophobicContact CB-CB 4.15Å; C2123-C2148 WeakPolarHBondContact CB-SG 3.28Å; C2123-C2148 WeakPolarHBondContact SG-CB 3.23Å; C2123-C2148 CovalentContact SG-SG 2.04Å; C2123-C2148 PolarHBondContact SG-SG 3.18Å; V2146-C2148 HydrophobicContact CG1-CB 4.47Å; V2146-C2148 WeakPolarHBondContact CG1-SG 3.37Å; C2148-H2223 PolarHBondContact O-CD2 2.92Å; C2148-L2224 PolarHBondContact N-O 3.08Å; C2148-L2224 PolarHBondContact O-N 2.88Å; C2148-L2224 VanDerWaalsContact O-O 3.08Å
2149	Y	90.8	Very high	89.1	Confident	13.5 Å²	13.5	29.1 Å²	29.1	5%	0.053	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	154.2	170.4	76.8	-82.1	0	0	0	111.4	N1604 A1605 L1606 V1607 K2127 M2191 T2221 V2222	N1604-Y2149 HydrophobicContact CB-CD1 3.89Å; N1604-Y2149 HydrophobicContact CB-CE1 3.89Å; N1604-Y2149 PolarHBondContact ND2-O 3.01Å; A1605-Y2149 VanDerWaalsContact O-CE1 3.25Å; A1605-Y2149 WeakPolarHBondContact O-CE1 3.29Å; L1606-Y2149 HydrophobicContact CD2-CD1 4.27Å; V1607-Y2149 PolarHBondContact O-OH 3.15Å; K2127-Y2149 HydrophobicContact CD-CE1 4.46Å; K2127-Y2149 WeakPolarHBondContact CD-OH 3.4Å; K2127-Y2149 PolarHBondContact NZ-OH 2.96Å; Y2149-M2191 HydrophobicContact CD1-CE 3.77Å; Y2149-M2191 HydrophobicContact CD2-CE 3.26Å; Y2149-M2191 HydrophobicContact CE1-CE 4.41Å; Y2149-M2191 HydrophobicContact CE2-CE 3.99Å; Y2149-M2191 HydrophobicContact CG-CE 3.12Å; Y2149-T2221 HydrophobicContact CD2-CG2 4.17Å; Y2149-V2222 CarbonylContact C-O 3.56Å; Y2149-V2222 VanDerWaalsContact CA-O 3.23Å; Y2149-V2222 WeakPolarHBondContact CA-O 3.22Å; Y2149-V2222 WeakPolarHBondContact CB-O 3.31Å
2150	K	90.5	Very high	89	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.6	175.8	-67.7	-148.8	174.4	-68.3	0	110.5	I2120 E2121 M2122 S2124 D2126 K2127 I2129 F2152 T2221 V2222	I2120-K2150 HydrophobicContact CG2-CD 4.17Å; E2121-K2150 WeakPolarHBondContact O-CE 3.4Å; M2122-K2150 VanDerWaalsContact C-CE 3.47Å; M2122-K2150 HydrophobicContact CE-CB 4.19Å; M2122-K2150 HydrophobicContact CE-CG 4.02Å; M2122-K2150 VanDerWaalsContact O-CE 3.3Å; M2122-K2150 WeakPolarHBondContact O-CE 3.38Å; M2122-K2150 WeakPolarHBondContact O-CG 3.26Å; M2122-K2150 HydrophobicContact SD-CB 4.14Å; M2122-K2150 HydrophobicContact SD-CD 4.06Å; M2122-K2150 HydrophobicContact SD-CG 3.94Å; S2124-K2150 PolarHBondContact O-NZ 3.3Å; S2124-K2150 VanDerWaalsContact OG-CE 3.3Å; S2124-K2150 WeakPolarHBondContact OG-CE 3.26Å; S2124-K2150 PolarHBondContact OG-NZ 3.08Å; D2126-K2150 WeakPolarHBondContact O-CD 3.14Å; D2126-K2150 WeakPolarHBondContact O-CE 3.16Å; D2126-K2150 PolarHBondContact O-NZ 3.04Å; K2127-K2150 WeakPolarHBondContact O-CA 3.29Å; I2129-K2150 HydrophobicContact CD1-CD 3.76Å; I2129-K2150 HydrophobicContact CD1-CG 4.41Å; K2150-F2152 HydrophobicContact CB-CD2 4.47Å; K2150-F2152 HydrophobicContact CB-CE2 3.77Å; K2150-F2152 HydrophobicContact CB-CZ 3.91Å; K2150-F2152 HydrophobicContact CD-CZ 4.22Å; K2150-F2152 HydrophobicContact CG-CZ 4.47Å; K2150-T2221 CarbonylContact O-C 3.57Å; K2150-T2221 WeakPolarHBondContact O-CA 3.42Å; K2150-V2222 PolarHBondContact N-O 2.95Å; K2150-V2222 PolarHBondContact O-N 3.04Å
2151	T	91	Very high	89	Confident	6.25 Å²	6.25	32.5 Å²	32.5	4%	0.038	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.5	175.3	-60.2	0	0	0	0	109.2	K2127 V2128 I2129 L2153 R2189 T2221	K2127-T2151 PolarHBondContact O-N 3.09Å; V2128-T2151 CarbonylContact C-O 3.55Å; V2128-T2151 VanDerWaalsContact CA-O 3.32Å; V2128-T2151 WeakPolarHBondContact CA-O 3.34Å; I2129-T2151 PolarHBondContact N-O 3.29Å; T2151-L2153 HydrophobicContact CG2-CD2 4.07Å; T2151-L2153 HydrophobicContact CG2-CG 4.43Å; T2151-R2189 HydrophobicContact CG2-CB 4.39Å; T2151-R2189 HydrophobicContact CG2-CG 4.03Å; T2151-T2221 WeakPolarHBondContact CG2-OG1 3.3Å; T2151-T2221 PolarHBondContact OG1-OG1 3.15Å
2152	F	92.9	Very high	89.1	Confident	0.25 Å²	0.25	33.4 Å²	33.4	0%	0.001	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.9	176.2	-59.6	-86.6	0	0	0	109.3	M2122 I2129 V2131 V2137 K2150 L2161 A2219 L2220 V2222 I2239	M2122-F2152 HydrophobicContact SD-CZ 4.47Å; I2129-F2152 HydrophobicContact CB-CD1 3.88Å; I2129-F2152 HydrophobicContact CB-CE1 4.07Å; I2129-F2152 HydrophobicContact CD1-CD1 4.26Å; I2129-F2152 HydrophobicContact CD1-CE1 3.67Å; I2129-F2152 HydrophobicContact CD1-CZ 4.2Å; I2129-F2152 HydrophobicContact CG1-CE1 4.44Å; I2129-F2152 HydrophobicContact CG2-CD1 4.05Å; I2129-F2152 HydrophobicContact CG2-CE1 4.2Å; I2129-F2152 CarbonylContact O-C 3.48Å; I2129-F2152 WeakPolarHBondContact O-CA 3.41Å; V2131-F2152 HydrophobicContact CG2-CB 4.26Å; V2131-F2152 HydrophobicContact CG2-CD1 4.12Å; V2137-F2152 HydrophobicContact CG1-CZ 4.45Å; V2137-F2152 HydrophobicContact CG2-CE1 3.82Å; V2137-F2152 HydrophobicContact CG2-CZ 3.66Å; K2150-F2152 HydrophobicContact CB-CD2 4.47Å; K2150-F2152 HydrophobicContact CB-CE2 3.77Å; K2150-F2152 HydrophobicContact CB-CZ 3.91Å; K2150-F2152 HydrophobicContact CD-CZ 4.22Å; K2150-F2152 HydrophobicContact CG-CZ 4.47Å; F2152-L2161 HydrophobicContact CB-CD1 3.82Å; F2152-L2161 VanDerWaalsContact O-CD1 3.28Å; F2152-L2161 WeakPolarHBondContact O-CD1 3.37Å; F2152-A2219 VanDerWaalsContact O-CA 3.32Å; F2152-A2219 WeakPolarHBondContact O-CA 3.41Å; F2152-L2220 PolarHBondContact N-O 3.18Å; F2152-L2220 PolarHBondContact O-N 3.07Å; F2152-V2222 HydrophobicContact CD2-CG2 3.97Å; F2152-V2222 HydrophobicContact CE2-CB 4.18Å; F2152-V2222 HydrophobicContact CE2-CG2 3.78Å; F2152-I2239 HydrophobicContact CB-CD1 4.49Å; F2152-I2239 HydrophobicContact CB-CG2 4.42Å; F2152-I2239 HydrophobicContact CD1-CD1 3.65Å; F2152-I2239 HydrophobicContact CD2-CD1 3.38Å; F2152-I2239 VanDerWaalsContact CD2-CD1 3.41Å; F2152-I2239 HydrophobicContact CE1-CD1 3.56Å; F2152-I2239 HydrophobicContact CE2-CD1 3.29Å; F2152-I2239 HydrophobicContact CG-CD1 3.56Å; F2152-I2239 HydrophobicContact CG-CG2 4.42Å; F2152-I2239 HydrophobicContact CZ-CD1 3.39Å; F2152-I2239 VanDerWaalsContact CZ-CD1 3.48Å
2153	L	92.3	Very high	89.2	Confident	16.75 Å²	16.75	32.9 Å²	32.9	9%	0.088	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.7	179.5	-60.4	178.3	0	0	0	109.2	V2128 I2129 E2130 V2131 T2151 L2155 R2189 N2218 A2219	V2128-L2153 HydrophobicContact CG1-CD1 3.39Å; V2128-L2153 VanDerWaalsContact CG1-CD1 3.42Å; V2128-L2153 HydrophobicContact CG1-CG 3.92Å; I2129-L2153 PolarHBondContact O-N 3.23Å; E2130-L2153 CarbonylContact C-O 3.54Å; E2130-L2153 WeakPolarHBondContact CA-O 3.34Å; V2131-L2153 PolarHBondContact N-O 3.12Å; T2151-L2153 HydrophobicContact CG2-CD2 4.07Å; T2151-L2153 HydrophobicContact CG2-CG 4.43Å; L2153-L2155 PolarHBondContact O-N 3.15Å; L2153-R2189 VanDerWaalsContact CD1-NH2 3.28Å; L2153-R2189 HydrophobicContact CD2-CG 4.4Å; L2153-N2218 CarbonylContact C-O 3.55Å; L2153-N2218 WeakPolarHBondContact CA-O 3.3Å; L2153-A2219 HydrophobicContact CD2-CB 3.52Å
2154	S	92.2	Very high	89.2	Confident	6 Å²	6	34.1 Å²	34.1	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	127.5	170	-176.2	0	0	0	0	109.8	V2131 N2156 N2218 T2241	V2131-S2154 WeakPolarHBondContact O-CA 3.08Å; S2154-N2156 WeakPolarHBondContact CB-O 3.37Å; S2154-N2156 PolarHBondContact O-N 3.06Å; S2154-N2156 PolarHBondContact OG-N 3.29Å; S2154-N2156 PolarHBondContact OG-O 3.12Å; S2154-N2218 PolarHBondContact N-O 3.07Å; S2154-T2241 WeakPolarHBondContact OG-CG2 3.43Å
2155	L	88.4	Confident	89.3	Confident	99.75 Å²	99.75	33.3 Å²	33.3	52%	0.522	19%	0.19	S	C	.	.	S	Bend	trans	-56.9	-33.3	173.4	-99.6	148.9	0	0	0	111.6	E2130 V2131 E2132 L2153	E2130-L2155 HydrophobicContact CB-CD1 4.35Å; E2130-L2155 HydrophobicContact CB-CD2 4.24Å; E2130-L2155 HydrophobicContact CB-CG 4.16Å; E2130-L2155 HydrophobicContact CG-CD2 4.46Å; E2130-L2155 WeakPolarHBondContact OE2-CD2 3.15Å; V2131-L2155 PolarHBondContact O-N 3.03Å; E2132-L2155 HydrophobicContact CB-CD1 3.74Å; E2132-L2155 HydrophobicContact CG-CD1 4.09Å; E2132-L2155 HydrophobicContact CG-CD2 4.3Å; L2153-L2155 PolarHBondContact O-N 3.15Å
2156	N	87.8	Confident	89.2	Confident	78.75 Å²	78.75	31.1 Å²	31.1	42%	0.421	18%	0.175	S	C	.	.	S	Bend	trans	-94.8	109.2	171.1	-153.5	-28.6	0	0	0	109.7	S2154 A2158 K2159	S2154-N2156 WeakPolarHBondContact CB-O 3.37Å; S2154-N2156 PolarHBondContact O-N 3.06Å; S2154-N2156 PolarHBondContact OG-N 3.29Å; S2154-N2156 PolarHBondContact OG-O 3.12Å; N2156-A2158 PolarHBondContact O-N 3.12Å; N2156-A2158 VanDerWaalsContact O-N 3.1Å; N2156-A2158 WeakPolarHBondContact OD1-CB 3.44Å; N2156-A2158 PolarHBondContact OD1-N 3.05Å; N2156-K2159 HydrophobicContact CB-CB 4.42Å; N2156-K2159 HydrophobicContact CB-CD 4.28Å; N2156-K2159 HydrophobicContact CB-CG 4.06Å; N2156-K2159 PolarHBondContact O-N 3.07Å
2157	S	85.2	Confident	89	Confident	93.5 Å²	93.5	30.8 Å²	30.8	65%	0.654	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.8	-178.6	40.3	0	0	0	0	114.8	N2218	S2157-N2218 PolarHBondContact OG-ND2 3.11Å
2158	A	86.4	Confident	88.8	Confident	90 Å²	90	30.5 Å²	30.5	74%	0.744	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-18.8	175.5	0	0	0	0	0	113.5	N2156	N2156-A2158 PolarHBondContact O-N 3.12Å; N2156-A2158 VanDerWaalsContact O-N 3.1Å; N2156-A2158 WeakPolarHBondContact OD1-CB 3.44Å; N2156-A2158 PolarHBondContact OD1-N 3.05Å
2159	K	88.6	Confident	88.5	Confident	58.5 Å²	58.5	31.5 Å²	31.5	25%	0.254	18%	0.178	S	C	.	.			trans	-89.3	140.5	-179.3	-65.2	-168.5	-175.4	179.3	0	111	E2132 N2156 T2241	E2132-K2159 PolarHBondContact O-NZ 3.1Å; N2156-K2159 HydrophobicContact CB-CB 4.42Å; N2156-K2159 HydrophobicContact CB-CD 4.28Å; N2156-K2159 HydrophobicContact CB-CG 4.06Å; N2156-K2159 PolarHBondContact O-N 3.07Å; K2159-T2241 HydrophobicContact CD-CG2 4.31Å; K2159-T2241 WeakPolarHBondContact CD-OG1 3.34Å; K2159-T2241 PolarHBondContact NZ-OG1 2.96Å
2160	K	91	Very high	88.2	Confident	108.75 Å²	108.75	31.5 Å²	31.5	47%	0.473	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	160.1	171	-62.9	176.2	179.6	-175.3	0	109.8	S2215 S2216 G2217 T2241 V2242	K2160-S2215 WeakPolarHBondContact CD-O 3.48Å; K2160-S2216 VanDerWaalsContact CE-O 3.27Å; K2160-S2216 WeakPolarHBondContact CE-O 3.28Å; K2160-G2217 WeakPolarHBondContact CA-O 3.45Å; K2160-T2241 CarbonylContact O-C 3.43Å; K2160-T2241 WeakPolarHBondContact O-CA 3.24Å; K2160-V2242 PolarHBondContact O-N 3.14Å
2161	L	92	Very high	87.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	142.1	173.6	-64.6	172.7	0	0	0	110.1	V2131 F2152 R2214 S2215 L2220 I2239 V2240 T2241	V2131-L2161 HydrophobicContact CB-CD2 4.19Å; V2131-L2161 HydrophobicContact CG1-CD2 4.23Å; V2131-L2161 HydrophobicContact CG2-CD2 4.5Å; F2152-L2161 HydrophobicContact CB-CD1 3.82Å; F2152-L2161 VanDerWaalsContact O-CD1 3.28Å; F2152-L2161 WeakPolarHBondContact O-CD1 3.37Å; L2161-R2214 WeakPolarHBondContact O-CA 3.32Å; L2161-S2215 WeakPolarHBondContact CA-OG 3.22Å; L2161-S2215 PolarHBondContact N-OG 2.93Å; L2161-S2215 PolarHBondContact O-N 2.87Å; L2161-S2215 PolarHBondContact O-OG 3.21Å; L2161-L2220 HydrophobicContact CB-CB 4.16Å; L2161-L2220 HydrophobicContact CB-CD2 4.42Å; L2161-L2220 HydrophobicContact CD1-CB 4.04Å; L2161-I2239 HydrophobicContact CD2-CG2 4.28Å; L2161-V2240 WeakPolarHBondContact CA-O 3.3Å; L2161-T2241 HydrophobicContact CD2-CG2 3.96Å
2162	E	90.2	Very high	86.9	Confident	23 Å²	23	35.7 Å²	35.7	11%	0.107	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.6	175.9	-177.2	169.6	150	0	0	109.1	P2212 V2213 R2214 I2239 V2240 V2242	E2162-P2212 HydrophobicContact CG-CB 3.72Å; E2162-P2212 HydrophobicContact CG-CG 4.48Å; E2162-P2212 VanDerWaalsContact OE1-CB 3.31Å; E2162-P2212 WeakPolarHBondContact OE1-CB 3.36Å; E2162-P2212 VanDerWaalsContact OE1-CG 3.29Å; E2162-P2212 WeakPolarHBondContact OE1-CG 3.41Å; E2162-V2213 CarbonylContact C-O 3.14Å; E2162-V2213 WeakPolarHBondContact CA-O 3.39Å; E2162-R2214 HydrophobicContact CB-CG 4.19Å; E2162-R2214 HydrophobicContact CG-CG 3.93Å; E2162-R2214 IonicContact OE1-CZ 2.75Å; E2162-R2214 IonicContact OE1-NE 3.1Å; E2162-R2214 PolarHBondContact OE1-NE 2.77Å; E2162-R2214 IonicContact OE1-NH2 3.54Å; E2162-R2214 PolarHBondContact OE1-NH2 3.1Å; E2162-R2214 IonicContact OE2-CZ 2.79Å; E2162-R2214 VanDerWaalsContact OE2-CZ 3.27Å; E2162-R2214 IonicContact OE2-NE 2.94Å; E2162-R2214 PolarHBondContact OE2-NE 2.96Å; E2162-R2214 IonicContact OE2-NH2 3.3Å; E2162-R2214 PolarHBondContact OE2-NH2 3.16Å; E2162-R2214 VanDerWaalsContact OE2-NH2 3.1Å; E2162-I2239 CarbonylContact O-C 3.54Å; E2162-I2239 VanDerWaalsContact O-CA 3.29Å; E2162-I2239 WeakPolarHBondContact O-CA 3.34Å; E2162-V2240 HydrophobicContact CB-CG2 3.98Å; E2162-V2240 HydrophobicContact CG-CG2 4.48Å; E2162-V2240 PolarHBondContact N-O 3.14Å; E2162-V2240 PolarHBondContact O-N 3.05Å; E2162-V2242 HydrophobicContact CB-CG2 3.57Å; E2162-V2242 HydrophobicContact CG-CG2 4.49Å; E2162-V2242 WeakPolarHBondContact OE2-CG2 3.26Å
2163	F	90.7	Very high	85.6	Confident	2.25 Å²	2.25	36.3 Å²	36.3	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.3	175.9	178.3	-81.2	0	0	0	109.3	L2165 F2185 F2200 P2212 V2213 L2220 V2222 A2237 E2238 I2239	F2163-L2165 HydrophobicContact CE1-CD2 3.71Å; F2163-L2165 HydrophobicContact CE1-CG 3.87Å; F2163-L2165 HydrophobicContact CZ-CD2 3.92Å; F2163-L2165 HydrophobicContact CZ-CG 4.5Å; F2163-F2185 HydrophobicContact CB-CE1 4.18Å; F2163-F2185 HydrophobicContact CD1-CD1 4.46Å; F2163-F2185 AromaticContact CD1-CE1 3.46Å; F2163-F2185 HydrophobicContact CD1-CE1 3.46Å; F2163-F2185 VanDerWaalsContact CD1-CE1 3.46Å; F2163-F2185 AromaticContact CD1-CZ 3.5Å; F2163-F2185 HydrophobicContact CD1-CZ 3.5Å; F2163-F2185 VanDerWaalsContact CD1-CZ 3.48Å; F2163-F2185 AromaticContact CD2-CE1 3.83Å; F2163-F2185 HydrophobicContact CD2-CE1 3.83Å; F2163-F2185 HydrophobicContact CD2-CZ 4.47Å; F2163-F2185 AromaticContact CE1-CE1 3.66Å; F2163-F2185 HydrophobicContact CE1-CE1 3.66Å; F2163-F2185 AromaticContact CE1-CZ 3.42Å; F2163-F2185 HydrophobicContact CE1-CZ 3.42Å; F2163-F2185 VanDerWaalsContact CE1-CZ 3.46Å; F2163-F2185 AromaticContact CE2-CE1 3.98Å; F2163-F2185 HydrophobicContact CE2-CE1 4.03Å; F2163-F2185 HydrophobicContact CE2-CZ 4.43Å; F2163-F2185 HydrophobicContact CG-CD1 4.44Å; F2163-F2185 AromaticContact CG-CE1 3.56Å; F2163-F2185 HydrophobicContact CG-CE1 3.56Å; F2163-F2185 HydrophobicContact CG-CZ 4.12Å; F2163-F2185 AromaticContact CZ-CE1 3.92Å; F2163-F2185 HydrophobicContact CZ-CE1 3.95Å; F2163-F2185 AromaticContact CZ-CZ 3.88Å; F2163-F2185 HydrophobicContact CZ-CZ 3.96Å; F2163-F2200 HydrophobicContact CD1-CE2 4.19Å; F2163-F2200 HydrophobicContact CE1-CD2 4.36Å; F2163-F2200 AromaticContact CE1-CE2 3.95Å; F2163-F2200 HydrophobicContact CE1-CE2 4.18Å; F2163-P2212 CarbonylContact O-C 3.48Å; F2163-P2212 WeakPolarHBondContact O-CA 3.39Å; F2163-V2213 HydrophobicContact CB-CB 4.46Å; F2163-V2213 PolarHBondContact N-O 3.07Å; F2163-V2213 PolarHBondContact O-N 2.96Å; F2163-L2220 HydrophobicContact CB-CD2 3.92Å; F2163-V2222 HydrophobicContact CD2-CG2 4.19Å; F2163-V2222 HydrophobicContact CE2-CG1 4.38Å; F2163-V2222 HydrophobicContact CE2-CG2 4.37Å; F2163-A2237 HydrophobicContact CD2-CB 4.29Å; F2163-A2237 HydrophobicContact CE1-CB 4Å; F2163-A2237 HydrophobicContact CE2-CB 3.46Å; F2163-A2237 VanDerWaalsContact CE2-CB 3.5Å; F2163-A2237 HydrophobicContact CZ-CB 3.29Å; F2163-E2238 CarbonylContact C-O 3.53Å; F2163-E2238 WeakPolarHBondContact CA-O 3.32Å; F2163-I2239 HydrophobicContact CD2-CD1 3.96Å; F2163-I2239 HydrophobicContact CD2-CG1 3.7Å; F2163-I2239 HydrophobicContact CE2-CD1 4.39Å; F2163-I2239 HydrophobicContact CE2-CG1 4.43Å
2164	K	86	Confident	84.2	Confident	27.25 Å²	27.25	36.6 Å²	36.6	12%	0.118	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.3	176.5	177.6	173.2	172.5	-173.9	0	109.9	M2096 H2097 D2104 P2212 A2237 E2238	M2096-K2164 HydrophobicContact CE-CB 4.47Å; M2096-K2164 HydrophobicContact CE-CD 3.36Å; M2096-K2164 VanDerWaalsContact CE-CE 3.46Å; M2096-K2164 HydrophobicContact CE-CG 4.07Å; M2096-K2164 HydrophobicContact SD-CD 3.93Å; M2096-K2164 WeakPolarHBondContact SD-CE 3.21Å; M2096-K2164 PolarHBondContact SD-NZ 3.47Å; H2097-K2164 PolarHBondContact O-NZ 2.8Å; D2104-K2164 IonicContact OD2-NZ 3.44Å; D2104-K2164 PolarHBondContact OD2-NZ 3.15Å; K2164-P2212 HydrophobicContact CB-CB 4.31Å; K2164-A2237 CarbonylContact O-C 3.49Å; K2164-A2237 VanDerWaalsContact O-CA 3.28Å; K2164-A2237 WeakPolarHBondContact O-CA 3.25Å; K2164-A2237 WeakPolarHBondContact O-CB 3.33Å; K2164-E2238 HydrophobicContact CB-CG 3.69Å; K2164-E2238 HydrophobicContact CD-CG 4.49Å; K2164-E2238 WeakPolarHBondContact CD-OE1 3.33Å; K2164-E2238 HydrophobicContact CG-CG 4.38Å; K2164-E2238 PolarHBondContact N-O 3.15Å; K2164-E2238 PolarHBondContact O-N 3.22Å
2165	L	86	Confident	82.4	Confident	6 Å²	6	42.2 Å²	42.2	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	132	173.2	-69.7	169.9	0	0	0	109.6	P2106 F2163 A2168 I2183 F2200 L2209 A2237	P2106-L2165 HydrophobicContact CB-CB 4.43Å; F2163-L2165 HydrophobicContact CE1-CD2 3.71Å; F2163-L2165 HydrophobicContact CE1-CG 3.87Å; F2163-L2165 HydrophobicContact CZ-CD2 3.92Å; F2163-L2165 HydrophobicContact CZ-CG 4.5Å; L2165-A2168 HydrophobicContact CB-CB 4.44Å; L2165-A2168 HydrophobicContact CD1-CB 4.1Å; L2165-A2168 HydrophobicContact CD2-CB 4.4Å; L2165-I2183 HydrophobicContact CD2-CD1 4.32Å; L2165-F2200 HydrophobicContact CD1-CD2 3.69Å; L2165-F2200 HydrophobicContact CD1-CE2 4.03Å; L2165-F2200 HydrophobicContact CD1-CG 4.24Å; L2165-F2200 HydrophobicContact CG-CD2 4.37Å; L2165-F2200 HydrophobicContact CG-CE2 4.36Å; L2165-L2209 HydrophobicContact CB-CD2 3.8Å; L2165-L2209 HydrophobicContact CB-CG 4.43Å; L2165-L2209 HydrophobicContact CD1-CB 4.4Å; L2165-L2209 HydrophobicContact CD1-CD2 3.74Å; L2165-L2209 WeakPolarHBondContact O-CD2 3.44Å; L2165-A2237 HydrophobicContact CD2-CB 4.09Å
2166	L	83.4	Confident	80.8	Confident	9 Å²	9	43.4 Å²	43.4	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-41.9	173.8	-60.2	178.5	0	0	0	110.8	L2094 M2096 P2106 L2107 L2136 I2236 E2238 T2274	L2094-L2166 HydrophobicContact CB-CD1 4.37Å; L2094-L2166 HydrophobicContact CD1-CD1 4.26Å; L2094-L2166 HydrophobicContact CD2-CB 4.42Å; M2096-L2166 HydrophobicContact CE-CD1 4.2Å; M2096-L2166 HydrophobicContact CE-CD2 4.22Å; M2096-L2166 HydrophobicContact CG-CD1 4.18Å; M2096-L2166 HydrophobicContact CG-CD2 4.31Å; M2096-L2166 HydrophobicContact SD-CD1 3.97Å; M2096-L2166 HydrophobicContact SD-CD2 3.29Å; M2096-L2166 WeakPolarHBondContact SD-CD2 3.5Å; P2106-L2166 WeakPolarHBondContact CA-O 3.25Å; L2107-L2166 PolarHBondContact N-O 3.12Å; L2136-L2166 HydrophobicContact CD2-CD1 3.75Å; L2166-I2236 WeakPolarHBondContact CB-O 2.99Å; L2166-I2236 HydrophobicContact CD1-CG2 4.48Å; L2166-I2236 PolarHBondContact N-O 3.09Å; L2166-E2238 HydrophobicContact CD1-CB 4.26Å; L2166-E2238 HydrophobicContact CD1-CG 4.48Å; L2166-E2238 HydrophobicContact CD2-CG 4.21Å; L2166-E2238 WeakPolarHBondContact CD2-OE2 3.4Å; L2166-E2238 HydrophobicContact CG-CB 4.43Å; L2166-E2238 HydrophobicContact CG-CG 4.29Å; L2166-T2274 HydrophobicContact CB-CG2 4.17Å; L2166-T2274 WeakPolarHBondContact O-CG2 3.47Å
2167	L	84.5	Confident	79.3	Confident	0.25 Å²	0.25	40.8 Å²	40.8	0%	0.001	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128.8	176.4	-176.5	163.8	0	0	0	107.2	L2092 L2107 A2110 F2112 G2234 L2235 I2236	L2092-L2167 HydrophobicContact CD1-CD1 4.3Å; L2092-L2167 HydrophobicContact CD2-CD1 4.21Å; L2107-L2167 HydrophobicContact CB-CB 4.24Å; L2107-L2167 HydrophobicContact CB-CD1 3.67Å; L2107-L2167 HydrophobicContact CB-CG 4.03Å; L2107-L2167 HydrophobicContact CD1-CD1 3.78Å; L2107-L2167 HydrophobicContact CG-CD1 4.42Å; L2107-L2167 CarbonylContact O-C 3.45Å; L2107-L2167 WeakPolarHBondContact O-CA 3.38Å; L2107-L2167 WeakPolarHBondContact O-CG 3.39Å; A2110-L2167 HydrophobicContact CB-CD1 3.53Å; A2110-L2167 VanDerWaalsContact CB-CD1 3.49Å; A2110-L2167 HydrophobicContact CB-CD2 3.6Å; A2110-L2167 HydrophobicContact CB-CG 4.35Å; F2112-L2167 HydrophobicContact CD1-CD1 4.08Å; F2112-L2167 HydrophobicContact CD1-CD2 4.46Å; F2112-L2167 HydrophobicContact CE1-CD1 4.24Å; F2112-L2167 HydrophobicContact CE1-CD2 4.09Å; L2167-G2234 WeakPolarHBondContact CD2-O 3.39Å; L2167-L2235 CarbonylContact O-C 3.55Å; L2167-L2235 WeakPolarHBondContact O-CA 3.38Å; L2167-L2235 WeakPolarHBondContact O-CB 3.42Å; L2167-I2236 HydrophobicContact CB-CB 4.21Å; L2167-I2236 HydrophobicContact CB-CG1 4.42Å; L2167-I2236 HydrophobicContact CD1-CD1 4.21Å; L2167-I2236 HydrophobicContact CD1-CG1 4.48Å; L2167-I2236 PolarHBondContact N-O 2.99Å; L2167-I2236 PolarHBondContact O-N 3.14Å; L2167-I2236 VanDerWaalsContact O-O 3.11Å
2168	A	84.5	Confident	78.1	Confident	1.25 Å²	1.25	40 Å²	40	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	103.5	178.7	0	0	0	0	0	110	P2106 L2107 L2108 L2165 L2235	P2106-A2168 HydrophobicContact CB-CB 4.14Å; P2106-A2168 VanDerWaalsContact CB-O 3.26Å; P2106-A2168 WeakPolarHBondContact CB-O 3.37Å; P2106-A2168 HydrophobicContact CG-CB 4.24Å; L2107-A2168 PolarHBondContact O-N 3.22Å; L2108-A2168 VanDerWaalsContact CD2-O 3.28Å; L2108-A2168 WeakPolarHBondContact CD2-O 3.12Å; L2165-A2168 HydrophobicContact CB-CB 4.44Å; L2165-A2168 HydrophobicContact CD1-CB 4.1Å; L2165-A2168 HydrophobicContact CD2-CB 4.4Å; A2168-L2235 HydrophobicContact CB-CB 4.4Å
2169	N	84.3	Confident	77.3	Confident	21.5 Å²	21.5	38.6 Å²	38.6	12%	0.115	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	80.6	166.2	-171.2	13.5	0	0	0	108	L2108 A2232 Y2233 G2234	L2108-N2169 VanDerWaalsContact O-CB 3.26Å; L2108-N2169 WeakPolarHBondContact O-CB 3.27Å; L2108-N2169 PolarHBondContact O-ND2 2.85Å; L2108-N2169 PolarHBondContact O-OD1 3.01Å; N2169-A2232 PolarHBondContact ND2-O 3.19Å; N2169-Y2233 HydrophobicContact CB-CD1 4.41Å; N2169-Y2233 VanDerWaalsContact CG-CD1 3.48Å; N2169-Y2233 WeakPolarHBondContact ND2-CD1 3.44Å; N2169-Y2233 WeakPolarHBondContact O-CB 3.37Å; N2169-Y2233 WeakPolarHBondContact OD1-CD1 3.36Å; N2169-Y2233 WeakPolarHBondContact OD1-CE1 3.32Å; N2169-G2234 CarbonylContact C-O 3.6Å; N2169-G2234 PolarHBondContact N-O 2.92Å; N2169-G2234 PolarHBondContact O-N 3.05Å; N2169-G2234 VanDerWaalsContact O-N 3.1Å
2170	I	83.6	Confident	76.6	Confident	11.5 Å²	11.5	39.7 Å²	39.7	6%	0.059	20%	0.196	C	C	.	.			trans	-80.4	130.6	-179.8	-57.8	175.6	0	0	0	108.6	D2181 I2183 F2200 H2202 L2209	I2170-D2181 HydrophobicContact CG2-CB 4.25Å; I2170-I2183 HydrophobicContact CD1-CD1 4.17Å; I2170-I2183 HydrophobicContact CD1-CG1 4.4Å; I2170-F2200 HydrophobicContact CD1-CB 4.43Å; I2170-H2202 PolarHBondContact O-ND1 2.86Å; I2170-L2209 HydrophobicContact CD1-CD2 4.15Å
2171	Y	80.2	Confident	76.3	Confident	17.75 Å²	17.75	34.7 Å²	34.7	7%	0.07	18%	0.175	C	C	.	.			trans	-66.7	138.8	-178.2	179.8	-106.4	0	0	0	112.1	Q1910 S2173 D2181 A2229 Y2233	Q1910-Y2171 WeakPolarHBondContact CB-OH 3.3Å; Q1910-Y2171 VanDerWaalsContact CD-OH 3.27Å; Q1910-Y2171 HydrophobicContact CG-CE2 4.26Å; Q1910-Y2171 WeakPolarHBondContact CG-OH 3.37Å; Q1910-Y2171 PolarHBondContact NE2-OH 3.14Å; Q1910-Y2171 PolarHBondContact OE1-OH 3.07Å; Y2171-S2173 PolarHBondContact O-N 3.11Å; Y2171-S2173 VanDerWaalsContact O-N 3.15Å; Y2171-D2181 WeakPolarHBondContact CB-OD2 3.27Å; Y2171-D2181 WeakPolarHBondContact CD1-OD2 3.41Å; Y2171-A2229 HydrophobicContact CD1-CB 4.2Å; Y2171-A2229 HydrophobicContact CD2-CB 3.66Å; Y2171-A2229 HydrophobicContact CE1-CB 4.33Å; Y2171-A2229 HydrophobicContact CE2-CB 4.04Å; Y2171-A2229 HydrophobicContact CG-CB 3.72Å; Y2171-Y2233 HydrophobicContact CD2-CD1 4.26Å; Y2171-Y2233 AromaticContact CD2-CD2 3.87Å; Y2171-Y2233 HydrophobicContact CD2-CD2 3.87Å; Y2171-Y2233 AromaticContact CD2-CE1 3.89Å; Y2171-Y2233 HydrophobicContact CD2-CE1 4.04Å; Y2171-Y2233 AromaticContact CD2-CE2 3.63Å; Y2171-Y2233 HydrophobicContact CD2-CE2 3.63Å; Y2171-Y2233 HydrophobicContact CD2-CG 4.19Å; Y2171-Y2233 AromaticContact CD2-CZ 3.72Å; Y2171-Y2233 AromaticContact CE2-CE2 3.99Å; Y2171-Y2233 HydrophobicContact CE2-CE2 4.07Å; Y2171-Y2233 AromaticContact CE2-CZ 3.97Å
2172	N	75.3	Confident	76.1	Confident	78 Å²	78	39.4 Å²	39.4	42%	0.417	19%	0.193	S	C	.	.			trans	-83.7	90.4	176.3	-169	-4.8	0	0	0	110.6	S2174 H2202	N2172-S2174 PolarHBondContact O-N 3.03Å; N2172-H2202 HydrophobicContact CB-CB 4.37Å; N2172-H2202 VanDerWaalsContact CB-CD2 3.44Å; N2172-H2202 WeakPolarHBondContact CB-CD2 3.44Å; N2172-H2202 PolarHBondContact ND2-CD2 2.82Å; N2172-H2202 VanDerWaalsContact ND2-CD2 3.26Å; N2172-H2202 PolarHBondContact ND2-CE1 2.95Å; N2172-H2202 PolarHBondContact ND2-ND1 2.79Å; N2172-H2202 PolarHBondContact ND2-NE2 2.99Å; N2172-H2202 VanDerWaalsContact ND2-NE2 3.14Å; N2172-H2202 PolarHBondContact OD1-CD2 2.87Å; N2172-H2202 PolarHBondContact OD1-ND1 3.28Å
2173	S	65.7	Low	76.1	Confident	12 Å²	12	38.6 Å²	38.6	8%	0.084	19%	0.189	C	C	.	.			trans	-72.2	114.9	161.6	61.1	0	0	0	0	108.4	Y2171 K2180 D2181	Y2171-S2173 PolarHBondContact O-N 3.11Å; Y2171-S2173 VanDerWaalsContact O-N 3.15Å; S2173-K2180 WeakPolarHBondContact OG-CA 3.39Å; S2173-D2181 PolarHBondContact OG-N 3.13Å; S2173-D2181 VanDerWaalsContact OG-N 3.15Å
2174	S	62.3	Low	76.1	Confident	22.75 Å²	22.75	38.5 Å²	38.5	16%	0.159	19%	0.188	C	C	.	.			trans	-41.7	149.9	177.3	155.6	0	0	0	0	112.5	D1973 N2172 Q2176 A2177	D1973-S2174 PolarHBondContact OD2-OG 3.36Å; N2172-S2174 PolarHBondContact O-N 3.03Å; S2174-Q2176 PolarHBondContact O-N 3.13Å; S2174-A2177 WeakPolarHBondContact O-CB 3.25Å; S2174-A2177 PolarHBondContact O-N 3.01Å
2175	D	53.7	Low	76.4	Confident	124.25 Å²	124.25	37.2 Å²	37.2	66%	0.664	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.6	-176.9	-87.7	-37.1	0	0	0	114.3	A2177 K2180	D2175-A2177 VanDerWaalsContact C-N 3.33Å; D2175-K2180 WeakPolarHBondContact O-CE 3.36Å; D2175-K2180 WeakPolarHBondContact OD1-CE 3.37Å; D2175-K2180 IonicContact OD1-NZ 3.27Å; D2175-K2180 PolarHBondContact OD1-NZ 3.26Å
2176	Q	54.5	Low	76.7	Confident	125.25 Å²	125.25	37.8 Å²	37.8	59%	0.585	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	2.5	178.7	-61.5	-175.6	-7.6	0	0	114.2	N1972 S2174 I2178	N1972-Q2176 HydrophobicContact CB-CB 4.16Å; N1972-Q2176 VanDerWaalsContact CB-O 3.28Å; N1972-Q2176 WeakPolarHBondContact CB-O 3.44Å; N1972-Q2176 PolarHBondContact ND2-O 3.15Å; S2174-Q2176 PolarHBondContact O-N 3.13Å; Q2176-I2178 PolarHBondContact O-N 3.02Å
2177	A	56.8	Low	76.9	Confident	23.25 Å²	23.25	39.5 Å²	39.5	19%	0.192	20%	0.195	C	C	.	.			trans	-62.2	127.5	175.1	0	0	0	0	0	109.9	S2174 D2175 R2179	S2174-A2177 WeakPolarHBondContact O-CB 3.25Å; S2174-A2177 PolarHBondContact O-N 3.01Å; D2175-A2177 VanDerWaalsContact C-N 3.33Å; A2177-R2179 PolarHBondContact O-N 3.14Å; A2177-R2179 VanDerWaalsContact O-N 3.11Å
2178	I	60.5	Low	77	Confident	78.25 Å²	78.25	40.7 Å²	40.7	40%	0.401	21%	0.207	S	C	.	.	S	Bend	trans	-53.7	-32.4	179.2	-61.5	173.5	0	0	0	111	M1453 Q1488 N1972 Q2176	M1453-I2178 HydrophobicContact CG-CD1 3.66Å; M1453-I2178 WeakPolarHBondContact O-CD1 3.45Å; Q1488-I2178 HydrophobicContact CB-CG2 4.18Å; N1972-I2178 WeakPolarHBondContact ND2-CG1 3.21Å; Q2176-I2178 PolarHBondContact O-N 3.02Å
2179	R	68.6	Low	76.9	Confident	60 Å²	60	48.4 Å²	48.4	23%	0.226	24%	0.236	C	C	.	.	S	Bend	trans	-130.1	117.2	175	-108.2	-179.2	-167.5	-150.4	4.7	109.3	Q1488 D1517 V2146 D2147 A2177 N2227	Q1488-R2179 VanDerWaalsContact C-NH2 3.34Å; Q1488-R2179 VanDerWaalsContact CA-NH2 3.35Å; Q1488-R2179 PolarHBondContact O-NE 3.26Å; Q1488-R2179 PolarHBondContact O-NH2 2.87Å; D1517-R2179 IonicContact OD1-NH2 3.17Å; D1517-R2179 IonicContact OD2-CZ 2.74Å; D1517-R2179 IonicContact OD2-NH1 3.33Å; D1517-R2179 PolarHBondContact OD2-NH1 2.86Å; D1517-R2179 IonicContact OD2-NH2 3.97Å; D1517-R2179 PolarHBondContact OD2-NH2 3.4Å; V2146-R2179 PolarHBondContact O-NH1 2.89Å; V2146-R2179 PolarHBondContact O-NH2 2.72Å; D2147-R2179 IonicContact OD2-CZ 2.99Å; D2147-R2179 IonicContact OD2-NH1 3.56Å; D2147-R2179 PolarHBondContact OD2-NH1 3.4Å; D2147-R2179 IonicContact OD2-NH2 3.24Å; D2147-R2179 PolarHBondContact OD2-NH2 3.03Å; A2177-R2179 PolarHBondContact O-N 3.14Å; A2177-R2179 VanDerWaalsContact O-N 3.11Å; R2179-N2227 PolarHBondContact O-ND2 3.15Å
2180	K	75.5	Confident	76.6	Confident	81.5 Å²	81.5	53.3 Å²	53.3	35%	0.354	26%	0.258	S	S	.	.			trans	-79.4	143.8	173	-66	-170.9	173.8	-165.3	0	111.2	S2173 D2175 R2182 E2203	S2173-K2180 WeakPolarHBondContact OG-CA 3.39Å; D2175-K2180 WeakPolarHBondContact O-CE 3.36Å; D2175-K2180 WeakPolarHBondContact OD1-CE 3.37Å; D2175-K2180 IonicContact OD1-NZ 3.27Å; D2175-K2180 PolarHBondContact OD1-NZ 3.26Å; K2180-R2182 PolarHBondContact O-N 2.98Å; K2180-E2203 IonicContact NZ-OE1 3.4Å; K2180-E2203 PolarHBondContact NZ-OE1 3.23Å
2181	D	84.6	Confident	76.3	Confident	3.25 Å²	3.25	54.8 Å²	54.8	2%	0.017	27%	0.265	C	S	.	.			trans	-68.8	125.3	171	-73.5	4.5	0	0	0	109.6	Y2141 I2170 Y2171 S2173 R2225 N2227	Y2141-D2181 WeakPolarHBondContact CE1-OD2 3.29Å; Y2141-D2181 VanDerWaalsContact CZ-OD2 3.28Å; Y2141-D2181 PolarHBondContact OH-OD2 2.85Å; I2170-D2181 HydrophobicContact CG2-CB 4.25Å; Y2171-D2181 WeakPolarHBondContact CB-OD2 3.27Å; Y2171-D2181 WeakPolarHBondContact CD1-OD2 3.41Å; S2173-D2181 PolarHBondContact OG-N 3.13Å; S2173-D2181 VanDerWaalsContact OG-N 3.15Å; D2181-R2225 WeakPolarHBondContact CA-O 3.31Å; D2181-N2227 WeakPolarHBondContact OD1-CB 3.38Å; D2181-N2227 PolarHBondContact OD1-N 3.17Å; D2181-N2227 PolarHBondContact OD1-ND2 3.18Å; D2181-N2227 PolarHBondContact OD2-N 2.81Å
2182	R	87.4	Confident	76.2	Confident	99.75 Å²	99.75	56 Å²	56	38%	0.376	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	147.6	-174.6	126.5	176.8	132.6	176.4	2.5	112.6	K2180 A2184 F2200 R2225	K2180-R2182 PolarHBondContact O-N 2.98Å; R2182-A2184 HydrophobicContact CG-CB 4.23Å; R2182-F2200 CarbonylContact C-O 3.5Å; R2182-F2200 VanDerWaalsContact CA-O 3.31Å; R2182-F2200 WeakPolarHBondContact CA-O 3.33Å; R2182-F2200 WeakPolarHBondContact CB-O 3.39Å; R2182-F2200 WeakPolarHBondContact CG-O 3.28Å; R2182-R2225 HydrophobicContact CG-CB 4.25Å; R2182-R2225 PolarHBondContact N-O 3.23Å; R2182-R2225 PolarHBondContact O-N 3.14Å
2183	I	90.8	Very high	76.3	Confident	4.75 Å²	4.75	57.9 Å²	57.9	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.5	167.1	-48.2	167	0	0	0	106.5	L2165 I2170 F2185 S2199 F2200 V2222 H2223 L2224 L2235	L2165-I2183 HydrophobicContact CD2-CD1 4.32Å; I2170-I2183 HydrophobicContact CD1-CD1 4.17Å; I2170-I2183 HydrophobicContact CD1-CG1 4.4Å; I2183-F2185 HydrophobicContact CB-CE2 4.3Å; I2183-F2185 HydrophobicContact CB-CZ 4.35Å; I2183-F2185 HydrophobicContact CG2-CE1 4.04Å; I2183-F2185 HydrophobicContact CG2-CE2 4.05Å; I2183-F2185 HydrophobicContact CG2-CZ 3.54Å; I2183-F2185 VanDerWaalsContact CG2-CZ 3.47Å; I2183-S2199 CarbonylContact O-C 3.41Å; I2183-S2199 WeakPolarHBondContact O-CA 3.37Å; I2183-S2199 WeakPolarHBondContact O-CB 3.32Å; I2183-F2200 HydrophobicContact CB-CB 4.35Å; I2183-F2200 HydrophobicContact CD1-CB 4.43Å; I2183-F2200 PolarHBondContact N-O 2.96Å; I2183-F2200 PolarHBondContact O-N 3.03Å; I2183-V2222 HydrophobicContact CG2-CG1 3.71Å; I2183-H2223 CarbonylContact C-O 3.36Å; I2183-H2223 VanDerWaalsContact CA-O 3.31Å; I2183-H2223 WeakPolarHBondContact CA-O 3.35Å; I2183-L2224 HydrophobicContact CG1-CD1 3.89Å; I2183-L2235 HydrophobicContact CD1-CD2 3.58Å; I2183-L2235 VanDerWaalsContact CD1-CD2 3.45Å; I2183-L2235 HydrophobicContact CG1-CD2 4.33Å
2184	A	90.4	Very high	77.1	Confident	0.25 Å²	0.25	62 Å²	62	0%	0.002	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.4	178.8	0	0	0	0	0	110.9	R2182 F2186 F2196 H2223	R2182-A2184 HydrophobicContact CG-CB 4.23Å; A2184-F2186 HydrophobicContact CB-CE2 3.78Å; A2184-F2186 HydrophobicContact CB-CZ 4.15Å; A2184-F2196 HydrophobicContact CB-CE2 4.19Å; A2184-H2223 HydrophobicContact CB-CB 4.31Å; A2184-H2223 PolarHBondContact N-O 3.02Å; A2184-H2223 PolarHBondContact O-N 3.01Å
2185	F	92.5	Very high	78.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.5	-178.8	-57.1	-82.5	0	0	0	110.6	F2163 I2183 I2197 D2198 F2200 V2213 L2220 T2221 V2222	F2163-F2185 HydrophobicContact CB-CE1 4.18Å; F2163-F2185 HydrophobicContact CD1-CD1 4.46Å; F2163-F2185 AromaticContact CD1-CE1 3.46Å; F2163-F2185 HydrophobicContact CD1-CE1 3.46Å; F2163-F2185 VanDerWaalsContact CD1-CE1 3.46Å; F2163-F2185 AromaticContact CD1-CZ 3.5Å; F2163-F2185 HydrophobicContact CD1-CZ 3.5Å; F2163-F2185 VanDerWaalsContact CD1-CZ 3.48Å; F2163-F2185 AromaticContact CD2-CE1 3.83Å; F2163-F2185 HydrophobicContact CD2-CE1 3.83Å; F2163-F2185 HydrophobicContact CD2-CZ 4.47Å; F2163-F2185 AromaticContact CE1-CE1 3.66Å; F2163-F2185 HydrophobicContact CE1-CE1 3.66Å; F2163-F2185 AromaticContact CE1-CZ 3.42Å; F2163-F2185 HydrophobicContact CE1-CZ 3.42Å; F2163-F2185 VanDerWaalsContact CE1-CZ 3.46Å; F2163-F2185 AromaticContact CE2-CE1 3.98Å; F2163-F2185 HydrophobicContact CE2-CE1 4.03Å; F2163-F2185 HydrophobicContact CE2-CZ 4.43Å; F2163-F2185 HydrophobicContact CG-CD1 4.44Å; F2163-F2185 AromaticContact CG-CE1 3.56Å; F2163-F2185 HydrophobicContact CG-CE1 3.56Å; F2163-F2185 HydrophobicContact CG-CZ 4.12Å; F2163-F2185 AromaticContact CZ-CE1 3.92Å; F2163-F2185 HydrophobicContact CZ-CE1 3.95Å; F2163-F2185 AromaticContact CZ-CZ 3.88Å; F2163-F2185 HydrophobicContact CZ-CZ 3.96Å; I2183-F2185 HydrophobicContact CB-CE2 4.3Å; I2183-F2185 HydrophobicContact CB-CZ 4.35Å; I2183-F2185 HydrophobicContact CG2-CE1 4.04Å; I2183-F2185 HydrophobicContact CG2-CE2 4.05Å; I2183-F2185 HydrophobicContact CG2-CZ 3.54Å; I2183-F2185 VanDerWaalsContact CG2-CZ 3.47Å; F2185-I2197 HydrophobicContact CB-CB 4.21Å; F2185-I2197 HydrophobicContact CB-CD1 4.36Å; F2185-I2197 PolarHBondContact O-N 3.06Å; F2185-D2198 HydrophobicContact CD2-CB 4.45Å; F2185-D2198 WeakPolarHBondContact CD2-O 3.39Å; F2185-D2198 PolarHBondContact N-O 3.25Å; F2185-F2200 HydrophobicContact CD2-CE2 4.42Å; F2185-F2200 AromaticContact CE2-CD2 3.35Å; F2185-F2200 HydrophobicContact CE2-CD2 3.35Å; F2185-F2200 AromaticContact CE2-CE2 3.41Å; F2185-F2200 HydrophobicContact CE2-CE2 3.41Å; F2185-F2200 VanDerWaalsContact CE2-CE2 3.43Å; F2185-F2200 HydrophobicContact CE2-CG 4.09Å; F2185-F2200 HydrophobicContact CE2-CZ 4.21Å; F2185-F2200 AromaticContact CZ-CD2 3.6Å; F2185-F2200 HydrophobicContact CZ-CD2 3.6Å; F2185-F2200 AromaticContact CZ-CE2 3.61Å; F2185-F2200 HydrophobicContact CZ-CE2 3.61Å; F2185-V2213 HydrophobicContact CB-CG1 3.95Å; F2185-V2213 HydrophobicContact CD1-CG1 4.39Å; F2185-V2213 HydrophobicContact CD2-CB 4.41Å; F2185-V2213 HydrophobicContact CD2-CG1 4.18Å; F2185-V2213 HydrophobicContact CD2-CG2 3.96Å; F2185-V2213 HydrophobicContact CE2-CG2 4Å; F2185-V2213 HydrophobicContact CG-CB 4.39Å; F2185-V2213 HydrophobicContact CG-CG1 3.9Å; F2185-V2213 HydrophobicContact CG-CG2 4.38Å; F2185-V2213 HydrophobicContact CZ-CG2 4.38Å; F2185-L2220 HydrophobicContact CB-CD1 4.43Å; F2185-L2220 HydrophobicContact CD1-CD1 4.49Å; F2185-T2221 WeakPolarHBondContact CA-O 3.4Å; F2185-V2222 HydrophobicContact CD1-CG1 4.31Å; F2185-V2222 HydrophobicContact CD1-CG2 3.98Å; F2185-V2222 HydrophobicContact CE1-CB 4.48Å; F2185-V2222 HydrophobicContact CE1-CG1 3.91Å; F2185-V2222 HydrophobicContact CE1-CG2 4.01Å
2186	F	90.7	Very high	79.8	Confident	18.5 Å²	18.5	59.8 Å²	59.8	8%	0.081	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.9	178.5	-58.3	-90.7	0	0	0	110.8	A2184 M2191 S2192 A2195 F2196 T2221 H2223	A2184-F2186 HydrophobicContact CB-CE2 3.78Å; A2184-F2186 HydrophobicContact CB-CZ 4.15Å; F2186-M2191 HydrophobicContact CD1-CB 4.47Å; F2186-M2191 HydrophobicContact CD1-CG 4.02Å; F2186-M2191 HydrophobicContact CD2-CB 4.49Å; F2186-M2191 HydrophobicContact CD2-CG 3.93Å; F2186-M2191 HydrophobicContact CD2-SD 4.18Å; F2186-M2191 HydrophobicContact CE1-CB 4.46Å; F2186-M2191 HydrophobicContact CE1-CG 3.74Å; F2186-M2191 HydrophobicContact CE2-CB 4.46Å; F2186-M2191 HydrophobicContact CE2-CG 3.96Å; F2186-M2191 VanDerWaalsContact CE2-CG 3.41Å; F2186-M2191 HydrophobicContact CE2-SD 4.03Å; F2186-M2191 HydrophobicContact CG-CB 4.49Å; F2186-M2191 HydrophobicContact CG-CG 4.24Å; F2186-M2191 HydrophobicContact CZ-CB 4.44Å; F2186-M2191 HydrophobicContact CZ-CG 3.42Å; F2186-M2191 VanDerWaalsContact CZ-CG 3.42Å; F2186-M2191 HydrophobicContact CZ-SD 4.04Å; F2186-S2192 WeakPolarHBondContact CD1-O 3.43Å; F2186-A2195 CarbonylContact C-O 3.57Å; F2186-A2195 VanDerWaalsContact CA-O 3.26Å; F2186-A2195 WeakPolarHBondContact CA-O 3.38Å; F2186-A2195 HydrophobicContact CB-CB 4.32Å; F2186-A2195 HydrophobicContact CD1-CB 4.35Å; F2186-F2196 HydrophobicContact CD1-CB 4.19Å; F2186-F2196 HydrophobicContact CD1-CD2 4.47Å; F2186-F2196 HydrophobicContact CE1-CB 4.08Å; F2186-F2196 AromaticContact CE1-CD2 3.96Å; F2186-F2196 HydrophobicContact CE1-CD2 4Å; F2186-F2196 HydrophobicContact CZ-CD2 4.25Å; F2186-T2221 PolarHBondContact N-O 3.22Å; F2186-T2221 PolarHBondContact O-N 3.02Å; F2186-H2223 HydrophobicContact CD2-CB 4.33Å; F2186-H2223 HydrophobicContact CE2-CB 3.86Å
2187	N	89.2	Confident	81.3	Confident	46.5 Å²	46.5	56.5 Å²	56.5	25%	0.249	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.3	173.5	-102.6	-25.1	0	0	0	110.4	A2195 I2197 S2215 S2216	N2187-A2195 WeakPolarHBondContact CB-O 3.27Å; N2187-A2195 PolarHBondContact N-O 3.24Å; N2187-A2195 WeakPolarHBondContact O-CB 3.33Å; N2187-I2197 HydrophobicContact CB-CD1 4.2Å; N2187-I2197 HydrophobicContact CB-CG1 4.2Å; N2187-I2197 VanDerWaalsContact CG-CD1 3.44Å; N2187-I2197 WeakPolarHBondContact ND2-CG1 3.43Å; N2187-I2197 WeakPolarHBondContact OD1-CD1 3.37Å; N2187-S2215 WeakPolarHBondContact OD1-CA 3.28Å; N2187-S2216 WeakPolarHBondContact ND2-CB 3.17Å; N2187-S2216 PolarHBondContact ND2-OG 3.22Å; N2187-S2216 PolarHBondContact OD1-N 3.2Å; N2187-S2216 PolarHBondContact OD1-OG 2.97Å
2188	G	86	Confident	82.7	Confident	25 Å²	25	58.5 Å²	58.5	26%	0.258	31%	0.307	S	S	.	.	S	Bend	trans	79.9	-159.7	-178.5	0	0	0	0	0	113.2	A2219 T2221	G2188-A2219 PolarHBondContact N-O 2.99Å; G2188-A2219 VanDerWaalsContact N-O 3.11Å; G2188-T2221 PolarHBondContact O-OG1 3Å
2189	R	82.8	Confident	84	Confident	162.25 Å²	162.25	56.5 Å²	56.5	61%	0.612	30%	0.3	S	S	*	.	S	Bend	trans	-95.8	-9.2	-176.3	-54.5	-169.1	176.2	173.9	-2.7	114.2	N1608 T2151 L2153	N1608-R2189 PolarHBondContact OD1-O 2.78Å; T2151-R2189 HydrophobicContact CG2-CB 4.39Å; T2151-R2189 HydrophobicContact CG2-CG 4.03Å; L2153-R2189 VanDerWaalsContact CD1-NH2 3.28Å; L2153-R2189 HydrophobicContact CD2-CG 4.4Å
2190	Q	77.3	Confident	84.8	Confident	123.5 Å²	123.5	53.8 Å²	53.8	58%	0.577	29%	0.29	S	S	*	.			trans	-105.2	128.5	-172.4	-84.4	-178.4	-5	0	0	111	S2192 A2195	Q2190-S2192 PolarHBondContact O-N 3.04Å; Q2190-S2192 VanDerWaalsContact O-N 3.1Å; Q2190-A2195 VanDerWaalsContact O-CB 3.3Å; Q2190-A2195 WeakPolarHBondContact O-CB 3.35Å
2191	M	77.3	Confident	85.1	Confident	44.75 Å²	44.75	50.6 Å²	50.6	22%	0.22	28%	0.28	C	S	.	.			trans	-83.4	87.9	170.3	-81.4	176.6	174.2	0	0	110.1	L1606 Y2149 F2186 T2221 H2223	L1606-M2191 HydrophobicContact CB-CE 4.11Å; L1606-M2191 HydrophobicContact CD1-CE 3.96Å; L1606-M2191 HydrophobicContact CD2-CE 4.23Å; L1606-M2191 HydrophobicContact CD2-SD 4.11Å; L1606-M2191 HydrophobicContact CG-CE 4.17Å; Y2149-M2191 HydrophobicContact CD1-CE 3.77Å; Y2149-M2191 HydrophobicContact CD2-CE 3.26Å; Y2149-M2191 HydrophobicContact CE1-CE 4.41Å; Y2149-M2191 HydrophobicContact CE2-CE 3.99Å; Y2149-M2191 HydrophobicContact CG-CE 3.12Å; F2186-M2191 HydrophobicContact CD1-CB 4.47Å; F2186-M2191 HydrophobicContact CD1-CG 4.02Å; F2186-M2191 HydrophobicContact CD2-CB 4.49Å; F2186-M2191 HydrophobicContact CD2-CG 3.93Å; F2186-M2191 HydrophobicContact CD2-SD 4.18Å; F2186-M2191 HydrophobicContact CE1-CB 4.46Å; F2186-M2191 HydrophobicContact CE1-CG 3.74Å; F2186-M2191 HydrophobicContact CE2-CB 4.46Å; F2186-M2191 HydrophobicContact CE2-CG 3.96Å; F2186-M2191 VanDerWaalsContact CE2-CG 3.41Å; F2186-M2191 HydrophobicContact CE2-SD 4.03Å; F2186-M2191 HydrophobicContact CG-CB 4.49Å; F2186-M2191 HydrophobicContact CG-CG 4.24Å; F2186-M2191 HydrophobicContact CZ-CB 4.44Å; F2186-M2191 HydrophobicContact CZ-CG 3.42Å; F2186-M2191 VanDerWaalsContact CZ-CG 3.42Å; F2186-M2191 HydrophobicContact CZ-SD 4.04Å; M2191-T2221 HydrophobicContact CE-CG2 3.82Å; M2191-T2221 HydrophobicContact CG-CG2 4.34Å; M2191-H2223 HydrophobicContact CE-CB 4.27Å; M2191-H2223 HydrophobicContact SD-CB 4.19Å
2192	S	78.3	Confident	84.6	Confident	41.5 Å²	41.5	53.7 Å²	53.7	29%	0.29	30%	0.295	S	S	.	.			trans	-123.3	158.6	171.6	69.2	0	0	0	0	110	F2186 Q2190 A2194 A2195 F2196	F2186-S2192 WeakPolarHBondContact CD1-O 3.43Å; Q2190-S2192 PolarHBondContact O-N 3.04Å; Q2190-S2192 VanDerWaalsContact O-N 3.1Å; S2192-A2194 PolarHBondContact O-N 3.07Å; S2192-A2195 PolarHBondContact O-N 3.17Å; S2192-A2195 WeakPolarHBondContact OG-CB 3.36Å; S2192-A2195 PolarHBondContact OG-N 3.14Å; S2192-F2196 PolarHBondContact O-N 2.93Å
2193	S	77.4	Confident	83.8	Confident	119.25 Å²	119.25	55.1 Å²	55.1	83%	0.834	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-57.9	-32.6	173.3	50.5	0	0	0	0	112.4	A2195 F2196	S2193-A2195 VanDerWaalsContact C-N 3.31Å; S2193-A2195 PolarHBondContact O-N 3.03Å; S2193-F2196 WeakPolarHBondContact O-CB 3.31Å; S2193-F2196 PolarHBondContact O-N 2.96Å
2194	A	81.7	Confident	82.8	Confident	96.5 Å²	96.5	57.1 Å²	57.1	80%	0.798	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-71.2	-24	176.4	0	0	0	0	0	113.7	S2192	S2192-A2194 PolarHBondContact O-N 3.07Å
2195	A	84.6	Confident	81.7	Confident	13.5 Å²	13.5	59.7 Å²	59.7	11%	0.112	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-89.8	-10.1	178.4	0	0	0	0	0	113.1	F2186 N2187 Q2190 S2192 S2193 I2197	F2186-A2195 CarbonylContact C-O 3.57Å; F2186-A2195 VanDerWaalsContact CA-O 3.26Å; F2186-A2195 WeakPolarHBondContact CA-O 3.38Å; F2186-A2195 HydrophobicContact CB-CB 4.32Å; F2186-A2195 HydrophobicContact CD1-CB 4.35Å; N2187-A2195 WeakPolarHBondContact CB-O 3.27Å; N2187-A2195 PolarHBondContact N-O 3.24Å; N2187-A2195 WeakPolarHBondContact O-CB 3.33Å; Q2190-A2195 VanDerWaalsContact O-CB 3.3Å; Q2190-A2195 WeakPolarHBondContact O-CB 3.35Å; S2192-A2195 PolarHBondContact O-N 3.17Å; S2192-A2195 WeakPolarHBondContact OG-CB 3.36Å; S2192-A2195 PolarHBondContact OG-N 3.14Å; S2193-A2195 VanDerWaalsContact C-N 3.31Å; S2193-A2195 PolarHBondContact O-N 3.03Å; A2195-I2197 PolarHBondContact O-N 3Å
2196	F	88.1	Confident	80.2	Confident	89 Å²	89	64.8 Å²	64.8	39%	0.39	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	132.4	-177.4	-179.7	-101.1	0	0	0	111.7	A2184 F2186 S2192 S2193 D2198	A2184-F2196 HydrophobicContact CB-CE2 4.19Å; F2186-F2196 HydrophobicContact CD1-CB 4.19Å; F2186-F2196 HydrophobicContact CD1-CD2 4.47Å; F2186-F2196 HydrophobicContact CE1-CB 4.08Å; F2186-F2196 AromaticContact CE1-CD2 3.96Å; F2186-F2196 HydrophobicContact CE1-CD2 4Å; F2186-F2196 HydrophobicContact CZ-CD2 4.25Å; S2192-F2196 PolarHBondContact O-N 2.93Å; S2193-F2196 WeakPolarHBondContact O-CB 3.31Å; S2193-F2196 PolarHBondContact O-N 2.96Å; F2196-D2198 VanDerWaalsContact CE2-O 3.25Å; F2196-D2198 WeakPolarHBondContact CE2-O 3.32Å; F2196-D2198 WeakPolarHBondContact CZ-O 3.29Å
2197	I	86.6	Confident	78.8	Confident	54.25 Å²	54.25	70 Å²	70	28%	0.278	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-61.3	178	-51.4	175	0	0	0	109.6	F2185 N2187 A2195 V2213 L2220	F2185-I2197 HydrophobicContact CB-CB 4.21Å; F2185-I2197 HydrophobicContact CB-CD1 4.36Å; F2185-I2197 PolarHBondContact O-N 3.06Å; N2187-I2197 HydrophobicContact CB-CD1 4.2Å; N2187-I2197 HydrophobicContact CB-CG1 4.2Å; N2187-I2197 VanDerWaalsContact CG-CD1 3.44Å; N2187-I2197 WeakPolarHBondContact ND2-CG1 3.43Å; N2187-I2197 WeakPolarHBondContact OD1-CD1 3.37Å; A2195-I2197 PolarHBondContact O-N 3Å; I2197-V2213 HydrophobicContact CB-CG1 4.32Å; I2197-V2213 HydrophobicContact CD1-CG1 4.39Å; I2197-V2213 HydrophobicContact CG2-CG1 3.77Å; I2197-L2220 HydrophobicContact CD1-CD1 3.86Å
2198	D	87.3	Confident	77.5	Confident	65.75 Å²	65.75	68.7 Å²	68.7	35%	0.352	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	171.5	-172.8	-160.4	3.1	0	0	0	110.3	F2185 F2196 F2200 V2213	F2185-D2198 HydrophobicContact CD2-CB 4.45Å; F2185-D2198 WeakPolarHBondContact CD2-O 3.39Å; F2185-D2198 PolarHBondContact N-O 3.25Å; F2196-D2198 VanDerWaalsContact CE2-O 3.25Å; F2196-D2198 WeakPolarHBondContact CE2-O 3.32Å; F2196-D2198 WeakPolarHBondContact CZ-O 3.29Å; D2198-F2200 WeakPolarHBondContact OD2-CE1 3.46Å; D2198-V2213 HydrophobicContact CB-CG1 4.46Å; D2198-V2213 HydrophobicContact CB-CG2 4.36Å
2199	S	87.7	Confident	76.5	Confident	36 Å²	36	68.5 Å²	68.5	25%	0.252	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	139.2	171	62.2	0	0	0	0	114	I2183	I2183-S2199 CarbonylContact O-C 3.41Å; I2183-S2199 WeakPolarHBondContact O-CA 3.37Å; I2183-S2199 WeakPolarHBondContact O-CB 3.32Å
2200	F	85.2	Confident	75.7	Confident	4.75 Å²	4.75	61.7 Å²	61.7	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142.5	172.1	-56.7	-43.5	0	0	0	111.7	F2163 L2165 I2170 R2182 I2183 F2185 D2198 T2204 G2208 L2209 S2210 V2213	F2163-F2200 HydrophobicContact CD1-CE2 4.19Å; F2163-F2200 HydrophobicContact CE1-CD2 4.36Å; F2163-F2200 AromaticContact CE1-CE2 3.95Å; F2163-F2200 HydrophobicContact CE1-CE2 4.18Å; L2165-F2200 HydrophobicContact CD1-CD2 3.69Å; L2165-F2200 HydrophobicContact CD1-CE2 4.03Å; L2165-F2200 HydrophobicContact CD1-CG 4.24Å; L2165-F2200 HydrophobicContact CG-CD2 4.37Å; L2165-F2200 HydrophobicContact CG-CE2 4.36Å; I2170-F2200 HydrophobicContact CD1-CB 4.43Å; R2182-F2200 CarbonylContact C-O 3.5Å; R2182-F2200 VanDerWaalsContact CA-O 3.31Å; R2182-F2200 WeakPolarHBondContact CA-O 3.33Å; R2182-F2200 WeakPolarHBondContact CB-O 3.39Å; R2182-F2200 WeakPolarHBondContact CG-O 3.28Å; I2183-F2200 HydrophobicContact CB-CB 4.35Å; I2183-F2200 HydrophobicContact CD1-CB 4.43Å; I2183-F2200 PolarHBondContact N-O 2.96Å; I2183-F2200 PolarHBondContact O-N 3.03Å; F2185-F2200 HydrophobicContact CD2-CE2 4.42Å; F2185-F2200 AromaticContact CE2-CD2 3.35Å; F2185-F2200 HydrophobicContact CE2-CD2 3.35Å; F2185-F2200 AromaticContact CE2-CE2 3.41Å; F2185-F2200 HydrophobicContact CE2-CE2 3.41Å; F2185-F2200 VanDerWaalsContact CE2-CE2 3.43Å; F2185-F2200 HydrophobicContact CE2-CG 4.09Å; F2185-F2200 HydrophobicContact CE2-CZ 4.21Å; F2185-F2200 AromaticContact CZ-CD2 3.6Å; F2185-F2200 HydrophobicContact CZ-CD2 3.6Å; F2185-F2200 AromaticContact CZ-CE2 3.61Å; F2185-F2200 HydrophobicContact CZ-CE2 3.61Å; D2198-F2200 WeakPolarHBondContact OD2-CE1 3.46Å; F2200-T2204 WeakPolarHBondContact CA-OG1 3.39Å; F2200-T2204 HydrophobicContact CD1-CG2 4.46Å; F2200-G2208 WeakPolarHBondContact CE1-O 3.28Å; F2200-L2209 HydrophobicContact CB-CD2 3.92Å; F2200-L2209 HydrophobicContact CD1-CD2 4.15Å; F2200-L2209 HydrophobicContact CG-CD2 4.05Å; F2200-S2210 WeakPolarHBondContact CE1-OG 3.44Å; F2200-S2210 WeakPolarHBondContact CZ-OG 3.15Å; F2200-V2213 HydrophobicContact CE1-CG2 4.37Å; F2200-V2213 HydrophobicContact CE2-CG2 3.69Å; F2200-V2213 HydrophobicContact CZ-CG2 3.38Å; F2200-V2213 VanDerWaalsContact CZ-CG2 3.43Å
2201	G	80.7	Confident	75.5	Confident	13.3333 Å²	13.3333	62.3 Å²	62.3	14%	0.137	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	-169.4	175.8	0	0	0	0	0	111.1	E2203 T2204 S2205	G2201-E2203 VanDerWaalsContact C-N 3.32Å; G2201-E2203 PolarHBondContact O-N 2.83Å; G2201-T2204 PolarHBondContact N-OG1 3.14Å; G2201-T2204 PolarHBondContact O-N 3.12Å; G2201-T2204 PolarHBondContact O-OG1 3.03Å; G2201-S2205 PolarHBondContact O-N 3.33Å; G2201-S2205 VanDerWaalsContact O-N 3.08Å; G2201-S2205 PolarHBondContact O-OG 3.38Å
2202	H	74.1	Confident	75.7	Confident	69.3333 Å²	69.3333	62.4 Å²	62.4	32%	0.321	35%	0.354	S	S	.	.	S	Bend	trans	-66.3	-35.9	177.3	-177.5	59.6	0	0	0	112.9	I2170 N2172 T2204 S2205 R2206	I2170-H2202 PolarHBondContact O-ND1 2.86Å; N2172-H2202 HydrophobicContact CB-CB 4.37Å; N2172-H2202 VanDerWaalsContact CB-CD2 3.44Å; N2172-H2202 WeakPolarHBondContact CB-CD2 3.44Å; N2172-H2202 PolarHBondContact ND2-CD2 2.82Å; N2172-H2202 VanDerWaalsContact ND2-CD2 3.26Å; N2172-H2202 PolarHBondContact ND2-CE1 2.95Å; N2172-H2202 PolarHBondContact ND2-ND1 2.79Å; N2172-H2202 PolarHBondContact ND2-NE2 2.99Å; N2172-H2202 VanDerWaalsContact ND2-NE2 3.14Å; N2172-H2202 PolarHBondContact OD1-CD2 2.87Å; N2172-H2202 PolarHBondContact OD1-ND1 3.28Å; H2202-T2204 VanDerWaalsContact C-N 3.25Å; H2202-T2204 PolarHBondContact O-N 3.21Å; H2202-S2205 PolarHBondContact O-N 2.8Å; H2202-R2206 PolarHBondContact NE2-NE 2.8Å; H2202-R2206 VanDerWaalsContact NE2-NE 3.18Å; H2202-R2206 PolarHBondContact NE2-NH2 2.77Å
2203	E	71	Confident	76.1	Confident	129 Å²	129	60.7 Å²	60.7	60%	0.603	34%	0.342	S	S	*	.	S	Bend	trans	-66.7	-27.4	179.6	-66.8	166.5	-139.7	0	0	112.9	K2180 G2201 S2205	K2180-E2203 IonicContact NZ-OE1 3.4Å; K2180-E2203 PolarHBondContact NZ-OE1 3.23Å; G2201-E2203 VanDerWaalsContact C-N 3.32Å; G2201-E2203 PolarHBondContact O-N 2.83Å; E2203-S2205 PolarHBondContact O-N 3.05Å
2204	T	70.7	Confident	76.7	Confident	47 Å²	47	61.1 Å²	61.1	29%	0.288	33%	0.325	S	S	.	.	S	Bend	trans	-68.8	104.2	179.3	49.7	0	0	0	0	110.8	F2200 G2201 H2202 R2206 H2207 L2209	F2200-T2204 WeakPolarHBondContact CA-OG1 3.39Å; F2200-T2204 HydrophobicContact CD1-CG2 4.46Å; G2201-T2204 PolarHBondContact N-OG1 3.14Å; G2201-T2204 PolarHBondContact O-N 3.12Å; G2201-T2204 PolarHBondContact O-OG1 3.03Å; H2202-T2204 VanDerWaalsContact C-N 3.25Å; H2202-T2204 PolarHBondContact O-N 3.21Å; T2204-R2206 PolarHBondContact O-N 3.29Å; T2204-R2206 VanDerWaalsContact O-N 3.13Å; T2204-H2207 PolarHBondContact O-N 3.42Å; T2204-L2209 VanDerWaalsContact OG1-CD2 3.32Å; T2204-L2209 WeakPolarHBondContact OG1-CD2 3.3Å
2205	S	65.9	Low	77.1	Confident	53 Å²	53	56.6 Å²	56.6	37%	0.371	29%	0.288	S	S	.	.			trans	-58.8	149.4	178.6	42	0	0	0	0	112.2	G2201 H2202 E2203 H2207 G2208 L2209	G2201-S2205 PolarHBondContact O-N 3.33Å; G2201-S2205 VanDerWaalsContact O-N 3.08Å; G2201-S2205 PolarHBondContact O-OG 3.38Å; H2202-S2205 PolarHBondContact O-N 2.8Å; E2203-S2205 PolarHBondContact O-N 3.05Å; S2205-H2207 PolarHBondContact O-N 3.44Å; S2205-G2208 WeakPolarHBondContact O-CA 3.37Å; S2205-G2208 PolarHBondContact O-N 2.88Å; S2205-G2208 PolarHBondContact OG-N 2.99Å; S2205-G2208 VanDerWaalsContact OG-N 3.14Å; S2205-L2209 PolarHBondContact O-N 2.81Å
2206	R	62.4	Low	77.2	Confident	107.667 Å²	107.667	59.8 Å²	59.8	41%	0.406	31%	0.309	S	S	.	.	H	α-helix	trans	-65.7	-34.8	177.2	-69.3	-173.5	179.9	-163.6	-1.8	113.2	E2105 L2108 H2202 T2204 G2208 L2209 S2210 S2895 S2896	E2105-R2206 WeakPolarHBondContact OE2-CD 3.48Å; E2105-R2206 IonicContact OE2-CZ 3.92Å; E2105-R2206 IonicContact OE2-NH1 2.97Å; E2105-R2206 PolarHBondContact OE2-NH1 2.95Å; L2108-R2206 VanDerWaalsContact CD1-NH2 3.26Å; H2202-R2206 PolarHBondContact NE2-NE 2.8Å; H2202-R2206 VanDerWaalsContact NE2-NE 3.18Å; H2202-R2206 PolarHBondContact NE2-NH2 2.77Å; T2204-R2206 PolarHBondContact O-N 3.29Å; T2204-R2206 VanDerWaalsContact O-N 3.13Å; R2206-G2208 VanDerWaalsContact C-N 3.33Å; R2206-G2208 PolarHBondContact O-N 3.4Å; R2206-G2208 VanDerWaalsContact O-N 3.17Å; R2206-L2209 PolarHBondContact O-N 3.17Å; R2206-S2210 PolarHBondContact O-N 3.25Å; R2206-S2210 VanDerWaalsContact O-N 3.14Å; R2206-S2895 PolarHBondContact NH2-O 3.36Å; R2206-S2895 PolarHBondContact NH2-OG 3.14Å; R2206-S2896 VanDerWaalsContact CZ-OG 3.31Å; R2206-S2896 PolarHBondContact NH1-OG 2.86Å; R2206-S2896 PolarHBondContact NH2-OG 3.29Å
2207	H	60.1	Low	77.2	Confident	127.333 Å²	127.333	57 Å²	57	59%	0.59	31%	0.306	S	S	*	.	H	α-helix	trans	-72.8	-13.8	178.9	-71.4	-71.3	0	0	0	112.6	E2103 T2204 S2205 L2209 S2210	E2103-H2207 IonicContact OE2-CE1 2.76Å; E2103-H2207 PolarHBondContact OE2-CE1 3.4Å; E2103-H2207 VanDerWaalsContact OE2-CE1 3.25Å; E2103-H2207 IonicContact OE2-ND1 3.73Å; E2103-H2207 PolarHBondContact OE2-ND1 2.96Å; T2204-H2207 PolarHBondContact O-N 3.42Å; S2205-H2207 PolarHBondContact O-N 3.44Å; H2207-L2209 PolarHBondContact O-N 2.82Å; H2207-S2210 WeakPolarHBondContact CA-OG 3.45Å; H2207-S2210 PolarHBondContact O-N 3.27Å; H2207-S2210 PolarHBondContact O-OG 2.98Å
2208	G	61.8	Low	77.5	Confident	19.6667 Å²	19.6667	57.3 Å²	57.3	20%	0.203	31%	0.308	C	S	.	.	H	α-helix	trans	-35.8	-54.3	179.7	0	0	0	0	0	112.2	F2200 S2205 R2206 S2210 Q2211	F2200-G2208 WeakPolarHBondContact CE1-O 3.28Å; S2205-G2208 WeakPolarHBondContact O-CA 3.37Å; S2205-G2208 PolarHBondContact O-N 2.88Å; S2205-G2208 PolarHBondContact OG-N 2.99Å; S2205-G2208 VanDerWaalsContact OG-N 3.14Å; R2206-G2208 VanDerWaalsContact C-N 3.33Å; R2206-G2208 PolarHBondContact O-N 3.4Å; R2206-G2208 VanDerWaalsContact O-N 3.17Å; G2208-S2210 VanDerWaalsContact C-N 3.3Å; G2208-S2210 PolarHBondContact O-N 3.14Å; G2208-Q2211 PolarHBondContact O-N 3.01Å
2209	L	66	Low	77.7	Confident	21 Å²	21	54.5 Å²	54.5	11%	0.11	29%	0.294	C	S	.	.	H	α-helix	trans	-65.6	5	177.1	-77.1	142.5	0	0	0	112.5	D2104 P2106 L2165 I2170 F2200 T2204 S2205 R2206 H2207 Q2211	D2104-L2209 HydrophobicContact CB-CD1 4.23Å; D2104-L2209 VanDerWaalsContact O-CD1 3.27Å; D2104-L2209 WeakPolarHBondContact O-CD1 3.41Å; P2106-L2209 HydrophobicContact CB-CD1 4.13Å; P2106-L2209 HydrophobicContact CG-CB 3.9Å; L2165-L2209 HydrophobicContact CB-CD2 3.8Å; L2165-L2209 HydrophobicContact CB-CG 4.43Å; L2165-L2209 HydrophobicContact CD1-CB 4.4Å; L2165-L2209 HydrophobicContact CD1-CD2 3.74Å; L2165-L2209 WeakPolarHBondContact O-CD2 3.44Å; I2170-L2209 HydrophobicContact CD1-CD2 4.15Å; F2200-L2209 HydrophobicContact CB-CD2 3.92Å; F2200-L2209 HydrophobicContact CD1-CD2 4.15Å; F2200-L2209 HydrophobicContact CG-CD2 4.05Å; T2204-L2209 VanDerWaalsContact OG1-CD2 3.32Å; T2204-L2209 WeakPolarHBondContact OG1-CD2 3.3Å; S2205-L2209 PolarHBondContact O-N 2.81Å; R2206-L2209 PolarHBondContact O-N 3.17Å; H2207-L2209 PolarHBondContact O-N 2.82Å; L2209-Q2211 VanDerWaalsContact C-N 3.34Å
2210	S	65.6	Low	77.9	Confident	20 Å²	20	52.8 Å²	52.8	14%	0.14	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-1.6	177.6	60.4	0	0	0	0	113.3	D2104 F2200 R2206 H2207 G2208	D2104-S2210 WeakPolarHBondContact O-CB 3.42Å; F2200-S2210 WeakPolarHBondContact CE1-OG 3.44Å; F2200-S2210 WeakPolarHBondContact CZ-OG 3.15Å; R2206-S2210 PolarHBondContact O-N 3.25Å; R2206-S2210 VanDerWaalsContact O-N 3.14Å; H2207-S2210 WeakPolarHBondContact CA-OG 3.45Å; H2207-S2210 PolarHBondContact O-N 3.27Å; H2207-S2210 PolarHBondContact O-OG 2.98Å; G2208-S2210 VanDerWaalsContact C-N 3.3Å; G2208-S2210 PolarHBondContact O-N 3.14Å
2211	Q	73.5	Confident	78.2	Confident	135 Å²	135	52.6 Å²	52.6	63%	0.631	28%	0.281	S	S	*	.	S	Bend	trans	-68.3	132.7	179.5	-68.7	-176.7	1.2	0	0	111.4	G2208 L2209 V2213	G2208-Q2211 PolarHBondContact O-N 3.01Å; L2209-Q2211 VanDerWaalsContact C-N 3.34Å; Q2211-V2213 PolarHBondContact O-N 3.36Å
2212	P	81.8	Confident	78.8	Confident	46.6667 Å²	46.6667	52 Å²	52	30%	0.303	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-72.5	137.3	179.6	29.2	-34.4	0	0	0	111.7	E2162 F2163 K2164 R2214	E2162-P2212 HydrophobicContact CG-CB 3.72Å; E2162-P2212 HydrophobicContact CG-CG 4.48Å; E2162-P2212 VanDerWaalsContact OE1-CB 3.31Å; E2162-P2212 WeakPolarHBondContact OE1-CB 3.36Å; E2162-P2212 VanDerWaalsContact OE1-CG 3.29Å; E2162-P2212 WeakPolarHBondContact OE1-CG 3.41Å; F2163-P2212 CarbonylContact O-C 3.48Å; F2163-P2212 WeakPolarHBondContact O-CA 3.39Å; K2164-P2212 HydrophobicContact CB-CB 4.31Å; P2212-R2214 PolarHBondContact O-N 2.81Å
2213	V	86.4	Confident	79.7	Confident	7.33333 Å²	7.33333	49 Å²	49	4%	0.044	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.9	-179.3	-174.7	0	0	0	0	109.5	E2162 F2163 F2185 I2197 D2198 F2200 Q2211	E2162-V2213 CarbonylContact C-O 3.14Å; E2162-V2213 WeakPolarHBondContact CA-O 3.39Å; F2163-V2213 HydrophobicContact CB-CB 4.46Å; F2163-V2213 PolarHBondContact N-O 3.07Å; F2163-V2213 PolarHBondContact O-N 2.96Å; F2185-V2213 HydrophobicContact CB-CG1 3.95Å; F2185-V2213 HydrophobicContact CD1-CG1 4.39Å; F2185-V2213 HydrophobicContact CD2-CB 4.41Å; F2185-V2213 HydrophobicContact CD2-CG1 4.18Å; F2185-V2213 HydrophobicContact CD2-CG2 3.96Å; F2185-V2213 HydrophobicContact CE2-CG2 4Å; F2185-V2213 HydrophobicContact CG-CB 4.39Å; F2185-V2213 HydrophobicContact CG-CG1 3.9Å; F2185-V2213 HydrophobicContact CG-CG2 4.38Å; F2185-V2213 HydrophobicContact CZ-CG2 4.38Å; I2197-V2213 HydrophobicContact CB-CG1 4.32Å; I2197-V2213 HydrophobicContact CD1-CG1 4.39Å; I2197-V2213 HydrophobicContact CG2-CG1 3.77Å; D2198-V2213 HydrophobicContact CB-CG1 4.46Å; D2198-V2213 HydrophobicContact CB-CG2 4.36Å; F2200-V2213 HydrophobicContact CE1-CG2 4.37Å; F2200-V2213 HydrophobicContact CE2-CG2 3.69Å; F2200-V2213 HydrophobicContact CZ-CG2 3.38Å; F2200-V2213 VanDerWaalsContact CZ-CG2 3.43Å; Q2211-V2213 PolarHBondContact O-N 3.36Å
2214	R	88.6	Confident	80.6	Confident	126.667 Å²	126.667	43 Å²	43	48%	0.478	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.7	-179.6	-69.2	-178.2	175	150.6	10.9	112.1	L2161 E2162 P2212	L2161-R2214 WeakPolarHBondContact O-CA 3.32Å; E2162-R2214 HydrophobicContact CB-CG 4.19Å; E2162-R2214 HydrophobicContact CG-CG 3.93Å; E2162-R2214 IonicContact OE1-CZ 2.75Å; E2162-R2214 IonicContact OE1-NE 3.1Å; E2162-R2214 PolarHBondContact OE1-NE 2.77Å; E2162-R2214 IonicContact OE1-NH2 3.54Å; E2162-R2214 PolarHBondContact OE1-NH2 3.1Å; E2162-R2214 IonicContact OE2-CZ 2.79Å; E2162-R2214 VanDerWaalsContact OE2-CZ 3.27Å; E2162-R2214 IonicContact OE2-NE 2.94Å; E2162-R2214 PolarHBondContact OE2-NE 2.96Å; E2162-R2214 IonicContact OE2-NH2 3.3Å; E2162-R2214 PolarHBondContact OE2-NH2 3.16Å; E2162-R2214 VanDerWaalsContact OE2-NH2 3.1Å; P2212-R2214 PolarHBondContact O-N 2.81Å
2215	S	91.1	Very high	81.4	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.021	23%	0.227	C	C	.	.			trans	-73.3	150.6	170.5	63.6	0	0	0	0	112	K2160 L2161 N2187 G2217	K2160-S2215 WeakPolarHBondContact CD-O 3.48Å; L2161-S2215 WeakPolarHBondContact CA-OG 3.22Å; L2161-S2215 PolarHBondContact N-OG 2.93Å; L2161-S2215 PolarHBondContact O-N 2.87Å; L2161-S2215 PolarHBondContact O-OG 3.21Å; N2187-S2215 WeakPolarHBondContact OD1-CA 3.28Å; S2215-G2217 PolarHBondContact OG-O 3.1Å
2216	S	87.6	Confident	82.5	Confident	79.3333 Å²	79.3333	40.3 Å²	40.3	56%	0.555	21%	0.21	S	C	*	.	S	Bend	trans	-77.3	-31.7	174.9	71.6	0	0	0	0	112.5	K2160 N2187	K2160-S2216 VanDerWaalsContact CE-O 3.27Å; K2160-S2216 WeakPolarHBondContact CE-O 3.28Å; N2187-S2216 WeakPolarHBondContact ND2-CB 3.17Å; N2187-S2216 PolarHBondContact ND2-OG 3.22Å; N2187-S2216 PolarHBondContact OD1-N 3.2Å; N2187-S2216 PolarHBondContact OD1-OG 2.97Å
2217	G	87.7	Confident	83.5	Confident	31.3333 Å²	31.3333	36.6 Å²	36.6	32%	0.323	20%	0.198	S	C	.	.	S	Bend	trans	-121.6	-157	178.9	0	0	0	0	0	113.2	K2160 S2215 A2219	K2160-G2217 WeakPolarHBondContact CA-O 3.45Å; S2215-G2217 PolarHBondContact OG-O 3.1Å; G2217-A2219 VanDerWaalsContact C-N 3.28Å; G2217-A2219 PolarHBondContact O-N 2.95Å
2218	N	91.6	Very high	84.5	Confident	60 Å²	60	31 Å²	31	32%	0.321	17%	0.174	S	C	.	.	S	Bend	trans	-83.3	5.5	-178.9	69	-25	0	0	0	114.6	L2153 S2154 S2157	L2153-N2218 CarbonylContact C-O 3.55Å; L2153-N2218 WeakPolarHBondContact CA-O 3.3Å; S2154-N2218 PolarHBondContact N-O 3.07Å; S2157-N2218 PolarHBondContact OG-ND2 3.11Å
2219	A	91.8	Very high	85.6	Confident	6.33333 Å²	6.33333	30.1 Å²	30.1	5%	0.052	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.1	-173.3	0	0	0	0	0	111.4	F2152 L2153 G2188 G2217	F2152-A2219 VanDerWaalsContact O-CA 3.32Å; F2152-A2219 WeakPolarHBondContact O-CA 3.41Å; L2153-A2219 HydrophobicContact CD2-CB 3.52Å; G2188-A2219 PolarHBondContact N-O 2.99Å; G2188-A2219 VanDerWaalsContact N-O 3.11Å; G2217-A2219 VanDerWaalsContact C-N 3.28Å; G2217-A2219 PolarHBondContact O-N 2.95Å
2220	L	92.9	Very high	86.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	119.5	178.6	179.6	65.3	0	0	0	109.2	F2152 L2161 F2163 F2185 I2197 V2222	F2152-L2220 PolarHBondContact N-O 3.18Å; F2152-L2220 PolarHBondContact O-N 3.07Å; L2161-L2220 HydrophobicContact CB-CB 4.16Å; L2161-L2220 HydrophobicContact CB-CD2 4.42Å; L2161-L2220 HydrophobicContact CD1-CB 4.04Å; F2163-L2220 HydrophobicContact CB-CD2 3.92Å; F2185-L2220 HydrophobicContact CB-CD1 4.43Å; F2185-L2220 HydrophobicContact CD1-CD1 4.49Å; I2197-L2220 HydrophobicContact CD1-CD1 3.86Å; L2220-V2222 HydrophobicContact CD2-CG2 4.41Å; L2220-V2222 HydrophobicContact CG-CG2 4.34Å
2221	T	91.9	Very high	87.3	Confident	0.666667 Å²	0.666667	31 Å²	31	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.8	173.2	-63.8	0	0	0	0	109.8	Y2149 K2150 T2151 F2185 F2186 G2188 M2191	Y2149-T2221 HydrophobicContact CD2-CG2 4.17Å; K2150-T2221 CarbonylContact O-C 3.57Å; K2150-T2221 WeakPolarHBondContact O-CA 3.42Å; T2151-T2221 WeakPolarHBondContact CG2-OG1 3.3Å; T2151-T2221 PolarHBondContact OG1-OG1 3.15Å; F2185-T2221 WeakPolarHBondContact CA-O 3.4Å; F2186-T2221 PolarHBondContact N-O 3.22Å; F2186-T2221 PolarHBondContact O-N 3.02Å; G2188-T2221 PolarHBondContact O-OG1 3Å; M2191-T2221 HydrophobicContact CE-CG2 3.82Å; M2191-T2221 HydrophobicContact CG-CG2 4.34Å
2222	V	92.8	Very high	87.7	Confident	1.33333 Å²	1.33333	26.1 Å²	26.1	1%	0.008	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.9	176.6	-174.6	0	0	0	0	108.3	M2122 Y2149 K2150 F2152 F2163 I2183 F2185 L2220 I2239	M2122-V2222 HydrophobicContact CE-CB 4.02Å; M2122-V2222 HydrophobicContact CE-CG1 3.67Å; M2122-V2222 HydrophobicContact SD-CB 4.44Å; M2122-V2222 HydrophobicContact SD-CG1 4.38Å; Y2149-V2222 CarbonylContact C-O 3.56Å; Y2149-V2222 VanDerWaalsContact CA-O 3.23Å; Y2149-V2222 WeakPolarHBondContact CA-O 3.22Å; Y2149-V2222 WeakPolarHBondContact CB-O 3.31Å; K2150-V2222 PolarHBondContact N-O 2.95Å; K2150-V2222 PolarHBondContact O-N 3.04Å; F2152-V2222 HydrophobicContact CD2-CG2 3.97Å; F2152-V2222 HydrophobicContact CE2-CB 4.18Å; F2152-V2222 HydrophobicContact CE2-CG2 3.78Å; F2163-V2222 HydrophobicContact CD2-CG2 4.19Å; F2163-V2222 HydrophobicContact CE2-CG1 4.38Å; F2163-V2222 HydrophobicContact CE2-CG2 4.37Å; I2183-V2222 HydrophobicContact CG2-CG1 3.71Å; F2185-V2222 HydrophobicContact CD1-CG1 4.31Å; F2185-V2222 HydrophobicContact CD1-CG2 3.98Å; F2185-V2222 HydrophobicContact CE1-CB 4.48Å; F2185-V2222 HydrophobicContact CE1-CG1 3.91Å; F2185-V2222 HydrophobicContact CE1-CG2 4.01Å; L2220-V2222 HydrophobicContact CD2-CG2 4.41Å; L2220-V2222 HydrophobicContact CG-CG2 4.34Å; V2222-I2239 HydrophobicContact CG2-CD1 4.5Å
2223	H	91.7	Very high	87.9	Confident	6 Å²	6	27.2 Å²	27.2	3%	0.028	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.4	178.1	176.1	-134	0	0	0	109.3	L1606 D2147 C2148 I2183 A2184 F2186 M2191	L1606-H2223 WeakPolarHBondContact CD2-NE2 3.28Å; D2147-H2223 IonicContact OD1-CD2 2.76Å; D2147-H2223 IonicContact OD1-CE1 3.09Å; D2147-H2223 IonicContact OD1-NE2 3.49Å; D2147-H2223 PolarHBondContact OD1-NE2 3.24Å; D2147-H2223 IonicContact OD2-NE2 3.63Å; C2148-H2223 PolarHBondContact O-CD2 2.92Å; I2183-H2223 CarbonylContact C-O 3.36Å; I2183-H2223 VanDerWaalsContact CA-O 3.31Å; I2183-H2223 WeakPolarHBondContact CA-O 3.35Å; A2184-H2223 HydrophobicContact CB-CB 4.31Å; A2184-H2223 PolarHBondContact N-O 3.02Å; A2184-H2223 PolarHBondContact O-N 3.01Å; F2186-H2223 HydrophobicContact CD2-CB 4.33Å; F2186-H2223 HydrophobicContact CE2-CB 3.86Å; M2191-H2223 HydrophobicContact CE-CB 4.27Å; M2191-H2223 HydrophobicContact SD-CB 4.19Å
2224	L	91.4	Very high	88	Confident	3.33333 Å²	3.33333	26.8 Å²	26.8	2%	0.017	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125	178.7	172.7	70.8	0	0	0	109.9	M2122 Y2139 C2148 I2183 L2235	M2122-L2224 HydrophobicContact CB-CD2 3.85Å; M2122-L2224 HydrophobicContact CE-CB 4.04Å; M2122-L2224 HydrophobicContact CG-CB 3.69Å; M2122-L2224 HydrophobicContact CG-CD2 4.06Å; M2122-L2224 HydrophobicContact CG-CG 4.34Å; Y2139-L2224 HydrophobicContact CD1-CD1 4.47Å; Y2139-L2224 HydrophobicContact CD1-CD2 3.62Å; Y2139-L2224 HydrophobicContact CD2-CD2 3.46Å; Y2139-L2224 VanDerWaalsContact CD2-CD2 3.46Å; Y2139-L2224 HydrophobicContact CE1-CD2 4.05Å; Y2139-L2224 HydrophobicContact CE2-CD2 3.91Å; Y2139-L2224 HydrophobicContact CG-CD2 3.28Å; C2148-L2224 PolarHBondContact N-O 3.08Å; C2148-L2224 PolarHBondContact O-N 2.88Å; C2148-L2224 VanDerWaalsContact O-O 3.08Å; I2183-L2224 HydrophobicContact CG1-CD1 3.89Å; L2224-L2235 HydrophobicContact CD1-CD2 4.2Å
2225	R	87.9	Confident	88.1	Confident	43 Å²	43	21 Å²	21	16%	0.162	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	123.6	168.3	-179.2	173.7	-69.4	167.4	-2.8	109.7	D2147 D2181 R2182	D2147-R2225 IonicContact OD1-NH2 2.79Å; D2147-R2225 IonicContact OD2-CZ 3.42Å; D2147-R2225 VanDerWaalsContact OD2-CZ 3.24Å; D2147-R2225 IonicContact OD2-NE 3.62Å; D2147-R2225 PolarHBondContact OD2-NE 3.05Å; D2147-R2225 IonicContact OD2-NH2 2.92Å; D2147-R2225 PolarHBondContact OD2-NH2 3.01Å; D2181-R2225 WeakPolarHBondContact CA-O 3.31Å; R2182-R2225 HydrophobicContact CG-CB 4.25Å; R2182-R2225 PolarHBondContact N-O 3.23Å; R2182-R2225 PolarHBondContact O-N 3.14Å
2226	A	87.7	Confident	88	Confident	1.33333 Å²	1.33333	20.9 Å²	20.9	1%	0.011	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.6	-177.2	0	0	0	0	0	110.7	Y2139 Y2141 P2145 V2146	Y2139-A2226 HydrophobicContact CD1-CB 4.49Å; Y2139-A2226 HydrophobicContact CE1-CB 3.55Å; Y2139-A2226 VanDerWaalsContact CE1-CB 3.48Å; Y2139-A2226 WeakPolarHBondContact OH-CB 3.4Å; Y2141-A2226 HydrophobicContact CD1-CB 4.09Å; Y2141-A2226 HydrophobicContact CE1-CB 3.5Å; Y2141-A2226 VanDerWaalsContact CE1-CB 3.45Å; P2145-A2226 CarbonylContact C-O 3.54Å; P2145-A2226 WeakPolarHBondContact CA-O 3.38Å; V2146-A2226 PolarHBondContact N-O 3.12Å; V2146-A2226 PolarHBondContact O-N 3.01Å
2227	N	83.9	Confident	88.1	Confident	28.6667 Å²	28.6667	17.1 Å²	17.1	15%	0.153	10%	0.1	C	C	.	.			trans	-80.9	172	169.9	-73.2	-49	0	0	0	111.2	Y2141 R2179 D2181 A2229	Y2141-N2227 WeakPolarHBondContact CD1-O 3.4Å; R2179-N2227 PolarHBondContact O-ND2 3.15Å; D2181-N2227 WeakPolarHBondContact OD1-CB 3.38Å; D2181-N2227 PolarHBondContact OD1-N 3.17Å; D2181-N2227 PolarHBondContact OD1-ND2 3.18Å; D2181-N2227 PolarHBondContact OD2-N 2.81Å; N2227-A2229 PolarHBondContact O-N 3.01Å
2228	A	81.7	Confident	88.1	Confident	9.66667 Å²	9.66667	16.3 Å²	16.3	8%	0.08	9%	0.088	C	C	.	.	S	Bend	trans	-66.6	124.1	174.6	0	0	0	0	0	111.1	Q1955 D2142 S2143	Q1955-A2228 HydrophobicContact CG-CB 4.12Å; D2142-A2228 WeakPolarHBondContact O-CA 3.34Å; S2143-A2228 WeakPolarHBondContact O-CB 3.47Å
2229	A	83.4	Confident	88.1	Confident	2.33333 Å²	2.33333	13.4 Å²	13.4	2%	0.019	7%	0.072	C	C	.	.			trans	-148.4	172.8	177.4	0	0	0	0	0	111	Y2141 D2142 Y2171 N2227 Y2233	Y2141-A2229 HydrophobicContact CD1-CB 3.71Å; Y2141-A2229 HydrophobicContact CE1-CB 4.5Å; Y2141-A2229 HydrophobicContact CG-CB 4.2Å; D2142-A2229 CarbonylContact C-O 3.5Å; D2142-A2229 WeakPolarHBondContact CA-O 3.46Å; D2142-A2229 PolarHBondContact O-N 2.96Å; D2142-A2229 VanDerWaalsContact O-N 3.16Å; Y2171-A2229 HydrophobicContact CD1-CB 4.2Å; Y2171-A2229 HydrophobicContact CD2-CB 3.66Å; Y2171-A2229 HydrophobicContact CE1-CB 4.33Å; Y2171-A2229 HydrophobicContact CE2-CB 4.04Å; Y2171-A2229 HydrophobicContact CG-CB 3.72Å; N2227-A2229 PolarHBondContact O-N 3.01Å; A2229-Y2233 HydrophobicContact CB-CD2 3.97Å
2230	D	85.3	Confident	87.9	Confident	50.3333 Å²	50.3333	13.5 Å²	13.5	27%	0.269	7%	0.073	S	C	.	.			trans	-71.4	154.3	176.5	-168.6	47.2	0	0	0	112	T1912 K1913 A2232 Y2233	T1912-D2230 HydrophobicContact CG2-CB 4.29Å; K1913-D2230 WeakPolarHBondContact CB-OD1 3.34Å; K1913-D2230 PolarHBondContact N-OD1 2.94Å; K1913-D2230 VanDerWaalsContact N-OD1 3.09Å; D2230-A2232 PolarHBondContact O-N 3.04Å; D2230-A2232 PolarHBondContact OD2-N 3.01Å; D2230-Y2233 HydrophobicContact CB-CD2 4.49Å; D2230-Y2233 WeakPolarHBondContact O-CD2 3.33Å; D2230-Y2233 PolarHBondContact O-N 3.02Å; D2230-Y2233 VanDerWaalsContact O-N 3.17Å
2231	G	81.8	Confident	87.8	Confident	9.66667 Å²	9.66667	13.5 Å²	13.5	10%	0.1	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	3.1	178.2	0	0	0	0	0	115.3	Y2114 K2140 Y2141 Y2233	Y2114-G2231 VanDerWaalsContact OH-CA 3.22Å; Y2114-G2231 WeakPolarHBondContact OH-CA 3.14Å; K2140-G2231 WeakPolarHBondContact CE-O 3.23Å; Y2141-G2231 WeakPolarHBondContact O-CA 3.2Å; G2231-Y2233 VanDerWaalsContact C-N 3.31Å
2232	A	81.9	Confident	87.5	Confident	30.3333 Å²	30.3333	15.4 Å²	15.4	25%	0.251	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-21.2	168.6	0	0	0	0	0	113.3	A2110 T2111 N2169 D2230	A2110-A2232 PolarHBondContact N-O 3.32Å; T2111-A2232 HydrophobicContact CG2-CB 4.25Å; T2111-A2232 WeakPolarHBondContact CG2-O 3.35Å; N2169-A2232 PolarHBondContact ND2-O 3.19Å; D2230-A2232 PolarHBondContact O-N 3.04Å; D2230-A2232 PolarHBondContact OD2-N 3.01Å
2233	Y	87.1	Confident	87.1	Confident	69.6667 Å²	69.6667	20.4 Å²	20.4	27%	0.273	12%	0.116	S	C	.	.			trans	-92.6	149.3	177.3	-60.3	-81.9	0	0	0	111.2	Y2141 N2169 Y2171 A2229 D2230 G2231	Y2141-Y2233 VanDerWaalsContact CD2-C 3.47Å; Y2141-Y2233 WeakPolarHBondContact CD2-O 3.39Å; Y2141-Y2233 PolarHBondContact N-O 2.87Å; Y2141-Y2233 VanDerWaalsContact N-O 3.12Å; N2169-Y2233 HydrophobicContact CB-CD1 4.41Å; N2169-Y2233 VanDerWaalsContact CG-CD1 3.48Å; N2169-Y2233 WeakPolarHBondContact ND2-CD1 3.44Å; N2169-Y2233 WeakPolarHBondContact O-CB 3.37Å; N2169-Y2233 WeakPolarHBondContact OD1-CD1 3.36Å; N2169-Y2233 WeakPolarHBondContact OD1-CE1 3.32Å; Y2171-Y2233 HydrophobicContact CD2-CD1 4.26Å; Y2171-Y2233 AromaticContact CD2-CD2 3.87Å; Y2171-Y2233 HydrophobicContact CD2-CD2 3.87Å; Y2171-Y2233 AromaticContact CD2-CE1 3.89Å; Y2171-Y2233 HydrophobicContact CD2-CE1 4.04Å; Y2171-Y2233 AromaticContact CD2-CE2 3.63Å; Y2171-Y2233 HydrophobicContact CD2-CE2 3.63Å; Y2171-Y2233 HydrophobicContact CD2-CG 4.19Å; Y2171-Y2233 AromaticContact CD2-CZ 3.72Å; Y2171-Y2233 AromaticContact CE2-CE2 3.99Å; Y2171-Y2233 HydrophobicContact CE2-CE2 4.07Å; Y2171-Y2233 AromaticContact CE2-CZ 3.97Å; A2229-Y2233 HydrophobicContact CB-CD2 3.97Å; D2230-Y2233 HydrophobicContact CB-CD2 4.49Å; D2230-Y2233 WeakPolarHBondContact O-CD2 3.33Å; D2230-Y2233 PolarHBondContact O-N 3.02Å; D2230-Y2233 VanDerWaalsContact O-N 3.17Å; G2231-Y2233 VanDerWaalsContact C-N 3.31Å
2234	G	88.7	Confident	86.4	Confident	0.666667 Å²	0.666667	22 Å²	22	1%	0.007	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.3	175.5	-175	0	0	0	0	0	113	A2110 Y2139 L2167 N2169	A2110-G2234 VanDerWaalsContact CB-C 3.48Å; A2110-G2234 VanDerWaalsContact CB-CA 3.48Å; A2110-G2234 WeakPolarHBondContact CB-O 3.43Å; Y2139-G2234 CarbonylContact O-C 3.56Å; Y2139-G2234 WeakPolarHBondContact O-CA 3.37Å; L2167-G2234 WeakPolarHBondContact CD2-O 3.39Å; N2169-G2234 CarbonylContact C-O 3.6Å; N2169-G2234 PolarHBondContact N-O 2.92Å; N2169-G2234 PolarHBondContact O-N 3.05Å; N2169-G2234 VanDerWaalsContact O-N 3.1Å
2235	L	90.1	Very high	85.7	Confident	4 Å²	4	23.5 Å²	23.5	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150.9	178.5	65.4	93.6	0	0	0	111.7	Y2138 Y2139 L2167 A2168 I2183 L2224 A2237	Y2138-L2235 VanDerWaalsContact CA-O 3.3Å; Y2138-L2235 WeakPolarHBondContact CA-O 3.3Å; Y2139-L2235 PolarHBondContact N-O 3.2Å; Y2139-L2235 PolarHBondContact O-N 3.1Å; L2167-L2235 CarbonylContact O-C 3.55Å; L2167-L2235 WeakPolarHBondContact O-CA 3.38Å; L2167-L2235 WeakPolarHBondContact O-CB 3.42Å; A2168-L2235 HydrophobicContact CB-CB 4.4Å; I2183-L2235 HydrophobicContact CD1-CD2 3.58Å; I2183-L2235 VanDerWaalsContact CD1-CD2 3.45Å; I2183-L2235 HydrophobicContact CG1-CD2 4.33Å; L2224-L2235 HydrophobicContact CD1-CD2 4.2Å; L2235-A2237 HydrophobicContact CD1-CB 4.43Å
2236	I	89.7	Confident	84.9	Confident	0.333333 Å²	0.333333	26.3 Å²	26.3	0%	0.002	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.6	164.8	-55.9	177.9	0	0	0	106.8	L2092 L2094 F2112 V2137 L2166 L2167	L2092-I2236 HydrophobicContact CD2-CD1 3.83Å; L2094-I2236 HydrophobicContact CD1-CD1 4.16Å; L2094-I2236 HydrophobicContact CD1-CG2 3.86Å; F2112-I2236 HydrophobicContact CD1-CD1 3.82Å; F2112-I2236 HydrophobicContact CD1-CG1 4.14Å; F2112-I2236 HydrophobicContact CE1-CD1 3.98Å; F2112-I2236 HydrophobicContact CE1-CG1 3.75Å; F2112-I2236 HydrophobicContact CG-CD1 4.21Å; F2112-I2236 HydrophobicContact CZ-CG1 4.07Å; V2137-I2236 CarbonylContact O-C 3.51Å; V2137-I2236 WeakPolarHBondContact O-CA 3.24Å; L2166-I2236 WeakPolarHBondContact CB-O 2.99Å; L2166-I2236 HydrophobicContact CD1-CG2 4.48Å; L2166-I2236 PolarHBondContact N-O 3.09Å; L2167-I2236 HydrophobicContact CB-CB 4.21Å; L2167-I2236 HydrophobicContact CB-CG1 4.42Å; L2167-I2236 HydrophobicContact CD1-CD1 4.21Å; L2167-I2236 HydrophobicContact CD1-CG1 4.48Å; L2167-I2236 PolarHBondContact N-O 2.99Å; L2167-I2236 PolarHBondContact O-N 3.14Å; L2167-I2236 VanDerWaalsContact O-O 3.11Å
2237	A	89.3	Confident	84.1	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.3	-178.9	0	0	0	0	0	110.4	L2136 V2137 F2163 K2164 L2165 L2235	L2136-A2237 CarbonylContact C-O 3.59Å; L2136-A2237 WeakPolarHBondContact CA-O 3.34Å; V2137-A2237 PolarHBondContact N-O 2.88Å; V2137-A2237 PolarHBondContact O-N 2.9Å; F2163-A2237 HydrophobicContact CD2-CB 4.29Å; F2163-A2237 HydrophobicContact CE1-CB 4Å; F2163-A2237 HydrophobicContact CE2-CB 3.46Å; F2163-A2237 VanDerWaalsContact CE2-CB 3.5Å; F2163-A2237 HydrophobicContact CZ-CB 3.29Å; K2164-A2237 CarbonylContact O-C 3.49Å; K2164-A2237 VanDerWaalsContact O-CA 3.28Å; K2164-A2237 WeakPolarHBondContact O-CA 3.25Å; K2164-A2237 WeakPolarHBondContact O-CB 3.33Å; L2165-A2237 HydrophobicContact CD2-CB 4.09Å; L2235-A2237 HydrophobicContact CD1-CB 4.43Å
2238	E	87.9	Confident	83.3	Confident	13.6667 Å²	13.6667	31.1 Å²	31.1	6%	0.064	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	142.2	170.8	94.6	-176.1	-150.8	0	0	110.3	M2096 R2134 L2136 F2163 K2164 L2166 V2240	M2096-E2238 HydrophobicContact CE-CB 3.62Å; M2096-E2238 HydrophobicContact CE-CG 4.34Å; M2096-E2238 WeakPolarHBondContact CE-OE2 3.41Å; M2096-E2238 VanDerWaalsContact CG-CD 3.49Å; M2096-E2238 WeakPolarHBondContact CG-OE2 3.32Å; M2096-E2238 HydrophobicContact SD-CB 3.97Å; M2096-E2238 HydrophobicContact SD-CG 4.16Å; R2134-E2238 IonicContact CZ-OE1 3.94Å; R2134-E2238 IonicContact NE-OE1 3.34Å; R2134-E2238 IonicContact NH1-OE1 3.64Å; L2136-E2238 HydrophobicContact CD2-CB 3.97Å; L2136-E2238 HydrophobicContact CD2-CG 4Å; F2163-E2238 CarbonylContact C-O 3.53Å; F2163-E2238 WeakPolarHBondContact CA-O 3.32Å; K2164-E2238 HydrophobicContact CB-CG 3.69Å; K2164-E2238 HydrophobicContact CD-CG 4.49Å; K2164-E2238 WeakPolarHBondContact CD-OE1 3.33Å; K2164-E2238 HydrophobicContact CG-CG 4.38Å; K2164-E2238 PolarHBondContact N-O 3.15Å; K2164-E2238 PolarHBondContact O-N 3.22Å; L2166-E2238 HydrophobicContact CD1-CB 4.26Å; L2166-E2238 HydrophobicContact CD1-CG 4.48Å; L2166-E2238 HydrophobicContact CD2-CG 4.21Å; L2166-E2238 WeakPolarHBondContact CD2-OE2 3.4Å; L2166-E2238 HydrophobicContact CG-CB 4.43Å; L2166-E2238 HydrophobicContact CG-CG 4.29Å; E2238-V2240 HydrophobicContact CB-CG1 4.43Å; E2238-V2240 HydrophobicContact CB-CG2 4.34Å; E2238-V2240 HydrophobicContact CG-CG1 4.41Å; E2238-V2240 HydrophobicContact CG-CG2 3.78Å; E2238-V2240 VanDerWaalsContact CG-CG2 3.45Å; E2238-V2240 VanDerWaalsContact OE1-CG2 3.24Å; E2238-V2240 WeakPolarHBondContact OE1-CG2 3.36Å
2239	I	90.4	Very high	82.9	Confident	0 Å²	0	32 Å²	32	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	116.3	170.1	-62	-178.8	0	0	0	107.5	V2131 R2134 V2135 V2137 F2152 L2161 E2162 F2163 V2222	V2131-I2239 HydrophobicContact CG2-CG2 4.49Å; R2134-I2239 CarbonylContact C-O 3.38Å; R2134-I2239 VanDerWaalsContact CA-O 3.26Å; R2134-I2239 WeakPolarHBondContact CA-O 3.32Å; V2135-I2239 PolarHBondContact N-O 3.11Å; V2135-I2239 PolarHBondContact O-N 3.16Å; V2137-I2239 HydrophobicContact CG2-CD1 3.75Å; V2137-I2239 HydrophobicContact CG2-CG1 4.2Å; F2152-I2239 HydrophobicContact CB-CD1 4.49Å; F2152-I2239 HydrophobicContact CB-CG2 4.42Å; F2152-I2239 HydrophobicContact CD1-CD1 3.65Å; F2152-I2239 HydrophobicContact CD2-CD1 3.38Å; F2152-I2239 VanDerWaalsContact CD2-CD1 3.41Å; F2152-I2239 HydrophobicContact CE1-CD1 3.56Å; F2152-I2239 HydrophobicContact CE2-CD1 3.29Å; F2152-I2239 HydrophobicContact CG-CD1 3.56Å; F2152-I2239 HydrophobicContact CG-CG2 4.42Å; F2152-I2239 HydrophobicContact CZ-CD1 3.39Å; F2152-I2239 VanDerWaalsContact CZ-CD1 3.48Å; L2161-I2239 HydrophobicContact CD2-CG2 4.28Å; E2162-I2239 CarbonylContact O-C 3.54Å; E2162-I2239 VanDerWaalsContact O-CA 3.29Å; E2162-I2239 WeakPolarHBondContact O-CA 3.34Å; F2163-I2239 HydrophobicContact CD2-CD1 3.96Å; F2163-I2239 HydrophobicContact CD2-CG1 3.7Å; F2163-I2239 HydrophobicContact CE2-CD1 4.39Å; F2163-I2239 HydrophobicContact CE2-CG1 4.43Å; V2222-I2239 HydrophobicContact CG2-CD1 4.5Å
2240	V	88.8	Confident	82.6	Confident	9 Å²	9	33 Å²	33	6%	0.055	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.4	-172.8	-139.7	0	0	0	0	110.9	M2096 K2133 R2134 L2161 E2162 E2238 A2244	M2096-V2240 HydrophobicContact SD-CG2 3.79Å; K2133-V2240 WeakPolarHBondContact O-CA 3.34Å; K2133-V2240 WeakPolarHBondContact O-CG1 3.48Å; R2134-V2240 HydrophobicContact CB-CG1 4.19Å; R2134-V2240 HydrophobicContact CB-CG2 4.06Å; L2161-V2240 WeakPolarHBondContact CA-O 3.3Å; E2162-V2240 HydrophobicContact CB-CG2 3.98Å; E2162-V2240 HydrophobicContact CG-CG2 4.48Å; E2162-V2240 PolarHBondContact N-O 3.14Å; E2162-V2240 PolarHBondContact O-N 3.05Å; E2238-V2240 HydrophobicContact CB-CG1 4.43Å; E2238-V2240 HydrophobicContact CB-CG2 4.34Å; E2238-V2240 HydrophobicContact CG-CG1 4.41Å; E2238-V2240 HydrophobicContact CG-CG2 3.78Å; E2238-V2240 VanDerWaalsContact CG-CG2 3.45Å; E2238-V2240 VanDerWaalsContact OE1-CG2 3.24Å; E2238-V2240 WeakPolarHBondContact OE1-CG2 3.36Å; V2240-A2244 HydrophobicContact CG1-CB 3.65Å; V2240-A2244 HydrophobicContact CG2-CB 4.27Å
2241	T	89.8	Confident	82.5	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	132.8	169.6	67.4	0	0	0	0	110.4	V2131 E2132 K2133 S2154 K2159 K2160 L2161 P2243 A2244	V2131-T2241 HydrophobicContact CG1-CG2 4.05Å; E2132-T2241 VanDerWaalsContact O-CG2 3.31Å; E2132-T2241 WeakPolarHBondContact O-CG2 3.3Å; E2132-T2241 PolarHBondContact O-OG1 3.13Å; K2133-T2241 PolarHBondContact O-N 2.93Å; K2133-T2241 PolarHBondContact O-OG1 3.18Å; S2154-T2241 WeakPolarHBondContact OG-CG2 3.43Å; K2159-T2241 HydrophobicContact CD-CG2 4.31Å; K2159-T2241 WeakPolarHBondContact CD-OG1 3.34Å; K2159-T2241 PolarHBondContact NZ-OG1 2.96Å; K2160-T2241 CarbonylContact O-C 3.43Å; K2160-T2241 WeakPolarHBondContact O-CA 3.24Å; L2161-T2241 HydrophobicContact CD2-CG2 3.96Å; T2241-P2243 CarbonylContact O-C 3.53Å; T2241-P2243 VanDerWaalsContact O-O 3.08Å; T2241-A2244 VanDerWaalsContact O-CA 3.27Å; T2241-A2244 WeakPolarHBondContact O-CA 3.3Å; T2241-A2244 PolarHBondContact O-N 3.1Å
2242	V	86.1	Confident	82.7	Confident	41 Å²	41	37.1 Å²	37.1	25%	0.248	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.1	179.2	-176.8	0	0	0	0	110	K2160 E2162	K2160-V2242 PolarHBondContact O-N 3.14Å; E2162-V2242 HydrophobicContact CB-CG2 3.57Å; E2162-V2242 HydrophobicContact CG-CG2 4.49Å; E2162-V2242 WeakPolarHBondContact OE2-CG2 3.26Å
2243	P	84.1	Confident	83.1	Confident	105 Å²	105	38 Å²	38	68%	0.682	22%	0.223	S	C	*	.	S	Bend	cis	-70.1	138.2	-1.3	29.4	-35	0	0	0	112.9	T2241	T2241-P2243 CarbonylContact O-C 3.53Å; T2241-P2243 VanDerWaalsContact O-O 3.08Å
2244	A	76.7	Confident	83.4	Confident	40 Å²	40	34.7 Å²	34.7	33%	0.331	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-65.1	124	-174.6	0	0	0	0	0	111.6	V2240 T2241	V2240-A2244 HydrophobicContact CG1-CB 3.65Å; V2240-A2244 HydrophobicContact CG2-CB 4.27Å; T2241-A2244 VanDerWaalsContact O-CA 3.27Å; T2241-A2244 WeakPolarHBondContact O-CA 3.3Å; T2241-A2244 PolarHBondContact O-N 3.1Å
2245	P	76.4	Confident	83.6	Confident	34 Å²	34	37.3 Å²	37.3	22%	0.221	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-69	143.9	172.5	28.3	-32.2	0	0	0	110	K2133 R2134	K2133-P2245 HydrophobicContact CB-CG 4Å; K2133-P2245 HydrophobicContact CG-CG 4.32Å; R2134-P2245 PolarHBondContact NH2-O 3.22Å
2246	P	71.8	Confident	83.8	Confident	102 Å²	102	37.3 Å²	37.3	66%	0.662	22%	0.222	S	C	*	.	P	Polyproline II helix	trans	-62.2	151.8	175.2	27.3	-34.4	0	0	0	111.2
2247	D	71.1	Confident	84	Confident	16.6667 Å²	16.6667	40 Å²	40	9%	0.089	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-65.8	127	174.4	-165.9	-40.6	0	0	0	109.8	H2071 R2134 A2249 P2250	H2071-D2247 IonicContact CE1-OD1 2.88Å; H2071-D2247 PolarHBondContact CE1-OD1 2.93Å; H2071-D2247 VanDerWaalsContact CE1-OD1 3.29Å; H2071-D2247 IonicContact CE1-OD2 3.16Å; H2071-D2247 IonicContact ND1-OD1 3.46Å; R2134-D2247 IonicContact CZ-OD2 2.96Å; R2134-D2247 IonicContact NH1-OD2 3.71Å; R2134-D2247 PolarHBondContact NH1-OD2 3.13Å; R2134-D2247 VanDerWaalsContact NH2-CA 3.28Å; R2134-D2247 VanDerWaalsContact NH2-N 3.11Å; D2247-A2249 VanDerWaalsContact C-N 3.28Å; D2247-A2249 PolarHBondContact O-N 2.8Å; D2247-A2249 VanDerWaalsContact OD1-C 3.28Å; D2247-A2249 PolarHBondContact OD1-N 3.18Å; D2247-P2250 HydrophobicContact CB-CB 4.44Å
2248	P	66.3	Low	84.2	Confident	114.333 Å²	114.333	43.3 Å²	43.3	74%	0.742	25%	0.249	S	C	*	.	S	Bend	trans	-64.2	-28	179.3	25.7	-35.5	0	0	0	113.9
2249	A	73.4	Confident	84.5	Confident	28.6667 Å²	28.6667	42.7 Å²	42.7	24%	0.237	25%	0.247	C	C	.	.	S	Bend	trans	-155	70.8	-173.1	0	0	0	0	0	112.8	H2071 A2072 D2247	H2071-A2249 WeakPolarHBondContact CA-O 3.48Å; H2071-A2249 HydrophobicContact CB-CB 4.37Å; H2071-A2249 PolarHBondContact ND1-O 3.21Å; A2072-A2249 HydrophobicContact CB-CB 4.48Å; A2072-A2249 PolarHBondContact N-O 2.94Å; D2247-A2249 VanDerWaalsContact C-N 3.28Å; D2247-A2249 PolarHBondContact O-N 2.8Å; D2247-A2249 VanDerWaalsContact OD1-C 3.28Å; D2247-A2249 PolarHBondContact OD1-N 3.18Å
2250	P	78.5	Confident	84.7	Confident	24.6667 Å²	24.6667	45.8 Å²	45.8	16%	0.16	26%	0.258	C	S	.	.			trans	-64.5	153.5	177.4	29.8	-37.6	0	0	0	111.8	H2097 D2247 K2252	H2097-P2250 WeakPolarHBondContact CE1-CB 3.29Å; H2097-P2250 WeakPolarHBondContact NE2-CB 3.45Å; H2097-P2250 WeakPolarHBondContact NE2-CG 3.43Å; D2247-P2250 HydrophobicContact CB-CB 4.44Å; P2250-K2252 PolarHBondContact O-N 2.61Å
2251	L	82.7	Confident	85	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	26%	0.256	C	S	.	.			trans	-67.4	117.3	175.1	-177.2	69.1	0	0	0	109.7	P2070 A2072 I2074 N2095 I2254 A2279	P2070-L2251 HydrophobicContact CB-CD1 4.31Å; P2070-L2251 HydrophobicContact CG-CB 4.46Å; P2070-L2251 HydrophobicContact CG-CD1 3.97Å; P2070-L2251 HydrophobicContact CG-CD2 3.84Å; P2070-L2251 HydrophobicContact CG-CG 4.28Å; A2072-L2251 WeakPolarHBondContact O-CA 3.45Å; A2072-L2251 WeakPolarHBondContact O-CD1 3.41Å; I2074-L2251 HydrophobicContact CD1-CD1 3.9Å; I2074-L2251 HydrophobicContact CD1-CD2 4.46Å; I2074-L2251 HydrophobicContact CG1-CD1 3.88Å; N2095-L2251 PolarHBondContact ND2-O 3.02Å; N2095-L2251 VanDerWaalsContact OD1-CB 3.3Å; N2095-L2251 WeakPolarHBondContact OD1-CB 3.24Å; N2095-L2251 PolarHBondContact OD1-N 2.95Å; N2095-L2251 VanDerWaalsContact OD1-N 3.16Å; L2251-I2254 HydrophobicContact CD1-CG1 4.29Å; L2251-I2254 HydrophobicContact CD2-CD1 3.95Å; L2251-I2254 HydrophobicContact CD2-CG1 4.13Å; L2251-I2254 HydrophobicContact CG-CG1 4.46Å; L2251-A2279 HydrophobicContact CB-CB 4.38Å; L2251-A2279 HydrophobicContact CD2-CB 3.8Å; L2251-A2279 HydrophobicContact CG-CB 3.66Å
2252	K	85.2	Confident	85.2	Confident	142 Å²	142	45.9 Å²	45.9	62%	0.617	26%	0.258	S	S	*	.			trans	-99.1	-47.9	-177.7	-68.9	-177.9	-178.9	178.5	0	113.5	A2072 P2250 A2279 V2280	A2072-K2252 PolarHBondContact O-N 3Å; P2250-K2252 PolarHBondContact O-N 2.61Å; K2252-A2279 VanDerWaalsContact C-CB 3.4Å; K2252-A2279 CarbonylContact O-C 3.41Å; K2252-A2279 WeakPolarHBondContact O-CA 3.19Å; K2252-A2279 VanDerWaalsContact O-CB 3.25Å; K2252-A2279 WeakPolarHBondContact O-CB 3.03Å; K2252-V2280 PolarHBondContact O-N 2.97Å
2253	N	90.9	Very high	85.5	Confident	48 Å²	48	48.7 Å²	48.7	26%	0.257	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.1	-173.7	-56.5	-40.1	0	0	0	111.2	E2073 I2074 F2255 V2280	E2073-N2253 HydrophobicContact CG-CB 4.18Å; E2073-N2253 PolarHBondContact OE2-ND2 3.35Å; E2073-N2253 VanDerWaalsContact OE2-ND2 3.16Å; I2074-N2253 PolarHBondContact N-O 2.97Å; I2074-N2253 VanDerWaalsContact N-O 3.13Å; N2253-F2255 HydrophobicContact CB-CD2 3.98Å; N2253-F2255 HydrophobicContact CB-CE2 3.33Å; N2253-F2255 HydrophobicContact CB-CZ 3.68Å; N2253-V2280 CarbonylContact C-O 3.47Å; N2253-V2280 WeakPolarHBondContact CA-O 3.21Å
2254	I	93.4	Very high	86	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	113.7	170.1	-59	171	0	0	0	107.4	I2074 L2091 L2251 I2256 Y2271 A2279 V2280 V2281 D2282	I2074-I2254 HydrophobicContact CB-CG1 4.5Å; I2074-I2254 HydrophobicContact CB-CG2 4.47Å; I2074-I2254 HydrophobicContact CD1-CG1 4.34Å; I2074-I2254 HydrophobicContact CG2-CG2 4.47Å; L2091-I2254 HydrophobicContact CD1-CD1 4.33Å; L2091-I2254 HydrophobicContact CD1-CG2 3.9Å; L2251-I2254 HydrophobicContact CD1-CG1 4.29Å; L2251-I2254 HydrophobicContact CD2-CD1 3.95Å; L2251-I2254 HydrophobicContact CD2-CG1 4.13Å; L2251-I2254 HydrophobicContact CG-CG1 4.46Å; I2254-I2256 HydrophobicContact CG2-CG1 4.33Å; I2254-Y2271 HydrophobicContact CD1-CD2 4.17Å; I2254-Y2271 HydrophobicContact CD1-CE1 4.32Å; I2254-Y2271 HydrophobicContact CD1-CE2 3.55Å; I2254-A2279 HydrophobicContact CD1-CB 4.24Å; I2254-A2279 HydrophobicContact CG1-CB 4.11Å; I2254-V2280 PolarHBondContact N-O 3.08Å; I2254-V2281 HydrophobicContact CB-CG2 4.43Å; I2254-V2281 HydrophobicContact CD1-CG2 4.15Å; I2254-D2282 PolarHBondContact O-N 2.79Å
2255	F	93.8	Very high	86.6	Confident	55.3333 Å²	55.3333	42.9 Å²	42.9	24%	0.243	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121	178.7	-64.4	-68.1	0	0	0	110.3	E2073 I2074 V2075 L2076 N2253 H2257 D2282	E2073-F2255 HydrophobicContact CG-CD2 4.17Å; E2073-F2255 HydrophobicContact CG-CE2 4.34Å; E2073-F2255 WeakPolarHBondContact OE1-CD2 3.22Å; E2073-F2255 WeakPolarHBondContact OE1-CE2 3.21Å; I2074-F2255 PolarHBondContact O-N 3.06Å; V2075-F2255 HydrophobicContact CG2-CD2 4.37Å; L2076-F2255 PolarHBondContact N-O 2.93Å; N2253-F2255 HydrophobicContact CB-CD2 3.98Å; N2253-F2255 HydrophobicContact CB-CE2 3.33Å; N2253-F2255 HydrophobicContact CB-CZ 3.68Å; F2255-H2257 AromaticContact CD1-NE2 3.72Å; F2255-H2257 AromaticContact CG-NE2 3.96Å; F2255-D2282 HydrophobicContact CD1-CB 3.83Å; F2255-D2282 HydrophobicContact CE1-CB 4.07Å
2256	I	94.4	Very high	87.3	Confident	3.66667 Å²	3.66667	43.6 Å²	43.6	2%	0.019	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	110.6	172.5	-49.4	-177.1	0	0	0	108	L2076 L2089 I2254 F2261 V2269 D2282 I2283 D2284	L2076-I2256 HydrophobicContact CB-CG2 4.47Å; L2076-I2256 HydrophobicContact CD1-CD1 4.49Å; L2076-I2256 HydrophobicContact CD1-CG1 4.29Å; L2089-I2256 HydrophobicContact CD2-CD1 3.66Å; I2254-I2256 HydrophobicContact CG2-CG1 4.33Å; I2256-F2261 HydrophobicContact CG2-CE2 4.44Å; I2256-V2269 HydrophobicContact CD1-CG1 4.44Å; I2256-D2282 PolarHBondContact N-O 3.17Å; I2256-I2283 HydrophobicContact CB-CG1 4.31Å; I2256-I2283 HydrophobicContact CB-CG2 4.44Å; I2256-I2283 HydrophobicContact CD1-CD1 4.42Å; I2256-I2283 HydrophobicContact CD1-CG1 4.24Å; I2256-I2283 HydrophobicContact CG1-CG1 4.43Å; I2256-I2283 WeakPolarHBondContact O-CA 3.41Å; I2256-D2284 PolarHBondContact O-N 3.35Å
2257	H	93.8	Very high	88.2	Confident	56 Å²	56	38.8 Å²	38.8	26%	0.259	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.3	-175.4	-92.2	-25	0	0	0	111.4	L2076 K2078 F2255 G2259 D2284	L2076-H2257 PolarHBondContact O-N 3.14Å; K2078-H2257 PolarHBondContact N-O 3Å; F2255-H2257 AromaticContact CD1-NE2 3.72Å; F2255-H2257 AromaticContact CG-NE2 3.96Å; H2257-G2259 VanDerWaalsContact C-N 3.32Å; H2257-G2259 PolarHBondContact O-N 3.23Å; H2257-D2284 WeakPolarHBondContact CA-O 3.37Å; H2257-D2284 IonicContact CE1-OD2 3.62Å; H2257-D2284 IonicContact ND1-OD2 3.27Å
2258	E	92.9	Very high	89.3	Confident	69.6667 Å²	69.6667	38 Å²	38	33%	0.326	19%	0.186	S	C	.	.	S	Bend	trans	56.3	37.8	175.7	-62.2	-179	-154.6	0	0	113.1	K2078 D2284 L2285 V2710	K2078-E2258 WeakPolarHBondContact CA-O 3.3Å; K2078-E2258 VanDerWaalsContact CE-CD 3.42Å; K2078-E2258 WeakPolarHBondContact CE-OE2 3.35Å; K2078-E2258 HydrophobicContact CG-CB 3.86Å; K2078-E2258 WeakPolarHBondContact CG-OE2 3.49Å; K2078-E2258 IonicContact NZ-OE2 3.21Å; E2258-D2284 PolarHBondContact N-O 3.28Å; E2258-D2284 VanDerWaalsContact N-O 3.09Å; E2258-L2285 VanDerWaalsContact CA-O 3.27Å; E2258-L2285 WeakPolarHBondContact CA-O 3.09Å; E2258-L2285 HydrophobicContact CG-CB 3.94Å; E2258-L2285 HydrophobicContact CG-CD1 4.11Å; E2258-V2710 HydrophobicContact CB-CG2 3.89Å; E2258-V2710 HydrophobicContact CG-CG2 4.31Å
2259	G	93.8	Very high	90.7	Very high	0.666667 Å²	0.666667	32.8 Å²	32.8	1%	0.007	15%	0.151	C	C	.	.			trans	-84.1	134.3	-178.9	0	0	0	0	0	113.3	M2079 H2257 C2286 S2287	M2079-G2259 CarbonylContact O-C 3.56Å; M2079-G2259 WeakPolarHBondContact O-CA 3.19Å; H2257-G2259 VanDerWaalsContact C-N 3.32Å; H2257-G2259 PolarHBondContact O-N 3.23Å; G2259-C2286 PolarHBondContact N-SG 3.05Å; G2259-C2286 VanDerWaalsContact N-SG 3.42Å; G2259-C2286 CarbonylContact O-C 3.56Å; G2259-C2286 VanDerWaalsContact O-CA 3.26Å; G2259-C2286 WeakPolarHBondContact O-CA 3.27Å; G2259-S2287 PolarHBondContact O-N 2.98Å
2260	R	94.8	Very high	91.7	Very high	65.6667 Å²	65.6667	33.6 Å²	33.6	25%	0.248	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.6	174	-178.1	173.8	-179.9	-165	-10.3	109.9	M2079 N2080 I2081 E2262 D2708	M2079-R2260 PolarHBondContact O-N 2.78Å; N2080-R2260 WeakPolarHBondContact OD1-CD 3.4Å; I2081-R2260 PolarHBondContact N-O 2.83Å; R2260-E2262 HydrophobicContact CG-CG 3.94Å; R2260-E2262 IonicContact CZ-OE1 3.38Å; R2260-E2262 IonicContact CZ-OE2 2.82Å; R2260-E2262 IonicContact NE-OE1 2.94Å; R2260-E2262 PolarHBondContact NE-OE1 2.98Å; R2260-E2262 IonicContact NE-OE2 3.71Å; R2260-E2262 PolarHBondContact NE-OE2 3.11Å; R2260-E2262 VanDerWaalsContact NH2-CD 3.28Å; R2260-E2262 IonicContact NH2-OE1 3.53Å; R2260-E2262 PolarHBondContact NH2-OE1 3.2Å; R2260-E2262 IonicContact NH2-OE2 3.42Å; R2260-E2262 PolarHBondContact NH2-OE2 3.27Å; R2260-D2708 IonicContact CZ-OD1 3.81Å; R2260-D2708 PolarHBondContact NH1-O 2.86Å; R2260-D2708 IonicContact NH1-OD1 2.68Å; R2260-D2708 PolarHBondContact NH1-OD1 3.02Å; R2260-D2708 IonicContact NH2-OD1 3.1Å
2261	F	95.7	Very high	92.4	Very high	0.666667 Å²	0.666667	32.6 Å²	32.6	0%	0.003	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	104.6	-178.8	-63.4	-96.2	0	0	0	109.5	I2081 L2089 I2256 A2268 V2269 S2287 F2288 N2289 N2291	I2081-F2261 HydrophobicContact CB-CD1 3.99Å; I2081-F2261 HydrophobicContact CB-CE1 4.25Å; I2081-F2261 HydrophobicContact CD1-CD1 4.29Å; I2081-F2261 HydrophobicContact CD1-CE1 3.67Å; I2081-F2261 HydrophobicContact CD1-CZ 4.32Å; I2081-F2261 HydrophobicContact CG1-CE1 4.41Å; I2081-F2261 HydrophobicContact CG2-CD1 4.31Å; I2081-F2261 WeakPolarHBondContact O-CA 3.14Å; L2089-F2261 HydrophobicContact CB-CE1 3.83Å; L2089-F2261 HydrophobicContact CB-CZ 4.35Å; L2089-F2261 HydrophobicContact CD2-CZ 4.47Å; I2256-F2261 HydrophobicContact CG2-CE2 4.44Å; F2261-A2268 HydrophobicContact CB-CB 3.68Å; F2261-A2268 HydrophobicContact CD1-CB 4.16Å; F2261-A2268 HydrophobicContact CG-CB 4.05Å; F2261-V2269 HydrophobicContact CD1-CG2 4.22Å; F2261-V2269 HydrophobicContact CE1-CG2 3.76Å; F2261-V2269 HydrophobicContact CE2-CG2 4.14Å; F2261-V2269 HydrophobicContact CZ-CG2 3.72Å; F2261-S2287 PolarHBondContact N-O 3.05Å; F2261-F2288 HydrophobicContact CB-CD1 3.78Å; F2261-F2288 HydrophobicContact CB-CE1 4.25Å; F2261-F2288 AromaticContact CD2-CD1 3.72Å; F2261-F2288 HydrophobicContact CD2-CD1 3.72Å; F2261-F2288 AromaticContact CD2-CE1 3.33Å; F2261-F2288 HydrophobicContact CD2-CE1 3.33Å; F2261-F2288 HydrophobicContact CD2-CZ 4.25Å; F2261-F2288 AromaticContact CE2-CE1 3.75Å; F2261-F2288 HydrophobicContact CE2-CE1 3.75Å; F2261-F2288 HydrophobicContact CE2-CZ 4.4Å; F2261-F2288 AromaticContact CG-CD1 3.93Å; F2261-F2288 HydrophobicContact CG-CD1 3.93Å; F2261-F2288 AromaticContact CG-CE1 3.87Å; F2261-F2288 HydrophobicContact CG-CE1 3.87Å; F2261-F2288 WeakPolarHBondContact O-CA 3.21Å; F2261-N2289 PolarHBondContact O-N 3.01Å; F2261-N2291 PolarHBondContact O-ND2 3.16Å; F2261-N2291 PolarHBondContact O-OD1 3.3Å
2262	E	93.5	Very high	92.7	Very high	10 Å²	10	32.6 Å²	32.6	5%	0.047	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.2	-175.9	-54	-169.8	164.5	0	0	113.4	I2081 T2082 D2083 R2260 N2264 N2289	I2081-E2262 PolarHBondContact O-N 3.23Å; I2081-E2262 VanDerWaalsContact O-N 3.12Å; T2082-E2262 VanDerWaalsContact CA-O 3.24Å; T2082-E2262 WeakPolarHBondContact CA-O 3.41Å; T2082-E2262 HydrophobicContact CG2-CB 3.99Å; T2082-E2262 HydrophobicContact CG2-CG 4.27Å; D2083-E2262 PolarHBondContact N-O 2.95Å; D2083-E2262 VanDerWaalsContact N-O 3.09Å; R2260-E2262 HydrophobicContact CG-CG 3.94Å; R2260-E2262 IonicContact CZ-OE1 3.38Å; R2260-E2262 IonicContact CZ-OE2 2.82Å; R2260-E2262 IonicContact NE-OE1 2.94Å; R2260-E2262 PolarHBondContact NE-OE1 2.98Å; R2260-E2262 IonicContact NE-OE2 3.71Å; R2260-E2262 PolarHBondContact NE-OE2 3.11Å; R2260-E2262 VanDerWaalsContact NH2-CD 3.28Å; R2260-E2262 IonicContact NH2-OE1 3.53Å; R2260-E2262 PolarHBondContact NH2-OE1 3.2Å; R2260-E2262 IonicContact NH2-OE2 3.42Å; R2260-E2262 PolarHBondContact NH2-OE2 3.27Å; E2262-N2264 VanDerWaalsContact C-N 3.29Å; E2262-N2264 PolarHBondContact N-ND2 3.29Å; E2262-N2264 PolarHBondContact O-N 3.01Å; E2262-N2264 VanDerWaalsContact O-N 3.15Å; E2262-N2264 PolarHBondContact O-ND2 2.8Å; E2262-N2289 VanDerWaalsContact CA-O 3.23Å; E2262-N2289 WeakPolarHBondContact CA-O 3.35Å; E2262-N2289 HydrophobicContact CG-CB 4.14Å; E2262-N2289 PolarHBondContact OE1-ND2 2.97Å
2263	R	92.8	Very high	92.8	Very high	101 Å²	101	25.9 Å²	25.9	38%	0.381	11%	0.112	S	C	.	.	S	Bend	trans	54.2	40.4	171.6	-59.7	-176.8	-62.2	-80.5	-6.3	113.2	D2083 N2289 Y2290	D2083-R2263 VanDerWaalsContact CA-O 3.3Å; D2083-R2263 WeakPolarHBondContact CA-O 3.35Å; D2083-R2263 PolarHBondContact N-O 2.83Å; D2083-R2263 WeakPolarHBondContact OD1-CB 3.26Å; D2083-R2263 WeakPolarHBondContact OD1-CD 3.34Å; D2083-R2263 IonicContact OD1-CZ 3.13Å; D2083-R2263 IonicContact OD1-NE 3.33Å; D2083-R2263 PolarHBondContact OD1-NE 3.14Å; D2083-R2263 IonicContact OD1-NH2 3.48Å; D2083-R2263 PolarHBondContact OD1-NH2 3.06Å; D2083-R2263 IonicContact OD2-CZ 3.15Å; D2083-R2263 IonicContact OD2-NE 3.61Å; D2083-R2263 PolarHBondContact OD2-NE 2.8Å; D2083-R2263 IonicContact OD2-NH2 3.24Å; D2083-R2263 PolarHBondContact OD2-NH2 3.08Å; R2263-N2289 PolarHBondContact N-O 3.12Å; R2263-N2289 VanDerWaalsContact N-O 3.16Å; R2263-Y2290 VanDerWaalsContact CA-O 3.3Å; R2263-Y2290 WeakPolarHBondContact CA-O 3.34Å; R2263-Y2290 HydrophobicContact CG-CG 4.47Å
2264	N	93.3	Very high	92.4	Very high	0.333333 Å²	0.333333	23.8 Å²	23.8	0%	0.002	10%	0.102	C	C	.	.			trans	-91.1	120.9	171.5	-58.9	-77.4	0	0	0	109.8	I2081 N2084 E2262 R2266 G2267 N2291 G2292	I2081-N2264 PolarHBondContact O-ND2 2.95Å; N2084-N2264 WeakPolarHBondContact CB-OD1 3.38Å; N2084-N2264 PolarHBondContact ND2-OD1 2.98Å; N2084-N2264 WeakPolarHBondContact O-CA 3.25Å; E2262-N2264 VanDerWaalsContact C-N 3.29Å; E2262-N2264 PolarHBondContact N-ND2 3.29Å; E2262-N2264 PolarHBondContact O-N 3.01Å; E2262-N2264 VanDerWaalsContact O-N 3.15Å; E2262-N2264 PolarHBondContact O-ND2 2.8Å; N2264-R2266 VanDerWaalsContact C-N 3.33Å; N2264-R2266 PolarHBondContact O-N 3.29Å; N2264-G2267 VanDerWaalsContact CB-O 3.27Å; N2264-G2267 WeakPolarHBondContact CB-O 3.3Å; N2264-G2267 PolarHBondContact O-N 2.96Å; N2264-N2291 WeakPolarHBondContact CB-OD1 3.3Å; N2264-N2291 PolarHBondContact N-OD1 3.11Å; N2264-N2291 VanDerWaalsContact N-OD1 3.12Å; N2264-N2291 PolarHBondContact ND2-OD1 3.11Å; N2264-N2291 WeakPolarHBondContact O-CA 3.38Å; N2264-G2292 PolarHBondContact O-N 2.85Å
2265	D	90.8	Very high	91.5	Very high	22.6667 Å²	22.6667	24 Å²	24	12%	0.121	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-37.9	-169.5	-84.1	10.7	0	0	0	113.4	N1929 N2084 L2085 G2086 G2292 Y2293 T2301	N1929-D2265 PolarHBondContact ND2-OD2 3.22Å; N1929-D2265 VanDerWaalsContact ND2-OD2 3.1Å; N2084-D2265 PolarHBondContact O-N 3.25Å; L2085-D2265 WeakPolarHBondContact CA-OD2 3.41Å; L2085-D2265 WeakPolarHBondContact CD2-OD2 3.41Å; L2085-D2265 VanDerWaalsContact O-CB 3.24Å; L2085-D2265 WeakPolarHBondContact O-CB 3.34Å; G2086-D2265 PolarHBondContact O-N 3.45Å; D2265-G2292 WeakPolarHBondContact O-CA 3.39Å; D2265-Y2293 HydrophobicContact CB-CD2 4.46Å; D2265-Y2293 HydrophobicContact CB-CE1 4.11Å; D2265-Y2293 HydrophobicContact CB-CE2 3.96Å; D2265-Y2293 WeakPolarHBondContact OD1-CE1 3.34Å; D2265-Y2293 WeakPolarHBondContact OD1-CE2 3.42Å; D2265-Y2293 PolarHBondContact OD1-OH 3Å; D2265-Y2293 PolarHBondContact OD2-OH 2.95Å; D2265-T2301 WeakPolarHBondContact O-CB 3.37Å; D2265-T2301 PolarHBondContact O-OG1 3.18Å
2266	R	89.9	Confident	90.6	Very high	47.6667 Å²	47.6667	22.5 Å²	22.5	18%	0.18	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	12	-174	-58.2	-178.4	175.8	115.8	-3.7	113.8	N1929 V1930 M2062 L2085 G2086 V2087 N2264 S2302	N1929-R2266 PolarHBondContact OD1-NH1 3.11Å; N1929-R2266 PolarHBondContact OD1-NH2 3.05Å; V1930-R2266 PolarHBondContact O-NH2 3.26Å; M2062-R2266 PolarHBondContact SD-NH1 3.19Å; M2062-R2266 VanDerWaalsContact SD-NH1 3.45Å; L2085-R2266 PolarHBondContact O-NE 2.76Å; L2085-R2266 PolarHBondContact O-NH1 2.99Å; G2086-R2266 PolarHBondContact O-N 3.28Å; V2087-R2266 HydrophobicContact CG2-CB 3.94Å; V2087-R2266 WeakPolarHBondContact CG2-O 3.1Å; N2264-R2266 VanDerWaalsContact C-N 3.33Å; N2264-R2266 PolarHBondContact O-N 3.29Å; R2266-S2302 VanDerWaalsContact O-CB 3.28Å; R2266-S2302 WeakPolarHBondContact O-CB 3.42Å; R2266-S2302 PolarHBondContact O-OG 2.85Å
2267	G	91.8	Very high	89.8	Confident	2.33333 Å²	2.33333	25.7 Å²	25.7	2%	0.024	12%	0.118	C	C	.	.			trans	115.8	169.3	-179.8	0	0	0	0	0	113.2	V2087 G2088 N2264	V2087-G2267 VanDerWaalsContact CA-O 3.29Å; V2087-G2267 WeakPolarHBondContact CA-O 3.41Å; G2088-G2267 PolarHBondContact N-O 2.84Å; N2264-G2267 VanDerWaalsContact CB-O 3.27Å; N2264-G2267 WeakPolarHBondContact CB-O 3.3Å; N2264-G2267 PolarHBondContact O-N 2.96Å
2268	A	94.6	Very high	89.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	-89	-59.7	-176.3	0	0	0	0	0	112.8	G2088 L2089 F2261 F2288 N2291 A2305	G2088-A2268 CarbonylContact C-O 3.57Å; G2088-A2268 VanDerWaalsContact CA-O 3.3Å; G2088-A2268 WeakPolarHBondContact CA-O 3.36Å; G2088-A2268 PolarHBondContact N-O 3.28Å; L2089-A2268 PolarHBondContact N-O 3.18Å; F2261-A2268 HydrophobicContact CB-CB 3.68Å; F2261-A2268 HydrophobicContact CD1-CB 4.16Å; F2261-A2268 HydrophobicContact CG-CB 4.05Å; A2268-F2288 HydrophobicContact CB-CD1 3.5Å; A2268-F2288 VanDerWaalsContact CB-CD1 3.48Å; A2268-F2288 HydrophobicContact CB-CE1 4.08Å; A2268-F2288 HydrophobicContact CB-CG 4.46Å; A2268-N2291 HydrophobicContact CB-CB 4.36Å; A2268-A2305 WeakPolarHBondContact CA-O 3.29Å; A2268-A2305 WeakPolarHBondContact CB-O 3.4Å; A2268-A2305 PolarHBondContact N-O 3.01Å
2269	V	95.2	Very high	89.2	Confident	4 Å²	4	20.1 Å²	20.1	2%	0.024	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.2	-174.6	-177.6	0	0	0	0	110.6	L2089 I2256 F2261 F2288 A2305 V2306 R2307	L2089-V2269 HydrophobicContact CB-CG2 4.31Å; L2089-V2269 HydrophobicContact CD2-CG1 4.24Å; L2089-V2269 CarbonylContact O-C 3.57Å; L2089-V2269 VanDerWaalsContact O-CA 3.31Å; L2089-V2269 WeakPolarHBondContact O-CA 3.36Å; I2256-V2269 HydrophobicContact CD1-CG1 4.44Å; F2261-V2269 HydrophobicContact CD1-CG2 4.22Å; F2261-V2269 HydrophobicContact CE1-CG2 3.76Å; F2261-V2269 HydrophobicContact CE2-CG2 4.14Å; F2261-V2269 HydrophobicContact CZ-CG2 3.72Å; V2269-F2288 HydrophobicContact CG2-CE1 3.7Å; V2269-F2288 HydrophobicContact CG2-CZ 4.34Å; V2269-A2305 PolarHBondContact N-O 3.04Å; V2269-A2305 VanDerWaalsContact N-O 3.07Å; V2269-V2306 HydrophobicContact CB-CG1 4.23Å; V2269-V2306 HydrophobicContact CB-CG2 4.12Å; V2269-V2306 HydrophobicContact CG2-CG2 4.43Å; V2269-V2306 CarbonylContact O-C 3.55Å; V2269-V2306 VanDerWaalsContact O-CA 3.31Å; V2269-V2306 WeakPolarHBondContact O-CA 3.33Å; V2269-R2307 PolarHBondContact O-N 3.04Å
2270	R	93.7	Very high	89.1	Confident	46.6667 Å²	46.6667	22.1 Å²	22.1	18%	0.176	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.4	171.8	-177.1	173	177.1	149.3	3.6	110.5	V2087 L2089 R2090 L2091 H2109 D2272 R2307	V2087-R2270 HydrophobicContact CG1-CB 4.13Å; L2089-R2270 PolarHBondContact O-N 3.08Å; R2090-R2270 CarbonylContact C-O 3.59Å; R2090-R2270 VanDerWaalsContact CA-O 3.31Å; R2090-R2270 WeakPolarHBondContact CA-O 3.29Å; R2090-R2270 HydrophobicContact CG-CB 4.35Å; L2091-R2270 PolarHBondContact N-O 3.04Å; H2109-R2270 PolarHBondContact O-NH2 3.16Å; R2270-D2272 IonicContact CZ-OD2 3.47Å; R2270-D2272 IonicContact NE-OD1 2.67Å; R2270-D2272 IonicContact NE-OD2 3.6Å; R2270-D2272 PolarHBondContact NE-OD2 3.13Å; R2270-D2272 IonicContact NH2-OD1 3.35Å; R2270-D2272 IonicContact NH2-OD2 2.73Å; R2270-D2272 PolarHBondContact NH2-OD2 3.25Å; R2270-D2272 VanDerWaalsContact NH2-OD2 3.15Å; R2270-R2307 CarbonylContact C-O 3.27Å; R2270-R2307 VanDerWaalsContact CA-O 3.3Å; R2270-R2307 WeakPolarHBondContact CA-O 3.26Å
2271	Y	93.1	Very high	89	Confident	3.33333 Å²	3.33333	19.2 Å²	19.2	1%	0.013	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.6	172.5	176.3	-129.4	0	0	0	109.5	L2091 I2254 C2273 V2281 R2307 L2308 S2309 M2310	L2091-Y2271 HydrophobicContact CB-CD2 3.65Å; L2091-Y2271 HydrophobicContact CB-CE2 4.43Å; L2091-Y2271 HydrophobicContact CB-CG 4.46Å; L2091-Y2271 HydrophobicContact CD1-CD2 4.47Å; L2091-Y2271 WeakPolarHBondContact O-CA 3.33Å; I2254-Y2271 HydrophobicContact CD1-CD2 4.17Å; I2254-Y2271 HydrophobicContact CD1-CE1 4.32Å; I2254-Y2271 HydrophobicContact CD1-CE2 3.55Å; Y2271-C2273 HydrophobicContact CE1-CB 4.1Å; Y2271-C2273 HydrophobicContact CE2-CB 3.88Å; Y2271-C2273 VanDerWaalsContact CZ-CB 3.46Å; Y2271-C2273 VanDerWaalsContact OH-CB 3.27Å; Y2271-C2273 WeakPolarHBondContact OH-CB 3.26Å; Y2271-V2281 HydrophobicContact CD1-CG2 4.08Å; Y2271-V2281 HydrophobicContact CE1-CG2 3.67Å; Y2271-R2307 PolarHBondContact N-O 3.21Å; Y2271-L2308 CarbonylContact O-C 3.55Å; Y2271-L2308 WeakPolarHBondContact O-CA 3.27Å; Y2271-S2309 PolarHBondContact O-N 3.26Å; Y2271-M2310 HydrophobicContact CD1-CE 4.15Å; Y2271-M2310 HydrophobicContact CD1-CG 4.18Å; Y2271-M2310 HydrophobicContact CE1-CE 4.33Å; Y2271-M2310 HydrophobicContact CE1-CG 4.16Å
2272	D	90	Very high	89	Confident	4.66667 Å²	4.66667	20.5 Å²	20.5	3%	0.025	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.7	171.6	-62.5	-57.1	0	0	0	107.5	L2091 L2092 G2093 L2107 A2110 R2270 S2309	L2091-D2272 PolarHBondContact O-N 3.33Å; L2092-D2272 CarbonylContact C-O 3.58Å; L2092-D2272 WeakPolarHBondContact CA-O 3.4Å; L2092-D2272 HydrophobicContact CD1-CB 4.16Å; G2093-D2272 PolarHBondContact N-O 3.01Å; L2107-D2272 HydrophobicContact CD1-CB 4.09Å; L2107-D2272 HydrophobicContact CD2-CB 3.92Å; A2110-D2272 HydrophobicContact CB-CB 4.25Å; R2270-D2272 IonicContact CZ-OD2 3.47Å; R2270-D2272 IonicContact NE-OD1 2.67Å; R2270-D2272 IonicContact NE-OD2 3.6Å; R2270-D2272 PolarHBondContact NE-OD2 3.13Å; R2270-D2272 IonicContact NH2-OD1 3.35Å; R2270-D2272 IonicContact NH2-OD2 2.73Å; R2270-D2272 PolarHBondContact NH2-OD2 3.25Å; R2270-D2272 VanDerWaalsContact NH2-OD2 3.15Å; D2272-S2309 WeakPolarHBondContact OD1-CB 3.35Å; D2272-S2309 PolarHBondContact OD1-OG 3.01Å
2273	C	87	Confident	89	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.7	177.9	67	0	0	0	0	114.4	G2093 L2107 Y2271 N2278 S2309 M2310 Y2311	G2093-C2273 CarbonylContact O-C 3.52Å; G2093-C2273 WeakPolarHBondContact O-CA 3.46Å; G2093-C2273 WeakPolarHBondContact O-CB 3.27Å; L2107-C2273 WeakPolarHBondContact CD2-O 3.47Å; Y2271-C2273 HydrophobicContact CE1-CB 4.1Å; Y2271-C2273 HydrophobicContact CE2-CB 3.88Å; Y2271-C2273 VanDerWaalsContact CZ-CB 3.46Å; Y2271-C2273 VanDerWaalsContact OH-CB 3.27Å; Y2271-C2273 WeakPolarHBondContact OH-CB 3.26Å; C2273-N2278 HydrophobicContact CB-CB 4.41Å; C2273-S2309 PolarHBondContact N-O 3.19Å; C2273-S2309 VanDerWaalsContact N-O 3.1Å; C2273-S2309 PolarHBondContact SG-O 3.03Å; C2273-S2309 VanDerWaalsContact SG-O 3.37Å; C2273-M2310 VanDerWaalsContact SG-CA 3.59Å; C2273-Y2311 WeakPolarHBondContact O-CD2 3.36Å; C2273-Y2311 PolarHBondContact SG-N 3.22Å; C2273-Y2311 VanDerWaalsContact SG-N 3.4Å
2274	T	81.8	Confident	89.1	Confident	5.33333 Å²	5.33333	16.8 Å²	16.8	3%	0.033	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	146.4	175.6	156.7	0	0	0	0	110	G2093 L2094 N2095 L2107 L2166 N2278	G2093-T2274 PolarHBondContact O-N 2.94Å; L2094-T2274 HydrophobicContact CD2-CG2 3.44Å; L2094-T2274 VanDerWaalsContact CD2-CG2 3.44Å; L2094-T2274 WeakPolarHBondContact CD2-OG1 3.46Å; N2095-T2274 PolarHBondContact N-O 2.98Å; N2095-T2274 VanDerWaalsContact N-O 3.09Å; L2107-T2274 HydrophobicContact CB-CG2 4.4Å; L2107-T2274 HydrophobicContact CD1-CG2 3.71Å; L2107-T2274 HydrophobicContact CG-CG2 4.13Å; L2166-T2274 HydrophobicContact CB-CG2 4.17Å; L2166-T2274 WeakPolarHBondContact O-CG2 3.47Å; T2274-N2278 PolarHBondContact O-OD1 3.02Å
2275	G	75.8	Confident	89.1	Confident	4.66667 Å²	4.66667	19.4 Å²	19.4	5%	0.048	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.2	173.7	178.9	0	0	0	0	0	114.9	N2095 N2278 N2312	N2095-G2275 VanDerWaalsContact O-CA 3.25Å; N2095-G2275 WeakPolarHBondContact O-CA 3.33Å; G2275-N2278 PolarHBondContact N-ND2 3.06Å; G2275-N2278 PolarHBondContact O-ND2 3.14Å; G2275-N2312 PolarHBondContact O-ND2 2.93Å
2276	D	73.7	Confident	89.3	Confident	23.6667 Å²	23.6667	18.4 Å²	18.4	13%	0.127	10%	0.097	C	C	.	.	S	Bend	trans	-65.4	-44.2	-176.8	-68.7	-31.4	0	0	0	112.9	N2095 H2097 S2098 S2099 N2312	N2095-D2276 PolarHBondContact O-N 3.24Å; H2097-D2276 HydrophobicContact CB-CB 4.11Å; H2097-D2276 VanDerWaalsContact CB-OD2 3.25Å; H2097-D2276 WeakPolarHBondContact CB-OD2 3.12Å; H2097-D2276 PolarHBondContact N-OD2 3.15Å; H2097-D2276 VanDerWaalsContact O-OD2 3.1Å; S2098-D2276 PolarHBondContact N-OD2 3.15Å; S2098-D2276 PolarHBondContact OG-OD2 3Å; S2098-D2276 VanDerWaalsContact OG-OD2 3.1Å; S2099-D2276 WeakPolarHBondContact CB-OD1 3.38Å; S2099-D2276 VanDerWaalsContact CB-OD2 3.26Å; S2099-D2276 WeakPolarHBondContact CB-OD2 3.14Å; S2099-D2276 PolarHBondContact N-OD2 2.88Å; S2099-D2276 VanDerWaalsContact OG-CG 3.25Å; S2099-D2276 PolarHBondContact OG-OD1 3.13Å; S2099-D2276 PolarHBondContact OG-OD2 2.62Å; D2276-N2312 WeakPolarHBondContact O-CB 3.29Å; D2276-N2312 PolarHBondContact O-ND2 3.07Å
2277	V	78.9	Confident	89.6	Confident	71.6667 Å²	71.6667	16.5 Å²	16.5	43%	0.434	9%	0.091	S	C	.	.	S	Bend	trans	-139.7	111.7	-179.7	-178.6	0	0	0	0	108.2	N2095	N2095-V2277 VanDerWaalsContact CB-O 3.3Å; N2095-V2277 WeakPolarHBondContact CB-O 3.35Å; N2095-V2277 PolarHBondContact ND2-O 3.08Å; N2095-V2277 VanDerWaalsContact ND2-O 3.13Å
2278	N	85.7	Confident	89.7	Confident	7 Å²	7	16.4 Å²	16.4	4%	0.037	9%	0.09	C	C	.	.	B	Isolated β-bridge	trans	-101.5	162.5	-178.9	-75.8	-52.8	0	0	0	112.6	C2273 T2274 G2275 Y2311 N2312 T2313	C2273-N2278 HydrophobicContact CB-CB 4.41Å; T2274-N2278 PolarHBondContact O-OD1 3.02Å; G2275-N2278 PolarHBondContact N-ND2 3.06Å; G2275-N2278 PolarHBondContact O-ND2 3.14Å; N2278-Y2311 WeakPolarHBondContact CB-O 3.21Å; N2278-Y2311 PolarHBondContact ND2-O 3.13Å; N2278-N2312 PolarHBondContact N-O 3.04Å; N2278-T2313 WeakPolarHBondContact CB-OG1 3.22Å
2279	A	87.7	Confident	89.7	Confident	0.666667 Å²	0.666667	16.7 Å²	16.7	1%	0.006	9%	0.091	C	C	.	.	P	Polyproline II helix	trans	-65.4	147.6	-171.6	0	0	0	0	0	113.9	L2251 K2252 I2254 T2313	L2251-A2279 HydrophobicContact CB-CB 4.38Å; L2251-A2279 HydrophobicContact CD2-CB 3.8Å; L2251-A2279 HydrophobicContact CG-CB 3.66Å; K2252-A2279 VanDerWaalsContact C-CB 3.4Å; K2252-A2279 CarbonylContact O-C 3.41Å; K2252-A2279 WeakPolarHBondContact O-CA 3.19Å; K2252-A2279 VanDerWaalsContact O-CB 3.25Å; K2252-A2279 WeakPolarHBondContact O-CB 3.03Å; I2254-A2279 HydrophobicContact CD1-CB 4.24Å; I2254-A2279 HydrophobicContact CG1-CB 4.11Å; A2279-T2313 VanDerWaalsContact O-CG2 3.26Å; A2279-T2313 WeakPolarHBondContact O-CG2 3.22Å
2280	V	91.5	Very high	89.6	Confident	42.3333 Å²	42.3333	20.7 Å²	20.7	26%	0.257	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	132.1	169.1	176.9	0	0	0	0	109.1	K2252 N2253 I2254	K2252-V2280 PolarHBondContact O-N 2.97Å; N2253-V2280 CarbonylContact C-O 3.47Å; N2253-V2280 WeakPolarHBondContact CA-O 3.21Å; I2254-V2280 PolarHBondContact N-O 3.08Å
2281	V	93.7	Very high	89.6	Confident	3.66667 Å²	3.66667	18.5 Å²	18.5	2%	0.022	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.5	-178.8	179.7	0	0	0	0	109.9	I2254 Y2271 I2283 M2310 S2315 F2316 K2317	I2254-V2281 HydrophobicContact CB-CG2 4.43Å; I2254-V2281 HydrophobicContact CD1-CG2 4.15Å; Y2271-V2281 HydrophobicContact CD1-CG2 4.08Å; Y2271-V2281 HydrophobicContact CE1-CG2 3.67Å; V2281-I2283 HydrophobicContact CG1-CD1 4.27Å; V2281-I2283 HydrophobicContact CG1-CG1 4.12Å; V2281-M2310 HydrophobicContact CB-CE 3.86Å; V2281-M2310 HydrophobicContact CG1-CE 4.08Å; V2281-M2310 HydrophobicContact CG2-CE 3.78Å; V2281-M2310 HydrophobicContact CG2-SD 4.38Å; V2281-S2315 PolarHBondContact N-O 3.1Å; V2281-F2316 HydrophobicContact CB-CD2 4.11Å; V2281-F2316 HydrophobicContact CG1-CD2 4.08Å; V2281-F2316 HydrophobicContact CG1-CE2 4.32Å; V2281-F2316 CarbonylContact O-C 3.05Å; V2281-F2316 WeakPolarHBondContact O-CA 3.38Å; V2281-K2317 PolarHBondContact O-N 2.88Å
2282	D	94.3	Very high	89.5	Confident	28.6667 Å²	28.6667	18.8 Å²	18.8	15%	0.153	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	118.4	176.9	-161.6	-3.4	0	0	0	110.1	I2254 F2255 I2256 K2317	I2254-D2282 PolarHBondContact O-N 2.79Å; F2255-D2282 HydrophobicContact CD1-CB 3.83Å; F2255-D2282 HydrophobicContact CE1-CB 4.07Å; I2256-D2282 PolarHBondContact N-O 3.17Å; D2282-K2317 WeakPolarHBondContact CA-O 3.41Å; D2282-K2317 HydrophobicContact CB-CB 4.4Å; D2282-K2317 WeakPolarHBondContact OD1-CB 3.31Å; D2282-K2317 VanDerWaalsContact OD1-CD 3.23Å; D2282-K2317 WeakPolarHBondContact OD1-CD 3.41Å; D2282-K2317 WeakPolarHBondContact OD1-CE 3.28Å; D2282-K2317 VanDerWaalsContact OD1-CG 3.22Å; D2282-K2317 WeakPolarHBondContact OD1-CG 3.32Å; D2282-K2317 IonicContact OD1-NZ 3.42Å; D2282-K2317 PolarHBondContact OD1-NZ 3.39Å; D2282-K2317 IonicContact OD2-NZ 2.69Å; D2282-K2317 PolarHBondContact OD2-NZ 3.4Å
2283	I	94.8	Very high	89.2	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.01	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	115	179.7	-55.8	177.7	0	0	0	107.6	I2256 V2281 C2286 F2288 K2317 L2318 Q2319	I2256-I2283 HydrophobicContact CB-CG1 4.31Å; I2256-I2283 HydrophobicContact CB-CG2 4.44Å; I2256-I2283 HydrophobicContact CD1-CD1 4.42Å; I2256-I2283 HydrophobicContact CD1-CG1 4.24Å; I2256-I2283 HydrophobicContact CG1-CG1 4.43Å; I2256-I2283 WeakPolarHBondContact O-CA 3.41Å; V2281-I2283 HydrophobicContact CG1-CD1 4.27Å; V2281-I2283 HydrophobicContact CG1-CG1 4.12Å; I2283-C2286 HydrophobicContact CG2-CB 4.02Å; I2283-F2288 HydrophobicContact CG2-CE2 4.49Å; I2283-F2288 HydrophobicContact CG2-CZ 4.34Å; I2283-K2317 PolarHBondContact N-O 3.31Å; I2283-L2318 HydrophobicContact CB-CD1 3.67Å; I2283-L2318 HydrophobicContact CD1-CD1 4.47Å; I2283-L2318 HydrophobicContact CG2-CD1 3.55Å; I2283-L2318 CarbonylContact O-C 3.53Å; I2283-L2318 VanDerWaalsContact O-CA 3.3Å; I2283-L2318 WeakPolarHBondContact O-CA 3.33Å; I2283-Q2319 PolarHBondContact O-N 3.15Å
2284	D	93.6	Very high	89	Confident	32 Å²	32	26.8 Å²	26.8	17%	0.171	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.5	-177.4	-167.2	19.1	0	0	0	111.7	I2256 H2257 E2258 C2286 Q2319 N2320	I2256-D2284 PolarHBondContact O-N 3.35Å; H2257-D2284 WeakPolarHBondContact CA-O 3.37Å; H2257-D2284 IonicContact CE1-OD2 3.62Å; H2257-D2284 IonicContact ND1-OD2 3.27Å; E2258-D2284 PolarHBondContact N-O 3.28Å; E2258-D2284 VanDerWaalsContact N-O 3.09Å; D2284-C2286 VanDerWaalsContact C-N 3.29Å; D2284-C2286 PolarHBondContact O-N 3.17Å; D2284-C2286 PolarHBondContact O-SG 2.93Å; D2284-C2286 VanDerWaalsContact O-SG 3.32Å; D2284-Q2319 WeakPolarHBondContact CA-O 3.26Å; D2284-Q2319 WeakPolarHBondContact OD1-CB 3.41Å; D2284-N2320 WeakPolarHBondContact OD1-CB 3.42Å; D2284-N2320 PolarHBondContact OD1-ND2 3.17Å
2285	L	94	Very high	89.1	Confident	55.3333 Å²	55.3333	27.1 Å²	27.1	29%	0.29	14%	0.138	S	C	.	.	S	Bend	trans	53.2	37.5	177.2	-66.8	164.9	0	0	0	114.1	E2258 Q2319 N2320 A2621 V2710 P2712	E2258-L2285 VanDerWaalsContact CA-O 3.27Å; E2258-L2285 WeakPolarHBondContact CA-O 3.09Å; E2258-L2285 HydrophobicContact CG-CB 3.94Å; E2258-L2285 HydrophobicContact CG-CD1 4.11Å; L2285-Q2319 PolarHBondContact N-O 3.06Å; L2285-N2320 WeakPolarHBondContact CA-O 3.3Å; L2285-N2320 HydrophobicContact CD2-CB 3.75Å; L2285-N2320 HydrophobicContact CG-CB 4.24Å; L2285-A2621 HydrophobicContact CB-CB 4.22Å; L2285-A2621 HydrophobicContact CD2-CB 3.82Å; L2285-V2710 VanDerWaalsContact O-CG2 3.26Å; L2285-V2710 WeakPolarHBondContact O-CG2 3.35Å; L2285-P2712 HydrophobicContact CD2-CG 4.45Å
2286	C	95.3	Very high	89.3	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.007	15%	0.148	C	C	.	.			trans	-99.1	145.9	-177.1	-69.3	0	0	0	0	113.4	G2259 I2283 D2284 F2288 S2321 M2322	G2259-C2286 PolarHBondContact N-SG 3.05Å; G2259-C2286 VanDerWaalsContact N-SG 3.42Å; G2259-C2286 CarbonylContact O-C 3.56Å; G2259-C2286 VanDerWaalsContact O-CA 3.26Å; G2259-C2286 WeakPolarHBondContact O-CA 3.27Å; I2283-C2286 HydrophobicContact CG2-CB 4.02Å; D2284-C2286 VanDerWaalsContact C-N 3.29Å; D2284-C2286 PolarHBondContact O-N 3.17Å; D2284-C2286 PolarHBondContact O-SG 2.93Å; D2284-C2286 VanDerWaalsContact O-SG 3.32Å; C2286-F2288 HydrophobicContact CB-CD2 4.41Å; C2286-F2288 HydrophobicContact CB-CE1 4.43Å; C2286-F2288 HydrophobicContact CB-CE2 3.66Å; C2286-F2288 HydrophobicContact CB-CZ 3.66Å; C2286-S2321 PolarHBondContact N-OG 3.12Å; C2286-S2321 VanDerWaalsContact N-OG 3.14Å; C2286-S2321 CarbonylContact O-C 3.5Å; C2286-S2321 WeakPolarHBondContact O-CA 3.44Å; C2286-S2321 VanDerWaalsContact O-CB 3.25Å; C2286-S2321 WeakPolarHBondContact O-CB 3.39Å; C2286-M2322 PolarHBondContact O-N 3.13Å
2287	S	94.9	Very high	89.5	Confident	7 Å²	7	33 Å²	33	5%	0.049	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	115.4	179.4	-175.5	0	0	0	0	110.8	G2259 F2261 N2289 M2322 A2621	G2259-S2287 PolarHBondContact O-N 2.98Å; F2261-S2287 PolarHBondContact N-O 3.05Å; S2287-N2289 PolarHBondContact OG-ND2 3.07Å; S2287-N2289 PolarHBondContact OG-OD1 2.8Å; S2287-M2322 PolarHBondContact OG-SD 2.81Å; S2287-A2621 WeakPolarHBondContact CB-O 3.42Å; S2287-A2621 PolarHBondContact OG-O 3.17Å
2288	F	95.7	Very high	89.4	Confident	0.666667 Å²	0.666667	32 Å²	32	0%	0.003	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	96.7	179.6	-55.1	-73.4	0	0	0	110	F2261 A2268 V2269 I2283 C2286 A2305 V2306 M2322 F2323 F2324 N2326	F2261-F2288 HydrophobicContact CB-CD1 3.78Å; F2261-F2288 HydrophobicContact CB-CE1 4.25Å; F2261-F2288 AromaticContact CD2-CD1 3.72Å; F2261-F2288 HydrophobicContact CD2-CD1 3.72Å; F2261-F2288 AromaticContact CD2-CE1 3.33Å; F2261-F2288 HydrophobicContact CD2-CE1 3.33Å; F2261-F2288 HydrophobicContact CD2-CZ 4.25Å; F2261-F2288 AromaticContact CE2-CE1 3.75Å; F2261-F2288 HydrophobicContact CE2-CE1 3.75Å; F2261-F2288 HydrophobicContact CE2-CZ 4.4Å; F2261-F2288 AromaticContact CG-CD1 3.93Å; F2261-F2288 HydrophobicContact CG-CD1 3.93Å; F2261-F2288 AromaticContact CG-CE1 3.87Å; F2261-F2288 HydrophobicContact CG-CE1 3.87Å; F2261-F2288 WeakPolarHBondContact O-CA 3.21Å; A2268-F2288 HydrophobicContact CB-CD1 3.5Å; A2268-F2288 VanDerWaalsContact CB-CD1 3.48Å; A2268-F2288 HydrophobicContact CB-CE1 4.08Å; A2268-F2288 HydrophobicContact CB-CG 4.46Å; V2269-F2288 HydrophobicContact CG2-CE1 3.7Å; V2269-F2288 HydrophobicContact CG2-CZ 4.34Å; I2283-F2288 HydrophobicContact CG2-CE2 4.49Å; I2283-F2288 HydrophobicContact CG2-CZ 4.34Å; C2286-F2288 HydrophobicContact CB-CD2 4.41Å; C2286-F2288 HydrophobicContact CB-CE1 4.43Å; C2286-F2288 HydrophobicContact CB-CE2 3.66Å; C2286-F2288 HydrophobicContact CB-CZ 3.66Å; F2288-A2305 HydrophobicContact CB-CB 4.49Å; F2288-V2306 HydrophobicContact CD1-CG2 3.86Å; F2288-V2306 HydrophobicContact CD2-CG2 4.17Å; F2288-V2306 HydrophobicContact CE1-CG2 3.7Å; F2288-V2306 HydrophobicContact CE2-CG2 4.01Å; F2288-V2306 HydrophobicContact CG-CG2 4.1Å; F2288-V2306 HydrophobicContact CZ-CG2 3.77Å; F2288-M2322 WeakPolarHBondContact CA-O 3.47Å; F2288-M2322 WeakPolarHBondContact CB-O 3.24Å; F2288-M2322 WeakPolarHBondContact CD2-O 3.38Å; F2288-M2322 PolarHBondContact N-O 3.05Å; F2288-F2323 HydrophobicContact CB-CD1 4.01Å; F2288-F2323 HydrophobicContact CB-CE1 4.3Å; F2288-F2323 HydrophobicContact CB-CG 4.44Å; F2288-F2323 AromaticContact CD2-CD1 3.85Å; F2288-F2323 HydrophobicContact CD2-CD1 3.99Å; F2288-F2323 HydrophobicContact CD2-CD2 4.28Å; F2288-F2323 AromaticContact CD2-CE1 3.6Å; F2288-F2323 HydrophobicContact CD2-CE1 3.6Å; F2288-F2323 VanDerWaalsContact CD2-CE1 3.45Å; F2288-F2323 AromaticContact CD2-CE2 3.89Å; F2288-F2323 HydrophobicContact CD2-CE2 3.89Å; F2288-F2323 HydrophobicContact CD2-CG 4.32Å; F2288-F2323 AromaticContact CD2-CZ 3.53Å; F2288-F2323 HydrophobicContact CD2-CZ 3.53Å; F2288-F2323 VanDerWaalsContact CD2-CZ 3.44Å; F2288-F2323 AromaticContact CE2-CE1 3.99Å; F2288-F2323 HydrophobicContact CE2-CE1 4.17Å; F2288-F2323 HydrophobicContact CE2-CE2 4.23Å; F2288-F2323 AromaticContact CE2-CZ 3.76Å; F2288-F2323 HydrophobicContact CE2-CZ 3.76Å; F2288-F2323 HydrophobicContact CG-CD1 4.25Å; F2288-F2323 AromaticContact CG-CE1 3.94Å; F2288-F2323 HydrophobicContact CG-CE1 4.06Å; F2288-F2323 HydrophobicContact CG-CZ 4.43Å; F2288-F2323 WeakPolarHBondContact O-CA 3.4Å; F2288-F2324 PolarHBondContact O-N 3.15Å; F2288-N2326 PolarHBondContact O-ND2 3.13Å; F2288-N2326 PolarHBondContact O-OD1 2.95Å
2289	N	94	Very high	89.2	Confident	6 Å²	6	32 Å²	32	3%	0.032	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.9	-174.8	-51.9	-38.8	0	0	0	112.6	F2261 E2262 R2263 S2287 N2291 M2322 F2324	F2261-N2289 PolarHBondContact O-N 3.01Å; E2262-N2289 VanDerWaalsContact CA-O 3.23Å; E2262-N2289 WeakPolarHBondContact CA-O 3.35Å; E2262-N2289 HydrophobicContact CG-CB 4.14Å; E2262-N2289 PolarHBondContact OE1-ND2 2.97Å; R2263-N2289 PolarHBondContact N-O 3.12Å; R2263-N2289 VanDerWaalsContact N-O 3.16Å; S2287-N2289 PolarHBondContact OG-ND2 3.07Å; S2287-N2289 PolarHBondContact OG-OD1 2.8Å; N2289-N2291 PolarHBondContact N-ND2 3.1Å; N2289-N2291 VanDerWaalsContact N-ND2 3.17Å; N2289-N2291 PolarHBondContact O-N 3.1Å; N2289-N2291 VanDerWaalsContact O-N 3.12Å; N2289-N2291 PolarHBondContact O-ND2 2.94Å; N2289-N2291 VanDerWaalsContact O-ND2 3.1Å; N2289-M2322 WeakPolarHBondContact OD1-CE 3.03Å; N2289-F2324 CarbonylContact C-O 3.32Å; N2289-F2324 VanDerWaalsContact CA-O 3.29Å; N2289-F2324 WeakPolarHBondContact CA-O 3.37Å; N2289-F2324 HydrophobicContact CB-CB 4.43Å; N2289-F2324 WeakPolarHBondContact OD1-CB 3.3Å
2290	Y	93.5	Very high	89.2	Confident	89 Å²	89	32.1 Å²	32.1	35%	0.349	15%	0.153	S	C	.	.	S	Bend	trans	56.8	28.9	171.4	-57.7	-84.5	0	0	0	115.2	R2263 F2324 R2325 N2326 E2629	R2263-Y2290 VanDerWaalsContact CA-O 3.3Å; R2263-Y2290 WeakPolarHBondContact CA-O 3.34Å; R2263-Y2290 HydrophobicContact CG-CG 4.47Å; Y2290-F2324 HydrophobicContact CE2-CD1 4.35Å; Y2290-F2324 PolarHBondContact N-O 3.32Å; Y2290-F2324 VanDerWaalsContact N-O 3.1Å; Y2290-R2325 WeakPolarHBondContact CA-O 3.22Å; Y2290-R2325 HydrophobicContact CD1-CB 4.02Å; Y2290-R2325 HydrophobicContact CE1-CB 4.07Å; Y2290-R2325 HydrophobicContact CE1-CG 4.33Å; Y2290-R2325 HydrophobicContact CG-CB 4.44Å; Y2290-R2325 WeakPolarHBondContact OH-CD 3.37Å; Y2290-R2325 PolarHBondContact OH-NE 3.41Å; Y2290-N2326 PolarHBondContact N-OD1 3.07Å; Y2290-E2629 PolarHBondContact OH-OE1 3.24Å; Y2290-E2629 PolarHBondContact OH-OE2 3.16Å
2291	N	93.6	Very high	88.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.145	C	C	.	.			trans	-91.4	130.2	-179.4	-57.2	-75.8	0	0	0	111.1	F2261 N2264 A2268 N2289 A2305 N2326 A2327	F2261-N2291 PolarHBondContact O-ND2 3.16Å; F2261-N2291 PolarHBondContact O-OD1 3.3Å; N2264-N2291 WeakPolarHBondContact CB-OD1 3.3Å; N2264-N2291 PolarHBondContact N-OD1 3.11Å; N2264-N2291 VanDerWaalsContact N-OD1 3.12Å; N2264-N2291 PolarHBondContact ND2-OD1 3.11Å; N2264-N2291 WeakPolarHBondContact O-CA 3.38Å; A2268-N2291 HydrophobicContact CB-CB 4.36Å; N2289-N2291 PolarHBondContact N-ND2 3.1Å; N2289-N2291 VanDerWaalsContact N-ND2 3.17Å; N2289-N2291 PolarHBondContact O-N 3.1Å; N2289-N2291 VanDerWaalsContact O-N 3.12Å; N2289-N2291 PolarHBondContact O-ND2 2.94Å; N2289-N2291 VanDerWaalsContact O-ND2 3.1Å; N2291-A2305 HydrophobicContact CB-CB 4.4Å; N2291-N2326 VanDerWaalsContact CB-OD1 3.28Å; N2291-N2326 WeakPolarHBondContact CB-OD1 3.47Å; N2291-N2326 PolarHBondContact N-OD1 3.01Å; N2291-N2326 PolarHBondContact ND2-OD1 3Å; N2291-N2326 CarbonylContact O-C 3.53Å; N2291-N2326 VanDerWaalsContact O-CA 3.25Å; N2291-N2326 WeakPolarHBondContact O-CA 3.39Å; N2291-N2326 WeakPolarHBondContact O-CB 3.4Å; N2291-A2327 PolarHBondContact O-N 3.03Å; N2291-A2327 VanDerWaalsContact O-N 3.14Å
2292	G	89.4	Confident	88.6	Confident	9.66667 Å²	9.66667	31.1 Å²	31.1	10%	0.1	15%	0.148	C	C	.	.	S	Bend	trans	75.7	145.8	-173.4	0	0	0	0	0	113.6	N2264 D2265 S2302	N2264-G2292 PolarHBondContact O-N 2.85Å; D2265-G2292 WeakPolarHBondContact O-CA 3.39Å; G2292-S2302 WeakPolarHBondContact CA-OG 3.46Å
2293	Y	83.8	Confident	88	Confident	85.3333 Å²	85.3333	31.5 Å²	31.5	34%	0.335	15%	0.152	S	C	.	.			trans	-126.8	154.5	175.8	29	-75.4	0	0	0	112.1	H1989 D2265 L2295 T2300 T2301	H1989-Y2293 PolarHBondContact CD2-OH 3.5Å; H1989-Y2293 AromaticContact NE2-CE2 3.88Å; H1989-Y2293 AromaticContact NE2-CZ 3.74Å; H1989-Y2293 PolarHBondContact NE2-OH 3.13Å; D2265-Y2293 HydrophobicContact CB-CD2 4.46Å; D2265-Y2293 HydrophobicContact CB-CE1 4.11Å; D2265-Y2293 HydrophobicContact CB-CE2 3.96Å; D2265-Y2293 WeakPolarHBondContact OD1-CE1 3.34Å; D2265-Y2293 WeakPolarHBondContact OD1-CE2 3.42Å; D2265-Y2293 PolarHBondContact OD1-OH 3Å; D2265-Y2293 PolarHBondContact OD2-OH 2.95Å; Y2293-L2295 HydrophobicContact CD2-CD2 3.92Å; Y2293-L2295 HydrophobicContact CE2-CD2 3.37Å; Y2293-L2295 HydrophobicContact CE2-CG 4.26Å; Y2293-T2300 VanDerWaalsContact O-CA 3.26Å; Y2293-T2300 WeakPolarHBondContact O-CA 3.46Å; Y2293-T2300 WeakPolarHBondContact O-CB 3.47Å; Y2293-T2301 HydrophobicContact CD1-CG2 4.14Å; Y2293-T2301 HydrophobicContact CD2-CG2 4.31Å; Y2293-T2301 HydrophobicContact CE1-CG2 3.74Å; Y2293-T2301 HydrophobicContact CE2-CG2 3.96Å; Y2293-T2301 HydrophobicContact CG-CG2 4.39Å; Y2293-T2301 PolarHBondContact N-OG1 2.92Å; Y2293-T2301 VanDerWaalsContact N-OG1 3.13Å; Y2293-T2301 PolarHBondContact O-N 3.18Å; Y2293-T2301 VanDerWaalsContact O-N 3.12Å; Y2293-T2301 PolarHBondContact O-OG1 2.91Å
2294	Q	84.4	Confident	87.8	Confident	87 Å²	87	31.6 Å²	31.6	41%	0.407	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	126.5	168.5	-178.5	175.5	14.5	0	0	109.2	E2297 I2357	Q2294-E2297 PolarHBondContact NE2-O 3.05Å; Q2294-I2357 HydrophobicContact CB-CD1 3.68Å; Q2294-I2357 VanDerWaalsContact CD-CD1 3.43Å; Q2294-I2357 HydrophobicContact CG-CD1 3.45Å; Q2294-I2357 VanDerWaalsContact CG-CD1 3.43Å
2295	L	83.8	Confident	87.7	Confident	12 Å²	12	30.1 Å²	30.1	6%	0.063	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-53.9	176.4	-63.6	173.8	0	0	0	110.8	P1886 Y1931 F1987 H1989 Y2293 F2299 T2301	P1886-L2295 WeakPolarHBondContact CG-O 3.23Å; Y1931-L2295 HydrophobicContact CD1-CD1 3.44Å; Y1931-L2295 HydrophobicContact CE1-CD1 3.69Å; Y1931-L2295 HydrophobicContact CG-CD1 4.11Å; F1987-L2295 HydrophobicContact CE1-CB 4.04Å; F1987-L2295 HydrophobicContact CE1-CD1 4.2Å; F1987-L2295 HydrophobicContact CZ-CB 4.35Å; H1989-L2295 HydrophobicContact CB-CD1 4.05Å; H1989-L2295 HydrophobicContact CB-CD2 4.18Å; H1989-L2295 VanDerWaalsContact CD2-CD2 3.48Å; H1989-L2295 WeakPolarHBondContact CD2-CD2 3.19Å; Y2293-L2295 HydrophobicContact CD2-CD2 3.92Å; Y2293-L2295 HydrophobicContact CE2-CD2 3.37Å; Y2293-L2295 HydrophobicContact CE2-CG 4.26Å; L2295-F2299 HydrophobicContact CB-CB 4.43Å; L2295-F2299 WeakPolarHBondContact CB-O 3.37Å; L2295-F2299 PolarHBondContact N-O 3.24Å; L2295-T2301 HydrophobicContact CD1-CG2 4Å; L2295-T2301 HydrophobicContact CD2-CG2 4.15Å; L2295-T2301 HydrophobicContact CG-CG2 4.08Å
2296	W	79.5	Confident	87.8	Confident	68.6667 Å²	68.6667	27.6 Å²	27.6	26%	0.26	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	122.5	179.5	-176.3	-95.3	0	0	0	109.3	D1884 P1886 F1892 F1987 N2298 F2299	D1884-W2296 WeakPolarHBondContact O-CZ2 2.94Å; D1884-W2296 PolarHBondContact O-NE1 3.36Å; P1886-W2296 HydrophobicContact CB-CE3 4.31Å; P1886-W2296 HydrophobicContact CB-CZ3 4.29Å; P1886-W2296 HydrophobicContact CG-CE3 4.29Å; F1892-W2296 HydrophobicContact CE2-CE3 4.11Å; F1892-W2296 HydrophobicContact CE2-CH2 4.07Å; F1892-W2296 HydrophobicContact CE2-CZ2 4.4Å; F1892-W2296 AromaticContact CE2-CZ3 3.89Å; F1892-W2296 HydrophobicContact CE2-CZ3 3.89Å; F1892-W2296 HydrophobicContact CZ-CE3 4.07Å; F1892-W2296 HydrophobicContact CZ-CH2 4.22Å; F1892-W2296 AromaticContact CZ-CZ3 3.71Å; F1892-W2296 HydrophobicContact CZ-CZ3 3.71Å; F1987-W2296 HydrophobicContact CE2-CB 3.96Å; F1987-W2296 HydrophobicContact CE2-CG 4.33Å; F1987-W2296 HydrophobicContact CZ-CB 3.81Å; F1987-W2296 HydrophobicContact CZ-CG 4.46Å; W2296-N2298 PolarHBondContact O-N 3.05Å; W2296-F2299 HydrophobicContact CB-CD2 4.49Å; W2296-F2299 AromaticContact CE3-CD2 3.51Å; W2296-F2299 HydrophobicContact CE3-CD2 3.51Å; W2296-F2299 AromaticContact CE3-CE2 3.63Å; W2296-F2299 HydrophobicContact CE3-CE2 3.63Å; W2296-F2299 HydrophobicContact CZ3-CD2 4.04Å; W2296-F2299 AromaticContact CZ3-CE2 3.7Å; W2296-F2299 HydrophobicContact CZ3-CE2 3.7Å; W2296-F2299 PolarHBondContact N-O 3.32Å; W2296-F2299 WeakPolarHBondContact O-CA 3.46Å; W2296-F2299 VanDerWaalsContact O-CB 3.26Å; W2296-F2299 WeakPolarHBondContact O-CB 3.29Å; W2296-F2299 WeakPolarHBondContact O-CD2 3.26Å; W2296-F2299 PolarHBondContact O-N 3.09Å
2297	E	78.4	Confident	87.7	Confident	83.3333 Å²	83.3333	30.6 Å²	30.6	39%	0.389	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	-110.7	179.8	-62.1	178.2	179.1	0	0	113	W1938 Q2294 F2299 I2357	W1938-E2297 WeakPolarHBondContact CZ3-OE2 3.24Å; Q2294-E2297 PolarHBondContact NE2-O 3.05Å; E2297-F2299 VanDerWaalsContact C-N 3.35Å; E2297-I2357 VanDerWaalsContact O-CD1 3.24Å; E2297-I2357 WeakPolarHBondContact O-CD1 3.46Å
2298	N	76.5	Confident	87.6	Confident	50.6667 Å²	50.6667	30.3 Å²	30.3	27%	0.271	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-1	179.2	-167.8	10	0	0	0	113.7	R1933 W2296 T2300 Y2385	R1933-N2298 PolarHBondContact NH1-O 2.91Å; R1933-N2298 VanDerWaalsContact NH1-O 3.13Å; R1933-N2298 PolarHBondContact NH2-O 3.24Å; R1933-N2298 VanDerWaalsContact NH2-O 3.14Å; W2296-N2298 PolarHBondContact O-N 3.05Å; N2298-T2300 PolarHBondContact O-N 3.08Å; N2298-Y2385 HydrophobicContact CB-CD2 4.48Å
2299	F	81.5	Confident	87.3	Confident	7.66667 Å²	7.66667	31 Å²	31	3%	0.034	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	113.7	172.8	-62.4	-89.9	0	0	0	109.5	F1892 R1933 F1987 L2295 W2296 E2297	F1892-F2299 HydrophobicContact CE1-CE2 4.37Å; F1892-F2299 HydrophobicContact CE1-CZ 4.21Å; F1892-F2299 AromaticContact CZ-CE2 3.89Å; F1892-F2299 HydrophobicContact CZ-CE2 3.89Å; F1892-F2299 HydrophobicContact CZ-CZ 4.18Å; R1933-F2299 HydrophobicContact CB-CD1 3.95Å; R1933-F2299 HydrophobicContact CB-CE1 4.2Å; R1933-F2299 VanDerWaalsContact CD-CD1 3.44Å; R1933-F2299 HydrophobicContact CG-CD1 3.72Å; R1933-F2299 HydrophobicContact CG-CE1 3.8Å; F1987-F2299 HydrophobicContact CB-CD1 4.33Å; F1987-F2299 HydrophobicContact CB-CE1 4.14Å; F1987-F2299 HydrophobicContact CB-CZ 4.38Å; F1987-F2299 HydrophobicContact CD1-CB 4.41Å; F1987-F2299 HydrophobicContact CD1-CD1 4.34Å; F1987-F2299 HydrophobicContact CD1-CG 4.35Å; F1987-F2299 HydrophobicContact CE1-CB 4.34Å; F1987-F2299 HydrophobicContact CG-CD1 4.35Å; F1987-F2299 HydrophobicContact CG-CE1 4.49Å; F1987-F2299 HydrophobicContact CG-CG 4.4Å; L2295-F2299 HydrophobicContact CB-CB 4.43Å; L2295-F2299 WeakPolarHBondContact CB-O 3.37Å; L2295-F2299 PolarHBondContact N-O 3.24Å; W2296-F2299 HydrophobicContact CB-CD2 4.49Å; W2296-F2299 AromaticContact CE3-CD2 3.51Å; W2296-F2299 HydrophobicContact CE3-CD2 3.51Å; W2296-F2299 AromaticContact CE3-CE2 3.63Å; W2296-F2299 HydrophobicContact CE3-CE2 3.63Å; W2296-F2299 HydrophobicContact CZ3-CD2 4.04Å; W2296-F2299 AromaticContact CZ3-CE2 3.7Å; W2296-F2299 HydrophobicContact CZ3-CE2 3.7Å; W2296-F2299 PolarHBondContact N-O 3.32Å; W2296-F2299 WeakPolarHBondContact O-CA 3.46Å; W2296-F2299 VanDerWaalsContact O-CB 3.26Å; W2296-F2299 WeakPolarHBondContact O-CB 3.29Å; W2296-F2299 WeakPolarHBondContact O-CD2 3.26Å; W2296-F2299 PolarHBondContact O-N 3.09Å; E2297-F2299 VanDerWaalsContact C-N 3.35Å
2300	T	86.9	Confident	87.1	Confident	1.33333 Å²	1.33333	30.8 Å²	30.8	1%	0.008	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	153	178	61.2	0	0	0	0	109.6	Y1931 Y2293 N2298 S2302 A2327 I2357 W2358	Y1931-T2300 VanDerWaalsContact CZ-O 3.3Å; Y1931-T2300 PolarHBondContact OH-O 3Å; Y2293-T2300 VanDerWaalsContact O-CA 3.26Å; Y2293-T2300 WeakPolarHBondContact O-CA 3.46Å; Y2293-T2300 WeakPolarHBondContact O-CB 3.47Å; N2298-T2300 PolarHBondContact O-N 3.08Å; T2300-S2302 VanDerWaalsContact C-N 3.32Å; T2300-S2302 VanDerWaalsContact CB-O 3.27Å; T2300-S2302 WeakPolarHBondContact CB-O 3.44Å; T2300-S2302 PolarHBondContact O-N 3.32Å; T2300-S2302 PolarHBondContact OG1-O 3.15Å; T2300-A2327 HydrophobicContact CG2-CB 4.47Å; T2300-I2357 HydrophobicContact CG2-CB 4.32Å; T2300-I2357 HydrophobicContact CG2-CD1 3.52Å; T2300-I2357 VanDerWaalsContact CG2-CD1 3.43Å; T2300-I2357 HydrophobicContact CG2-CG1 4.44Å; T2300-I2357 HydrophobicContact CG2-CG2 4.09Å; T2300-W2358 PolarHBondContact OG1-NE1 2.82Å
2301	T	85	Confident	86.7	Confident	16 Å²	16	28.7 Å²	28.7	10%	0.098	14%	0.138	C	C	.	.	S	Bend	trans	-70.7	-28.2	177	53.9	0	0	0	0	113.3	Y1931 D2265 Y2293 L2295	Y1931-T2301 HydrophobicContact CD2-CG2 4.48Å; D2265-T2301 WeakPolarHBondContact O-CB 3.37Å; D2265-T2301 PolarHBondContact O-OG1 3.18Å; Y2293-T2301 HydrophobicContact CD1-CG2 4.14Å; Y2293-T2301 HydrophobicContact CD2-CG2 4.31Å; Y2293-T2301 HydrophobicContact CE1-CG2 3.74Å; Y2293-T2301 HydrophobicContact CE2-CG2 3.96Å; Y2293-T2301 HydrophobicContact CG-CG2 4.39Å; Y2293-T2301 PolarHBondContact N-OG1 2.92Å; Y2293-T2301 VanDerWaalsContact N-OG1 3.13Å; Y2293-T2301 PolarHBondContact O-N 3.18Å; Y2293-T2301 VanDerWaalsContact O-N 3.12Å; Y2293-T2301 PolarHBondContact O-OG1 2.91Å; L2295-T2301 HydrophobicContact CD1-CG2 4Å; L2295-T2301 HydrophobicContact CD2-CG2 4.15Å; L2295-T2301 HydrophobicContact CG-CG2 4.08Å
2302	S	87	Confident	86.3	Confident	10 Å²	10	28.8 Å²	28.8	7%	0.07	14%	0.139	C	C	.	.			trans	-132.1	157.2	177.2	102.8	0	0	0	0	111.5	R2266 G2292 T2300 G2304 A2327 W2358	R2266-S2302 VanDerWaalsContact O-CB 3.28Å; R2266-S2302 WeakPolarHBondContact O-CB 3.42Å; R2266-S2302 PolarHBondContact O-OG 2.85Å; G2292-S2302 WeakPolarHBondContact CA-OG 3.46Å; T2300-S2302 VanDerWaalsContact C-N 3.32Å; T2300-S2302 VanDerWaalsContact CB-O 3.27Å; T2300-S2302 WeakPolarHBondContact CB-O 3.44Å; T2300-S2302 PolarHBondContact O-N 3.32Å; T2300-S2302 PolarHBondContact OG1-O 3.15Å; S2302-G2304 PolarHBondContact OG-N 2.65Å; S2302-G2304 PolarHBondContact OG-O 2.85Å; S2302-A2327 PolarHBondContact OG-O 3.05Å; S2302-W2358 PolarHBondContact O-NE1 3.06Å
2303	S	83.7	Confident	86.2	Confident	36.3333 Å²	36.3333	28.5 Å²	28.5	25%	0.254	13%	0.134	S	C	.	.	S	Bend	trans	-99.9	10.8	171.8	70.2	0	0	0	0	113	R2307	S2303-R2307 VanDerWaalsContact N-NH2 3.13Å; S2303-R2307 PolarHBondContact OG-NE 3.38Å; S2303-R2307 PolarHBondContact OG-NH1 3.4Å; S2303-R2307 VanDerWaalsContact OG-NH1 3.1Å
2304	G	89	Confident	86.4	Confident	4.66667 Å²	4.66667	29.3 Å²	29.3	5%	0.048	14%	0.142	C	C	.	.			trans	161.7	150.2	-176.7	0	0	0	0	0	112.1	S2302 A2327	S2302-G2304 PolarHBondContact OG-N 2.65Å; S2302-G2304 PolarHBondContact OG-O 2.85Å; G2304-A2327 VanDerWaalsContact CA-O 3.28Å; G2304-A2327 WeakPolarHBondContact CA-O 3.45Å; G2304-A2327 PolarHBondContact N-O 2.94Å
2305	A	92.5	Very high	86.7	Confident	1 Å²	1	27 Å²	27	1%	0.008	14%	0.135	C	C	.	.	S	Bend	trans	-67.7	-44.9	176.8	0	0	0	0	0	112.1	A2268 V2269 F2288 N2291 F2323 N2326 G2328 G2329	A2268-A2305 WeakPolarHBondContact CA-O 3.29Å; A2268-A2305 WeakPolarHBondContact CB-O 3.4Å; A2268-A2305 PolarHBondContact N-O 3.01Å; V2269-A2305 PolarHBondContact N-O 3.04Å; V2269-A2305 VanDerWaalsContact N-O 3.07Å; F2288-A2305 HydrophobicContact CB-CB 4.49Å; N2291-A2305 HydrophobicContact CB-CB 4.4Å; A2305-F2323 HydrophobicContact CB-CD1 4.14Å; A2305-F2323 HydrophobicContact CB-CE1 4.33Å; A2305-N2326 HydrophobicContact CB-CB 3.85Å; A2305-G2328 PolarHBondContact N-O 3.42Å; A2305-G2329 PolarHBondContact N-O 3.18Å
2306	V	95.2	Very high	87.2	Confident	1.33333 Å²	1.33333	26.4 Å²	26.4	1%	0.008	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	121.8	178.9	177	0	0	0	0	109.2	V2269 F2288 L2308 F2323 G2329 L2330 S2331	V2269-V2306 HydrophobicContact CB-CG1 4.23Å; V2269-V2306 HydrophobicContact CB-CG2 4.12Å; V2269-V2306 HydrophobicContact CG2-CG2 4.43Å; V2269-V2306 CarbonylContact O-C 3.55Å; V2269-V2306 VanDerWaalsContact O-CA 3.31Å; V2269-V2306 WeakPolarHBondContact O-CA 3.33Å; F2288-V2306 HydrophobicContact CD1-CG2 3.86Å; F2288-V2306 HydrophobicContact CD2-CG2 4.17Å; F2288-V2306 HydrophobicContact CE1-CG2 3.7Å; F2288-V2306 HydrophobicContact CE2-CG2 4.01Å; F2288-V2306 HydrophobicContact CG-CG2 4.1Å; F2288-V2306 HydrophobicContact CZ-CG2 3.77Å; V2306-L2308 HydrophobicContact CG1-CD1 4.26Å; V2306-L2308 HydrophobicContact CG1-CD2 3.95Å; V2306-L2308 HydrophobicContact CG1-CG 3.97Å; V2306-F2323 HydrophobicContact CB-CE1 3.93Å; V2306-F2323 HydrophobicContact CB-CZ 4.35Å; V2306-F2323 HydrophobicContact CG2-CE1 3.56Å; V2306-F2323 HydrophobicContact CG2-CZ 4.01Å; V2306-G2329 PolarHBondContact N-O 3.15Å; V2306-G2329 VanDerWaalsContact N-O 3.13Å; V2306-L2330 HydrophobicContact CB-CD1 3.85Å; V2306-L2330 HydrophobicContact CG1-CD1 3.61Å; V2306-L2330 CarbonylContact O-C 3.59Å; V2306-L2330 WeakPolarHBondContact O-CA 3.41Å; V2306-S2331 PolarHBondContact O-N 3.16Å
2307	R	93.5	Very high	87.9	Confident	64 Å²	64	26.7 Å²	26.7	24%	0.242	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	123.1	177.4	-146.8	-176.8	-170.3	162.6	3.3	110.8	V2269 R2270 Y2271 S2303 S2331 F2333	V2269-R2307 PolarHBondContact O-N 3.04Å; R2270-R2307 CarbonylContact C-O 3.27Å; R2270-R2307 VanDerWaalsContact CA-O 3.3Å; R2270-R2307 WeakPolarHBondContact CA-O 3.26Å; Y2271-R2307 PolarHBondContact N-O 3.21Å; S2303-R2307 VanDerWaalsContact N-NH2 3.13Å; S2303-R2307 PolarHBondContact OG-NE 3.38Å; S2303-R2307 PolarHBondContact OG-NH1 3.4Å; S2303-R2307 VanDerWaalsContact OG-NH1 3.1Å; R2307-S2331 CarbonylContact C-O 3.54Å; R2307-S2331 VanDerWaalsContact CA-O 3.31Å; R2307-S2331 WeakPolarHBondContact CA-O 3.41Å; R2307-F2333 HydrophobicContact CG-CE2 4.48Å
2308	L	93.1	Very high	88.7	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	113.5	-177.4	-50.4	175.2	0	0	0	108.9	Y2271 V2306 M2310 F2316 L2330 S2331 I2332 F2333	Y2271-L2308 CarbonylContact O-C 3.55Å; Y2271-L2308 WeakPolarHBondContact O-CA 3.27Å; V2306-L2308 HydrophobicContact CG1-CD1 4.26Å; V2306-L2308 HydrophobicContact CG1-CD2 3.95Å; V2306-L2308 HydrophobicContact CG1-CG 3.97Å; L2308-M2310 HydrophobicContact CB-CE 3.77Å; L2308-M2310 HydrophobicContact CB-CG 4.31Å; L2308-M2310 HydrophobicContact CB-SD 4.2Å; L2308-M2310 HydrophobicContact CD1-CE 3.62Å; L2308-M2310 VanDerWaalsContact CD1-CE 3.49Å; L2308-M2310 HydrophobicContact CD2-CE 4.36Å; L2308-M2310 HydrophobicContact CG-CE 4.14Å; L2308-F2316 HydrophobicContact CD1-CD2 4.17Å; L2308-F2316 HydrophobicContact CD1-CE2 3.39Å; L2308-F2316 VanDerWaalsContact CD1-CE2 3.45Å; L2308-F2316 HydrophobicContact CD1-CZ 3.7Å; L2308-L2330 HydrophobicContact CD1-CD1 4.28Å; L2308-S2331 PolarHBondContact N-O 3.03Å; L2308-I2332 HydrophobicContact CB-CG1 4.44Å; L2308-I2332 HydrophobicContact CD1-CD1 4.46Å; L2308-I2332 HydrophobicContact CD1-CG1 4.3Å; L2308-I2332 CarbonylContact O-C 3.58Å; L2308-I2332 WeakPolarHBondContact O-CA 3.28Å; L2308-F2333 PolarHBondContact O-N 3.11Å
2309	S	90.1	Very high	89.4	Confident	15 Å²	15	21.4 Å²	21.4	11%	0.105	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	94	173.5	-43.5	0	0	0	0	108.3	Y2271 D2272 C2273 F2333	Y2271-S2309 PolarHBondContact O-N 3.26Å; D2272-S2309 WeakPolarHBondContact OD1-CB 3.35Å; D2272-S2309 PolarHBondContact OD1-OG 3.01Å; C2273-S2309 PolarHBondContact N-O 3.19Å; C2273-S2309 VanDerWaalsContact N-O 3.1Å; C2273-S2309 PolarHBondContact SG-O 3.03Å; C2273-S2309 VanDerWaalsContact SG-O 3.37Å; S2309-F2333 CarbonylContact C-O 3.53Å; S2309-F2333 WeakPolarHBondContact CA-O 3.27Å
2310	M	88.8	Confident	90	Very high	1.33333 Å²	1.33333	22.9 Å²	22.9	1%	0.007	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.1	-171.6	-65.3	-175.3	-179.8	0	0	111.6	Y2271 C2273 V2281 L2308 T2313 F2316 F2333 A2334 A2335 M2343	Y2271-M2310 HydrophobicContact CD1-CE 4.15Å; Y2271-M2310 HydrophobicContact CD1-CG 4.18Å; Y2271-M2310 HydrophobicContact CE1-CE 4.33Å; Y2271-M2310 HydrophobicContact CE1-CG 4.16Å; C2273-M2310 VanDerWaalsContact SG-CA 3.59Å; V2281-M2310 HydrophobicContact CB-CE 3.86Å; V2281-M2310 HydrophobicContact CG1-CE 4.08Å; V2281-M2310 HydrophobicContact CG2-CE 3.78Å; V2281-M2310 HydrophobicContact CG2-SD 4.38Å; L2308-M2310 HydrophobicContact CB-CE 3.77Å; L2308-M2310 HydrophobicContact CB-CG 4.31Å; L2308-M2310 HydrophobicContact CB-SD 4.2Å; L2308-M2310 HydrophobicContact CD1-CE 3.62Å; L2308-M2310 VanDerWaalsContact CD1-CE 3.49Å; L2308-M2310 HydrophobicContact CD2-CE 4.36Å; L2308-M2310 HydrophobicContact CG-CE 4.14Å; M2310-T2313 HydrophobicContact SD-CG2 4.09Å; M2310-F2316 HydrophobicContact CE-CB 4.32Å; M2310-F2316 HydrophobicContact CE-CD2 3.56Å; M2310-F2316 VanDerWaalsContact CE-CD2 3.5Å; M2310-F2316 HydrophobicContact CE-CE2 4.11Å; M2310-F2316 HydrophobicContact CE-CG 4.08Å; M2310-F2316 HydrophobicContact SD-CB 4.2Å; M2310-F2316 HydrophobicContact SD-CD2 4.37Å; M2310-F2316 HydrophobicContact SD-CG 4.31Å; M2310-F2333 PolarHBondContact N-O 2.96Å; M2310-A2334 CarbonylContact O-C 3.57Å; M2310-A2334 VanDerWaalsContact O-CA 3.28Å; M2310-A2334 WeakPolarHBondContact O-CA 3.21Å; M2310-A2335 PolarHBondContact O-N 2.86Å; M2310-M2343 HydrophobicContact CB-CE 4.21Å; M2310-M2343 HydrophobicContact CE-CE 4.44Å; M2310-M2343 HydrophobicContact CG-CE 4.26Å; M2310-M2343 HydrophobicContact SD-CE 3.38Å; M2310-M2343 WeakPolarHBondContact SD-CE 3.32Å; M2310-M2343 HydrophobicContact SD-SD 3.86Å
2311	Y	85.1	Confident	90.4	Very high	44.3333 Å²	44.3333	22.9 Å²	22.9	17%	0.174	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	133.7	175.1	-67.7	-101.7	0	0	0	108.4	L2107 C2273 N2278 T2313 F2333 A2335	L2107-Y2311 HydrophobicContact CD2-CD2 4.18Å; L2107-Y2311 HydrophobicContact CD2-CE2 3.53Å; L2107-Y2311 HydrophobicContact CG-CE2 4.07Å; C2273-Y2311 WeakPolarHBondContact O-CD2 3.36Å; C2273-Y2311 PolarHBondContact SG-N 3.22Å; C2273-Y2311 VanDerWaalsContact SG-N 3.4Å; N2278-Y2311 WeakPolarHBondContact CB-O 3.21Å; N2278-Y2311 PolarHBondContact ND2-O 3.13Å; Y2311-T2313 PolarHBondContact O-N 2.89Å; Y2311-T2313 PolarHBondContact O-OG1 3.1Å; Y2311-T2313 VanDerWaalsContact O-OG1 3.09Å; Y2311-F2333 AromaticContact CE1-CE1 3.91Å; Y2311-F2333 HydrophobicContact CE1-CE1 3.91Å; Y2311-F2333 HydrophobicContact CE2-CD1 4.25Å; Y2311-F2333 HydrophobicContact CE2-CE1 4.17Å; Y2311-F2333 AromaticContact CZ-CE1 3.56Å; Y2311-F2333 VanDerWaalsContact OH-CE1 3.31Å; Y2311-F2333 WeakPolarHBondContact OH-CE1 3.24Å; Y2311-A2335 CarbonylContact C-O 3.54Å; Y2311-A2335 VanDerWaalsContact CA-O 3.3Å; Y2311-A2335 WeakPolarHBondContact CA-O 3.21Å; Y2311-A2335 HydrophobicContact CD1-CB 3.94Å; Y2311-A2335 HydrophobicContact CE1-CB 4.1Å
2312	N	84.6	Confident	90.8	Very high	3.66667 Å²	3.66667	23.4 Å²	23.4	2%	0.02	12%	0.118	C	C	.	.	S	Bend	trans	45.8	38.3	179.7	-60.2	-36.5	0	0	0	114.3	G2275 D2276 N2278 A2335 S2336 T2337 A2341	G2275-N2312 PolarHBondContact O-ND2 2.93Å; D2276-N2312 WeakPolarHBondContact O-CB 3.29Å; D2276-N2312 PolarHBondContact O-ND2 3.07Å; N2278-N2312 PolarHBondContact N-O 3.04Å; N2312-A2335 PolarHBondContact N-O 3.17Å; N2312-S2336 VanDerWaalsContact OD1-CA 3.24Å; N2312-S2336 WeakPolarHBondContact OD1-CA 3.39Å; N2312-T2337 PolarHBondContact OD1-N 2.86Å; N2312-T2337 PolarHBondContact OD1-OG1 3.05Å; N2312-A2341 HydrophobicContact CB-CB 4.22Å
2313	T	88	Confident	91.2	Very high	2.33333 Å²	2.33333	22.9 Å²	22.9	1%	0.014	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-96.9	118.3	179.2	-62.5	0	0	0	0	109.1	N2278 A2279 M2310 Y2311 M2343	N2278-T2313 WeakPolarHBondContact CB-OG1 3.22Å; A2279-T2313 VanDerWaalsContact O-CG2 3.26Å; A2279-T2313 WeakPolarHBondContact O-CG2 3.22Å; M2310-T2313 HydrophobicContact SD-CG2 4.09Å; Y2311-T2313 PolarHBondContact O-N 2.89Å; Y2311-T2313 PolarHBondContact O-OG1 3.1Å; Y2311-T2313 VanDerWaalsContact O-OG1 3.09Å; T2313-M2343 WeakPolarHBondContact O-CA 3.43Å; T2313-M2343 WeakPolarHBondContact O-CB 3.42Å; T2313-M2343 WeakPolarHBondContact O-CG 3.42Å; T2313-M2343 PolarHBondContact O-N 2.79Å
2314	Q	88	Confident	91.7	Very high	103.333 Å²	103.333	22.3 Å²	22.3	48%	0.483	11%	0.108	S	C	.	.			trans	-75.2	-31.5	-171.7	-67.7	179.7	-17.1	0	0	114.2	V2344	Q2314-V2344 PolarHBondContact O-N 3.22Å
2315	S	90.9	Very high	91.9	Very high	37.3333 Å²	37.3333	26.9 Å²	26.9	26%	0.261	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	135.7	-174.9	179.9	0	0	0	0	111.8	V2281 V2344	V2281-S2315 PolarHBondContact N-O 3.1Å; S2315-V2344 WeakPolarHBondContact CA-O 3.36Å
2316	F	93.9	Very high	92	Very high	1 Å²	1	26.9 Å²	26.9	0%	0.004	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	133.9	172.6	164.8	-111.2	0	0	0	109.9	V2281 L2308 M2310 L2318 I2332 M2343 V2344 G2345 L2346 I2347	V2281-F2316 HydrophobicContact CB-CD2 4.11Å; V2281-F2316 HydrophobicContact CG1-CD2 4.08Å; V2281-F2316 HydrophobicContact CG1-CE2 4.32Å; V2281-F2316 CarbonylContact O-C 3.05Å; V2281-F2316 WeakPolarHBondContact O-CA 3.38Å; L2308-F2316 HydrophobicContact CD1-CD2 4.17Å; L2308-F2316 HydrophobicContact CD1-CE2 3.39Å; L2308-F2316 VanDerWaalsContact CD1-CE2 3.45Å; L2308-F2316 HydrophobicContact CD1-CZ 3.7Å; M2310-F2316 HydrophobicContact CE-CB 4.32Å; M2310-F2316 HydrophobicContact CE-CD2 3.56Å; M2310-F2316 VanDerWaalsContact CE-CD2 3.5Å; M2310-F2316 HydrophobicContact CE-CE2 4.11Å; M2310-F2316 HydrophobicContact CE-CG 4.08Å; M2310-F2316 HydrophobicContact SD-CB 4.2Å; M2310-F2316 HydrophobicContact SD-CD2 4.37Å; M2310-F2316 HydrophobicContact SD-CG 4.31Å; F2316-L2318 HydrophobicContact CE1-CB 4.1Å; F2316-L2318 HydrophobicContact CE2-CB 4.21Å; F2316-L2318 HydrophobicContact CZ-CB 3.57Å; F2316-L2318 VanDerWaalsContact CZ-CB 3.47Å; F2316-L2318 HydrophobicContact CZ-CD2 4.41Å; F2316-L2318 HydrophobicContact CZ-CG 4.47Å; F2316-I2332 HydrophobicContact CD1-CD1 3.89Å; F2316-I2332 HydrophobicContact CE1-CD1 3.26Å; F2316-I2332 HydrophobicContact CZ-CD1 3.73Å; F2316-M2343 HydrophobicContact CB-CE 3.81Å; F2316-M2343 HydrophobicContact CB-CG 4.32Å; F2316-M2343 HydrophobicContact CB-SD 4.02Å; F2316-M2343 HydrophobicContact CG-CE 4.29Å; F2316-V2344 PolarHBondContact N-O 2.85Å; F2316-V2344 VanDerWaalsContact N-O 3.14Å; F2316-G2345 CarbonylContact O-C 3.54Å; F2316-G2345 VanDerWaalsContact O-CA 3.27Å; F2316-G2345 WeakPolarHBondContact O-CA 3.4Å; F2316-L2346 PolarHBondContact O-N 3.04Å; F2316-I2347 HydrophobicContact CE1-CG1 4Å
2317	K	93.8	Very high	91.7	Very high	73 Å²	73	27 Å²	27	32%	0.317	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.7	178.4	-95	177.5	176.6	-171.1	0	109.8	V2281 D2282 I2283 Q2319 L2346	V2281-K2317 PolarHBondContact O-N 2.88Å; D2282-K2317 WeakPolarHBondContact CA-O 3.41Å; D2282-K2317 HydrophobicContact CB-CB 4.4Å; D2282-K2317 WeakPolarHBondContact OD1-CB 3.31Å; D2282-K2317 VanDerWaalsContact OD1-CD 3.23Å; D2282-K2317 WeakPolarHBondContact OD1-CD 3.41Å; D2282-K2317 WeakPolarHBondContact OD1-CE 3.28Å; D2282-K2317 VanDerWaalsContact OD1-CG 3.22Å; D2282-K2317 WeakPolarHBondContact OD1-CG 3.32Å; D2282-K2317 IonicContact OD1-NZ 3.42Å; D2282-K2317 PolarHBondContact OD1-NZ 3.39Å; D2282-K2317 IonicContact OD2-NZ 2.69Å; D2282-K2317 PolarHBondContact OD2-NZ 3.4Å; I2283-K2317 PolarHBondContact N-O 3.31Å; K2317-Q2319 HydrophobicContact CG-CG 3.73Å; K2317-L2346 CarbonylContact C-O 3.59Å; K2317-L2346 WeakPolarHBondContact CA-O 3.42Å; K2317-L2346 HydrophobicContact CG-CB 4.46Å
2318	L	95.1	Very high	91.5	Very high	1 Å²	1	24 Å²	24	1%	0.005	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	116.9	171.8	176	67.8	0	0	0	108.6	I2283 F2316 F2323 L2330 L2346 I2347 R2348	I2283-L2318 HydrophobicContact CB-CD1 3.67Å; I2283-L2318 HydrophobicContact CD1-CD1 4.47Å; I2283-L2318 HydrophobicContact CG2-CD1 3.55Å; I2283-L2318 CarbonylContact O-C 3.53Å; I2283-L2318 VanDerWaalsContact O-CA 3.3Å; I2283-L2318 WeakPolarHBondContact O-CA 3.33Å; F2316-L2318 HydrophobicContact CE1-CB 4.1Å; F2316-L2318 HydrophobicContact CE2-CB 4.21Å; F2316-L2318 HydrophobicContact CZ-CB 3.57Å; F2316-L2318 VanDerWaalsContact CZ-CB 3.47Å; F2316-L2318 HydrophobicContact CZ-CD2 4.41Å; F2316-L2318 HydrophobicContact CZ-CG 4.47Å; L2318-F2323 HydrophobicContact CD2-CE2 4.07Å; L2318-F2323 HydrophobicContact CD2-CZ 4.15Å; L2318-L2330 HydrophobicContact CD2-CD1 4.4Å; L2318-L2330 HydrophobicContact CD2-CD2 3.43Å; L2318-L2330 VanDerWaalsContact CD2-CD2 3.45Å; L2318-L2330 HydrophobicContact CD2-CG 4.42Å; L2318-L2346 PolarHBondContact N-O 2.9Å; L2318-I2347 HydrophobicContact CD2-CG2 4.33Å; L2318-I2347 WeakPolarHBondContact O-CA 3.4Å; L2318-R2348 PolarHBondContact O-N 2.84Å
2319	Q	92.3	Very high	91.5	Very high	22.6667 Å²	22.6667	23.9 Å²	23.9	11%	0.106	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.8	-171.6	-55.4	-167.1	-6.9	0	0	112.5	I2283 D2284 L2285 K2317 S2321 L2346 R2348	I2283-Q2319 PolarHBondContact O-N 3.15Å; D2284-Q2319 WeakPolarHBondContact CA-O 3.26Å; D2284-Q2319 WeakPolarHBondContact OD1-CB 3.41Å; L2285-Q2319 PolarHBondContact N-O 3.06Å; K2317-Q2319 HydrophobicContact CG-CG 3.73Å; Q2319-S2321 WeakPolarHBondContact O-CB 3.33Å; Q2319-S2321 PolarHBondContact O-N 2.92Å; Q2319-S2321 PolarHBondContact O-OG 3.19Å; Q2319-L2346 VanDerWaalsContact NE2-CD2 3.3Å; Q2319-R2348 WeakPolarHBondContact CA-O 3.38Å; Q2319-R2348 HydrophobicContact CB-CG 4.11Å; Q2319-R2348 HydrophobicContact CG-CB 4.36Å; Q2319-R2348 HydrophobicContact CG-CG 3.7Å; Q2319-R2348 VanDerWaalsContact NE2-CZ 3.35Å; Q2319-R2348 VanDerWaalsContact NE2-NE 3.15Å; Q2319-R2348 VanDerWaalsContact OE1-CZ 3.24Å; Q2319-R2348 VanDerWaalsContact OE1-NE 3.15Å
2320	N	93	Very high	91.7	Very high	40 Å²	40	23.2 Å²	23.2	21%	0.214	11%	0.108	C	C	.	.	S	Bend	trans	49.4	33.9	169.2	-47.7	-52.7	0	0	0	114.1	D2284 L2285 R2348 N2349 P2619 A2621	D2284-N2320 WeakPolarHBondContact OD1-CB 3.42Å; D2284-N2320 PolarHBondContact OD1-ND2 3.17Å; L2285-N2320 WeakPolarHBondContact CA-O 3.3Å; L2285-N2320 HydrophobicContact CD2-CB 3.75Å; L2285-N2320 HydrophobicContact CG-CB 4.24Å; N2320-R2348 PolarHBondContact N-O 2.87Å; N2320-R2348 VanDerWaalsContact N-O 3.14Å; N2320-N2349 VanDerWaalsContact CA-O 3.3Å; N2320-N2349 WeakPolarHBondContact CA-O 3.29Å; N2320-N2349 VanDerWaalsContact OD1-CB 3.24Å; N2320-N2349 WeakPolarHBondContact OD1-CB 3.46Å; N2320-N2349 PolarHBondContact OD1-ND2 3.16Å; N2320-P2619 CarbonylContact C-O 3.49Å; N2320-P2619 WeakPolarHBondContact CA-O 3.22Å; N2320-A2621 WeakPolarHBondContact O-CB 3.36Å; N2320-A2621 PolarHBondContact O-N 3.5Å
2321	S	95.1	Very high	92	Very high	1 Å²	1	24 Å²	24	1%	0.007	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-114	148.6	-170.1	-65.4	0	0	0	0	112.3	C2286 Q2319 C2350 A2351	C2286-S2321 PolarHBondContact N-OG 3.12Å; C2286-S2321 VanDerWaalsContact N-OG 3.14Å; C2286-S2321 CarbonylContact O-C 3.5Å; C2286-S2321 WeakPolarHBondContact O-CA 3.44Å; C2286-S2321 VanDerWaalsContact O-CB 3.25Å; C2286-S2321 WeakPolarHBondContact O-CB 3.39Å; Q2319-S2321 WeakPolarHBondContact O-CB 3.33Å; Q2319-S2321 PolarHBondContact O-N 2.92Å; Q2319-S2321 PolarHBondContact O-OG 3.19Å; S2321-C2350 CarbonylContact O-C 3.48Å; S2321-C2350 WeakPolarHBondContact O-CA 3.39Å; S2321-C2350 WeakPolarHBondContact O-CB 3.39Å; S2321-A2351 PolarHBondContact O-N 3.23Å
2322	M	94.4	Very high	92.4	Very high	26 Å²	26	21.9 Å²	21.9	13%	0.128	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.1	-178.2	154.2	97.7	-154.7	0	0	112.1	C2286 S2287 F2288 N2289 F2324 A2351 V2622 F2630	C2286-M2322 PolarHBondContact O-N 3.13Å; S2287-M2322 PolarHBondContact OG-SD 2.81Å; F2288-M2322 WeakPolarHBondContact CA-O 3.47Å; F2288-M2322 WeakPolarHBondContact CB-O 3.24Å; F2288-M2322 WeakPolarHBondContact CD2-O 3.38Å; F2288-M2322 PolarHBondContact N-O 3.05Å; N2289-M2322 WeakPolarHBondContact OD1-CE 3.03Å; M2322-F2324 HydrophobicContact CE-CB 4.05Å; M2322-F2324 HydrophobicContact CE-CD2 3.86Å; M2322-F2324 HydrophobicContact CE-CG 4.14Å; M2322-F2324 HydrophobicContact CG-CB 4.19Å; M2322-A2351 CarbonylContact C-O 3.54Å; M2322-A2351 WeakPolarHBondContact CA-O 3.38Å; M2322-A2351 HydrophobicContact CE-CB 4.39Å; M2322-A2351 HydrophobicContact SD-CB 3.33Å; M2322-A2351 WeakPolarHBondContact SD-CB 3.42Å; M2322-V2622 HydrophobicContact CB-CG1 3.54Å; M2322-V2622 HydrophobicContact CG-CG1 3.48Å; M2322-V2622 VanDerWaalsContact CG-CG1 3.48Å; M2322-F2630 HydrophobicContact CE-CD2 3.42Å; M2322-F2630 VanDerWaalsContact CE-CD2 3.42Å; M2322-F2630 HydrophobicContact CE-CE2 3.56Å; M2322-F2630 HydrophobicContact CE-CG 4.28Å; M2322-F2630 HydrophobicContact CE-CZ 4.5Å
2323	F	95.4	Very high	92.7	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	98.4	174.1	-67.7	-99.7	0	0	0	109	F2288 A2305 V2306 L2318 L2330 A2351 F2352 G2353 N2355	F2288-F2323 HydrophobicContact CB-CD1 4.01Å; F2288-F2323 HydrophobicContact CB-CE1 4.3Å; F2288-F2323 HydrophobicContact CB-CG 4.44Å; F2288-F2323 AromaticContact CD2-CD1 3.85Å; F2288-F2323 HydrophobicContact CD2-CD1 3.99Å; F2288-F2323 HydrophobicContact CD2-CD2 4.28Å; F2288-F2323 AromaticContact CD2-CE1 3.6Å; F2288-F2323 HydrophobicContact CD2-CE1 3.6Å; F2288-F2323 VanDerWaalsContact CD2-CE1 3.45Å; F2288-F2323 AromaticContact CD2-CE2 3.89Å; F2288-F2323 HydrophobicContact CD2-CE2 3.89Å; F2288-F2323 HydrophobicContact CD2-CG 4.32Å; F2288-F2323 AromaticContact CD2-CZ 3.53Å; F2288-F2323 HydrophobicContact CD2-CZ 3.53Å; F2288-F2323 VanDerWaalsContact CD2-CZ 3.44Å; F2288-F2323 AromaticContact CE2-CE1 3.99Å; F2288-F2323 HydrophobicContact CE2-CE1 4.17Å; F2288-F2323 HydrophobicContact CE2-CE2 4.23Å; F2288-F2323 AromaticContact CE2-CZ 3.76Å; F2288-F2323 HydrophobicContact CE2-CZ 3.76Å; F2288-F2323 HydrophobicContact CG-CD1 4.25Å; F2288-F2323 AromaticContact CG-CE1 3.94Å; F2288-F2323 HydrophobicContact CG-CE1 4.06Å; F2288-F2323 HydrophobicContact CG-CZ 4.43Å; F2288-F2323 WeakPolarHBondContact O-CA 3.4Å; A2305-F2323 HydrophobicContact CB-CD1 4.14Å; A2305-F2323 HydrophobicContact CB-CE1 4.33Å; V2306-F2323 HydrophobicContact CB-CE1 3.93Å; V2306-F2323 HydrophobicContact CB-CZ 4.35Å; V2306-F2323 HydrophobicContact CG2-CE1 3.56Å; V2306-F2323 HydrophobicContact CG2-CZ 4.01Å; L2318-F2323 HydrophobicContact CD2-CE2 4.07Å; L2318-F2323 HydrophobicContact CD2-CZ 4.15Å; F2323-L2330 HydrophobicContact CE1-CB 4.31Å; F2323-L2330 HydrophobicContact CZ-CB 4.26Å; F2323-A2351 PolarHBondContact N-O 2.97Å; F2323-F2352 HydrophobicContact CB-CD1 3.58Å; F2323-F2352 HydrophobicContact CB-CE1 4.03Å; F2323-F2352 HydrophobicContact CB-CG 4.33Å; F2323-F2352 HydrophobicContact CD1-CD1 4.46Å; F2323-F2352 HydrophobicContact CD1-CE1 4.16Å; F2323-F2352 AromaticContact CD2-CD1 3.7Å; F2323-F2352 HydrophobicContact CD2-CD1 3.7Å; F2323-F2352 AromaticContact CD2-CE1 3.28Å; F2323-F2352 HydrophobicContact CD2-CE1 3.28Å; F2323-F2352 HydrophobicContact CD2-CG 4.44Å; F2323-F2352 AromaticContact CD2-CZ 3.8Å; F2323-F2352 HydrophobicContact CD2-CZ 3.8Å; F2323-F2352 HydrophobicContact CE1-CE1 4.45Å; F2323-F2352 HydrophobicContact CE2-CD1 4.47Å; F2323-F2352 AromaticContact CE2-CE1 3.68Å; F2323-F2352 HydrophobicContact CE2-CE1 3.68Å; F2323-F2352 AromaticContact CE2-CZ 3.92Å; F2323-F2352 HydrophobicContact CE2-CZ 3.92Å; F2323-F2352 AromaticContact CG-CD1 3.67Å; F2323-F2352 HydrophobicContact CG-CD1 3.67Å; F2323-F2352 AromaticContact CG-CE1 3.57Å; F2323-F2352 HydrophobicContact CG-CE1 3.57Å; F2323-F2352 HydrophobicContact CG-CZ 4.46Å; F2323-F2352 HydrophobicContact CZ-CE1 4.25Å; F2323-F2352 CarbonylContact O-C 3.34Å; F2323-F2352 WeakPolarHBondContact O-CA 3.31Å; F2323-G2353 PolarHBondContact O-N 3.02Å; F2323-N2355 PolarHBondContact O-ND2 3.05Å; F2323-N2355 VanDerWaalsContact O-ND2 3.13Å; F2323-N2355 PolarHBondContact O-OD1 2.77Å
2324	F	94	Very high	92.8	Very high	24 Å²	24	24 Å²	24	11%	0.105	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.3	-175	-158	-118.3	0	0	0	113.1	F2288 N2289 Y2290 M2322 N2326 G2353 N2354 V2626 F2630 E2633	F2288-F2324 PolarHBondContact O-N 3.15Å; N2289-F2324 CarbonylContact C-O 3.32Å; N2289-F2324 VanDerWaalsContact CA-O 3.29Å; N2289-F2324 WeakPolarHBondContact CA-O 3.37Å; N2289-F2324 HydrophobicContact CB-CB 4.43Å; N2289-F2324 WeakPolarHBondContact OD1-CB 3.3Å; Y2290-F2324 HydrophobicContact CE2-CD1 4.35Å; Y2290-F2324 PolarHBondContact N-O 3.32Å; Y2290-F2324 VanDerWaalsContact N-O 3.1Å; M2322-F2324 HydrophobicContact CE-CB 4.05Å; M2322-F2324 HydrophobicContact CE-CD2 3.86Å; M2322-F2324 HydrophobicContact CE-CG 4.14Å; M2322-F2324 HydrophobicContact CG-CB 4.19Å; F2324-N2326 VanDerWaalsContact C-N 3.28Å; F2324-N2326 PolarHBondContact N-ND2 3.18Å; F2324-N2326 VanDerWaalsContact N-ND2 3.17Å; F2324-N2326 PolarHBondContact O-N 2.98Å; F2324-N2326 PolarHBondContact O-ND2 3.04Å; F2324-G2353 VanDerWaalsContact CA-O 3.29Å; F2324-G2353 WeakPolarHBondContact CA-O 3.41Å; F2324-G2353 VanDerWaalsContact CD2-O 3.27Å; F2324-G2353 WeakPolarHBondContact CD2-O 3.41Å; F2324-N2354 HydrophobicContact CD2-CB 4.42Å; F2324-N2354 HydrophobicContact CE1-CB 4.42Å; F2324-N2354 WeakPolarHBondContact CE1-ND2 3.27Å; F2324-N2354 HydrophobicContact CE2-CB 4.11Å; F2324-N2354 WeakPolarHBondContact CE2-ND2 3.22Å; F2324-N2354 WeakPolarHBondContact CZ-ND2 3.41Å; F2324-V2626 HydrophobicContact CD1-CG1 3.92Å; F2324-V2626 HydrophobicContact CE1-CG1 4.32Å; F2324-F2630 HydrophobicContact CD2-CD2 4.12Å; F2324-F2630 AromaticContact CE2-CD2 3.92Å; F2324-F2630 HydrophobicContact CE2-CD2 3.92Å; F2324-E2633 VanDerWaalsContact CZ-OE2 3.3Å; F2324-E2633 WeakPolarHBondContact CZ-OE2 3.43Å
2325	R	93.3	Very high	92.7	Very high	100 Å²	100	19.8 Å²	19.8	38%	0.377	10%	0.097	S	C	.	.	S	Bend	trans	54.6	37.5	173.5	-62.6	177.9	176.5	-85.6	6.4	114.7	Y2290 G2353 N2354 E2629 E2633	Y2290-R2325 WeakPolarHBondContact CA-O 3.22Å; Y2290-R2325 HydrophobicContact CD1-CB 4.02Å; Y2290-R2325 HydrophobicContact CE1-CB 4.07Å; Y2290-R2325 HydrophobicContact CE1-CG 4.33Å; Y2290-R2325 HydrophobicContact CG-CB 4.44Å; Y2290-R2325 WeakPolarHBondContact OH-CD 3.37Å; Y2290-R2325 PolarHBondContact OH-NE 3.41Å; R2325-G2353 PolarHBondContact N-O 3.12Å; R2325-G2353 VanDerWaalsContact N-O 3.12Å; R2325-N2354 VanDerWaalsContact CA-O 3.24Å; R2325-N2354 WeakPolarHBondContact CA-O 3.32Å; R2325-N2354 HydrophobicContact CG-CB 3.81Å; R2325-N2354 PolarHBondContact NH1-ND2 3.09Å; R2325-E2629 IonicContact CZ-OE1 2.66Å; R2325-E2629 IonicContact NE-OE1 3.22Å; R2325-E2629 PolarHBondContact NE-OE1 3.14Å; R2325-E2629 IonicContact NH2-OE1 3.9Å; R2325-E2629 PolarHBondContact NH2-OE1 3.36Å; R2325-E2633 IonicContact CZ-OE1 2.94Å; R2325-E2633 IonicContact NH1-OE1 3.56Å; R2325-E2633 PolarHBondContact NH1-OE1 2.96Å; R2325-E2633 IonicContact NH2-OE1 3.98Å; R2325-E2633 PolarHBondContact NH2-OE1 3.16Å; R2325-E2633 IonicContact NH2-OE2 3.97Å
2326	N	94.1	Very high	92.2	Very high	1.66667 Å²	1.66667	18.1 Å²	18.1	1%	0.009	9%	0.086	C	C	.	.			trans	-96.3	158.3	176.2	-53.6	-73.1	0	0	0	111.4	F2288 Y2290 N2291 A2305 F2324 G2328 N2355 V2356	F2288-N2326 PolarHBondContact O-ND2 3.13Å; F2288-N2326 PolarHBondContact O-OD1 2.95Å; Y2290-N2326 PolarHBondContact N-OD1 3.07Å; N2291-N2326 VanDerWaalsContact CB-OD1 3.28Å; N2291-N2326 WeakPolarHBondContact CB-OD1 3.47Å; N2291-N2326 PolarHBondContact N-OD1 3.01Å; N2291-N2326 PolarHBondContact ND2-OD1 3Å; N2291-N2326 CarbonylContact O-C 3.53Å; N2291-N2326 VanDerWaalsContact O-CA 3.25Å; N2291-N2326 WeakPolarHBondContact O-CA 3.39Å; N2291-N2326 WeakPolarHBondContact O-CB 3.4Å; A2305-N2326 HydrophobicContact CB-CB 3.85Å; F2324-N2326 VanDerWaalsContact C-N 3.28Å; F2324-N2326 PolarHBondContact N-ND2 3.18Å; F2324-N2326 VanDerWaalsContact N-ND2 3.17Å; F2324-N2326 PolarHBondContact O-N 2.98Å; F2324-N2326 PolarHBondContact O-ND2 3.04Å; N2326-G2328 VanDerWaalsContact C-N 3.31Å; N2326-G2328 VanDerWaalsContact CB-O 3.26Å; N2326-G2328 WeakPolarHBondContact CB-O 3.41Å; N2326-G2328 PolarHBondContact O-N 2.99Å; N2326-G2328 VanDerWaalsContact O-N 3.08Å; N2326-N2355 WeakPolarHBondContact CB-OD1 3.39Å; N2326-N2355 PolarHBondContact N-OD1 3.14Å; N2326-N2355 PolarHBondContact ND2-OD1 3.13Å; N2326-N2355 VanDerWaalsContact ND2-OD1 3.1Å; N2326-N2355 CarbonylContact O-C 3.39Å; N2326-N2355 VanDerWaalsContact O-CA 3.29Å; N2326-N2355 WeakPolarHBondContact O-CA 3.18Å; N2326-V2356 PolarHBondContact O-N 3.45Å
2327	A	90.1	Very high	91.3	Very high	3.66667 Å²	3.66667	21 Å²	21	3%	0.03	10%	0.104	C	C	.	.	B	Isolated β-bridge	trans	-74.5	69.2	168	0	0	0	0	0	110.8	N2291 T2300 S2302 G2304 V2356 W2358	N2291-A2327 PolarHBondContact O-N 3.03Å; N2291-A2327 VanDerWaalsContact O-N 3.14Å; T2300-A2327 HydrophobicContact CG2-CB 4.47Å; S2302-A2327 PolarHBondContact OG-O 3.05Å; G2304-A2327 VanDerWaalsContact CA-O 3.28Å; G2304-A2327 WeakPolarHBondContact CA-O 3.45Å; G2304-A2327 PolarHBondContact N-O 2.94Å; A2327-V2356 CarbonylContact C-O 3.58Å; A2327-V2356 WeakPolarHBondContact CA-O 3.43Å; A2327-W2358 WeakPolarHBondContact O-CB 3.08Å
2328	G	89.1	Confident	90.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	96.9	161.1	-169.4	0	0	0	0	0	112.9	A2305 N2326 V2356	A2305-G2328 PolarHBondContact N-O 3.42Å; N2326-G2328 VanDerWaalsContact C-N 3.31Å; N2326-G2328 VanDerWaalsContact CB-O 3.26Å; N2326-G2328 WeakPolarHBondContact CB-O 3.41Å; N2326-G2328 PolarHBondContact O-N 2.99Å; N2326-G2328 VanDerWaalsContact O-N 3.08Å; G2328-V2356 PolarHBondContact N-O 3.15Å; G2328-V2356 VanDerWaalsContact N-O 3.11Å
2329	G	92	Very high	89.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.132	C	C	.	.			trans	-103.5	-110.6	-175.7	0	0	0	0	0	113.4	A2305 V2306 E2359 T2360	A2305-G2329 PolarHBondContact N-O 3.18Å; V2306-G2329 PolarHBondContact N-O 3.15Å; V2306-G2329 VanDerWaalsContact N-O 3.13Å; G2329-E2359 PolarHBondContact N-O 3.32Å; G2329-E2359 VanDerWaalsContact N-O 3.14Å; G2329-T2360 CarbonylContact C-O 3.34Å; G2329-T2360 VanDerWaalsContact CA-O 3.24Å; G2329-T2360 WeakPolarHBondContact CA-O 3.4Å
2330	L	95.3	Very high	88.9	Confident	1.33333 Å²	1.33333	28.3 Å²	28.3	1%	0.007	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.8	-178.3	176.2	65.5	0	0	0	110.7	V2306 L2308 L2318 F2323 I2332 I2347 F2352 T2360 L2361 K2362	V2306-L2330 HydrophobicContact CB-CD1 3.85Å; V2306-L2330 HydrophobicContact CG1-CD1 3.61Å; V2306-L2330 CarbonylContact O-C 3.59Å; V2306-L2330 WeakPolarHBondContact O-CA 3.41Å; L2308-L2330 HydrophobicContact CD1-CD1 4.28Å; L2318-L2330 HydrophobicContact CD2-CD1 4.4Å; L2318-L2330 HydrophobicContact CD2-CD2 3.43Å; L2318-L2330 VanDerWaalsContact CD2-CD2 3.45Å; L2318-L2330 HydrophobicContact CD2-CG 4.42Å; F2323-L2330 HydrophobicContact CE1-CB 4.31Å; F2323-L2330 HydrophobicContact CZ-CB 4.26Å; L2330-I2332 HydrophobicContact CD1-CD1 4.38Å; L2330-I2332 HydrophobicContact CD1-CG1 4.08Å; L2330-I2332 HydrophobicContact CD2-CD1 4.01Å; L2330-I2332 HydrophobicContact CD2-CG1 4.39Å; L2330-I2332 HydrophobicContact CG-CD1 4.22Å; L2330-I2332 HydrophobicContact CG-CG1 4.05Å; L2330-I2347 HydrophobicContact CD2-CD1 3.82Å; L2330-I2347 HydrophobicContact CD2-CG1 4.37Å; L2330-F2352 HydrophobicContact CB-CE1 3.99Å; L2330-F2352 HydrophobicContact CB-CZ 4.38Å; L2330-T2360 PolarHBondContact N-O 3.29Å; L2330-L2361 HydrophobicContact CB-CD1 4.16Å; L2330-L2361 HydrophobicContact CD2-CD1 3.83Å; L2330-L2361 HydrophobicContact CG-CD1 4.16Å; L2330-L2361 CarbonylContact O-C 3.39Å; L2330-L2361 WeakPolarHBondContact O-CA 3.26Å; L2330-K2362 PolarHBondContact O-N 3.06Å
2331	S	94	Very high	88.2	Confident	17.3333 Å²	17.3333	26.8 Å²	26.8	12%	0.121	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	118.7	173.8	179.3	0	0	0	0	110.7	V2306 R2307 L2308 F2333 K2362	V2306-S2331 PolarHBondContact O-N 3.16Å; R2307-S2331 CarbonylContact C-O 3.54Å; R2307-S2331 VanDerWaalsContact CA-O 3.31Å; R2307-S2331 WeakPolarHBondContact CA-O 3.41Å; L2308-S2331 PolarHBondContact N-O 3.03Å; S2331-F2333 WeakPolarHBondContact OG-CE2 3.29Å; S2331-K2362 CarbonylContact C-O 3.51Å; S2331-K2362 WeakPolarHBondContact CA-O 3.28Å
2332	I	93.6	Very high	87.7	Confident	0.333333 Å²	0.333333	31.8 Å²	31.8	0%	0.002	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.2	177.2	-56	177.5	0	0	0	108.8	L2308 F2316 L2330 A2334 M2343 I2347 K2362 L2363 V2364	L2308-I2332 HydrophobicContact CB-CG1 4.44Å; L2308-I2332 HydrophobicContact CD1-CD1 4.46Å; L2308-I2332 HydrophobicContact CD1-CG1 4.3Å; L2308-I2332 CarbonylContact O-C 3.58Å; L2308-I2332 WeakPolarHBondContact O-CA 3.28Å; F2316-I2332 HydrophobicContact CD1-CD1 3.89Å; F2316-I2332 HydrophobicContact CE1-CD1 3.26Å; F2316-I2332 HydrophobicContact CZ-CD1 3.73Å; L2330-I2332 HydrophobicContact CD1-CD1 4.38Å; L2330-I2332 HydrophobicContact CD1-CG1 4.08Å; L2330-I2332 HydrophobicContact CD2-CD1 4.01Å; L2330-I2332 HydrophobicContact CD2-CG1 4.39Å; L2330-I2332 HydrophobicContact CG-CD1 4.22Å; L2330-I2332 HydrophobicContact CG-CG1 4.05Å; I2332-A2334 HydrophobicContact CG2-CB 4.36Å; I2332-M2343 HydrophobicContact CG2-CE 4.25Å; I2332-I2347 HydrophobicContact CD1-CD1 4.31Å; I2332-K2362 PolarHBondContact N-O 3.26Å; I2332-L2363 HydrophobicContact CB-CD2 3.87Å; I2332-L2363 HydrophobicContact CD1-CD2 3.84Å; I2332-L2363 HydrophobicContact CG1-CD2 4.09Å; I2332-V2364 PolarHBondContact O-N 2.97Å
2333	F	91.3	Very high	87.5	Confident	48.3333 Å²	48.3333	30.7 Å²	30.7	21%	0.212	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.3	164.2	-152.2	-91.4	0	0	0	107.5	R2307 L2308 S2309 M2310 Y2311 S2331 A2335 K2362 V2364 R2366	R2307-F2333 HydrophobicContact CG-CE2 4.48Å; L2308-F2333 PolarHBondContact O-N 3.11Å; S2309-F2333 CarbonylContact C-O 3.53Å; S2309-F2333 WeakPolarHBondContact CA-O 3.27Å; M2310-F2333 PolarHBondContact N-O 2.96Å; Y2311-F2333 AromaticContact CE1-CE1 3.91Å; Y2311-F2333 HydrophobicContact CE1-CE1 3.91Å; Y2311-F2333 HydrophobicContact CE2-CD1 4.25Å; Y2311-F2333 HydrophobicContact CE2-CE1 4.17Å; Y2311-F2333 AromaticContact CZ-CE1 3.56Å; Y2311-F2333 VanDerWaalsContact OH-CE1 3.31Å; Y2311-F2333 WeakPolarHBondContact OH-CE1 3.24Å; S2331-F2333 WeakPolarHBondContact OG-CE2 3.29Å; F2333-A2335 HydrophobicContact CE1-CB 4.11Å; F2333-A2335 HydrophobicContact CZ-CB 4.39Å; F2333-K2362 HydrophobicContact CZ-CD 4.31Å; F2333-V2364 CarbonylContact C-O 3.58Å; F2333-V2364 WeakPolarHBondContact CA-O 3.24Å; F2333-V2364 HydrophobicContact CD1-CB 3.67Å; F2333-V2364 HydrophobicContact CD1-CG1 4.13Å; F2333-V2364 HydrophobicContact CD1-CG2 4.1Å; F2333-V2364 HydrophobicContact CD2-CB 4.08Å; F2333-V2364 HydrophobicContact CD2-CG1 3.87Å; F2333-V2364 HydrophobicContact CE1-CB 3.96Å; F2333-V2364 HydrophobicContact CE1-CG1 4.46Å; F2333-V2364 HydrophobicContact CE1-CG2 3.85Å; F2333-V2364 HydrophobicContact CE2-CG1 4.11Å; F2333-R2366 HydrophobicContact CZ-CG 4.46Å
2334	A	89.7	Confident	87.3	Confident	1.66667 Å²	1.66667	33.4 Å²	33.4	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	127.7	-178	0	0	0	0	0	111.4	M2310 I2332 M2343 V2364 G2365 R2366 Q2369 M2394	M2310-A2334 CarbonylContact O-C 3.57Å; M2310-A2334 VanDerWaalsContact O-CA 3.28Å; M2310-A2334 WeakPolarHBondContact O-CA 3.21Å; I2332-A2334 HydrophobicContact CG2-CB 4.36Å; A2334-M2343 HydrophobicContact CB-CE 3.61Å; A2334-M2343 VanDerWaalsContact CB-CE 3.45Å; A2334-M2343 HydrophobicContact CB-SD 3.97Å; A2334-V2364 PolarHBondContact N-O 2.92Å; A2334-G2365 CarbonylContact O-C 3.55Å; A2334-G2365 VanDerWaalsContact O-CA 3.26Å; A2334-G2365 WeakPolarHBondContact O-CA 3.37Å; A2334-R2366 PolarHBondContact O-N 3.12Å; A2334-Q2369 HydrophobicContact CB-CB 4.48Å; A2334-Q2369 HydrophobicContact CB-CG 3.92Å; A2334-Q2369 WeakPolarHBondContact O-CG 3.45Å; A2334-M2394 HydrophobicContact CB-CE 3.64Å; A2334-M2394 HydrophobicContact CB-SD 4.5Å
2335	A	85.6	Confident	87.2	Confident	14.6667 Å²	14.6667	32.3 Å²	32.3	12%	0.121	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	148.7	175.8	0	0	0	0	0	111	M2310 Y2311 N2312 F2333 R2366 Q2369	M2310-A2335 PolarHBondContact O-N 2.86Å; Y2311-A2335 CarbonylContact C-O 3.54Å; Y2311-A2335 VanDerWaalsContact CA-O 3.3Å; Y2311-A2335 WeakPolarHBondContact CA-O 3.21Å; Y2311-A2335 HydrophobicContact CD1-CB 3.94Å; Y2311-A2335 HydrophobicContact CE1-CB 4.1Å; N2312-A2335 PolarHBondContact N-O 3.17Å; F2333-A2335 HydrophobicContact CE1-CB 4.11Å; F2333-A2335 HydrophobicContact CZ-CB 4.39Å; A2335-R2366 HydrophobicContact CB-CB 4.12Å; A2335-Q2369 VanDerWaalsContact C-NE2 3.33Å
2336	S	80.6	Confident	87.2	Confident	3.33333 Å²	3.33333	28.9 Å²	28.9	2%	0.023	17%	0.169	C	C	.	.			trans	-139.6	147.2	171.7	59.9	0	0	0	0	111.8	N2312 T2338 A2341 R2366 N2367 Q2369	N2312-S2336 VanDerWaalsContact OD1-CA 3.24Å; N2312-S2336 WeakPolarHBondContact OD1-CA 3.39Å; S2336-T2338 PolarHBondContact OG-O 3.18Å; S2336-A2341 WeakPolarHBondContact CB-O 3.35Å; S2336-R2366 PolarHBondContact N-O 3.02Å; S2336-N2367 VanDerWaalsContact O-CB 3.22Å; S2336-N2367 WeakPolarHBondContact O-CB 3.36Å; S2336-N2367 PolarHBondContact O-ND2 3.18Å; S2336-N2367 PolarHBondContact OG-O 2.93Å; S2336-N2367 VanDerWaalsContact OG-O 3.07Å; S2336-Q2369 VanDerWaalsContact CB-NE2 3.32Å; S2336-Q2369 VanDerWaalsContact N-NE2 3.18Å; S2336-Q2369 PolarHBondContact OG-NE2 3.13Å
2337	T	74.8	Confident	87.2	Confident	61.6667 Å²	61.6667	28.8 Å²	28.8	38%	0.378	17%	0.169	S	C	.	.	S	Bend	trans	-81.6	-33.5	178.5	56.6	0	0	0	0	112.1	V2102 N2312	V2102-T2337 HydrophobicContact CG1-CG2 3.78Å; N2312-T2337 PolarHBondContact OD1-N 2.86Å; N2312-T2337 PolarHBondContact OD1-OG1 3.05Å
2338	T	75.8	Confident	87.3	Confident	60.6667 Å²	60.6667	31 Å²	31	37%	0.372	18%	0.176	S	C	.	.	S	Bend	trans	-124.9	150.6	179.7	64.1	0	0	0	0	111.4	S2336 S2340 A2341	S2336-T2338 PolarHBondContact OG-O 3.18Å; T2338-S2340 WeakPolarHBondContact CB-OG 3.4Å; T2338-S2340 PolarHBondContact O-N 3.1Å; T2338-S2340 PolarHBondContact OG1-OG 3.35Å; T2338-A2341 PolarHBondContact O-N 3.17Å; T2338-A2341 WeakPolarHBondContact OG1-CB 3.27Å; T2338-A2341 PolarHBondContact OG1-N 3.09Å
2339	P	76.7	Confident	87.4	Confident	83.6667 Å²	83.6667	32.1 Å²	32.1	54%	0.543	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-61.1	-25.3	173.9	-7.9	12.2	0	0	0	113.4	A2341 R2342 Y2368	P2339-A2341 VanDerWaalsContact C-N 3.32Å; P2339-R2342 VanDerWaalsContact O-CB 3.3Å; P2339-R2342 WeakPolarHBondContact O-CB 3.34Å; P2339-R2342 WeakPolarHBondContact O-CD 3.33Å; P2339-R2342 VanDerWaalsContact O-CG 3.27Å; P2339-R2342 WeakPolarHBondContact O-CG 3.44Å; P2339-R2342 PolarHBondContact O-N 3.09Å; P2339-Y2368 HydrophobicContact CB-CD2 4.4Å; P2339-Y2368 HydrophobicContact CG-CD2 4.02Å; P2339-Y2368 HydrophobicContact CG-CE2 3.98Å
2340	S	78.2	Confident	87.5	Confident	104 Å²	104	32.2 Å²	32.2	73%	0.727	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-71.8	-24	174.8	-29.1	0	0	0	0	113.4	T2338 R2342	T2338-S2340 WeakPolarHBondContact CB-OG 3.4Å; T2338-S2340 PolarHBondContact O-N 3.1Å; T2338-S2340 PolarHBondContact OG1-OG 3.35Å; S2340-R2342 VanDerWaalsContact C-N 3.34Å
2341	A	78.2	Confident	87.4	Confident	9 Å²	9	32.7 Å²	32.7	7%	0.074	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-95.5	13.7	176.1	0	0	0	0	0	112.8	N2312 S2336 T2338 P2339	N2312-A2341 HydrophobicContact CB-CB 4.22Å; S2336-A2341 WeakPolarHBondContact CB-O 3.35Å; T2338-A2341 PolarHBondContact O-N 3.17Å; T2338-A2341 WeakPolarHBondContact OG1-CB 3.27Å; T2338-A2341 PolarHBondContact OG1-N 3.09Å; P2339-A2341 VanDerWaalsContact C-N 3.32Å
2342	R	85.2	Confident	87.5	Confident	107.333 Å²	107.333	31.9 Å²	31.9	41%	0.405	18%	0.181	S	C	.	.			trans	-61.7	141.3	179.4	73.9	-177.9	-178.7	171.4	-2.7	111.8	P2339 S2340 E2423	P2339-R2342 VanDerWaalsContact O-CB 3.3Å; P2339-R2342 WeakPolarHBondContact O-CB 3.34Å; P2339-R2342 WeakPolarHBondContact O-CD 3.33Å; P2339-R2342 VanDerWaalsContact O-CG 3.27Å; P2339-R2342 WeakPolarHBondContact O-CG 3.44Å; P2339-R2342 PolarHBondContact O-N 3.09Å; S2340-R2342 VanDerWaalsContact C-N 3.34Å; R2342-E2423 IonicContact NH1-OE1 2.98Å; R2342-E2423 PolarHBondContact NH1-OE1 3.09Å
2343	M	90.1	Very high	87.4	Confident	2.33333 Å²	2.33333	31.9 Å²	31.9	1%	0.011	18%	0.181	C	C	.	.			trans	-78.6	129.1	172.4	-170	-157.5	60.5	0	0	110.7	M2310 T2313 F2316 I2332 A2334 Q2369 K2370 V2371 M2394	M2310-M2343 HydrophobicContact CB-CE 4.21Å; M2310-M2343 HydrophobicContact CE-CE 4.44Å; M2310-M2343 HydrophobicContact CG-CE 4.26Å; M2310-M2343 HydrophobicContact SD-CE 3.38Å; M2310-M2343 WeakPolarHBondContact SD-CE 3.32Å; M2310-M2343 HydrophobicContact SD-SD 3.86Å; T2313-M2343 WeakPolarHBondContact O-CA 3.43Å; T2313-M2343 WeakPolarHBondContact O-CB 3.42Å; T2313-M2343 WeakPolarHBondContact O-CG 3.42Å; T2313-M2343 PolarHBondContact O-N 2.79Å; F2316-M2343 HydrophobicContact CB-CE 3.81Å; F2316-M2343 HydrophobicContact CB-CG 4.32Å; F2316-M2343 HydrophobicContact CB-SD 4.02Å; F2316-M2343 HydrophobicContact CG-CE 4.29Å; I2332-M2343 HydrophobicContact CG2-CE 4.25Å; A2334-M2343 HydrophobicContact CB-CE 3.61Å; A2334-M2343 VanDerWaalsContact CB-CE 3.45Å; A2334-M2343 HydrophobicContact CB-SD 3.97Å; M2343-Q2369 HydrophobicContact CE-CB 4.49Å; M2343-K2370 PolarHBondContact O-N 3.08Å; M2343-K2370 VanDerWaalsContact O-N 3.1Å; M2343-V2371 HydrophobicContact CE-CG2 3.71Å; M2343-V2371 HydrophobicContact SD-CG2 4.39Å; M2343-M2394 HydrophobicContact CE-CE 3.46Å; M2343-M2394 VanDerWaalsContact CE-CE 3.46Å; M2343-M2394 HydrophobicContact CE-SD 4.03Å
2344	V	90.8	Very high	87.5	Confident	57.3333 Å²	57.3333	30.9 Å²	30.9	35%	0.347	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	105.8	161.5	-176.4	0	0	0	0	108.6	Q2314 S2315 F2316 K2370 Y2372	Q2314-V2344 PolarHBondContact O-N 3.22Å; S2315-V2344 WeakPolarHBondContact CA-O 3.36Å; F2316-V2344 PolarHBondContact N-O 2.85Å; F2316-V2344 VanDerWaalsContact N-O 3.14Å; V2344-K2370 CarbonylContact C-O 3.49Å; V2344-K2370 WeakPolarHBondContact CA-O 3.24Å; V2344-Y2372 HydrophobicContact CG1-CD2 4.31Å; V2344-Y2372 HydrophobicContact CG1-CE2 3.93Å
2345	G	92	Very high	87.7	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	145.3	178.4	0	0	0	0	0	113.1	F2316 K2370 V2371 Y2372	F2316-G2345 CarbonylContact O-C 3.54Å; F2316-G2345 VanDerWaalsContact O-CA 3.27Å; F2316-G2345 WeakPolarHBondContact O-CA 3.4Å; G2345-K2370 PolarHBondContact N-O 2.94Å; G2345-V2371 CarbonylContact O-C 3.57Å; G2345-V2371 WeakPolarHBondContact O-CA 3.37Å; G2345-Y2372 PolarHBondContact O-N 3.01Å
2346	L	93.7	Very high	87.9	Confident	29 Å²	29	32.1 Å²	32.1	15%	0.152	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	114.4	173.4	175.6	64	0	0	0	110.1	F2316 K2317 L2318 Q2319 R2348 Y2372 V2374 I2664	F2316-L2346 PolarHBondContact O-N 3.04Å; K2317-L2346 CarbonylContact C-O 3.59Å; K2317-L2346 WeakPolarHBondContact CA-O 3.42Å; K2317-L2346 HydrophobicContact CG-CB 4.46Å; L2318-L2346 PolarHBondContact N-O 2.9Å; Q2319-L2346 VanDerWaalsContact NE2-CD2 3.3Å; L2346-R2348 HydrophobicContact CD1-CB 4.26Å; L2346-R2348 HydrophobicContact CG-CB 4.28Å; L2346-Y2372 CarbonylContact C-O 3.54Å; L2346-Y2372 WeakPolarHBondContact CA-O 3.44Å; L2346-V2374 HydrophobicContact CD1-CG2 4.34Å; L2346-I2664 HydrophobicContact CD1-CD1 3.78Å; L2346-I2664 HydrophobicContact CD2-CD1 3.37Å; L2346-I2664 HydrophobicContact CG-CD1 4.22Å
2347	I	94.7	Very high	88.2	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	106.2	172	-57.4	168.4	0	0	0	107	F2316 L2318 L2330 I2332 C2350 L2361 L2363 V2371 Y2372 A2373 V2374 N2376	F2316-I2347 HydrophobicContact CE1-CG1 4Å; L2318-I2347 HydrophobicContact CD2-CG2 4.33Å; L2318-I2347 WeakPolarHBondContact O-CA 3.4Å; L2330-I2347 HydrophobicContact CD2-CD1 3.82Å; L2330-I2347 HydrophobicContact CD2-CG1 4.37Å; I2332-I2347 HydrophobicContact CD1-CD1 4.31Å; I2347-C2350 HydrophobicContact CG2-CB 4.37Å; I2347-L2361 HydrophobicContact CD1-CD1 3.9Å; I2347-L2363 HydrophobicContact CD1-CD2 4.3Å; I2347-V2371 HydrophobicContact CD1-CG1 3.95Å; I2347-V2371 HydrophobicContact CG1-CG1 4.26Å; I2347-Y2372 PolarHBondContact N-O 3.21Å; I2347-A2373 CarbonylContact O-C 3.57Å; I2347-A2373 VanDerWaalsContact O-CA 3.3Å; I2347-A2373 WeakPolarHBondContact O-CA 3.46Å; I2347-V2374 PolarHBondContact O-N 3.12Å; I2347-N2376 PolarHBondContact O-ND2 3.17Å
2348	R	91.3	Very high	89	Confident	48.3333 Å²	48.3333	30.6 Å²	30.6	18%	0.182	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.2	-175.9	152.3	174.9	177.7	-164.7	-1.8	112.1	L2318 Q2319 N2320 L2346 C2350 V2374 F2662 E2667	L2318-R2348 PolarHBondContact O-N 2.84Å; Q2319-R2348 WeakPolarHBondContact CA-O 3.38Å; Q2319-R2348 HydrophobicContact CB-CG 4.11Å; Q2319-R2348 HydrophobicContact CG-CB 4.36Å; Q2319-R2348 HydrophobicContact CG-CG 3.7Å; Q2319-R2348 VanDerWaalsContact NE2-CZ 3.35Å; Q2319-R2348 VanDerWaalsContact NE2-NE 3.15Å; Q2319-R2348 VanDerWaalsContact OE1-CZ 3.24Å; Q2319-R2348 VanDerWaalsContact OE1-NE 3.15Å; N2320-R2348 PolarHBondContact N-O 2.87Å; N2320-R2348 VanDerWaalsContact N-O 3.14Å; L2346-R2348 HydrophobicContact CD1-CB 4.26Å; L2346-R2348 HydrophobicContact CG-CB 4.28Å; R2348-C2350 PolarHBondContact O-N 3.28Å; R2348-C2350 PolarHBondContact O-SG 3.08Å; R2348-C2350 VanDerWaalsContact O-SG 3.33Å; R2348-V2374 VanDerWaalsContact CA-O 3.29Å; R2348-V2374 WeakPolarHBondContact CA-O 3.31Å; R2348-V2374 HydrophobicContact CB-CB 4.47Å; R2348-V2374 HydrophobicContact CG-CB 4.45Å; R2348-F2662 PolarHBondContact NH1-O 3.43Å; R2348-E2667 IonicContact CZ-OE1 3.79Å; R2348-E2667 IonicContact CZ-OE2 3.49Å; R2348-E2667 IonicContact NH1-OE1 2.7Å; R2348-E2667 PolarHBondContact NH1-OE1 2.91Å; R2348-E2667 IonicContact NH1-OE2 3.73Å; R2348-E2667 PolarHBondContact NH1-OE2 2.98Å; R2348-E2667 VanDerWaalsContact NH2-CD 3.33Å; R2348-E2667 IonicContact NH2-OE1 3.56Å; R2348-E2667 PolarHBondContact NH2-OE1 3.3Å; R2348-E2667 IonicContact NH2-OE2 3.75Å; R2348-E2667 PolarHBondContact NH2-OE2 2.91Å; R2348-E2667 VanDerWaalsContact NH2-OE2 3.16Å
2349	N	92.1	Very high	89.8	Confident	24.6667 Å²	24.6667	28.2 Å²	28.2	13%	0.132	16%	0.156	C	C	.	.	S	Bend	trans	55.2	30	169.3	-71.8	-3.3	0	0	0	112.9	N2320 V2374 N2375 N2376 P2619 G2620	N2320-N2349 VanDerWaalsContact CA-O 3.3Å; N2320-N2349 WeakPolarHBondContact CA-O 3.29Å; N2320-N2349 VanDerWaalsContact OD1-CB 3.24Å; N2320-N2349 WeakPolarHBondContact OD1-CB 3.46Å; N2320-N2349 PolarHBondContact OD1-ND2 3.16Å; N2349-V2374 PolarHBondContact N-O 3Å; N2349-V2374 VanDerWaalsContact N-O 3.16Å; N2349-N2375 WeakPolarHBondContact CA-O 3.36Å; N2349-N2375 PolarHBondContact N-O 3.08Å; N2349-N2375 WeakPolarHBondContact OD1-CB 3.33Å; N2349-N2375 PolarHBondContact OD1-ND2 3.43Å; N2349-N2376 PolarHBondContact N-OD1 2.9Å; N2349-P2619 HydrophobicContact CB-CB 3.73Å; N2349-P2619 HydrophobicContact CB-CG 3.74Å; N2349-P2619 CarbonylContact O-C 3.48Å; N2349-P2619 WeakPolarHBondContact O-CG 3.45Å; N2349-G2620 PolarHBondContact O-N 2.97Å
2350	C	94.4	Very high	90.6	Very high	0.666667 Å²	0.666667	24.3 Å²	24.3	1%	0.005	13%	0.13	C	C	.	.			trans	-98.2	148.2	179.3	-65.6	0	0	0	0	111	S2321 I2347 R2348 F2352 N2376 Y2377	S2321-C2350 CarbonylContact O-C 3.48Å; S2321-C2350 WeakPolarHBondContact O-CA 3.39Å; S2321-C2350 WeakPolarHBondContact O-CB 3.39Å; I2347-C2350 HydrophobicContact CG2-CB 4.37Å; R2348-C2350 PolarHBondContact O-N 3.28Å; R2348-C2350 PolarHBondContact O-SG 3.08Å; R2348-C2350 VanDerWaalsContact O-SG 3.33Å; C2350-F2352 HydrophobicContact CB-CD2 4.47Å; C2350-F2352 HydrophobicContact CB-CE2 3.73Å; C2350-F2352 HydrophobicContact CB-CZ 4.19Å; C2350-N2376 WeakPolarHBondContact CB-OD1 3.3Å; C2350-N2376 PolarHBondContact N-OD1 3.06Å; C2350-N2376 CarbonylContact O-C 3.55Å; C2350-N2376 VanDerWaalsContact O-CA 3.29Å; C2350-N2376 WeakPolarHBondContact O-CA 3.4Å; C2350-N2376 WeakPolarHBondContact O-CB 3.32Å; C2350-Y2377 PolarHBondContact O-N 2.94Å
2351	A	93.4	Very high	91.4	Very high	12.6667 Å²	12.6667	19.3 Å²	19.3	11%	0.105	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.4	177.6	0	0	0	0	0	110.7	S2321 M2322 F2323 Y2377 V2618	S2321-A2351 PolarHBondContact O-N 3.23Å; M2322-A2351 CarbonylContact C-O 3.54Å; M2322-A2351 WeakPolarHBondContact CA-O 3.38Å; M2322-A2351 HydrophobicContact CE-CB 4.39Å; M2322-A2351 HydrophobicContact SD-CB 3.33Å; M2322-A2351 WeakPolarHBondContact SD-CB 3.42Å; F2323-A2351 PolarHBondContact N-O 2.97Å; A2351-Y2377 CarbonylContact C-O 3.56Å; A2351-Y2377 WeakPolarHBondContact CA-O 3.47Å; A2351-Y2377 HydrophobicContact CB-CD1 4.39Å; A2351-V2618 HydrophobicContact CB-CG1 3.76Å
2352	F	95	Very high	92.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	104	-179.2	-61.4	-91.3	0	0	0	108.4	F2323 L2330 C2350 Y2377 F2378 G2379 N2381	F2323-F2352 HydrophobicContact CB-CD1 3.58Å; F2323-F2352 HydrophobicContact CB-CE1 4.03Å; F2323-F2352 HydrophobicContact CB-CG 4.33Å; F2323-F2352 HydrophobicContact CD1-CD1 4.46Å; F2323-F2352 HydrophobicContact CD1-CE1 4.16Å; F2323-F2352 AromaticContact CD2-CD1 3.7Å; F2323-F2352 HydrophobicContact CD2-CD1 3.7Å; F2323-F2352 AromaticContact CD2-CE1 3.28Å; F2323-F2352 HydrophobicContact CD2-CE1 3.28Å; F2323-F2352 HydrophobicContact CD2-CG 4.44Å; F2323-F2352 AromaticContact CD2-CZ 3.8Å; F2323-F2352 HydrophobicContact CD2-CZ 3.8Å; F2323-F2352 HydrophobicContact CE1-CE1 4.45Å; F2323-F2352 HydrophobicContact CE2-CD1 4.47Å; F2323-F2352 AromaticContact CE2-CE1 3.68Å; F2323-F2352 HydrophobicContact CE2-CE1 3.68Å; F2323-F2352 AromaticContact CE2-CZ 3.92Å; F2323-F2352 HydrophobicContact CE2-CZ 3.92Å; F2323-F2352 AromaticContact CG-CD1 3.67Å; F2323-F2352 HydrophobicContact CG-CD1 3.67Å; F2323-F2352 AromaticContact CG-CE1 3.57Å; F2323-F2352 HydrophobicContact CG-CE1 3.57Å; F2323-F2352 HydrophobicContact CG-CZ 4.46Å; F2323-F2352 HydrophobicContact CZ-CE1 4.25Å; F2323-F2352 CarbonylContact O-C 3.34Å; F2323-F2352 WeakPolarHBondContact O-CA 3.31Å; L2330-F2352 HydrophobicContact CB-CE1 3.99Å; L2330-F2352 HydrophobicContact CB-CZ 4.38Å; C2350-F2352 HydrophobicContact CB-CD2 4.47Å; C2350-F2352 HydrophobicContact CB-CE2 3.73Å; C2350-F2352 HydrophobicContact CB-CZ 4.19Å; F2352-Y2377 PolarHBondContact N-O 2.86Å; F2352-F2378 HydrophobicContact CB-CD1 3.69Å; F2352-F2378 HydrophobicContact CB-CE1 4.05Å; F2352-F2378 HydrophobicContact CB-CG 4.46Å; F2352-F2378 HydrophobicContact CD1-CE1 4.42Å; F2352-F2378 AromaticContact CD2-CD1 3.75Å; F2352-F2378 HydrophobicContact CD2-CD1 3.75Å; F2352-F2378 AromaticContact CD2-CE1 3.29Å; F2352-F2378 HydrophobicContact CD2-CE1 3.29Å; F2352-F2378 HydrophobicContact CD2-CE2 4.46Å; F2352-F2378 HydrophobicContact CD2-CG 4.47Å; F2352-F2378 AromaticContact CD2-CZ 3.72Å; F2352-F2378 HydrophobicContact CD2-CZ 3.72Å; F2352-F2378 AromaticContact CE2-CE1 3.79Å; F2352-F2378 HydrophobicContact CE2-CE1 3.79Å; F2352-F2378 AromaticContact CE2-CZ 3.89Å; F2352-F2378 HydrophobicContact CE2-CZ 3.89Å; F2352-F2378 AromaticContact CG-CD1 3.89Å; F2352-F2378 HydrophobicContact CG-CD1 3.89Å; F2352-F2378 AromaticContact CG-CE1 3.69Å; F2352-F2378 HydrophobicContact CG-CE1 3.69Å; F2352-F2378 HydrophobicContact CG-CZ 4.49Å; F2352-F2378 HydrophobicContact CZ-CE1 4.49Å; F2352-F2378 CarbonylContact O-C 3.59Å; F2352-F2378 WeakPolarHBondContact O-CA 3.36Å; F2352-G2379 PolarHBondContact O-N 3.04Å; F2352-N2381 PolarHBondContact O-ND2 2.93Å; F2352-N2381 VanDerWaalsContact O-ND2 3.11Å
2353	G	92.3	Very high	92.6	Very high	0.333333 Å²	0.333333	16.1 Å²	16.1	0%	0.003	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	139.4	-176.5	0	0	0	0	0	114.5	F2323 F2324 R2325 N2355 G2379 N2381	F2323-G2353 PolarHBondContact O-N 3.02Å; F2324-G2353 VanDerWaalsContact CA-O 3.29Å; F2324-G2353 WeakPolarHBondContact CA-O 3.41Å; F2324-G2353 VanDerWaalsContact CD2-O 3.27Å; F2324-G2353 WeakPolarHBondContact CD2-O 3.41Å; R2325-G2353 PolarHBondContact N-O 3.12Å; R2325-G2353 VanDerWaalsContact N-O 3.12Å; G2353-N2355 PolarHBondContact N-ND2 3.27Å; G2353-N2355 PolarHBondContact O-N 2.95Å; G2353-N2355 VanDerWaalsContact O-N 3.11Å; G2353-N2355 PolarHBondContact O-ND2 2.84Å; G2353-G2379 VanDerWaalsContact CA-O 3.31Å; G2353-G2379 WeakPolarHBondContact CA-O 3.34Å; G2353-N2381 WeakPolarHBondContact CA-OD1 3.45Å
2354	N	93.3	Very high	92.7	Very high	27 Å²	27	17.3 Å²	17.3	14%	0.144	9%	0.09	C	C	.	.	S	Bend	trans	54	26.9	175.5	-60	-17.7	0	0	0	115.3	F2324 R2325 V2356 G2379 R2380 N2381 E2633	F2324-N2354 HydrophobicContact CD2-CB 4.42Å; F2324-N2354 HydrophobicContact CE1-CB 4.42Å; F2324-N2354 WeakPolarHBondContact CE1-ND2 3.27Å; F2324-N2354 HydrophobicContact CE2-CB 4.11Å; F2324-N2354 WeakPolarHBondContact CE2-ND2 3.22Å; F2324-N2354 WeakPolarHBondContact CZ-ND2 3.41Å; R2325-N2354 VanDerWaalsContact CA-O 3.24Å; R2325-N2354 WeakPolarHBondContact CA-O 3.32Å; R2325-N2354 HydrophobicContact CG-CB 3.81Å; R2325-N2354 PolarHBondContact NH1-ND2 3.09Å; N2354-V2356 VanDerWaalsContact O-CG2 3.32Å; N2354-V2356 WeakPolarHBondContact O-CG2 3.34Å; N2354-G2379 PolarHBondContact N-O 2.98Å; N2354-G2379 VanDerWaalsContact N-O 3.08Å; N2354-R2380 VanDerWaalsContact CA-O 3.23Å; N2354-R2380 WeakPolarHBondContact CA-O 3.27Å; N2354-R2380 PolarHBondContact N-O 2.94Å; N2354-R2380 VanDerWaalsContact OD1-CB 3.24Å; N2354-R2380 WeakPolarHBondContact OD1-CB 3.3Å; N2354-N2381 PolarHBondContact N-OD1 3.2Å; N2354-E2633 VanDerWaalsContact ND2-CD 3.27Å; N2354-E2633 PolarHBondContact ND2-OE1 2.72Å; N2354-E2633 PolarHBondContact ND2-OE2 3.37Å
2355	N	93.1	Very high	92.4	Very high	0.333333 Å²	0.333333	14.6 Å²	14.6	0%	0.002	7%	0.074	C	C	.	.			trans	-75.9	152	175.5	-57.8	-67.7	0	0	0	110.5	F2323 N2326 G2353 T2360 N2381 W2382	F2323-N2355 PolarHBondContact O-ND2 3.05Å; F2323-N2355 VanDerWaalsContact O-ND2 3.13Å; F2323-N2355 PolarHBondContact O-OD1 2.77Å; N2326-N2355 WeakPolarHBondContact CB-OD1 3.39Å; N2326-N2355 PolarHBondContact N-OD1 3.14Å; N2326-N2355 PolarHBondContact ND2-OD1 3.13Å; N2326-N2355 VanDerWaalsContact ND2-OD1 3.1Å; N2326-N2355 CarbonylContact O-C 3.39Å; N2326-N2355 VanDerWaalsContact O-CA 3.29Å; N2326-N2355 WeakPolarHBondContact O-CA 3.18Å; G2353-N2355 PolarHBondContact N-ND2 3.27Å; G2353-N2355 PolarHBondContact O-N 2.95Å; G2353-N2355 VanDerWaalsContact O-N 3.11Å; G2353-N2355 PolarHBondContact O-ND2 2.84Å; N2355-T2360 HydrophobicContact CB-CG2 4.17Å; N2355-N2381 WeakPolarHBondContact CB-OD1 3.4Å; N2355-N2381 PolarHBondContact N-OD1 2.85Å; N2355-N2381 PolarHBondContact ND2-OD1 2.96Å; N2355-N2381 VanDerWaalsContact ND2-OD1 3.11Å; N2355-N2381 CarbonylContact O-C 3.42Å; N2355-N2381 WeakPolarHBondContact O-CA 3.4Å; N2355-W2382 PolarHBondContact O-N 3.32Å
2356	V	91.2	Very high	91.9	Very high	42.6667 Å²	42.6667	20 Å²	20	26%	0.259	9%	0.094	S	C	.	.	B	Isolated β-bridge	trans	-126.5	142.2	-163.2	178.8	0	0	0	0	111.9	N2326 A2327 G2328 N2354 W2358 W2382	N2326-V2356 PolarHBondContact O-N 3.45Å; A2327-V2356 CarbonylContact C-O 3.58Å; A2327-V2356 WeakPolarHBondContact CA-O 3.43Å; G2328-V2356 PolarHBondContact N-O 3.15Å; G2328-V2356 VanDerWaalsContact N-O 3.11Å; N2354-V2356 VanDerWaalsContact O-CG2 3.32Å; N2354-V2356 WeakPolarHBondContact O-CG2 3.34Å; V2356-W2358 VanDerWaalsContact C-N 3.3Å; V2356-W2358 PolarHBondContact O-N 3.21Å; V2356-W2382 CarbonylContact C-O 3.56Å; V2356-W2382 VanDerWaalsContact CA-O 3.29Å; V2356-W2382 WeakPolarHBondContact CA-O 3.25Å; V2356-W2382 HydrophobicContact CG1-CE3 3.7Å; V2356-W2382 HydrophobicContact CG1-CZ3 3.96Å; V2356-W2382 HydrophobicContact CG2-CE3 4.47Å
2357	I	86.9	Confident	90.9	Very high	0.333333 Å²	0.333333	22.6 Å²	22.6	0%	0.002	11%	0.108	C	C	.	.	S	Bend	trans	67	-60.2	174.8	-64.7	150.7	0	0	0	116.1	Q2294 E2297 T2300 W2382 S2383 Y2385	Q2294-I2357 HydrophobicContact CB-CD1 3.68Å; Q2294-I2357 VanDerWaalsContact CD-CD1 3.43Å; Q2294-I2357 HydrophobicContact CG-CD1 3.45Å; Q2294-I2357 VanDerWaalsContact CG-CD1 3.43Å; E2297-I2357 VanDerWaalsContact O-CD1 3.24Å; E2297-I2357 WeakPolarHBondContact O-CD1 3.46Å; T2300-I2357 HydrophobicContact CG2-CB 4.32Å; T2300-I2357 HydrophobicContact CG2-CD1 3.52Å; T2300-I2357 VanDerWaalsContact CG2-CD1 3.43Å; T2300-I2357 HydrophobicContact CG2-CG1 4.44Å; T2300-I2357 HydrophobicContact CG2-CG2 4.09Å; I2357-W2382 HydrophobicContact CG1-CZ3 4.36Å; I2357-W2382 PolarHBondContact N-O 3.02Å; I2357-S2383 WeakPolarHBondContact O-CA 3.48Å; I2357-S2383 PolarHBondContact O-OG 2.97Å; I2357-Y2385 HydrophobicContact CG2-CD2 4.48Å
2358	W	90.2	Very high	90.1	Very high	32.6667 Å²	32.6667	27.6 Å²	27.6	12%	0.124	13%	0.128	C	C	.	.	S	Bend	trans	-89.2	168.7	-173	-69.5	93.1	0	0	0	111.9	T2300 S2302 A2327 V2356 T2360 S2383 K2386	T2300-W2358 PolarHBondContact OG1-NE1 2.82Å; S2302-W2358 PolarHBondContact O-NE1 3.06Å; A2327-W2358 WeakPolarHBondContact O-CB 3.08Å; V2356-W2358 VanDerWaalsContact C-N 3.3Å; V2356-W2358 PolarHBondContact O-N 3.21Å; W2358-T2360 PolarHBondContact O-N 3.01Å; W2358-S2383 PolarHBondContact O-OG 3.05Å; W2358-K2386 HydrophobicContact CE3-CG 4.46Å
2359	E	92.8	Very high	89.9	Confident	10.6667 Å²	10.6667	25.3 Å²	25.3	5%	0.05	12%	0.119	C	C	.	.			trans	-55.9	136.7	175.7	-56.2	92.4	144.8	0	0	111	G2329 K2362 K2386 D2387 F2390	G2329-E2359 PolarHBondContact N-O 3.32Å; G2329-E2359 VanDerWaalsContact N-O 3.14Å; E2359-K2362 HydrophobicContact CB-CB 4.01Å; E2359-K2362 HydrophobicContact CG-CB 4.47Å; E2359-K2362 HydrophobicContact CG-CD 4.41Å; E2359-K2362 IonicContact OE1-NZ 3.17Å; E2359-K2362 PolarHBondContact OE1-NZ 3.2Å; E2359-K2362 IonicContact OE2-NZ 3.57Å; E2359-K2386 HydrophobicContact CG-CB 4.1Å; E2359-D2387 WeakPolarHBondContact CA-O 3.28Å; E2359-D2387 WeakPolarHBondContact CB-O 3.24Å; E2359-D2387 VanDerWaalsContact CG-O 3.28Å; E2359-D2387 WeakPolarHBondContact CG-O 3.28Å; E2359-F2390 HydrophobicContact CG-CB 4.04Å
2360	T	94.1	Very high	89.8	Confident	0.333333 Å²	0.333333	26.3 Å²	26.3	0%	0.002	12%	0.122	C	C	.	.	S	Bend	trans	-79.1	-34.4	176.8	69.4	0	0	0	0	111.7	G2329 L2330 N2355 W2358 N2381 V2388	G2329-T2360 CarbonylContact C-O 3.34Å; G2329-T2360 VanDerWaalsContact CA-O 3.24Å; G2329-T2360 WeakPolarHBondContact CA-O 3.4Å; L2330-T2360 PolarHBondContact N-O 3.29Å; N2355-T2360 HydrophobicContact CB-CG2 4.17Å; W2358-T2360 PolarHBondContact O-N 3.01Å; T2360-N2381 HydrophobicContact CG2-CB 3.4Å; T2360-N2381 VanDerWaalsContact CG2-CB 3.49Å; T2360-N2381 VanDerWaalsContact CG2-CG 3.47Å; T2360-V2388 WeakPolarHBondContact CA-O 3.48Å; T2360-V2388 WeakPolarHBondContact CB-O 3.42Å; T2360-V2388 HydrophobicContact CG2-CG1 3.89Å; T2360-V2388 PolarHBondContact N-O 2.99Å; T2360-V2388 WeakPolarHBondContact OG1-CG1 3.3Å; T2360-V2388 PolarHBondContact OG1-O 3.11Å
2361	L	95.3	Very high	89.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	112.2	172.2	177.1	62	0	0	0	108.4	L2330 I2347 L2363 F2378 V2388 V2389 F2390 F2398	L2330-L2361 HydrophobicContact CB-CD1 4.16Å; L2330-L2361 HydrophobicContact CD2-CD1 3.83Å; L2330-L2361 HydrophobicContact CG-CD1 4.16Å; L2330-L2361 CarbonylContact O-C 3.39Å; L2330-L2361 WeakPolarHBondContact O-CA 3.26Å; I2347-L2361 HydrophobicContact CD1-CD1 3.9Å; L2361-L2363 HydrophobicContact CD1-CD1 4.28Å; L2361-L2363 HydrophobicContact CD1-CD2 3.87Å; L2361-L2363 HydrophobicContact CD1-CG 3.96Å; L2361-L2363 HydrophobicContact CD2-CD1 4.21Å; L2361-L2363 HydrophobicContact CD2-CG 4.49Å; L2361-L2363 HydrophobicContact CG-CD1 4.26Å; L2361-L2363 HydrophobicContact CG-CD2 4.48Å; L2361-L2363 HydrophobicContact CG-CG 4.03Å; L2361-F2378 HydrophobicContact CB-CE1 4.02Å; L2361-F2378 HydrophobicContact CB-CZ 4.42Å; L2361-F2378 HydrophobicContact CD2-CE1 4.37Å; L2361-F2378 HydrophobicContact CD2-CZ 3.93Å; L2361-V2388 PolarHBondContact N-O 3.09Å; L2361-V2389 HydrophobicContact CB-CG1 4.21Å; L2361-V2389 HydrophobicContact CB-CG2 4.12Å; L2361-V2389 HydrophobicContact CD2-CG1 4.1Å; L2361-V2389 HydrophobicContact CG-CG1 4.26Å; L2361-V2389 CarbonylContact O-C 3.59Å; L2361-V2389 VanDerWaalsContact O-CA 3.29Å; L2361-V2389 WeakPolarHBondContact O-CA 3.35Å; L2361-F2390 PolarHBondContact O-N 3.05Å; L2361-F2398 HydrophobicContact CD2-CE1 4.04Å; L2361-F2398 HydrophobicContact CD2-CZ 4.23Å
2362	K	94.6	Very high	89.7	Confident	48.3333 Å²	48.3333	29.3 Å²	29.3	21%	0.21	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	121.6	176.1	-175.7	173.3	-167.1	142.9	0	109.6	L2330 S2331 I2332 F2333 E2359 V2364 F2390	L2330-K2362 PolarHBondContact O-N 3.06Å; S2331-K2362 CarbonylContact C-O 3.51Å; S2331-K2362 WeakPolarHBondContact CA-O 3.28Å; I2332-K2362 PolarHBondContact N-O 3.26Å; F2333-K2362 HydrophobicContact CZ-CD 4.31Å; E2359-K2362 HydrophobicContact CB-CB 4.01Å; E2359-K2362 HydrophobicContact CG-CB 4.47Å; E2359-K2362 HydrophobicContact CG-CD 4.41Å; E2359-K2362 IonicContact OE1-NZ 3.17Å; E2359-K2362 PolarHBondContact OE1-NZ 3.2Å; E2359-K2362 IonicContact OE2-NZ 3.57Å; K2362-V2364 HydrophobicContact CG-CG2 4.16Å; K2362-F2390 CarbonylContact C-O 3.56Å; K2362-F2390 WeakPolarHBondContact CA-O 3.43Å; K2362-F2390 HydrophobicContact CG-CB 4.47Å; K2362-F2390 HydrophobicContact CG-CD1 4.12Å
2363	L	93.8	Very high	89.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	104.8	-176	-66.6	-176.4	0	0	0	109	I2332 I2347 L2361 V2371 F2390 V2391 D2392 M2394 V2396	I2332-L2363 HydrophobicContact CB-CD2 3.87Å; I2332-L2363 HydrophobicContact CD1-CD2 3.84Å; I2332-L2363 HydrophobicContact CG1-CD2 4.09Å; I2347-L2363 HydrophobicContact CD1-CD2 4.3Å; L2361-L2363 HydrophobicContact CD1-CD1 4.28Å; L2361-L2363 HydrophobicContact CD1-CD2 3.87Å; L2361-L2363 HydrophobicContact CD1-CG 3.96Å; L2361-L2363 HydrophobicContact CD2-CD1 4.21Å; L2361-L2363 HydrophobicContact CD2-CG 4.49Å; L2361-L2363 HydrophobicContact CG-CD1 4.26Å; L2361-L2363 HydrophobicContact CG-CD2 4.48Å; L2361-L2363 HydrophobicContact CG-CG 4.03Å; L2363-V2371 HydrophobicContact CD1-CB 4.42Å; L2363-V2371 HydrophobicContact CD1-CG1 4.21Å; L2363-F2390 PolarHBondContact N-O 3.1Å; L2363-V2391 HydrophobicContact CB-CB 4.48Å; L2363-V2391 HydrophobicContact CB-CG1 4.29Å; L2363-V2391 HydrophobicContact CB-CG2 4.26Å; L2363-V2391 HydrophobicContact CD1-CG2 4.24Å; L2363-V2391 CarbonylContact O-C 3.57Å; L2363-V2391 WeakPolarHBondContact O-CA 3.37Å; L2363-D2392 PolarHBondContact O-N 2.92Å; L2363-M2394 HydrophobicContact CB-CE 3.47Å; L2363-M2394 VanDerWaalsContact CB-CE 3.47Å; L2363-M2394 HydrophobicContact CB-SD 3.86Å; L2363-M2394 HydrophobicContact CD1-CE 4.05Å; L2363-M2394 HydrophobicContact CD1-SD 4.48Å; L2363-M2394 HydrophobicContact CD2-CE 3.97Å; L2363-M2394 HydrophobicContact CG-CE 4.01Å; L2363-V2396 HydrophobicContact CD1-CG1 4.19Å; L2363-V2396 HydrophobicContact CD1-CG2 3.95Å
2364	V	91.1	Very high	89.6	Confident	28.3333 Å²	28.3333	30.5 Å²	30.5	17%	0.172	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	116.8	179.5	-178.1	0	0	0	0	108.8	I2332 F2333 A2334 K2362 F2390 D2392	I2332-V2364 PolarHBondContact O-N 2.97Å; F2333-V2364 CarbonylContact C-O 3.58Å; F2333-V2364 WeakPolarHBondContact CA-O 3.24Å; F2333-V2364 HydrophobicContact CD1-CB 3.67Å; F2333-V2364 HydrophobicContact CD1-CG1 4.13Å; F2333-V2364 HydrophobicContact CD1-CG2 4.1Å; F2333-V2364 HydrophobicContact CD2-CB 4.08Å; F2333-V2364 HydrophobicContact CD2-CG1 3.87Å; F2333-V2364 HydrophobicContact CE1-CB 3.96Å; F2333-V2364 HydrophobicContact CE1-CG1 4.46Å; F2333-V2364 HydrophobicContact CE1-CG2 3.85Å; F2333-V2364 HydrophobicContact CE2-CG1 4.11Å; A2334-V2364 PolarHBondContact N-O 2.92Å; K2362-V2364 HydrophobicContact CG-CG2 4.16Å; V2364-F2390 HydrophobicContact CG2-CD1 4.3Å; V2364-F2390 HydrophobicContact CG2-CE1 4.11Å; V2364-D2392 WeakPolarHBondContact CA-O 3.14Å
2365	G	85.9	Confident	89.4	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	163.5	179.2	0	0	0	0	0	113.5	A2334 D2392 H2393	A2334-G2365 CarbonylContact O-C 3.55Å; A2334-G2365 VanDerWaalsContact O-CA 3.26Å; A2334-G2365 WeakPolarHBondContact O-CA 3.37Å; G2365-D2392 PolarHBondContact N-O 2.85Å; G2365-H2393 CarbonylContact C-O 3.57Å; G2365-H2393 WeakPolarHBondContact CA-O 3.31Å; G2365-H2393 WeakPolarHBondContact O-CB 3.35Å
2366	R	81.1	Confident	89.5	Confident	113.667 Å²	113.667	31.3 Å²	31.3	43%	0.429	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	140.4	157.9	-65.5	-172.9	179.3	-176	0.1	108.7	E2105 F2333 A2334 A2335 S2336 Q2369	E2105-R2366 IonicContact OE1-CZ 2.72Å; E2105-R2366 IonicContact OE1-NH1 3.92Å; E2105-R2366 PolarHBondContact OE1-NH1 2.85Å; E2105-R2366 IonicContact OE1-NH2 3.63Å; E2105-R2366 PolarHBondContact OE1-NH2 2.81Å; E2105-R2366 IonicContact OE2-CZ 2.92Å; E2105-R2366 IonicContact OE2-NH1 3.11Å; E2105-R2366 PolarHBondContact OE2-NH1 3.05Å; E2105-R2366 IonicContact OE2-NH2 3.64Å; E2105-R2366 PolarHBondContact OE2-NH2 2.72Å; F2333-R2366 HydrophobicContact CZ-CG 4.46Å; A2334-R2366 PolarHBondContact O-N 3.12Å; A2335-R2366 HydrophobicContact CB-CB 4.12Å; S2336-R2366 PolarHBondContact N-O 3.02Å; R2366-Q2369 WeakPolarHBondContact O-CG 3.4Å; R2366-Q2369 PolarHBondContact O-NE2 3.08Å
2367	N	73	Confident	89.5	Confident	82.6667 Å²	82.6667	30.6 Å²	30.6	44%	0.442	14%	0.136	S	C	.	.	S	Bend	trans	59.9	72.5	173.2	-53.1	-20.3	0	0	0	115.6	S2336 Q2369	S2336-N2367 VanDerWaalsContact O-CB 3.22Å; S2336-N2367 WeakPolarHBondContact O-CB 3.36Å; S2336-N2367 PolarHBondContact O-ND2 3.18Å; S2336-N2367 PolarHBondContact OG-O 2.93Å; S2336-N2367 VanDerWaalsContact OG-O 3.07Å; N2367-Q2369 PolarHBondContact O-N 3.18Å; N2367-Q2369 PolarHBondContact O-NE2 2.94Å; N2367-Q2369 VanDerWaalsContact O-NE2 3.13Å
2368	Y	76.5	Confident	89.9	Confident	104 Å²	104	30.6 Å²	30.6	41%	0.408	14%	0.136	S	C	.	.	S	Bend	trans	67.2	31	166.3	-46.4	-89.4	0	0	0	118	P2339 Y2417 V2420	P2339-Y2368 HydrophobicContact CB-CD2 4.4Å; P2339-Y2368 HydrophobicContact CG-CD2 4.02Å; P2339-Y2368 HydrophobicContact CG-CE2 3.98Å; Y2368-Y2417 VanDerWaalsContact C-OH 3.26Å; Y2368-Y2417 VanDerWaalsContact CA-OH 3.28Å; Y2368-Y2417 WeakPolarHBondContact CA-OH 3.3Å; Y2368-Y2417 HydrophobicContact CD1-CE1 4.37Å; Y2368-Y2417 WeakPolarHBondContact CD2-OH 3.4Å; Y2368-Y2417 HydrophobicContact CE1-CE1 4.36Å; Y2368-Y2417 VanDerWaalsContact CE2-OH 3.31Å; Y2368-Y2417 WeakPolarHBondContact CE2-OH 3.47Å; Y2368-Y2417 VanDerWaalsContact CG-OH 3.25Å; Y2368-Y2417 PolarHBondContact N-OH 2.78Å; Y2368-V2420 HydrophobicContact CD1-CG1 4.06Å; Y2368-V2420 HydrophobicContact CD1-CG2 3.77Å; Y2368-V2420 HydrophobicContact CE1-CB 4.41Å; Y2368-V2420 HydrophobicContact CE1-CG1 3.91Å; Y2368-V2420 HydrophobicContact CE1-CG2 3.24Å; Y2368-V2420 VanDerWaalsContact CE1-CG2 3.45Å
2369	Q	87.5	Confident	90	Very high	1.66667 Å²	1.66667	29.1 Å²	29.1	1%	0.008	13%	0.13	C	C	.	.			trans	-72.9	147.4	173.1	-47.3	-50.8	-32.5	0	0	112.8	A2334 A2335 S2336 M2343 R2366 N2367 M2394 L2395 Y2417	A2334-Q2369 HydrophobicContact CB-CB 4.48Å; A2334-Q2369 HydrophobicContact CB-CG 3.92Å; A2334-Q2369 WeakPolarHBondContact O-CG 3.45Å; A2335-Q2369 VanDerWaalsContact C-NE2 3.33Å; S2336-Q2369 VanDerWaalsContact CB-NE2 3.32Å; S2336-Q2369 VanDerWaalsContact N-NE2 3.18Å; S2336-Q2369 PolarHBondContact OG-NE2 3.13Å; M2343-Q2369 HydrophobicContact CE-CB 4.49Å; R2366-Q2369 WeakPolarHBondContact O-CG 3.4Å; R2366-Q2369 PolarHBondContact O-NE2 3.08Å; N2367-Q2369 PolarHBondContact O-N 3.18Å; N2367-Q2369 PolarHBondContact O-NE2 2.94Å; N2367-Q2369 VanDerWaalsContact O-NE2 3.13Å; Q2369-M2394 HydrophobicContact CB-CE 3.44Å; Q2369-M2394 VanDerWaalsContact CB-CE 3.44Å; Q2369-M2394 HydrophobicContact CB-CG 3.91Å; Q2369-M2394 HydrophobicContact CB-SD 3.64Å; Q2369-M2394 WeakPolarHBondContact CB-SD 3.48Å; Q2369-M2394 HydrophobicContact CG-CE 4.1Å; Q2369-M2394 HydrophobicContact CG-SD 4.26Å; Q2369-M2394 WeakPolarHBondContact O-CG 3.4Å; Q2369-L2395 PolarHBondContact O-N 3.09Å; Q2369-L2395 VanDerWaalsContact O-N 3.15Å; Q2369-Y2417 PolarHBondContact N-OH 3.16Å; Q2369-Y2417 PolarHBondContact O-OH 2.82Å
2370	K	89.2	Confident	90	Very high	45 Å²	45	33 Å²	33	20%	0.196	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.5	179.2	-169.9	168.8	-166	158	0	112.6	M2343 V2344 G2345 Y2372 L2395 E2423	M2343-K2370 PolarHBondContact O-N 3.08Å; M2343-K2370 VanDerWaalsContact O-N 3.1Å; V2344-K2370 CarbonylContact C-O 3.49Å; V2344-K2370 WeakPolarHBondContact CA-O 3.24Å; G2345-K2370 PolarHBondContact N-O 2.94Å; K2370-Y2372 HydrophobicContact CD-CE2 4.27Å; K2370-Y2372 VanDerWaalsContact CE-OH 3.24Å; K2370-Y2372 WeakPolarHBondContact CE-OH 3.28Å; K2370-Y2372 HydrophobicContact CG-CE2 4.25Å; K2370-L2395 CarbonylContact C-O 3.57Å; K2370-L2395 VanDerWaalsContact CA-O 3.29Å; K2370-L2395 WeakPolarHBondContact CA-O 3.3Å; K2370-L2395 HydrophobicContact CD-CD2 3.8Å; K2370-L2395 HydrophobicContact CG-CB 4.33Å; K2370-L2395 HydrophobicContact CG-CD2 4.03Å; K2370-E2423 IonicContact NZ-OE2 3.29Å; K2370-E2423 PolarHBondContact NZ-OE2 2.77Å
2371	V	92.6	Very high	90	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.1	177.6	177.8	0	0	0	0	111.6	M2343 G2345 I2347 L2363 M2394 L2395 V2396 N2397	M2343-V2371 HydrophobicContact CE-CG2 3.71Å; M2343-V2371 HydrophobicContact SD-CG2 4.39Å; G2345-V2371 CarbonylContact O-C 3.57Å; G2345-V2371 WeakPolarHBondContact O-CA 3.37Å; I2347-V2371 HydrophobicContact CD1-CG1 3.95Å; I2347-V2371 HydrophobicContact CG1-CG1 4.26Å; L2363-V2371 HydrophobicContact CD1-CB 4.42Å; L2363-V2371 HydrophobicContact CD1-CG1 4.21Å; V2371-M2394 HydrophobicContact CB-CE 3.64Å; V2371-M2394 HydrophobicContact CB-SD 4.13Å; V2371-M2394 HydrophobicContact CG2-CE 3.6Å; V2371-M2394 HydrophobicContact CG2-CG 4.39Å; V2371-M2394 HydrophobicContact CG2-SD 3.56Å; V2371-M2394 WeakPolarHBondContact CG2-SD 3.37Å; V2371-L2395 PolarHBondContact N-O 3.15Å; V2371-V2396 HydrophobicContact CB-CG1 4.5Å; V2371-V2396 HydrophobicContact CB-CG2 4.45Å; V2371-V2396 VanDerWaalsContact O-CA 3.31Å; V2371-V2396 WeakPolarHBondContact O-CA 3.47Å; V2371-N2397 PolarHBondContact O-N 3.23Å
2372	Y	93.2	Very high	89.9	Confident	75.3333 Å²	75.3333	38.5 Å²	38.5	30%	0.295	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.7	172.2	-62.3	-88.6	0	0	0	109.6	V2344 G2345 L2346 I2347 K2370 N2397	V2344-Y2372 HydrophobicContact CG1-CD2 4.31Å; V2344-Y2372 HydrophobicContact CG1-CE2 3.93Å; G2345-Y2372 PolarHBondContact O-N 3.01Å; L2346-Y2372 CarbonylContact C-O 3.54Å; L2346-Y2372 WeakPolarHBondContact CA-O 3.44Å; I2347-Y2372 PolarHBondContact N-O 3.21Å; K2370-Y2372 HydrophobicContact CD-CE2 4.27Å; K2370-Y2372 VanDerWaalsContact CE-OH 3.24Å; K2370-Y2372 WeakPolarHBondContact CE-OH 3.28Å; K2370-Y2372 HydrophobicContact CG-CE2 4.25Å; Y2372-N2397 HydrophobicContact CD1-CB 3.73Å; Y2372-N2397 HydrophobicContact CE1-CB 4.16Å
2373	A	93.7	Very high	89.6	Confident	0.333333 Å²	0.333333	36.2 Å²	36.2	0%	0.003	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	102.6	173.9	0	0	0	0	0	109	I2347 N2397 F2398 T2399 N2401	I2347-A2373 CarbonylContact O-C 3.57Å; I2347-A2373 VanDerWaalsContact O-CA 3.3Å; I2347-A2373 WeakPolarHBondContact O-CA 3.46Å; A2373-N2397 PolarHBondContact N-O 2.87Å; A2373-F2398 HydrophobicContact CB-CD1 3.43Å; A2373-F2398 VanDerWaalsContact CB-CD1 3.44Å; A2373-F2398 HydrophobicContact CB-CE1 3.5Å; A2373-F2398 VanDerWaalsContact CB-CE1 3.44Å; A2373-F2398 HydrophobicContact CB-CG 4.27Å; A2373-F2398 HydrophobicContact CB-CZ 4.4Å; A2373-F2398 WeakPolarHBondContact O-CA 3.4Å; A2373-T2399 PolarHBondContact O-N 3Å; A2373-N2401 PolarHBondContact O-ND2 3.1Å; A2373-N2401 PolarHBondContact O-OD1 2.9Å
2374	V	91.8	Very high	89.1	Confident	25.6667 Å²	25.6667	37.3 Å²	37.3	16%	0.156	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.2	-169.8	-173.8	0	0	0	0	111.8	L2346 I2347 R2348 N2349 N2376 T2399 F2662	L2346-V2374 HydrophobicContact CD1-CG2 4.34Å; I2347-V2374 PolarHBondContact O-N 3.12Å; R2348-V2374 VanDerWaalsContact CA-O 3.29Å; R2348-V2374 WeakPolarHBondContact CA-O 3.31Å; R2348-V2374 HydrophobicContact CB-CB 4.47Å; R2348-V2374 HydrophobicContact CG-CB 4.45Å; N2349-V2374 PolarHBondContact N-O 3Å; N2349-V2374 VanDerWaalsContact N-O 3.16Å; V2374-N2376 VanDerWaalsContact C-N 3.29Å; V2374-N2376 PolarHBondContact N-ND2 3.1Å; V2374-N2376 VanDerWaalsContact N-ND2 3.16Å; V2374-N2376 PolarHBondContact O-N 3.22Å; V2374-N2376 PolarHBondContact O-ND2 2.85Å; V2374-T2399 WeakPolarHBondContact CA-O 3.35Å; V2374-T2399 WeakPolarHBondContact CG1-OG1 3.32Å; V2374-T2399 WeakPolarHBondContact CG2-OG1 3.45Å; V2374-F2662 HydrophobicContact CG1-CD1 4.44Å
2375	N	90.4	Very high	88.6	Confident	41.3333 Å²	41.3333	40.8 Å²	40.8	22%	0.221	17%	0.173	C	C	.	.	S	Bend	trans	54.5	41.2	174.9	-138.5	33.7	0	0	0	113.6	N2349 T2399 R2400 F2662	N2349-N2375 WeakPolarHBondContact CA-O 3.36Å; N2349-N2375 PolarHBondContact N-O 3.08Å; N2349-N2375 WeakPolarHBondContact OD1-CB 3.33Å; N2349-N2375 PolarHBondContact OD1-ND2 3.43Å; N2375-T2399 PolarHBondContact N-O 3.16Å; N2375-T2399 VanDerWaalsContact N-O 3.08Å; N2375-R2400 WeakPolarHBondContact CA-O 3.31Å; N2375-R2400 WeakPolarHBondContact OD1-CB 3.32Å; N2375-F2662 HydrophobicContact CB-CD1 3.92Å; N2375-F2662 HydrophobicContact CB-CD2 4.27Å; N2375-F2662 HydrophobicContact CB-CE1 3.79Å; N2375-F2662 HydrophobicContact CB-CE2 4.18Å; N2375-F2662 HydrophobicContact CB-CG 4.17Å; N2375-F2662 HydrophobicContact CB-CZ 3.95Å; N2375-F2662 VanDerWaalsContact CG-CE2 3.43Å; N2375-F2662 WeakPolarHBondContact ND2-CD2 3.43Å; N2375-F2662 VanDerWaalsContact ND2-CE2 3.25Å; N2375-F2662 WeakPolarHBondContact ND2-CE2 3.19Å; N2375-F2662 VanDerWaalsContact OD1-CZ 3.29Å; N2375-F2662 WeakPolarHBondContact OD1-CZ 3.49Å
2376	N	93.6	Very high	88.7	Confident	2.33333 Å²	2.33333	43.8 Å²	43.8	1%	0.012	19%	0.187	C	C	.	.			trans	-97	149.1	175.2	-53.5	-67.4	0	0	0	111.4	I2347 N2349 C2350 V2374 F2378 N2401 T2402	I2347-N2376 PolarHBondContact O-ND2 3.17Å; N2349-N2376 PolarHBondContact N-OD1 2.9Å; C2350-N2376 WeakPolarHBondContact CB-OD1 3.3Å; C2350-N2376 PolarHBondContact N-OD1 3.06Å; C2350-N2376 CarbonylContact O-C 3.55Å; C2350-N2376 VanDerWaalsContact O-CA 3.29Å; C2350-N2376 WeakPolarHBondContact O-CA 3.4Å; C2350-N2376 WeakPolarHBondContact O-CB 3.32Å; V2374-N2376 VanDerWaalsContact C-N 3.29Å; V2374-N2376 PolarHBondContact N-ND2 3.1Å; V2374-N2376 VanDerWaalsContact N-ND2 3.16Å; V2374-N2376 PolarHBondContact O-N 3.22Å; V2374-N2376 PolarHBondContact O-ND2 2.85Å; N2376-F2378 HydrophobicContact CB-CD2 4.48Å; N2376-F2378 HydrophobicContact CB-CE2 3.76Å; N2376-F2378 HydrophobicContact CB-CZ 4.21Å; N2376-N2401 VanDerWaalsContact CB-OD1 3.26Å; N2376-N2401 WeakPolarHBondContact CB-OD1 3.09Å; N2376-N2401 PolarHBondContact N-OD1 2.88Å; N2376-N2401 PolarHBondContact ND2-OD1 2.99Å; N2376-N2401 CarbonylContact O-C 3.53Å; N2376-N2401 VanDerWaalsContact O-CA 3.25Å; N2376-N2401 WeakPolarHBondContact O-CA 3.37Å; N2376-N2401 WeakPolarHBondContact O-CB 3.27Å; N2376-T2402 PolarHBondContact O-N 2.94Å
2377	Y	92.6	Very high	89.1	Confident	29.6667 Å²	29.6667	38.7 Å²	38.7	12%	0.116	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.5	178.6	177.5	-91.5	0	0	0	110.3	C2350 A2351 F2352 T2402 L2616 F2630 Q2634	C2350-Y2377 PolarHBondContact O-N 2.94Å; A2351-Y2377 CarbonylContact C-O 3.56Å; A2351-Y2377 WeakPolarHBondContact CA-O 3.47Å; A2351-Y2377 HydrophobicContact CB-CD1 4.39Å; F2352-Y2377 PolarHBondContact N-O 2.86Å; Y2377-T2402 HydrophobicContact CD2-CG2 4.16Å; Y2377-T2402 HydrophobicContact CE2-CG2 4.26Å; Y2377-L2616 HydrophobicContact CE2-CD2 4.24Å; Y2377-F2630 HydrophobicContact CD1-CZ 4.17Å; Y2377-F2630 HydrophobicContact CE1-CE2 4.15Å; Y2377-F2630 AromaticContact CE1-CZ 3.6Å; Y2377-F2630 HydrophobicContact CE1-CZ 3.6Å; Y2377-Q2634 VanDerWaalsContact OH-CD 3.29Å; Y2377-Q2634 PolarHBondContact OH-NE2 3.27Å; Y2377-Q2634 PolarHBondContact OH-OE1 2.78Å
2378	F	94.4	Very high	90.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	104.1	175.2	-62	-89.5	0	0	0	108.5	F2352 L2361 N2376 V2389 N2401 T2402 F2403 Y2404 N2406	F2352-F2378 HydrophobicContact CB-CD1 3.69Å; F2352-F2378 HydrophobicContact CB-CE1 4.05Å; F2352-F2378 HydrophobicContact CB-CG 4.46Å; F2352-F2378 HydrophobicContact CD1-CE1 4.42Å; F2352-F2378 AromaticContact CD2-CD1 3.75Å; F2352-F2378 HydrophobicContact CD2-CD1 3.75Å; F2352-F2378 AromaticContact CD2-CE1 3.29Å; F2352-F2378 HydrophobicContact CD2-CE1 3.29Å; F2352-F2378 HydrophobicContact CD2-CE2 4.46Å; F2352-F2378 HydrophobicContact CD2-CG 4.47Å; F2352-F2378 AromaticContact CD2-CZ 3.72Å; F2352-F2378 HydrophobicContact CD2-CZ 3.72Å; F2352-F2378 AromaticContact CE2-CE1 3.79Å; F2352-F2378 HydrophobicContact CE2-CE1 3.79Å; F2352-F2378 AromaticContact CE2-CZ 3.89Å; F2352-F2378 HydrophobicContact CE2-CZ 3.89Å; F2352-F2378 AromaticContact CG-CD1 3.89Å; F2352-F2378 HydrophobicContact CG-CD1 3.89Å; F2352-F2378 AromaticContact CG-CE1 3.69Å; F2352-F2378 HydrophobicContact CG-CE1 3.69Å; F2352-F2378 HydrophobicContact CG-CZ 4.49Å; F2352-F2378 HydrophobicContact CZ-CE1 4.49Å; F2352-F2378 CarbonylContact O-C 3.59Å; F2352-F2378 WeakPolarHBondContact O-CA 3.36Å; L2361-F2378 HydrophobicContact CB-CE1 4.02Å; L2361-F2378 HydrophobicContact CB-CZ 4.42Å; L2361-F2378 HydrophobicContact CD2-CE1 4.37Å; L2361-F2378 HydrophobicContact CD2-CZ 3.93Å; N2376-F2378 HydrophobicContact CB-CD2 4.48Å; N2376-F2378 HydrophobicContact CB-CE2 3.76Å; N2376-F2378 HydrophobicContact CB-CZ 4.21Å; F2378-V2389 HydrophobicContact CD1-CG2 4.34Å; F2378-V2389 HydrophobicContact CE1-CG2 4.14Å; F2378-V2389 HydrophobicContact CZ-CG2 4.44Å; F2378-N2401 HydrophobicContact CE2-CB 4.41Å; F2378-T2402 PolarHBondContact N-O 2.92Å; F2378-F2403 HydrophobicContact CB-CD1 3.56Å; F2378-F2403 HydrophobicContact CB-CE1 3.88Å; F2378-F2403 HydrophobicContact CB-CG 4.31Å; F2378-F2403 HydrophobicContact CD1-CE1 4.27Å; F2378-F2403 AromaticContact CD2-CD1 3.83Å; F2378-F2403 HydrophobicContact CD2-CD1 3.83Å; F2378-F2403 AromaticContact CD2-CE1 3.34Å; F2378-F2403 HydrophobicContact CD2-CE1 3.34Å; F2378-F2403 HydrophobicContact CD2-CE2 4.34Å; F2378-F2403 HydrophobicContact CD2-CG 4.48Å; F2378-F2403 AromaticContact CD2-CZ 3.65Å; F2378-F2403 HydrophobicContact CD2-CZ 3.65Å; F2378-F2403 AromaticContact CE2-CE1 3.88Å; F2378-F2403 HydrophobicContact CE2-CE1 3.88Å; F2378-F2403 AromaticContact CE2-CZ 3.87Å; F2378-F2403 HydrophobicContact CE2-CZ 3.87Å; F2378-F2403 AromaticContact CG-CD1 3.82Å; F2378-F2403 HydrophobicContact CG-CD1 3.82Å; F2378-F2403 AromaticContact CG-CE1 3.57Å; F2378-F2403 HydrophobicContact CG-CE1 3.57Å; F2378-F2403 HydrophobicContact CG-CZ 4.34Å; F2378-F2403 CarbonylContact O-C 3.54Å; F2378-F2403 VanDerWaalsContact O-CA 3.3Å; F2378-F2403 WeakPolarHBondContact O-CA 3.17Å; F2378-Y2404 PolarHBondContact O-N 2.77Å; F2378-N2406 PolarHBondContact O-ND2 2.93Å
2379	G	92.3	Very high	91	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.7	-174.5	0	0	0	0	0	113.3	F2352 G2353 N2354 N2381 Y2404	F2352-G2379 PolarHBondContact O-N 3.04Å; G2353-G2379 VanDerWaalsContact CA-O 3.31Å; G2353-G2379 WeakPolarHBondContact CA-O 3.34Å; N2354-G2379 PolarHBondContact N-O 2.98Å; N2354-G2379 VanDerWaalsContact N-O 3.08Å; G2379-N2381 VanDerWaalsContact C-N 3.27Å; G2379-N2381 PolarHBondContact N-ND2 2.88Å; G2379-N2381 PolarHBondContact O-N 2.95Å; G2379-N2381 VanDerWaalsContact O-N 3.1Å; G2379-N2381 PolarHBondContact O-ND2 3.18Å; G2379-Y2404 CarbonylContact C-O 3.55Å; G2379-Y2404 VanDerWaalsContact CA-O 3.3Å; G2379-Y2404 WeakPolarHBondContact CA-O 3.41Å
2380	R	92.9	Very high	91.3	Very high	92.3333 Å²	92.3333	31.7 Å²	31.7	35%	0.348	14%	0.135	S	C	.	.	S	Bend	trans	58.9	27.7	168.6	-60.4	-178.6	-178.9	-177.7	2.1	115.3	N2354 Y2404 N2405 N2406 E2633	N2354-R2380 VanDerWaalsContact CA-O 3.23Å; N2354-R2380 WeakPolarHBondContact CA-O 3.27Å; N2354-R2380 PolarHBondContact N-O 2.94Å; N2354-R2380 VanDerWaalsContact OD1-CB 3.24Å; N2354-R2380 WeakPolarHBondContact OD1-CB 3.3Å; R2380-Y2404 PolarHBondContact N-O 3.12Å; R2380-N2405 VanDerWaalsContact CA-O 3.23Å; R2380-N2405 WeakPolarHBondContact CA-O 3.25Å; R2380-N2405 HydrophobicContact CG-CB 4.2Å; R2380-N2406 PolarHBondContact N-OD1 3.05Å; R2380-E2633 VanDerWaalsContact NH1-C 3.33Å; R2380-E2633 PolarHBondContact NH1-O 3.21Å; R2380-E2633 PolarHBondContact NH2-O 2.86Å
2381	N	94.4	Very high	91.4	Very high	0.666667 Å²	0.666667	29.5 Å²	29.5	0%	0.004	13%	0.126	C	C	.	.			trans	-79.2	140.6	175.9	-58	-72.9	0	0	0	110.2	F2352 G2353 N2354 N2355 T2360 G2379 V2388 N2406 T2407	F2352-N2381 PolarHBondContact O-ND2 2.93Å; F2352-N2381 VanDerWaalsContact O-ND2 3.11Å; G2353-N2381 WeakPolarHBondContact CA-OD1 3.45Å; N2354-N2381 PolarHBondContact N-OD1 3.2Å; N2355-N2381 WeakPolarHBondContact CB-OD1 3.4Å; N2355-N2381 PolarHBondContact N-OD1 2.85Å; N2355-N2381 PolarHBondContact ND2-OD1 2.96Å; N2355-N2381 VanDerWaalsContact ND2-OD1 3.11Å; N2355-N2381 CarbonylContact O-C 3.42Å; N2355-N2381 WeakPolarHBondContact O-CA 3.4Å; T2360-N2381 HydrophobicContact CG2-CB 3.4Å; T2360-N2381 VanDerWaalsContact CG2-CB 3.49Å; T2360-N2381 VanDerWaalsContact CG2-CG 3.47Å; G2379-N2381 VanDerWaalsContact C-N 3.27Å; G2379-N2381 PolarHBondContact N-ND2 2.88Å; G2379-N2381 PolarHBondContact O-N 2.95Å; G2379-N2381 VanDerWaalsContact O-N 3.1Å; G2379-N2381 PolarHBondContact O-ND2 3.18Å; N2381-V2388 HydrophobicContact CB-CG1 4.36Å; N2381-N2406 WeakPolarHBondContact CB-OD1 3.35Å; N2381-N2406 PolarHBondContact N-OD1 2.84Å; N2381-N2406 VanDerWaalsContact N-OD1 3.09Å; N2381-N2406 PolarHBondContact ND2-OD1 2.94Å; N2381-N2406 CarbonylContact O-C 3.54Å; N2381-N2406 WeakPolarHBondContact O-CA 3.32Å; N2381-T2407 PolarHBondContact O-N 3.08Å; N2381-T2407 PolarHBondContact O-OG1 2.87Å
2382	W	92.3	Very high	91.3	Very high	115.667 Å²	115.667	31.6 Å²	31.6	44%	0.438	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	96.8	-174.3	-177.3	75.4	0	0	0	111.1	N2355 V2356 I2357 P2384 T2407	N2355-W2382 PolarHBondContact O-N 3.32Å; V2356-W2382 CarbonylContact C-O 3.56Å; V2356-W2382 VanDerWaalsContact CA-O 3.29Å; V2356-W2382 WeakPolarHBondContact CA-O 3.25Å; V2356-W2382 HydrophobicContact CG1-CE3 3.7Å; V2356-W2382 HydrophobicContact CG1-CZ3 3.96Å; V2356-W2382 HydrophobicContact CG2-CE3 4.47Å; I2357-W2382 HydrophobicContact CG1-CZ3 4.36Å; I2357-W2382 PolarHBondContact N-O 3.02Å; W2382-P2384 HydrophobicContact CD2-CG 4.27Å; W2382-P2384 HydrophobicContact CE3-CG 4.19Å; W2382-P2384 HydrophobicContact CH2-CG 3.97Å; W2382-P2384 HydrophobicContact CZ2-CB 4.4Å; W2382-P2384 HydrophobicContact CZ2-CG 3.71Å; W2382-P2384 HydrophobicContact CZ3-CG 4.25Å; W2382-P2384 WeakPolarHBondContact O-CD 3.18Å; W2382-T2407 VanDerWaalsContact CA-OG1 3.31Å; W2382-T2407 WeakPolarHBondContact CA-OG1 3.3Å
2383	S	89.8	Confident	91	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	68.3	-176.1	-85.6	0	0	0	0	110.6	I2357 W2358 Y2385 K2386 T2407 G2408	I2357-S2383 WeakPolarHBondContact O-CA 3.48Å; I2357-S2383 PolarHBondContact O-OG 2.97Å; W2358-S2383 PolarHBondContact O-OG 3.05Å; S2383-Y2385 VanDerWaalsContact C-N 3.26Å; S2383-Y2385 PolarHBondContact O-N 2.84Å; S2383-K2386 WeakPolarHBondContact CB-O 3.43Å; S2383-K2386 CarbonylContact O-C 3.52Å; S2383-K2386 PolarHBondContact O-N 3.31Å; S2383-K2386 VanDerWaalsContact OG-C 3.26Å; S2383-K2386 WeakPolarHBondContact OG-CB 3.39Å; S2383-K2386 PolarHBondContact OG-O 2.83Å; S2383-T2407 PolarHBondContact N-O 2.92Å; S2383-G2408 WeakPolarHBondContact O-CA 3.42Å
2384	P	82.6	Confident	90.6	Very high	23.3333 Å²	23.3333	31.5 Å²	31.5	15%	0.152	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.3	-170.2	27.3	-37.4	0	0	0	114.9	W2382 T2438	W2382-P2384 HydrophobicContact CD2-CG 4.27Å; W2382-P2384 HydrophobicContact CE3-CG 4.19Å; W2382-P2384 HydrophobicContact CH2-CG 3.97Å; W2382-P2384 HydrophobicContact CZ2-CB 4.4Å; W2382-P2384 HydrophobicContact CZ2-CG 3.71Å; W2382-P2384 HydrophobicContact CZ3-CG 4.25Å; W2382-P2384 WeakPolarHBondContact O-CD 3.18Å; P2384-T2438 PolarHBondContact O-OG1 2.04Å
2385	Y	80.4	Confident	90.5	Very high	100.667 Å²	100.667	30.8 Å²	30.8	40%	0.395	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	0.4	-176.8	-50.6	-65.1	0	0	0	113.6	N2298 I2357 S2383	N2298-Y2385 HydrophobicContact CB-CD2 4.48Å; I2357-Y2385 HydrophobicContact CG2-CD2 4.48Å; S2383-Y2385 VanDerWaalsContact C-N 3.26Å; S2383-Y2385 PolarHBondContact O-N 2.84Å
2386	K	87.6	Confident	90.5	Very high	65.3333 Å²	65.3333	29 Å²	29	28%	0.284	13%	0.125	S	C	.	.	S	Bend	trans	-148.3	162.5	-171.9	-67.1	-63.5	173.9	-168.1	0	111.4	W2358 E2359 S2383 G2408 T2409	W2358-K2386 HydrophobicContact CE3-CG 4.46Å; E2359-K2386 HydrophobicContact CG-CB 4.1Å; S2383-K2386 WeakPolarHBondContact CB-O 3.43Å; S2383-K2386 CarbonylContact O-C 3.52Å; S2383-K2386 PolarHBondContact O-N 3.31Å; S2383-K2386 VanDerWaalsContact OG-C 3.26Å; S2383-K2386 WeakPolarHBondContact OG-CB 3.39Å; S2383-K2386 PolarHBondContact OG-O 2.83Å; K2386-G2408 WeakPolarHBondContact O-CA 3.34Å; K2386-T2409 PolarHBondContact O-N 3Å; K2386-T2409 PolarHBondContact O-OG1 3.18Å
2387	D	90.8	Very high	90.4	Very high	5.33333 Å²	5.33333	30.2 Å²	30.2	3%	0.029	13%	0.131	C	C	.	.			trans	-73.3	148	175.6	-55.2	-47.7	0	0	0	110.4	E2359 V2389 F2390 T2409 H2410 H2413 H2440	E2359-D2387 WeakPolarHBondContact CA-O 3.28Å; E2359-D2387 WeakPolarHBondContact CB-O 3.24Å; E2359-D2387 VanDerWaalsContact CG-O 3.28Å; E2359-D2387 WeakPolarHBondContact CG-O 3.28Å; D2387-V2389 VanDerWaalsContact C-N 3.35Å; D2387-F2390 HydrophobicContact CB-CB 4.37Å; D2387-F2390 WeakPolarHBondContact OD2-CD2 3.37Å; D2387-T2409 PolarHBondContact N-OG1 2.9Å; D2387-T2409 VanDerWaalsContact N-OG1 3.11Å; D2387-T2409 WeakPolarHBondContact OD1-CB 3.34Å; D2387-T2409 PolarHBondContact OD1-OG1 2.88Å; D2387-H2410 CarbonylContact C-O 3.51Å; D2387-H2410 VanDerWaalsContact CA-O 3.28Å; D2387-H2410 WeakPolarHBondContact CA-O 3.31Å; D2387-H2410 WeakPolarHBondContact OD1-CA 3.42Å; D2387-H2410 VanDerWaalsContact OD1-CB 3.26Å; D2387-H2410 WeakPolarHBondContact OD1-CB 3.4Å; D2387-H2410 IonicContact OD1-CE1 3.21Å; D2387-H2410 IonicContact OD1-CG 3.39Å; D2387-H2410 PolarHBondContact OD1-N 2.83Å; D2387-H2410 IonicContact OD1-ND1 2.99Å; D2387-H2410 PolarHBondContact OD1-ND1 3.01Å; D2387-H2413 HydrophobicContact CB-CB 4.34Å; D2387-H2413 IonicContact OD2-CG 3.5Å; D2387-H2440 IonicContact OD1-CD2 2.65Å; D2387-H2440 IonicContact OD1-CE1 3.97Å; D2387-H2440 IonicContact OD1-NE2 2.76Å; D2387-H2440 PolarHBondContact OD1-NE2 3.44Å; D2387-H2440 IonicContact OD2-CE1 3.8Å; D2387-H2440 PolarHBondContact OD2-CE1 3.01Å; D2387-H2440 IonicContact OD2-NE2 3.19Å; D2387-H2440 PolarHBondContact OD2-NE2 3.32Å
2388	V	93.8	Very high	90.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-66.7	-46.6	176	176.3	0	0	0	0	109.5	T2360 L2361 N2381 N2406 H2410 I2411	T2360-V2388 WeakPolarHBondContact CA-O 3.48Å; T2360-V2388 WeakPolarHBondContact CB-O 3.42Å; T2360-V2388 HydrophobicContact CG2-CG1 3.89Å; T2360-V2388 PolarHBondContact N-O 2.99Å; T2360-V2388 WeakPolarHBondContact OG1-CG1 3.3Å; T2360-V2388 PolarHBondContact OG1-O 3.11Å; L2361-V2388 PolarHBondContact N-O 3.09Å; N2381-V2388 HydrophobicContact CB-CG1 4.36Å; V2388-N2406 HydrophobicContact CG1-CB 4.16Å; V2388-N2406 HydrophobicContact CG2-CB 3.9Å; V2388-H2410 PolarHBondContact N-O 3.07Å; V2388-I2411 HydrophobicContact CB-CG2 4.44Å; V2388-I2411 WeakPolarHBondContact CB-O 3.34Å; V2388-I2411 HydrophobicContact CG2-CD1 3.99Å
2389	V	95.2	Very high	90.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.9	171.2	-179.8	0	0	0	0	109.4	L2361 F2378 D2387 V2391 F2398 F2403 I2411 V2412 H2413	L2361-V2389 HydrophobicContact CB-CG1 4.21Å; L2361-V2389 HydrophobicContact CB-CG2 4.12Å; L2361-V2389 HydrophobicContact CD2-CG1 4.1Å; L2361-V2389 HydrophobicContact CG-CG1 4.26Å; L2361-V2389 CarbonylContact O-C 3.59Å; L2361-V2389 VanDerWaalsContact O-CA 3.29Å; L2361-V2389 WeakPolarHBondContact O-CA 3.35Å; F2378-V2389 HydrophobicContact CD1-CG2 4.34Å; F2378-V2389 HydrophobicContact CE1-CG2 4.14Å; F2378-V2389 HydrophobicContact CZ-CG2 4.44Å; D2387-V2389 VanDerWaalsContact C-N 3.35Å; V2389-V2391 HydrophobicContact CG1-CG2 4.25Å; V2389-F2398 HydrophobicContact CG1-CE1 4.33Å; V2389-F2398 HydrophobicContact CG1-CE2 4.49Å; V2389-F2398 HydrophobicContact CG1-CZ 3.72Å; V2389-F2403 HydrophobicContact CG2-CE1 3.67Å; V2389-F2403 HydrophobicContact CG2-CZ 4.28Å; V2389-I2411 PolarHBondContact N-O 3.19Å; V2389-V2412 HydrophobicContact CB-CG1 4.36Å; V2389-V2412 HydrophobicContact CB-CG2 4.36Å; V2389-V2412 HydrophobicContact CG1-CG1 4.31Å; V2389-V2412 WeakPolarHBondContact O-CA 3.47Å; V2389-H2413 PolarHBondContact O-N 2.94Å
2390	F	93.5	Very high	90.2	Very high	40.6667 Å²	40.6667	36 Å²	36	18%	0.178	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.2	177.6	-177.5	-96.2	0	0	0	110.1	E2359 L2361 K2362 L2363 V2364 D2387 D2392 H2413	E2359-F2390 HydrophobicContact CG-CB 4.04Å; L2361-F2390 PolarHBondContact O-N 3.05Å; K2362-F2390 CarbonylContact C-O 3.56Å; K2362-F2390 WeakPolarHBondContact CA-O 3.43Å; K2362-F2390 HydrophobicContact CG-CB 4.47Å; K2362-F2390 HydrophobicContact CG-CD1 4.12Å; L2363-F2390 PolarHBondContact N-O 3.1Å; V2364-F2390 HydrophobicContact CG2-CD1 4.3Å; V2364-F2390 HydrophobicContact CG2-CE1 4.11Å; D2387-F2390 HydrophobicContact CB-CB 4.37Å; D2387-F2390 WeakPolarHBondContact OD2-CD2 3.37Å; F2390-D2392 HydrophobicContact CD1-CB 4.4Å; F2390-D2392 HydrophobicContact CE1-CB 3.54Å; F2390-D2392 VanDerWaalsContact CE1-CB 3.49Å; F2390-D2392 HydrophobicContact CZ-CB 3.8Å; F2390-H2413 HydrophobicContact CD2-CB 3.96Å; F2390-H2413 AromaticContact CD2-CG 3.8Å; F2390-H2413 AromaticContact CD2-ND1 3.67Å; F2390-H2413 AromaticContact CE2-CE1 3.76Å; F2390-H2413 AromaticContact CE2-CG 3.92Å; F2390-H2413 AromaticContact CE2-ND1 3.5Å; F2390-H2413 WeakPolarHBondContact CE2-ND1 3.26Å
2391	V	92.4	Very high	90.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.3	172.4	-176.2	0	0	0	0	108.8	L2363 V2389 M2394 V2396 F2398 H2413 L2414 G2415	L2363-V2391 HydrophobicContact CB-CB 4.48Å; L2363-V2391 HydrophobicContact CB-CG1 4.29Å; L2363-V2391 HydrophobicContact CB-CG2 4.26Å; L2363-V2391 HydrophobicContact CD1-CG2 4.24Å; L2363-V2391 CarbonylContact O-C 3.57Å; L2363-V2391 WeakPolarHBondContact O-CA 3.37Å; V2389-V2391 HydrophobicContact CG1-CG2 4.25Å; V2391-M2394 HydrophobicContact CG1-CB 4.39Å; V2391-V2396 HydrophobicContact CB-CG1 4.43Å; V2391-V2396 HydrophobicContact CB-CG2 4.4Å; V2391-V2396 HydrophobicContact CG1-CB 4.33Å; V2391-V2396 HydrophobicContact CG1-CG1 3.53Å; V2391-V2396 HydrophobicContact CG1-CG2 3.6Å; V2391-V2396 VanDerWaalsContact CG1-CG2 3.42Å; V2391-V2396 HydrophobicContact CG2-CG1 3.99Å; V2391-V2396 HydrophobicContact CG2-CG2 4.11Å; V2391-F2398 HydrophobicContact CG2-CE2 3.95Å; V2391-F2398 HydrophobicContact CG2-CZ 4.1Å; V2391-H2413 WeakPolarHBondContact CB-O 3.41Å; V2391-H2413 PolarHBondContact N-O 3.01Å; V2391-H2413 PolarHBondContact O-ND1 3.04Å; V2391-H2413 VanDerWaalsContact O-ND1 3.14Å; V2391-L2414 HydrophobicContact CG2-CD2 4.36Å; V2391-G2415 WeakPolarHBondContact O-CA 3.3Å; V2391-G2415 PolarHBondContact O-N 3.17Å
2392	D	88.9	Confident	90	Very high	43 Å²	43	32.5 Å²	32.5	23%	0.23	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	140.8	175.2	-173.6	39.1	0	0	0	111.8	L2363 V2364 G2365 F2390 M2394	L2363-D2392 PolarHBondContact O-N 2.92Å; V2364-D2392 WeakPolarHBondContact CA-O 3.14Å; G2365-D2392 PolarHBondContact N-O 2.85Å; F2390-D2392 HydrophobicContact CD1-CB 4.4Å; F2390-D2392 HydrophobicContact CE1-CB 3.54Å; F2390-D2392 VanDerWaalsContact CE1-CB 3.49Å; F2390-D2392 HydrophobicContact CZ-CB 3.8Å; D2392-M2394 PolarHBondContact O-N 2.97Å
2393	H	87	Confident	90	Very high	74.6667 Å²	74.6667	26.9 Å²	26.9	35%	0.346	12%	0.124	S	C	.	.	S	Bend	trans	45.9	35.1	179	-67.8	85.6	0	0	0	114.8	G2365 G2416 Y2417	G2365-H2393 CarbonylContact C-O 3.57Å; G2365-H2393 WeakPolarHBondContact CA-O 3.31Å; G2365-H2393 WeakPolarHBondContact O-CB 3.35Å; H2393-G2416 VanDerWaalsContact CA-O 3.29Å; H2393-G2416 WeakPolarHBondContact CA-O 3.35Å; H2393-G2416 PolarHBondContact N-O 3.11Å; H2393-Y2417 VanDerWaalsContact C-CE1 3.49Å; H2393-Y2417 WeakPolarHBondContact O-CE1 3.27Å; H2393-Y2417 PolarHBondContact O-OH 3.26Å
2394	M	86.8	Confident	90.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-144	142.6	-178.4	-173	160	66	0	0	111.4	A2334 M2343 L2363 Q2369 V2371 V2391 D2392 V2396 Q2425	A2334-M2394 HydrophobicContact CB-CE 3.64Å; A2334-M2394 HydrophobicContact CB-SD 4.5Å; M2343-M2394 HydrophobicContact CE-CE 3.46Å; M2343-M2394 VanDerWaalsContact CE-CE 3.46Å; M2343-M2394 HydrophobicContact CE-SD 4.03Å; L2363-M2394 HydrophobicContact CB-CE 3.47Å; L2363-M2394 VanDerWaalsContact CB-CE 3.47Å; L2363-M2394 HydrophobicContact CB-SD 3.86Å; L2363-M2394 HydrophobicContact CD1-CE 4.05Å; L2363-M2394 HydrophobicContact CD1-SD 4.48Å; L2363-M2394 HydrophobicContact CD2-CE 3.97Å; L2363-M2394 HydrophobicContact CG-CE 4.01Å; Q2369-M2394 HydrophobicContact CB-CE 3.44Å; Q2369-M2394 VanDerWaalsContact CB-CE 3.44Å; Q2369-M2394 HydrophobicContact CB-CG 3.91Å; Q2369-M2394 HydrophobicContact CB-SD 3.64Å; Q2369-M2394 WeakPolarHBondContact CB-SD 3.48Å; Q2369-M2394 HydrophobicContact CG-CE 4.1Å; Q2369-M2394 HydrophobicContact CG-SD 4.26Å; Q2369-M2394 WeakPolarHBondContact O-CG 3.4Å; V2371-M2394 HydrophobicContact CB-CE 3.64Å; V2371-M2394 HydrophobicContact CB-SD 4.13Å; V2371-M2394 HydrophobicContact CG2-CE 3.6Å; V2371-M2394 HydrophobicContact CG2-CG 4.39Å; V2371-M2394 HydrophobicContact CG2-SD 3.56Å; V2371-M2394 WeakPolarHBondContact CG2-SD 3.37Å; V2391-M2394 HydrophobicContact CG1-CB 4.39Å; D2392-M2394 PolarHBondContact O-N 2.97Å; M2394-V2396 HydrophobicContact CE-CG2 3.56Å; M2394-V2396 HydrophobicContact CG-CG2 4.26Å; M2394-V2396 PolarHBondContact O-N 3.04Å; M2394-V2396 HydrophobicContact SD-CG2 4.48Å; M2394-Q2425 PolarHBondContact O-NE2 3.23Å
2395	L	88.2	Confident	90.6	Very high	10.6667 Å²	10.6667	30.2 Å²	30.2	6%	0.056	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	121.8	174	-96.6	142.9	0	0	0	110	Q2369 K2370 V2371 Y2417 E2423 Q2425	Q2369-L2395 PolarHBondContact O-N 3.09Å; Q2369-L2395 VanDerWaalsContact O-N 3.15Å; K2370-L2395 CarbonylContact C-O 3.57Å; K2370-L2395 VanDerWaalsContact CA-O 3.29Å; K2370-L2395 WeakPolarHBondContact CA-O 3.3Å; K2370-L2395 HydrophobicContact CD-CD2 3.8Å; K2370-L2395 HydrophobicContact CG-CB 4.33Å; K2370-L2395 HydrophobicContact CG-CD2 4.03Å; V2371-L2395 PolarHBondContact N-O 3.15Å; L2395-Y2417 HydrophobicContact CB-CD2 4.37Å; L2395-Y2417 HydrophobicContact CB-CE2 3.87Å; L2395-E2423 HydrophobicContact CD1-CB 3.91Å; L2395-E2423 HydrophobicContact CD1-CG 4.34Å; L2395-E2423 WeakPolarHBondContact CD1-O 3.49Å; L2395-E2423 WeakPolarHBondContact CD1-OE2 3.44Å; L2395-E2423 HydrophobicContact CD2-CB 3.99Å; L2395-E2423 HydrophobicContact CD2-CG 4.35Å; L2395-E2423 WeakPolarHBondContact CD2-OE2 3.47Å; L2395-Q2425 HydrophobicContact CD1-CB 4.47Å; L2395-Q2425 HydrophobicContact CD1-CG 3.76Å; L2395-Q2425 HydrophobicContact CD2-CG 4.07Å
2396	V	91	Very high	91.2	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.024	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	141.6	179.9	-144.5	0	0	0	0	111.4	L2363 V2371 V2391 M2394 F2398 L2414 Q2425 L2426	L2363-V2396 HydrophobicContact CD1-CG1 4.19Å; L2363-V2396 HydrophobicContact CD1-CG2 3.95Å; V2371-V2396 HydrophobicContact CB-CG1 4.5Å; V2371-V2396 HydrophobicContact CB-CG2 4.45Å; V2371-V2396 VanDerWaalsContact O-CA 3.31Å; V2371-V2396 WeakPolarHBondContact O-CA 3.47Å; V2391-V2396 HydrophobicContact CB-CG1 4.43Å; V2391-V2396 HydrophobicContact CB-CG2 4.4Å; V2391-V2396 HydrophobicContact CG1-CB 4.33Å; V2391-V2396 HydrophobicContact CG1-CG1 3.53Å; V2391-V2396 HydrophobicContact CG1-CG2 3.6Å; V2391-V2396 VanDerWaalsContact CG1-CG2 3.42Å; V2391-V2396 HydrophobicContact CG2-CG1 3.99Å; V2391-V2396 HydrophobicContact CG2-CG2 4.11Å; M2394-V2396 HydrophobicContact CE-CG2 3.56Å; M2394-V2396 HydrophobicContact CG-CG2 4.26Å; M2394-V2396 PolarHBondContact O-N 3.04Å; M2394-V2396 HydrophobicContact SD-CG2 4.48Å; V2396-F2398 HydrophobicContact CB-CD2 4.26Å; V2396-F2398 HydrophobicContact CB-CE2 3.95Å; V2396-F2398 HydrophobicContact CG1-CD1 4.48Å; V2396-F2398 HydrophobicContact CG1-CD2 3.59Å; V2396-F2398 HydrophobicContact CG1-CE1 4.27Å; V2396-F2398 HydrophobicContact CG1-CE2 3.62Å; V2396-F2398 HydrophobicContact CG1-CG 4.2Å; V2396-F2398 HydrophobicContact CG1-CZ 3.66Å; V2396-F2398 HydrophobicContact CG2-CD2 4.03Å; V2396-F2398 HydrophobicContact CG2-CE2 3.82Å; V2396-L2414 HydrophobicContact CG2-CD2 3.88Å; V2396-Q2425 HydrophobicContact CG2-CB 4.45Å; V2396-Q2425 HydrophobicContact CG2-CG 4.14Å; V2396-Q2425 WeakPolarHBondContact O-CA 3.37Å; V2396-L2426 PolarHBondContact O-N 2.93Å; V2396-L2426 VanDerWaalsContact O-N 3.13Å
2397	N	92	Very high	91.5	Very high	27 Å²	27	23.5 Å²	23.5	14%	0.144	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	101.3	169.2	-179	-4	0	0	0	109.2	V2371 Y2372 A2373 T2399 L2426	V2371-N2397 PolarHBondContact O-N 3.23Å; Y2372-N2397 HydrophobicContact CD1-CB 3.73Å; Y2372-N2397 HydrophobicContact CE1-CB 4.16Å; A2373-N2397 PolarHBondContact N-O 2.87Å; N2397-T2399 WeakPolarHBondContact OD1-CG2 3.15Å; N2397-T2399 PolarHBondContact OD1-OG1 3.14Å; N2397-L2426 CarbonylContact C-O 3.4Å; N2397-L2426 WeakPolarHBondContact CA-O 3.22Å; N2397-L2426 HydrophobicContact CB-CB 4.31Å
2398	F	93.3	Very high	91.5	Very high	1 Å²	1	23.3 Å²	23.3	0%	0.004	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	106.8	171	-73.4	-77.4	0	0	0	109.4	L2361 A2373 V2389 V2391 V2396 N2401 L2414 L2426 F2427 R2428 N2430	L2361-F2398 HydrophobicContact CD2-CE1 4.04Å; L2361-F2398 HydrophobicContact CD2-CZ 4.23Å; A2373-F2398 HydrophobicContact CB-CD1 3.43Å; A2373-F2398 VanDerWaalsContact CB-CD1 3.44Å; A2373-F2398 HydrophobicContact CB-CE1 3.5Å; A2373-F2398 VanDerWaalsContact CB-CE1 3.44Å; A2373-F2398 HydrophobicContact CB-CG 4.27Å; A2373-F2398 HydrophobicContact CB-CZ 4.4Å; A2373-F2398 WeakPolarHBondContact O-CA 3.4Å; V2389-F2398 HydrophobicContact CG1-CE1 4.33Å; V2389-F2398 HydrophobicContact CG1-CE2 4.49Å; V2389-F2398 HydrophobicContact CG1-CZ 3.72Å; V2391-F2398 HydrophobicContact CG2-CE2 3.95Å; V2391-F2398 HydrophobicContact CG2-CZ 4.1Å; V2396-F2398 HydrophobicContact CB-CD2 4.26Å; V2396-F2398 HydrophobicContact CB-CE2 3.95Å; V2396-F2398 HydrophobicContact CG1-CD1 4.48Å; V2396-F2398 HydrophobicContact CG1-CD2 3.59Å; V2396-F2398 HydrophobicContact CG1-CE1 4.27Å; V2396-F2398 HydrophobicContact CG1-CE2 3.62Å; V2396-F2398 HydrophobicContact CG1-CG 4.2Å; V2396-F2398 HydrophobicContact CG1-CZ 3.66Å; V2396-F2398 HydrophobicContact CG2-CD2 4.03Å; V2396-F2398 HydrophobicContact CG2-CE2 3.82Å; F2398-N2401 WeakPolarHBondContact CA-ND2 3.4Å; F2398-L2414 HydrophobicContact CD2-CD2 4.27Å; F2398-L2414 HydrophobicContact CE2-CD2 4.03Å; F2398-L2426 PolarHBondContact N-O 3.04Å; F2398-F2427 HydrophobicContact CB-CD2 3.53Å; F2398-F2427 HydrophobicContact CB-CE2 3.81Å; F2398-F2427 HydrophobicContact CB-CG 4.42Å; F2398-F2427 AromaticContact CD2-CD2 3.91Å; F2398-F2427 HydrophobicContact CD2-CD2 3.91Å; F2398-F2427 HydrophobicContact CD2-CE2 4.18Å; F2398-F2427 AromaticContact CG-CD2 3.93Å; F2398-F2427 HydrophobicContact CG-CD2 3.97Å; F2398-F2427 HydrophobicContact CG-CE2 4.03Å; F2398-F2427 WeakPolarHBondContact O-CA 3.44Å; F2398-R2428 PolarHBondContact O-N 3.16Å; F2398-N2430 PolarHBondContact O-ND2 3.03Å; F2398-N2430 PolarHBondContact O-OD1 2.83Å
2399	T	91.6	Very high	91.2	Very high	28.6667 Å²	28.6667	23.5 Å²	23.5	18%	0.176	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127	175.5	-38.9	0	0	0	0	111.6	A2373 V2374 N2375 N2397 N2401 R2428	A2373-T2399 PolarHBondContact O-N 3Å; V2374-T2399 WeakPolarHBondContact CA-O 3.35Å; V2374-T2399 WeakPolarHBondContact CG1-OG1 3.32Å; V2374-T2399 WeakPolarHBondContact CG2-OG1 3.45Å; N2375-T2399 PolarHBondContact N-O 3.16Å; N2375-T2399 VanDerWaalsContact N-O 3.08Å; N2397-T2399 WeakPolarHBondContact OD1-CG2 3.15Å; N2397-T2399 PolarHBondContact OD1-OG1 3.14Å; T2399-N2401 VanDerWaalsContact C-N 3.34Å; T2399-N2401 PolarHBondContact N-ND2 3.02Å; T2399-N2401 PolarHBondContact O-N 3.04Å; T2399-N2401 PolarHBondContact O-ND2 2.97Å; T2399-R2428 VanDerWaalsContact CA-O 3.29Å; T2399-R2428 WeakPolarHBondContact CA-O 3.36Å
2400	R	89	Confident	91	Very high	122 Å²	122	23.5 Å²	23.5	46%	0.46	11%	0.113	S	C	.	.	S	Bend	trans	57.6	34.8	173.4	-61.3	178.4	-178	168.5	-3.2	115	N2375 R2428 S2429 N2430	N2375-R2400 WeakPolarHBondContact CA-O 3.31Å; N2375-R2400 WeakPolarHBondContact OD1-CB 3.32Å; R2400-R2428 PolarHBondContact N-O 2.87Å; R2400-S2429 VanDerWaalsContact CA-O 3.27Å; R2400-S2429 WeakPolarHBondContact CA-O 3.39Å; R2400-N2430 PolarHBondContact N-OD1 3.02Å
2401	N	92.4	Very high	91	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.			trans	-87.1	149.1	173.4	-53.3	-81	0	0	0	110.7	A2373 N2376 F2378 F2398 T2399 F2403 N2430 V2431	A2373-N2401 PolarHBondContact O-ND2 3.1Å; A2373-N2401 PolarHBondContact O-OD1 2.9Å; N2376-N2401 VanDerWaalsContact CB-OD1 3.26Å; N2376-N2401 WeakPolarHBondContact CB-OD1 3.09Å; N2376-N2401 PolarHBondContact N-OD1 2.88Å; N2376-N2401 PolarHBondContact ND2-OD1 2.99Å; N2376-N2401 CarbonylContact O-C 3.53Å; N2376-N2401 VanDerWaalsContact O-CA 3.25Å; N2376-N2401 WeakPolarHBondContact O-CA 3.37Å; N2376-N2401 WeakPolarHBondContact O-CB 3.27Å; F2378-N2401 HydrophobicContact CE2-CB 4.41Å; F2398-N2401 WeakPolarHBondContact CA-ND2 3.4Å; T2399-N2401 VanDerWaalsContact C-N 3.34Å; T2399-N2401 PolarHBondContact N-ND2 3.02Å; T2399-N2401 PolarHBondContact O-N 3.04Å; T2399-N2401 PolarHBondContact O-ND2 2.97Å; N2401-F2403 HydrophobicContact CB-CE2 3.85Å; N2401-F2403 HydrophobicContact CB-CZ 4.36Å; N2401-N2430 WeakPolarHBondContact CB-OD1 3.39Å; N2401-N2430 PolarHBondContact N-OD1 3.23Å; N2401-N2430 PolarHBondContact ND2-OD1 3.03Å; N2401-N2430 CarbonylContact O-C 3.55Å; N2401-N2430 VanDerWaalsContact O-CA 3.26Å; N2401-N2430 WeakPolarHBondContact O-CA 3.36Å; N2401-N2430 WeakPolarHBondContact O-CB 3.33Å; N2401-V2431 PolarHBondContact O-N 3.09Å
2402	T	90.7	Very high	91.1	Very high	19.5 Å²	19.5	21.5 Å²	21.5	12%	0.12	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.5	178.2	-56.8	0	0	0	0	109.9	N2376 Y2377 F2378 V2431 Y2433	N2376-T2402 PolarHBondContact O-N 2.94Å; Y2377-T2402 HydrophobicContact CD2-CG2 4.16Å; Y2377-T2402 HydrophobicContact CE2-CG2 4.26Å; F2378-T2402 PolarHBondContact N-O 2.92Å; T2402-V2431 CarbonylContact C-O 3.4Å; T2402-V2431 WeakPolarHBondContact CA-O 3.45Å; T2402-V2431 HydrophobicContact CG2-CG1 4.37Å; T2402-Y2433 HydrophobicContact CG2-CE1 4.16Å
2403	F	94	Very high	91.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	109.9	175.7	-61.7	-92.2	0	0	0	109.5	F2378 V2389 N2401 I2411 V2412 F2427 V2431 L2432 Y2433 N2435	F2378-F2403 HydrophobicContact CB-CD1 3.56Å; F2378-F2403 HydrophobicContact CB-CE1 3.88Å; F2378-F2403 HydrophobicContact CB-CG 4.31Å; F2378-F2403 HydrophobicContact CD1-CE1 4.27Å; F2378-F2403 AromaticContact CD2-CD1 3.83Å; F2378-F2403 HydrophobicContact CD2-CD1 3.83Å; F2378-F2403 AromaticContact CD2-CE1 3.34Å; F2378-F2403 HydrophobicContact CD2-CE1 3.34Å; F2378-F2403 HydrophobicContact CD2-CE2 4.34Å; F2378-F2403 HydrophobicContact CD2-CG 4.48Å; F2378-F2403 AromaticContact CD2-CZ 3.65Å; F2378-F2403 HydrophobicContact CD2-CZ 3.65Å; F2378-F2403 AromaticContact CE2-CE1 3.88Å; F2378-F2403 HydrophobicContact CE2-CE1 3.88Å; F2378-F2403 AromaticContact CE2-CZ 3.87Å; F2378-F2403 HydrophobicContact CE2-CZ 3.87Å; F2378-F2403 AromaticContact CG-CD1 3.82Å; F2378-F2403 HydrophobicContact CG-CD1 3.82Å; F2378-F2403 AromaticContact CG-CE1 3.57Å; F2378-F2403 HydrophobicContact CG-CE1 3.57Å; F2378-F2403 HydrophobicContact CG-CZ 4.34Å; F2378-F2403 CarbonylContact O-C 3.54Å; F2378-F2403 VanDerWaalsContact O-CA 3.3Å; F2378-F2403 WeakPolarHBondContact O-CA 3.17Å; V2389-F2403 HydrophobicContact CG2-CE1 3.67Å; V2389-F2403 HydrophobicContact CG2-CZ 4.28Å; N2401-F2403 HydrophobicContact CB-CE2 3.85Å; N2401-F2403 HydrophobicContact CB-CZ 4.36Å; F2403-I2411 HydrophobicContact CB-CG2 4.39Å; F2403-I2411 HydrophobicContact CD1-CG2 3.96Å; F2403-I2411 HydrophobicContact CG-CG2 4.39Å; F2403-V2412 HydrophobicContact CE1-CG2 3.98Å; F2403-V2412 HydrophobicContact CE2-CG2 4.34Å; F2403-V2412 HydrophobicContact CZ-CG2 3.88Å; F2403-F2427 HydrophobicContact CE2-CE2 4.47Å; F2403-F2427 HydrophobicContact CE2-CZ 4.22Å; F2403-V2431 PolarHBondContact N-O 3.33Å; F2403-L2432 HydrophobicContact CB-CB 4.44Å; F2403-L2432 HydrophobicContact CB-CD2 4.3Å; F2403-L2432 HydrophobicContact CB-CG 3.99Å; F2403-L2432 HydrophobicContact CD2-CD1 4.34Å; F2403-L2432 HydrophobicContact CD2-CD2 4.07Å; F2403-L2432 HydrophobicContact CD2-CG 3.81Å; F2403-L2432 HydrophobicContact CG-CD2 4.29Å; F2403-L2432 HydrophobicContact CG-CG 4.2Å; F2403-L2432 WeakPolarHBondContact O-CA 3.39Å; F2403-Y2433 PolarHBondContact O-N 3.04Å; F2403-N2435 PolarHBondContact O-ND2 3.04Å; F2403-N2435 VanDerWaalsContact O-ND2 3.08Å
2404	Y	91.6	Very high	91.5	Very high	34 Å²	34	16.5 Å²	16.5	13%	0.133	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.7	-176.5	170.2	-123.6	0	0	0	112.3	F2378 G2379 R2380 N2406 Y2433 D2434	F2378-Y2404 PolarHBondContact O-N 2.77Å; G2379-Y2404 CarbonylContact C-O 3.55Å; G2379-Y2404 VanDerWaalsContact CA-O 3.3Å; G2379-Y2404 WeakPolarHBondContact CA-O 3.41Å; R2380-Y2404 PolarHBondContact N-O 3.12Å; Y2404-N2406 PolarHBondContact N-ND2 2.75Å; Y2404-N2406 VanDerWaalsContact N-ND2 3.19Å; Y2404-N2406 PolarHBondContact O-N 2.85Å; Y2404-N2406 VanDerWaalsContact O-N 3.1Å; Y2404-N2406 PolarHBondContact O-ND2 2.81Å; Y2404-Y2433 WeakPolarHBondContact CA-O 3.24Å; Y2404-Y2433 AromaticContact CD2-CD2 3.63Å; Y2404-Y2433 HydrophobicContact CD2-CD2 3.63Å; Y2404-Y2433 HydrophobicContact CD2-CE1 4.09Å; Y2404-Y2433 AromaticContact CD2-CE2 3.08Å; Y2404-Y2433 HydrophobicContact CD2-CE2 3.08Å; Y2404-Y2433 HydrophobicContact CD2-CG 4.33Å; Y2404-Y2433 AromaticContact CD2-CZ 3.35Å; Y2404-Y2433 VanDerWaalsContact CD2-CZ 3.48Å; Y2404-Y2433 WeakPolarHBondContact CD2-OH 3.45Å; Y2404-Y2433 HydrophobicContact CE2-CD2 4.03Å; Y2404-Y2433 AromaticContact CE2-CE2 3.42Å; Y2404-Y2433 HydrophobicContact CE2-CE2 3.42Å; Y2404-Y2433 VanDerWaalsContact CE2-CE2 3.49Å; Y2404-Y2433 AromaticContact CE2-CZ 3.92Å; Y2404-Y2433 HydrophobicContact CG-CE1 4.32Å; Y2404-Y2433 AromaticContact CG-CE2 3.92Å; Y2404-Y2433 HydrophobicContact CG-CE2 3.97Å; Y2404-Y2433 AromaticContact CG-CZ 3.75Å; Y2404-D2434 HydrophobicContact CD2-CB 4.39Å; Y2404-D2434 HydrophobicContact CE2-CB 4.24Å
2405	N	92.4	Very high	91.3	Very high	58 Å²	58	16.6 Å²	16.6	31%	0.31	8%	0.08	S	C	.	.	S	Bend	trans	51.1	37.5	170.3	-165.7	5.5	0	0	0	114.1	R2380 Y2433 D2434 N2435	R2380-N2405 VanDerWaalsContact CA-O 3.23Å; R2380-N2405 WeakPolarHBondContact CA-O 3.25Å; R2380-N2405 HydrophobicContact CG-CB 4.2Å; N2405-Y2433 PolarHBondContact N-O 2.94Å; N2405-D2434 VanDerWaalsContact CA-O 3.26Å; N2405-D2434 WeakPolarHBondContact CA-O 3.44Å; N2405-N2435 PolarHBondContact N-OD1 2.93Å
2406	N	94	Very high	90.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.08	C	C	.	.			trans	-88.8	147.9	175.1	-55.2	-79.9	0	0	0	110.1	F2378 R2380 N2381 V2388 Y2404 I2411 N2435 I2436	F2378-N2406 PolarHBondContact O-ND2 2.93Å; R2380-N2406 PolarHBondContact N-OD1 3.05Å; N2381-N2406 WeakPolarHBondContact CB-OD1 3.35Å; N2381-N2406 PolarHBondContact N-OD1 2.84Å; N2381-N2406 VanDerWaalsContact N-OD1 3.09Å; N2381-N2406 PolarHBondContact ND2-OD1 2.94Å; N2381-N2406 CarbonylContact O-C 3.54Å; N2381-N2406 WeakPolarHBondContact O-CA 3.32Å; V2388-N2406 HydrophobicContact CG1-CB 4.16Å; V2388-N2406 HydrophobicContact CG2-CB 3.9Å; Y2404-N2406 PolarHBondContact N-ND2 2.75Å; Y2404-N2406 VanDerWaalsContact N-ND2 3.19Å; Y2404-N2406 PolarHBondContact O-N 2.85Å; Y2404-N2406 VanDerWaalsContact O-N 3.1Å; Y2404-N2406 PolarHBondContact O-ND2 2.81Å; N2406-I2411 HydrophobicContact CB-CD1 4.24Å; N2406-I2411 WeakPolarHBondContact O-CD1 3.38Å; N2406-N2435 WeakPolarHBondContact CB-OD1 3.22Å; N2406-N2435 PolarHBondContact N-OD1 3.3Å; N2406-N2435 PolarHBondContact ND2-OD1 3.18Å; N2406-N2435 CarbonylContact O-C 3.56Å; N2406-N2435 WeakPolarHBondContact O-CA 3.43Å; N2406-I2436 PolarHBondContact O-N 2.88Å
2407	T	92.4	Very high	89.6	Confident	26 Å²	26	16.8 Å²	16.8	16%	0.16	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.6	174.1	-4.8	0	0	0	0	109	N2381 W2382 S2383 I2436 T2438	N2381-T2407 PolarHBondContact O-N 3.08Å; N2381-T2407 PolarHBondContact O-OG1 2.87Å; W2382-T2407 VanDerWaalsContact CA-OG1 3.31Å; W2382-T2407 WeakPolarHBondContact CA-OG1 3.3Å; S2383-T2407 PolarHBondContact N-O 2.92Å; T2407-I2436 VanDerWaalsContact CA-O 3.3Å; T2407-I2436 WeakPolarHBondContact CA-O 3.32Å; T2407-I2436 HydrophobicContact CG2-CB 4.12Å; T2407-I2436 HydrophobicContact CG2-CD1 4.17Å; T2407-I2436 HydrophobicContact CG2-CG1 4.42Å; T2407-I2436 HydrophobicContact CG2-CG2 4.43Å; T2407-T2438 HydrophobicContact CG2-CG2 4.18Å
2408	G	90.7	Very high	88.5	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	175.3	179.1	0	0	0	0	0	112	S2383 K2386 I2436 A2437 T2438	S2383-G2408 WeakPolarHBondContact O-CA 3.42Å; K2386-G2408 WeakPolarHBondContact O-CA 3.34Å; G2408-I2436 PolarHBondContact N-O 3.11Å; G2408-I2436 VanDerWaalsContact N-O 3.09Å; G2408-A2437 CarbonylContact O-C 3.54Å; G2408-A2437 VanDerWaalsContact O-CA 3.26Å; G2408-A2437 WeakPolarHBondContact O-CA 3.31Å; G2408-T2438 VanDerWaalsContact C-OG1 3.3Å; G2408-T2438 PolarHBondContact O-N 2.84Å; G2408-T2438 PolarHBondContact O-OG1 3.03Å
2409	T	88.2	Confident	87.3	Confident	3.5 Å²	3.5	26.6 Å²	26.6	2%	0.021	13%	0.126	C	C	.	.	S	Bend	trans	-62.4	-54	168.3	44	0	0	0	0	109.8	K2386 D2387 T2438 G2439 H2440	K2386-T2409 PolarHBondContact O-N 3Å; K2386-T2409 PolarHBondContact O-OG1 3.18Å; D2387-T2409 PolarHBondContact N-OG1 2.9Å; D2387-T2409 VanDerWaalsContact N-OG1 3.11Å; D2387-T2409 WeakPolarHBondContact OD1-CB 3.34Å; D2387-T2409 PolarHBondContact OD1-OG1 2.88Å; T2409-T2438 WeakPolarHBondContact CA-OG1 3.25Å; T2409-T2438 PolarHBondContact N-OG1 2.83Å; T2409-T2438 PolarHBondContact O-N 3.05Å; T2409-G2439 WeakPolarHBondContact CG2-O 3.13Å; T2409-G2439 WeakPolarHBondContact O-CA 3.32Å; T2409-G2439 PolarHBondContact O-N 3.34Å; T2409-H2440 VanDerWaalsContact CB-ND1 3.32Å; T2409-H2440 WeakPolarHBondContact CB-ND1 3.31Å; T2409-H2440 PolarHBondContact OG1-CE1 2.81Å; T2409-H2440 PolarHBondContact OG1-ND1 2.99Å
2410	H	91	Very high	86.2	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.124	C	C	.	.			trans	-121.2	160.7	156.8	-50.7	113.9	0	0	0	109.8	D2387 V2388 H2413 H2440 E2503 Y2505 S2507 F2510	D2387-H2410 CarbonylContact C-O 3.51Å; D2387-H2410 VanDerWaalsContact CA-O 3.28Å; D2387-H2410 WeakPolarHBondContact CA-O 3.31Å; D2387-H2410 WeakPolarHBondContact OD1-CA 3.42Å; D2387-H2410 VanDerWaalsContact OD1-CB 3.26Å; D2387-H2410 WeakPolarHBondContact OD1-CB 3.4Å; D2387-H2410 IonicContact OD1-CE1 3.21Å; D2387-H2410 IonicContact OD1-CG 3.39Å; D2387-H2410 PolarHBondContact OD1-N 2.83Å; D2387-H2410 IonicContact OD1-ND1 2.99Å; D2387-H2410 PolarHBondContact OD1-ND1 3.01Å; V2388-H2410 PolarHBondContact N-O 3.07Å; H2410-H2413 AromaticContact ND1-CD2 3.91Å; H2410-H2440 AromaticContact CE1-CD2 3.43Å; H2410-H2440 PolarHBondContact CE1-CD2 2.81Å; H2410-H2440 AromaticContact CE1-NE2 3.54Å; H2410-H2440 PolarHBondContact CE1-NE2 3.12Å; H2410-H2440 AromaticContact ND1-CD2 3.49Å; H2410-H2440 PolarHBondContact ND1-CD2 2.88Å; H2410-H2440 AromaticContact ND1-NE2 3.51Å; H2410-H2440 PolarHBondContact ND1-NE2 2.79Å; H2410-H2440 AromaticContact NE2-CD2 3.87Å; H2410-E2503 PolarHBondContact CE1-O 3.31Å; H2410-E2503 PolarHBondContact NE2-O 2.96Å; H2410-Y2505 PolarHBondContact NE2-O 3.01Å; H2410-S2507 WeakPolarHBondContact CA-O 3.32Å; H2410-S2507 PolarHBondContact CD2-O 3.3Å; H2410-S2507 PolarHBondContact CD2-OG 3.26Å; H2410-F2510 AromaticContact CE1-CG 3.96Å
2411	I	93.8	Very high	85.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	S	Bend	trans	-82.3	-43.4	173.9	-51.4	-57.4	0	0	0	110.1	V2388 V2389 F2403 N2406 N2435 T2508	V2388-I2411 HydrophobicContact CB-CG2 4.44Å; V2388-I2411 WeakPolarHBondContact CB-O 3.34Å; V2388-I2411 HydrophobicContact CG2-CD1 3.99Å; V2389-I2411 PolarHBondContact N-O 3.19Å; F2403-I2411 HydrophobicContact CB-CG2 4.39Å; F2403-I2411 HydrophobicContact CD1-CG2 3.96Å; F2403-I2411 HydrophobicContact CG-CG2 4.39Å; N2406-I2411 HydrophobicContact CB-CD1 4.24Å; N2406-I2411 WeakPolarHBondContact O-CD1 3.38Å; I2411-N2435 HydrophobicContact CD1-CB 3.78Å; I2411-N2435 HydrophobicContact CG1-CB 3.74Å; I2411-T2508 CarbonylContact C-O 3.51Å; I2411-T2508 WeakPolarHBondContact CA-O 3.41Å; I2411-T2508 VanDerWaalsContact CB-O 3.32Å; I2411-T2508 WeakPolarHBondContact CB-O 3.43Å; I2411-T2508 HydrophobicContact CG1-CG2 4.29Å; I2411-T2508 PolarHBondContact N-O 3.23Å; I2411-T2508 VanDerWaalsContact N-O 3.16Å
2412	V	94.4	Very high	84.1	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	112.6	175.1	-171.4	0	0	0	0	109.9	V2389 F2403 L2414 F2427 T2508 V2509 F2510	V2389-V2412 HydrophobicContact CB-CG1 4.36Å; V2389-V2412 HydrophobicContact CB-CG2 4.36Å; V2389-V2412 HydrophobicContact CG1-CG1 4.31Å; V2389-V2412 WeakPolarHBondContact O-CA 3.47Å; F2403-V2412 HydrophobicContact CE1-CG2 3.98Å; F2403-V2412 HydrophobicContact CE2-CG2 4.34Å; F2403-V2412 HydrophobicContact CZ-CG2 3.88Å; V2412-L2414 HydrophobicContact CG1-CD2 3.82Å; V2412-L2414 HydrophobicContact CG1-CG 3.99Å; V2412-F2427 HydrophobicContact CG1-CE2 4.21Å; V2412-F2427 HydrophobicContact CG2-CE2 4.31Å; V2412-F2427 HydrophobicContact CG2-CZ 4.41Å; V2412-T2508 PolarHBondContact N-O 3.2Å; V2412-V2509 HydrophobicContact CB-CG2 4.45Å; V2412-V2509 WeakPolarHBondContact O-CA 3.41Å; V2412-F2510 PolarHBondContact O-N 3.4Å
2413	H	92.9	Very high	83.5	Confident	9.5 Å²	9.5	31.1 Å²	31.1	4%	0.044	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.3	170	179.4	-77.7	0	0	0	109.8	D2387 V2389 F2390 V2391 H2410 F2510	D2387-H2413 HydrophobicContact CB-CB 4.34Å; D2387-H2413 IonicContact OD2-CG 3.5Å; V2389-H2413 PolarHBondContact O-N 2.94Å; F2390-H2413 HydrophobicContact CD2-CB 3.96Å; F2390-H2413 AromaticContact CD2-CG 3.8Å; F2390-H2413 AromaticContact CD2-ND1 3.67Å; F2390-H2413 AromaticContact CE2-CE1 3.76Å; F2390-H2413 AromaticContact CE2-CG 3.92Å; F2390-H2413 AromaticContact CE2-ND1 3.5Å; F2390-H2413 WeakPolarHBondContact CE2-ND1 3.26Å; V2391-H2413 WeakPolarHBondContact CB-O 3.41Å; V2391-H2413 PolarHBondContact N-O 3.01Å; V2391-H2413 PolarHBondContact O-ND1 3.04Å; V2391-H2413 VanDerWaalsContact O-ND1 3.14Å; H2410-H2413 AromaticContact ND1-CD2 3.91Å; H2413-F2510 AromaticContact CD2-CD1 3.35Å; H2413-F2510 WeakPolarHBondContact CD2-CD1 3.33Å; H2413-F2510 AromaticContact NE2-CD1 3.38Å; H2413-F2510 VanDerWaalsContact NE2-CD1 3.28Å; H2413-F2510 WeakPolarHBondContact NE2-CD1 3.47Å; H2413-F2510 AromaticContact NE2-CE1 3.6Å
2414	L	91	Very high	83	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	90	179.4	-64.3	177.4	0	0	0	110.2	V2391 V2396 F2398 V2412 G2416 V2509 F2510 A2512 V2516	V2391-L2414 HydrophobicContact CG2-CD2 4.36Å; V2396-L2414 HydrophobicContact CG2-CD2 3.88Å; F2398-L2414 HydrophobicContact CD2-CD2 4.27Å; F2398-L2414 HydrophobicContact CE2-CD2 4.03Å; V2412-L2414 HydrophobicContact CG1-CD2 3.82Å; V2412-L2414 HydrophobicContact CG1-CG 3.99Å; L2414-G2416 PolarHBondContact O-N 2.81Å; L2414-V2509 HydrophobicContact CD1-CG1 4.05Å; L2414-V2509 HydrophobicContact CG-CG1 4.49Å; L2414-F2510 WeakPolarHBondContact CB-O 3.32Å; L2414-F2510 PolarHBondContact N-O 3.07Å; L2414-A2512 VanDerWaalsContact O-CB 3.27Å; L2414-A2512 WeakPolarHBondContact O-CB 3.41Å; L2414-A2512 PolarHBondContact O-N 3.18Å; L2414-V2516 HydrophobicContact CD1-CG1 3.67Å
2415	G	82.3	Confident	82.8	Confident	2.5 Å²	2.5	33.7 Å²	33.7	3%	0.026	18%	0.178	C	C	.	.			trans	-68.4	52.3	177.4	0	0	0	0	0	113.2	V2391 Q2425	V2391-G2415 WeakPolarHBondContact O-CA 3.3Å; V2391-G2415 PolarHBondContact O-N 3.17Å; G2415-Q2425 PolarHBondContact O-NE2 2.84Å
2416	G	70.3	Confident	82.7	Confident	4.5 Å²	4.5	33.4 Å²	33.4	5%	0.046	18%	0.176	C	C	.	.			trans	-1.6	172.1	-178.7	0	0	0	0	0	114.2	H2393 L2414 Q2425	H2393-G2416 VanDerWaalsContact CA-O 3.29Å; H2393-G2416 WeakPolarHBondContact CA-O 3.35Å; H2393-G2416 PolarHBondContact N-O 3.11Å; L2414-G2416 PolarHBondContact O-N 2.81Å; G2416-Q2425 VanDerWaalsContact CA-NE2 3.34Å
2417	Y	73.5	Confident	82.6	Confident	14 Å²	14	33.5 Å²	33.5	6%	0.055	18%	0.176	C	C	.	.			trans	-100.6	125.6	158.5	-120.6	-77.5	0	0	0	107.9	Y2368 Q2369 H2393 L2395 D2419 V2420 Q2515	Y2368-Y2417 VanDerWaalsContact C-OH 3.26Å; Y2368-Y2417 VanDerWaalsContact CA-OH 3.28Å; Y2368-Y2417 WeakPolarHBondContact CA-OH 3.3Å; Y2368-Y2417 HydrophobicContact CD1-CE1 4.37Å; Y2368-Y2417 WeakPolarHBondContact CD2-OH 3.4Å; Y2368-Y2417 HydrophobicContact CE1-CE1 4.36Å; Y2368-Y2417 VanDerWaalsContact CE2-OH 3.31Å; Y2368-Y2417 WeakPolarHBondContact CE2-OH 3.47Å; Y2368-Y2417 VanDerWaalsContact CG-OH 3.25Å; Y2368-Y2417 PolarHBondContact N-OH 2.78Å; Q2369-Y2417 PolarHBondContact N-OH 3.16Å; Q2369-Y2417 PolarHBondContact O-OH 2.82Å; H2393-Y2417 VanDerWaalsContact C-CE1 3.49Å; H2393-Y2417 WeakPolarHBondContact O-CE1 3.27Å; H2393-Y2417 PolarHBondContact O-OH 3.26Å; L2395-Y2417 HydrophobicContact CB-CD2 4.37Å; L2395-Y2417 HydrophobicContact CB-CE2 3.87Å; Y2417-D2419 HydrophobicContact CE1-CB 3.91Å; Y2417-D2419 PolarHBondContact O-N 2.75Å; Y2417-V2420 HydrophobicContact CD1-CB 3.7Å; Y2417-V2420 HydrophobicContact CD1-CG2 4.11Å; Y2417-V2420 HydrophobicContact CE1-CB 3.7Å; Y2417-V2420 HydrophobicContact CE1-CG2 3.36Å; Y2417-V2420 HydrophobicContact CG-CB 4.28Å; Y2417-V2420 HydrophobicContact CG-CG2 4.02Å; Y2417-Q2515 PolarHBondContact O-OE1 3.13Å; Y2417-Q2515 VanDerWaalsContact O-OE1 3.08Å
2418	R	68.8	Low	82.6	Confident	113.5 Å²	113.5	38.1 Å²	38.1	43%	0.428	19%	0.191	S	C	.	.	S	Bend	trans	-80.9	-29.5	-178	-63.6	-175.8	-176.7	174.4	0.5	113	A2542	R2418-A2542 WeakPolarHBondContact O-CB 3.34Å; R2418-A2542 PolarHBondContact O-N 3.01Å
2419	D	69.3	Low	82.5	Confident	121.5 Å²	121.5	39.8 Å²	39.8	65%	0.65	20%	0.202	S	C	*	.	S	Bend	trans	-95.8	-11.9	-166.6	-51.1	-44.8	0	0	0	115.5	Y2417 A2542	Y2417-D2419 HydrophobicContact CE1-CB 3.91Å; Y2417-D2419 PolarHBondContact O-N 2.75Å; D2419-A2542 VanDerWaalsContact C-CB 3.47Å; D2419-A2542 WeakPolarHBondContact O-CB 3.39Å
2420	V	68.5	Low	82.7	Confident	21.5 Å²	21.5	39.6 Å²	39.6	13%	0.13	20%	0.201	C	C	.	.			trans	-118.1	113.1	-167.8	178.2	0	0	0	0	111.7	Y2368 Y2417 T2422 Q2515	Y2368-V2420 HydrophobicContact CD1-CG1 4.06Å; Y2368-V2420 HydrophobicContact CD1-CG2 3.77Å; Y2368-V2420 HydrophobicContact CE1-CB 4.41Å; Y2368-V2420 HydrophobicContact CE1-CG1 3.91Å; Y2368-V2420 HydrophobicContact CE1-CG2 3.24Å; Y2368-V2420 VanDerWaalsContact CE1-CG2 3.45Å; Y2417-V2420 HydrophobicContact CD1-CB 3.7Å; Y2417-V2420 HydrophobicContact CD1-CG2 4.11Å; Y2417-V2420 HydrophobicContact CE1-CB 3.7Å; Y2417-V2420 HydrophobicContact CE1-CG2 3.36Å; Y2417-V2420 HydrophobicContact CG-CB 4.28Å; Y2417-V2420 HydrophobicContact CG-CG2 4.02Å; V2420-T2422 WeakPolarHBondContact CG1-OG1 3.49Å; V2420-T2422 PolarHBondContact O-N 2.99Å; V2420-Q2515 PolarHBondContact O-NE2 3.3Å; V2420-Q2515 PolarHBondContact O-OE1 3.03Å; V2420-Q2515 VanDerWaalsContact O-OE1 3.05Å
2421	S	65.5	Low	82.7	Confident	67.5 Å²	67.5	40.5 Å²	40.5	47%	0.472	21%	0.206	S	C	.	.	S	Bend	trans	-81.4	-12.7	-175.2	61.2	0	0	0	0	116.3
2422	T	70.9	Confident	82.6	Confident	113.5 Å²	113.5	40.5 Å²	40.5	70%	0.696	21%	0.206	S	C	*	.	S	Bend	trans	-93.2	-22.1	-162.5	55.2	0	0	0	0	116.3	V2420	V2420-T2422 WeakPolarHBondContact CG1-OG1 3.49Å; V2420-T2422 PolarHBondContact O-N 2.99Å
2423	E	78.1	Confident	82.5	Confident	62 Å²	62	41.1 Å²	41.1	29%	0.29	21%	0.209	S	C	.	.			trans	-121.1	129.5	-176.5	-64.6	-163.3	-152.3	0	0	111.2	R2342 K2370 L2395	R2342-E2423 IonicContact NH1-OE1 2.98Å; R2342-E2423 PolarHBondContact NH1-OE1 3.09Å; K2370-E2423 IonicContact NZ-OE2 3.29Å; K2370-E2423 PolarHBondContact NZ-OE2 2.77Å; L2395-E2423 HydrophobicContact CD1-CB 3.91Å; L2395-E2423 HydrophobicContact CD1-CG 4.34Å; L2395-E2423 WeakPolarHBondContact CD1-O 3.49Å; L2395-E2423 WeakPolarHBondContact CD1-OE2 3.44Å; L2395-E2423 HydrophobicContact CD2-CB 3.99Å; L2395-E2423 HydrophobicContact CD2-CG 4.35Å; L2395-E2423 WeakPolarHBondContact CD2-OE2 3.47Å
2424	F	83.6	Confident	82.4	Confident	84.5 Å²	84.5	43.9 Å²	43.9	37%	0.371	22%	0.224	S	C	.	.			trans	-95.6	141.1	176.9	-73.9	-104.1	0	0	0	110.9	Q2515 K2517 Y2543	F2424-Q2515 CarbonylContact C-O 3.6Å; F2424-Q2515 WeakPolarHBondContact CA-O 3.46Å; F2424-Q2515 HydrophobicContact CD1-CB 4.29Å; F2424-K2517 HydrophobicContact CB-CB 4.41Å; F2424-Y2543 HydrophobicContact CE1-CD1 4.39Å; F2424-Y2543 AromaticContact CE1-CE1 3.94Å; F2424-Y2543 HydrophobicContact CE1-CE1 3.94Å; F2424-Y2543 HydrophobicContact CZ-CD1 4.48Å; F2424-Y2543 HydrophobicContact CZ-CD2 4.4Å; F2424-Y2543 HydrophobicContact CZ-CE1 4.2Å; F2424-Y2543 AromaticContact CZ-CE2 3.99Å; F2424-Y2543 HydrophobicContact CZ-CE2 4.04Å; F2424-Y2543 AromaticContact CZ-CZ 3.89Å
2425	Q	87.7	Confident	82.5	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.019	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	134.6	166.1	-69.3	-174.4	-10.8	0	0	109.3	M2394 L2395 V2396 G2415 G2416 Q2515 V2516 K2517	M2394-Q2425 PolarHBondContact O-NE2 3.23Å; L2395-Q2425 HydrophobicContact CD1-CB 4.47Å; L2395-Q2425 HydrophobicContact CD1-CG 3.76Å; L2395-Q2425 HydrophobicContact CD2-CG 4.07Å; V2396-Q2425 HydrophobicContact CG2-CB 4.45Å; V2396-Q2425 HydrophobicContact CG2-CG 4.14Å; V2396-Q2425 WeakPolarHBondContact O-CA 3.37Å; G2415-Q2425 PolarHBondContact O-NE2 2.84Å; G2416-Q2425 VanDerWaalsContact CA-NE2 3.34Å; Q2425-Q2515 PolarHBondContact N-O 2.97Å; Q2425-V2516 HydrophobicContact CB-CG2 4.38Å; Q2425-K2517 PolarHBondContact O-N 3.13Å
2426	L	90.1	Very high	83	Confident	52 Å²	52	46.5 Å²	46.5	27%	0.272	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.5	-176.2	-119.5	118.8	0	0	0	109.9	V2396 N2397 F2398 R2428 K2517	V2396-L2426 PolarHBondContact O-N 2.93Å; V2396-L2426 VanDerWaalsContact O-N 3.13Å; N2397-L2426 CarbonylContact C-O 3.4Å; N2397-L2426 WeakPolarHBondContact CA-O 3.22Å; N2397-L2426 HydrophobicContact CB-CB 4.31Å; F2398-L2426 PolarHBondContact N-O 3.04Å; L2426-R2428 HydrophobicContact CD1-CB 4.26Å; L2426-R2428 HydrophobicContact CD2-CB 4.17Å; L2426-R2428 HydrophobicContact CG-CB 3.95Å; L2426-K2517 HydrophobicContact CD1-CB 4.28Å; L2426-K2517 HydrophobicContact CD1-CD 4.48Å; L2426-K2517 HydrophobicContact CD1-CG 4.4Å; L2426-K2517 HydrophobicContact CD2-CB 4.15Å; L2426-K2517 HydrophobicContact CD2-CD 4.14Å; L2426-K2517 HydrophobicContact CD2-CG 4.46Å
2427	F	92.5	Very high	83.9	Confident	0.5 Å²	0.5	46.5 Å²	46.5	0%	0.002	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	91.3	171.5	-161.5	-94.8	0	0	0	107.7	F2398 F2403 V2412 N2430 L2432 K2517 I2518 E2519 N2521 F2523	F2398-F2427 HydrophobicContact CB-CD2 3.53Å; F2398-F2427 HydrophobicContact CB-CE2 3.81Å; F2398-F2427 HydrophobicContact CB-CG 4.42Å; F2398-F2427 AromaticContact CD2-CD2 3.91Å; F2398-F2427 HydrophobicContact CD2-CD2 3.91Å; F2398-F2427 HydrophobicContact CD2-CE2 4.18Å; F2398-F2427 AromaticContact CG-CD2 3.93Å; F2398-F2427 HydrophobicContact CG-CD2 3.97Å; F2398-F2427 HydrophobicContact CG-CE2 4.03Å; F2398-F2427 WeakPolarHBondContact O-CA 3.44Å; F2403-F2427 HydrophobicContact CE2-CE2 4.47Å; F2403-F2427 HydrophobicContact CE2-CZ 4.22Å; V2412-F2427 HydrophobicContact CG1-CE2 4.21Å; V2412-F2427 HydrophobicContact CG2-CE2 4.31Å; V2412-F2427 HydrophobicContact CG2-CZ 4.41Å; F2427-N2430 HydrophobicContact CD1-CB 4.34Å; F2427-N2430 VanDerWaalsContact CD1-ND2 3.29Å; F2427-N2430 WeakPolarHBondContact CD1-ND2 3.33Å; F2427-N2430 HydrophobicContact CE1-CB 3.69Å; F2427-N2430 WeakPolarHBondContact CE1-ND2 3.28Å; F2427-N2430 WeakPolarHBondContact CG-ND2 3.45Å; F2427-N2430 HydrophobicContact CZ-CB 3.8Å; F2427-L2432 HydrophobicContact CE1-CD1 3.73Å; F2427-L2432 HydrophobicContact CZ-CD1 3.92Å; F2427-L2432 HydrophobicContact CZ-CD2 4.31Å; F2427-K2517 PolarHBondContact N-O 3.26Å; F2427-I2518 HydrophobicContact CB-CG1 4.27Å; F2427-I2518 HydrophobicContact CD1-CG2 4.2Å; F2427-I2518 WeakPolarHBondContact O-CA 3.36Å; F2427-E2519 PolarHBondContact O-N 3.12Å; F2427-N2521 VanDerWaalsContact CD1-OD1 3.31Å; F2427-N2521 WeakPolarHBondContact CD1-OD1 3.33Å; F2427-N2521 PolarHBondContact O-ND2 2.88Å; F2427-N2521 PolarHBondContact O-OD1 3.41Å; F2427-F2523 HydrophobicContact CE1-CE1 4.46Å; F2427-F2523 HydrophobicContact CE1-CZ 4.28Å
2428	R	90.9	Very high	84.4	Confident	124 Å²	124	47.5 Å²	47.5	47%	0.468	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.9	-168.3	-174.7	177	178.6	177.9	3.9	113.6	F2398 T2399 R2400 L2426 N2430 E2519	F2398-R2428 PolarHBondContact O-N 3.16Å; T2399-R2428 VanDerWaalsContact CA-O 3.29Å; T2399-R2428 WeakPolarHBondContact CA-O 3.36Å; R2400-R2428 PolarHBondContact N-O 2.87Å; L2426-R2428 HydrophobicContact CD1-CB 4.26Å; L2426-R2428 HydrophobicContact CD2-CB 4.17Å; L2426-R2428 HydrophobicContact CG-CB 3.95Å; R2428-N2430 PolarHBondContact N-ND2 2.82Å; R2428-N2430 VanDerWaalsContact N-ND2 3.11Å; R2428-N2430 PolarHBondContact O-N 3.01Å; R2428-N2430 VanDerWaalsContact O-N 3.12Å; R2428-N2430 PolarHBondContact O-ND2 2.99Å; R2428-E2519 VanDerWaalsContact CA-O 3.28Å; R2428-E2519 WeakPolarHBondContact CA-O 3.16Å
2429	S	89.6	Confident	84.8	Confident	34.5 Å²	34.5	42.2 Å²	42.2	24%	0.241	23%	0.225	C	C	.	.	S	Bend	trans	56.4	26.3	172.6	-58.3	0	0	0	0	114.7	R2400 E2519 N2520 N2521	R2400-S2429 VanDerWaalsContact CA-O 3.27Å; R2400-S2429 WeakPolarHBondContact CA-O 3.39Å; S2429-E2519 PolarHBondContact N-O 3.18Å; S2429-N2520 VanDerWaalsContact CA-O 3.25Å; S2429-N2520 WeakPolarHBondContact CA-O 3.36Å; S2429-N2521 PolarHBondContact N-OD1 3.04Å
2430	N	92.3	Very high	84.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.			trans	-82.5	154.3	174.8	-53.5	-73.2	0	0	0	110.5	F2398 R2400 N2401 F2427 R2428 L2432 N2521 F2522	F2398-N2430 PolarHBondContact O-ND2 3.03Å; F2398-N2430 PolarHBondContact O-OD1 2.83Å; R2400-N2430 PolarHBondContact N-OD1 3.02Å; N2401-N2430 WeakPolarHBondContact CB-OD1 3.39Å; N2401-N2430 PolarHBondContact N-OD1 3.23Å; N2401-N2430 PolarHBondContact ND2-OD1 3.03Å; N2401-N2430 CarbonylContact O-C 3.55Å; N2401-N2430 VanDerWaalsContact O-CA 3.26Å; N2401-N2430 WeakPolarHBondContact O-CA 3.36Å; N2401-N2430 WeakPolarHBondContact O-CB 3.33Å; F2427-N2430 HydrophobicContact CD1-CB 4.34Å; F2427-N2430 VanDerWaalsContact CD1-ND2 3.29Å; F2427-N2430 WeakPolarHBondContact CD1-ND2 3.33Å; F2427-N2430 HydrophobicContact CE1-CB 3.69Å; F2427-N2430 WeakPolarHBondContact CE1-ND2 3.28Å; F2427-N2430 WeakPolarHBondContact CG-ND2 3.45Å; F2427-N2430 HydrophobicContact CZ-CB 3.8Å; R2428-N2430 PolarHBondContact N-ND2 2.82Å; R2428-N2430 VanDerWaalsContact N-ND2 3.11Å; R2428-N2430 PolarHBondContact O-N 3.01Å; R2428-N2430 VanDerWaalsContact O-N 3.12Å; R2428-N2430 PolarHBondContact O-ND2 2.99Å; N2430-L2432 HydrophobicContact CB-CD1 3.94Å; N2430-N2521 WeakPolarHBondContact CA-OD1 3.44Å; N2430-N2521 VanDerWaalsContact CB-OD1 3.3Å; N2430-N2521 WeakPolarHBondContact CB-OD1 3.25Å; N2430-N2521 PolarHBondContact N-OD1 3.11Å; N2430-N2521 PolarHBondContact ND2-OD1 2.86Å; N2430-N2521 VanDerWaalsContact ND2-OD1 3.11Å; N2430-N2521 CarbonylContact O-C 3.56Å; N2430-N2521 VanDerWaalsContact O-CA 3.28Å; N2430-N2521 WeakPolarHBondContact O-CA 3.42Å; N2430-N2521 WeakPolarHBondContact O-CB 3.46Å; N2430-F2522 PolarHBondContact O-N 2.73Å
2431	V	90.6	Very high	84.5	Confident	19 Å²	19	40.5 Å²	40.5	12%	0.115	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	115.5	-175.5	173.1	0	0	0	0	108.5	N2401 T2402 F2403 Y2433 F2522 P2598	N2401-V2431 PolarHBondContact O-N 3.09Å; T2402-V2431 CarbonylContact C-O 3.4Å; T2402-V2431 WeakPolarHBondContact CA-O 3.45Å; T2402-V2431 HydrophobicContact CG2-CG1 4.37Å; F2403-V2431 PolarHBondContact N-O 3.33Å; V2431-Y2433 HydrophobicContact CG1-CD1 3.84Å; V2431-Y2433 HydrophobicContact CG1-CE1 4.07Å; V2431-F2522 HydrophobicContact CG1-CD1 4.11Å; V2431-F2522 HydrophobicContact CG2-CB 4.4Å; V2431-P2598 HydrophobicContact CG1-CB 3.32Å
2432	L	93	Very high	83.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	110	-175.9	-62.6	90.9	0	0	0	109.9	F2403 F2427 N2430 V2509 F2522 F2523 S2524 N2525	F2403-L2432 HydrophobicContact CB-CB 4.44Å; F2403-L2432 HydrophobicContact CB-CD2 4.3Å; F2403-L2432 HydrophobicContact CB-CG 3.99Å; F2403-L2432 HydrophobicContact CD2-CD1 4.34Å; F2403-L2432 HydrophobicContact CD2-CD2 4.07Å; F2403-L2432 HydrophobicContact CD2-CG 3.81Å; F2403-L2432 HydrophobicContact CG-CD2 4.29Å; F2403-L2432 HydrophobicContact CG-CG 4.2Å; F2403-L2432 WeakPolarHBondContact O-CA 3.39Å; F2427-L2432 HydrophobicContact CE1-CD1 3.73Å; F2427-L2432 HydrophobicContact CZ-CD1 3.92Å; F2427-L2432 HydrophobicContact CZ-CD2 4.31Å; N2430-L2432 HydrophobicContact CB-CD1 3.94Å; L2432-V2509 HydrophobicContact CD2-CG2 4.34Å; L2432-F2522 PolarHBondContact N-O 2.96Å; L2432-F2523 HydrophobicContact CB-CD1 4.17Å; L2432-F2523 HydrophobicContact CD1-CD1 4.09Å; L2432-F2523 HydrophobicContact CD1-CE1 3.79Å; L2432-F2523 HydrophobicContact CD1-CZ 4.46Å; L2432-F2523 HydrophobicContact CD2-CD1 4.42Å; L2432-F2523 HydrophobicContact CD2-CE1 4.13Å; L2432-F2523 HydrophobicContact CG-CD1 4.44Å; L2432-F2523 HydrophobicContact CG-CE1 4.38Å; L2432-S2524 PolarHBondContact O-N 3Å; L2432-N2525 PolarHBondContact O-ND2 2.98Å
2433	Y	90.7	Very high	82.3	Confident	12.5 Å²	12.5	44.7 Å²	44.7	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	149.8	179.8	68.9	-75.2	0	0	0	113.8	T2402 F2403 Y2404 N2405 V2431 N2435 S2524 N2525 P2598	T2402-Y2433 HydrophobicContact CG2-CE1 4.16Å; F2403-Y2433 PolarHBondContact O-N 3.04Å; Y2404-Y2433 WeakPolarHBondContact CA-O 3.24Å; Y2404-Y2433 AromaticContact CD2-CD2 3.63Å; Y2404-Y2433 HydrophobicContact CD2-CD2 3.63Å; Y2404-Y2433 HydrophobicContact CD2-CE1 4.09Å; Y2404-Y2433 AromaticContact CD2-CE2 3.08Å; Y2404-Y2433 HydrophobicContact CD2-CE2 3.08Å; Y2404-Y2433 HydrophobicContact CD2-CG 4.33Å; Y2404-Y2433 AromaticContact CD2-CZ 3.35Å; Y2404-Y2433 VanDerWaalsContact CD2-CZ 3.48Å; Y2404-Y2433 WeakPolarHBondContact CD2-OH 3.45Å; Y2404-Y2433 HydrophobicContact CE2-CD2 4.03Å; Y2404-Y2433 AromaticContact CE2-CE2 3.42Å; Y2404-Y2433 HydrophobicContact CE2-CE2 3.42Å; Y2404-Y2433 VanDerWaalsContact CE2-CE2 3.49Å; Y2404-Y2433 AromaticContact CE2-CZ 3.92Å; Y2404-Y2433 HydrophobicContact CG-CE1 4.32Å; Y2404-Y2433 AromaticContact CG-CE2 3.92Å; Y2404-Y2433 HydrophobicContact CG-CE2 3.97Å; Y2404-Y2433 AromaticContact CG-CZ 3.75Å; N2405-Y2433 PolarHBondContact N-O 2.94Å; V2431-Y2433 HydrophobicContact CG1-CD1 3.84Å; V2431-Y2433 HydrophobicContact CG1-CE1 4.07Å; Y2433-N2435 PolarHBondContact N-ND2 2.92Å; Y2433-N2435 VanDerWaalsContact N-ND2 3.16Å; Y2433-N2435 PolarHBondContact O-N 2.89Å; Y2433-N2435 VanDerWaalsContact O-N 3.15Å; Y2433-N2435 PolarHBondContact O-ND2 3.16Å; Y2433-S2524 VanDerWaalsContact CA-O 3.32Å; Y2433-S2524 WeakPolarHBondContact CA-O 3.37Å; Y2433-N2525 VanDerWaalsContact C-OD1 3.24Å; Y2433-N2525 VanDerWaalsContact CA-OD1 3.27Å; Y2433-N2525 WeakPolarHBondContact CA-OD1 3.31Å; Y2433-N2525 PolarHBondContact N-OD1 2.87Å; Y2433-P2598 HydrophobicContact CD1-CB 3.75Å; Y2433-P2598 HydrophobicContact CD1-CG 4.07Å; Y2433-P2598 HydrophobicContact CD2-CG 4.32Å; Y2433-P2598 HydrophobicContact CE1-CB 3.72Å; Y2433-P2598 HydrophobicContact CE1-CG 4.26Å; Y2433-P2598 VanDerWaalsContact CE1-O 3.23Å; Y2433-P2598 WeakPolarHBondContact CE1-O 3.4Å; Y2433-P2598 HydrophobicContact CE2-CG 4.47Å; Y2433-P2598 HydrophobicContact CG-CB 4.3Å; Y2433-P2598 HydrophobicContact CG-CG 4.1Å; Y2433-P2598 VanDerWaalsContact CZ-O 3.32Å; Y2433-P2598 PolarHBondContact OH-O 2.83Å
2434	D	91.1	Very high	80.4	Confident	67.5 Å²	67.5	48.2 Å²	48.2	36%	0.361	24%	0.237	S	C	.	.	S	Bend	trans	55.2	19.9	-179.4	-58.5	-24.1	0	0	0	115.1	Y2404 N2405 S2524 N2525	Y2404-D2434 HydrophobicContact CD2-CB 4.39Å; Y2404-D2434 HydrophobicContact CE2-CB 4.24Å; N2405-D2434 VanDerWaalsContact CA-O 3.26Å; N2405-D2434 WeakPolarHBondContact CA-O 3.44Å; D2434-S2524 PolarHBondContact N-O 3.11Å; D2434-S2524 VanDerWaalsContact N-O 3.16Å; D2434-N2525 PolarHBondContact N-OD1 2.86Å
2435	N	93.7	Very high	78.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.247	C	C	.	.			trans	-82.5	154.1	177.7	-53.5	-82.3	0	0	0	111.5	F2403 N2405 N2406 I2411 Y2433 N2525 N2528	F2403-N2435 PolarHBondContact O-ND2 3.04Å; F2403-N2435 VanDerWaalsContact O-ND2 3.08Å; N2405-N2435 PolarHBondContact N-OD1 2.93Å; N2406-N2435 WeakPolarHBondContact CB-OD1 3.22Å; N2406-N2435 PolarHBondContact N-OD1 3.3Å; N2406-N2435 PolarHBondContact ND2-OD1 3.18Å; N2406-N2435 CarbonylContact O-C 3.56Å; N2406-N2435 WeakPolarHBondContact O-CA 3.43Å; I2411-N2435 HydrophobicContact CD1-CB 3.78Å; I2411-N2435 HydrophobicContact CG1-CB 3.74Å; Y2433-N2435 PolarHBondContact N-ND2 2.92Å; Y2433-N2435 VanDerWaalsContact N-ND2 3.16Å; Y2433-N2435 PolarHBondContact O-N 2.89Å; Y2433-N2435 VanDerWaalsContact O-N 3.15Å; Y2433-N2435 PolarHBondContact O-ND2 3.16Å; N2435-N2525 WeakPolarHBondContact CB-OD1 3.37Å; N2435-N2525 PolarHBondContact N-OD1 3.08Å; N2435-N2525 PolarHBondContact ND2-OD1 2.93Å; N2435-N2528 PolarHBondContact O-ND2 2.84Å
2436	I	92.5	Very high	75.8	Confident	59 Å²	59	52.9 Å²	52.9	30%	0.303	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.2	-177.9	-57.7	171.9	0	0	0	109.9	N2406 T2407 G2408 D2527 N2528	N2406-I2436 PolarHBondContact O-N 2.88Å; T2407-I2436 VanDerWaalsContact CA-O 3.3Å; T2407-I2436 WeakPolarHBondContact CA-O 3.32Å; T2407-I2436 HydrophobicContact CG2-CB 4.12Å; T2407-I2436 HydrophobicContact CG2-CD1 4.17Å; T2407-I2436 HydrophobicContact CG2-CG1 4.42Å; T2407-I2436 HydrophobicContact CG2-CG2 4.43Å; G2408-I2436 PolarHBondContact N-O 3.11Å; G2408-I2436 VanDerWaalsContact N-O 3.09Å; I2436-D2527 HydrophobicContact CG1-CB 4.23Å; I2436-N2528 WeakPolarHBondContact CA-OD1 3.39Å
2437	A	89.9	Confident	73.4	Confident	4.5 Å²	4.5	57.7 Å²	57.7	4%	0.037	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128	177	0	0	0	0	0	110.6	G2408 H2506 S2507 N2528	G2408-A2437 CarbonylContact O-C 3.54Å; G2408-A2437 VanDerWaalsContact O-CA 3.26Å; G2408-A2437 WeakPolarHBondContact O-CA 3.31Å; A2437-H2506 HydrophobicContact CB-CB 4.22Å; A2437-H2506 WeakPolarHBondContact O-CB 3.38Å; A2437-H2506 PolarHBondContact O-ND1 2.85Å; A2437-S2507 VanDerWaalsContact CB-O 3.29Å; A2437-S2507 WeakPolarHBondContact CB-O 3.37Å; A2437-N2528 PolarHBondContact N-OD1 2.91Å
2438	T	84.1	Confident	70.7	Confident	36 Å²	36	68 Å²	68	22%	0.221	33%	0.33	C	S	.	.			trans	-99.4	-17	-177.7	56.7	0	0	0	0	113.7	P2384 T2407 G2408 T2409 H2443 F2451 H2506	P2384-T2438 PolarHBondContact O-OG1 2.04Å; T2407-T2438 HydrophobicContact CG2-CG2 4.18Å; G2408-T2438 VanDerWaalsContact C-OG1 3.3Å; G2408-T2438 PolarHBondContact O-N 2.84Å; G2408-T2438 PolarHBondContact O-OG1 3.03Å; T2409-T2438 WeakPolarHBondContact CA-OG1 3.25Å; T2409-T2438 PolarHBondContact N-OG1 2.83Å; T2409-T2438 PolarHBondContact O-N 3.05Å; T2438-H2443 PolarHBondContact O-CD2 3.17Å; T2438-F2451 HydrophobicContact CG2-CE1 4.17Å; T2438-H2506 VanDerWaalsContact C-CE1 3.41Å; T2438-H2506 WeakPolarHBondContact CA-ND1 3.15Å; T2438-H2506 PolarHBondContact O-CE1 2.71Å; T2438-H2506 PolarHBondContact O-ND1 3.06Å; T2438-H2506 VanDerWaalsContact O-ND1 3.08Å
2439	G	76.7	Confident	67.9	Low	3 Å²	3	64.2 Å²	64.2	3%	0.031	33%	0.33	C	S	.	.			trans	73.6	157.7	-176.7	0	0	0	0	0	113.5	T2409 G2441	T2409-G2439 WeakPolarHBondContact CG2-O 3.13Å; T2409-G2439 WeakPolarHBondContact O-CA 3.32Å; T2409-G2439 PolarHBondContact O-N 3.34Å; G2439-G2441 PolarHBondContact O-N 3.33Å
2440	H	70.7	Confident	65.1	Low	55 Å²	55	73 Å²	73	26%	0.255	36%	0.359	S	S	.	.	S	Bend	trans	-76.7	130.4	175.3	-68.4	-71.8	0	0	0	111.8	D2387 T2409 H2410 E2503 R2504	D2387-H2440 IonicContact OD1-CD2 2.65Å; D2387-H2440 IonicContact OD1-CE1 3.97Å; D2387-H2440 IonicContact OD1-NE2 2.76Å; D2387-H2440 PolarHBondContact OD1-NE2 3.44Å; D2387-H2440 IonicContact OD2-CE1 3.8Å; D2387-H2440 PolarHBondContact OD2-CE1 3.01Å; D2387-H2440 IonicContact OD2-NE2 3.19Å; D2387-H2440 PolarHBondContact OD2-NE2 3.32Å; T2409-H2440 VanDerWaalsContact CB-ND1 3.32Å; T2409-H2440 WeakPolarHBondContact CB-ND1 3.31Å; T2409-H2440 PolarHBondContact OG1-CE1 2.81Å; T2409-H2440 PolarHBondContact OG1-ND1 2.99Å; H2410-H2440 AromaticContact CE1-CD2 3.43Å; H2410-H2440 PolarHBondContact CE1-CD2 2.81Å; H2410-H2440 AromaticContact CE1-NE2 3.54Å; H2410-H2440 PolarHBondContact CE1-NE2 3.12Å; H2410-H2440 AromaticContact ND1-CD2 3.49Å; H2410-H2440 PolarHBondContact ND1-CD2 2.88Å; H2410-H2440 AromaticContact ND1-NE2 3.51Å; H2410-H2440 PolarHBondContact ND1-NE2 2.79Å; H2410-H2440 AromaticContact NE2-CD2 3.87Å; H2440-E2503 HydrophobicContact CB-CB 4.4Å; H2440-E2503 PolarHBondContact CD2-O 2.76Å; H2440-E2503 VanDerWaalsContact CD2-O 3.3Å; H2440-E2503 PolarHBondContact N-O 3.36Å; H2440-R2504 PolarHBondContact N-O 2.92Å; H2440-R2504 VanDerWaalsContact O-CA 3.28Å; H2440-R2504 WeakPolarHBondContact O-CA 3.19Å; H2440-R2504 VanDerWaalsContact O-CB 3.31Å; H2440-R2504 WeakPolarHBondContact O-CB 3.31Å; H2440-R2504 VanDerWaalsContact O-CG 3.25Å; H2440-R2504 WeakPolarHBondContact O-CG 3.4Å
2441	G	59.4	Low	62.4	Low	51 Å²	51	80.3 Å²	80.3	53%	0.526	39%	0.391	S	S	.	.	S	Bend	trans	120	178.4	174.3	0	0	0	0	0	114.5	G2439 H2443	G2439-G2441 PolarHBondContact O-N 3.33Å; G2441-H2443 PolarHBondContact O-N 3.41Å; G2441-H2443 VanDerWaalsContact O-N 3.08Å
2442	Y	49.6	Very low	59.7	Low	202.5 Å²	202.5	81.8 Å²	81.8	79%	0.794	41%	0.41	S	S	*	.			trans	-80.4	100.2	179.6	-64.6	-78	0	0	0	110.8	F2444 W2494	Y2442-F2444 PolarHBondContact O-N 2.99Å; Y2442-F2444 VanDerWaalsContact O-N 3.14Å; Y2442-W2494 WeakPolarHBondContact O-CH2 3.19Å; Y2442-W2494 WeakPolarHBondContact O-CZ3 3.4Å
2443	H	41.5	Very low	56.8	Low	67 Å²	67	91 Å²	91	31%	0.31	45%	0.45	S	S	.	.			trans	-65.4	102.3	172	-72.9	-66.1	0	0	0	111.1	T2438 G2441 R2504	T2438-H2443 PolarHBondContact O-CD2 3.17Å; G2441-H2443 PolarHBondContact O-N 3.41Å; G2441-H2443 VanDerWaalsContact O-N 3.08Å; H2443-R2504 PolarHBondContact CE1-O 3.06Å; H2443-R2504 PolarHBondContact NE2-O 2.91Å
2444	F	38.2	Very low	54.2	Low	135.5 Å²	135.5	98.7 Å²	98.7	59%	0.594	49%	0.487	S	S	*	.			trans	-76.9	131.4	156.1	-84.9	-82.9	0	0	0	109.4	Y2442 P2446 W2494 W2495	Y2442-F2444 PolarHBondContact O-N 2.99Å; Y2442-F2444 VanDerWaalsContact O-N 3.14Å; F2444-P2446 WeakPolarHBondContact O-CD 3.43Å; F2444-W2494 HydrophobicContact CB-CZ2 4.22Å; F2444-W2494 AromaticContact CD2-CE2 3.72Å; F2444-W2494 HydrophobicContact CD2-CH2 4.19Å; F2444-W2494 AromaticContact CD2-CZ2 3.49Å; F2444-W2494 HydrophobicContact CD2-CZ2 3.49Å; F2444-W2494 VanDerWaalsContact CD2-CZ2 3.49Å; F2444-W2494 AromaticContact CD2-NE1 3.91Å; F2444-W2494 HydrophobicContact CE2-CZ2 4.35Å; F2444-W2494 HydrophobicContact CG-CZ2 4.31Å; F2444-W2495 HydrophobicContact CD2-CE3 4.27Å; F2444-W2495 HydrophobicContact CD2-CZ3 4.47Å; F2444-W2495 AromaticContact CE2-CE3 3.99Å; F2444-W2495 HydrophobicContact CE2-CE3 3.99Å; F2444-W2495 AromaticContact CE2-CZ3 3.84Å; F2444-W2495 HydrophobicContact CE2-CZ3 3.84Å; F2444-W2495 HydrophobicContact CZ-CZ3 4.02Å
2445	I	36.3	Very low	51.4	Low	114.5 Å²	114.5	104.4 Å²	104.4	59%	0.587	51%	0.511	S	S	*	.			trans	-61.6	130	175.7	-61	168.8	0	0	0	109	Q2447	I2445-Q2447 VanDerWaalsContact C-N 3.3Å; I2445-Q2447 HydrophobicContact CG2-CG 4.15Å; I2445-Q2447 PolarHBondContact O-N 3.41Å
2446	P	39.1	Very low	48.4	Very low	73 Å²	73	108 Å²	108	47%	0.474	55%	0.548	S	S	.	.	S	Bend	trans	-75.8	54.9	-168.8	8.9	-2.3	0	0	0	113.5	F2444 Y2448 G2449 F2451	F2444-P2446 WeakPolarHBondContact O-CD 3.43Å; P2446-Y2448 PolarHBondContact O-N 3.4Å; P2446-G2449 WeakPolarHBondContact CB-O 3.2Å; P2446-G2449 PolarHBondContact O-N 3.05Å; P2446-F2451 HydrophobicContact CB-CD2 3.92Å; P2446-F2451 HydrophobicContact CB-CE2 4.25Å; P2446-F2451 HydrophobicContact CG-CD2 3.7Å; P2446-F2451 HydrophobicContact CG-CE2 3.75Å
2447	Q	40	Very low	45.4	Very low	153.5 Å²	153.5	112.2 Å²	112.2	72%	0.717	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-12.5	172.6	-72	-170.3	-5.3	0	0	113.1	I2445	I2445-Q2447 VanDerWaalsContact C-N 3.3Å; I2445-Q2447 HydrophobicContact CG2-CG 4.15Å; I2445-Q2447 PolarHBondContact O-N 3.41Å
2448	Y	35.3	Very low	42.6	Very low	216 Å²	216	117.5 Å²	117.5	85%	0.847	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.8	53.8	177.4	-59.1	-77.2	0	0	0	112.7	P2446	P2446-Y2448 PolarHBondContact O-N 3.4Å
2449	G	31.8	Very low	40.1	Very low	45 Å²	45	122.9 Å²	122.9	46%	0.464	63%	0.63	S	S	.	*			trans	-144.4	124.9	-179.1	0	0	0	0	0	111.3	P2446 F2451	P2446-G2449 WeakPolarHBondContact CB-O 3.2Å; P2446-G2449 PolarHBondContact O-N 3.05Å; G2449-F2451 PolarHBondContact O-N 3.36Å
2450	Y	30	Very low	37.9	Very low	218 Å²	218	128.9 Å²	128.9	86%	0.855	67%	0.666	S	S	*	*			trans	-73.8	109.2	-175	-179.5	-95.7	0	0	0	111.5	G2452	Y2450-G2452 PolarHBondContact O-N 2.98Å; Y2450-G2452 VanDerWaalsContact O-N 3.15Å
2451	F	36	Very low	36.1	Very low	154.5 Å²	154.5	131.6 Å²	131.6	68%	0.678	69%	0.689	S	S	*	*			trans	-92.4	115.2	160.3	-72.8	-79.3	0	0	0	109.5	T2438 P2446 G2449	T2438-F2451 HydrophobicContact CG2-CE1 4.17Å; P2446-F2451 HydrophobicContact CB-CD2 3.92Å; P2446-F2451 HydrophobicContact CB-CE2 4.25Å; P2446-F2451 HydrophobicContact CG-CD2 3.7Å; P2446-F2451 HydrophobicContact CG-CE2 3.75Å; G2449-F2451 PolarHBondContact O-N 3.36Å
2452	G	34.1	Very low	34.8	Very low	49.5 Å²	49.5	134.2 Å²	134.2	51%	0.51	70%	0.699	S	S	.	*			trans	-62	149.7	167	0	0	0	0	0	111	Y2450 Q2454	Y2450-G2452 PolarHBondContact O-N 2.98Å; Y2450-G2452 VanDerWaalsContact O-N 3.15Å; G2452-Q2454 PolarHBondContact O-N 3.07Å
2453	K	32.6	Very low	34	Very low	193.5 Å²	193.5	132.2 Å²	132.2	84%	0.841	70%	0.701	S	S	*	*				-81.3	118.4	94	-65.6	168.1	175.8	174.4	0	110.7	E2455	K2453-E2455 PolarHBondContact O-N 3.2Å; K2453-E2455 VanDerWaalsContact O-N 3.14Å
2454	Q	34.8	Very low	33.6	Very low	174.5 Å²	174.5	137.5 Å²	137.5	82%	0.815	73%	0.725	S	S	*	*			trans	-97.9	104.6	163.3	-132.1	175.6	3.7	0	0	108	G2452 G2456	G2452-Q2454 PolarHBondContact O-N 3.07Å; Q2454-G2456 PolarHBondContact O-N 3.37Å
2455	E	32.3	Very low	33.5	Very low	186.5 Å²	186.5	136.6 Å²	136.6	87%	0.871	74%	0.736	S	S	*	*			trans	-70.9	123.1	173.7	-67.8	-176.5	163.8	0	0	109.3	K2453	K2453-E2455 PolarHBondContact O-N 3.2Å; K2453-E2455 VanDerWaalsContact O-N 3.14Å
2456	G	32	Very low	33.3	Very low	75 Å²	75	142.2 Å²	142.2	77%	0.773	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	96.4	32.7	155.2	0	0	0	0	0	118.8	Q2454	Q2454-G2456 PolarHBondContact O-N 3.37Å
2457	L	29.8	Very low	32.8	Very low	147.5 Å²	147.5	148.4 Å²	148.4	77%	0.772	77%	0.769	S	S	*	*			trans	-113.6	125.8	160.5	-80.6	166.2	0	0	0	111	I2459	L2457-I2459 PolarHBondContact O-N 2.93Å
2458	P	31.4	Very low	32.6	Very low	116.5 Å²	116.5	152.6 Å²	152.6	76%	0.756	78%	0.779	S	S	*	*			trans	-78.1	108	-170.1	30	-33.2	0	0	0	112	V2460	P2458-V2460 PolarHBondContact O-N 3.22Å
2459	I	30.4	Very low	32.4	Very low	149.5 Å²	149.5	153.8 Å²	153.8	77%	0.767	78%	0.781	S	S	*	*			trans	-36.3	109.5	161.3	-55.9	172.8	0	0	0	111.7	L2457 P2461	L2457-I2459 PolarHBondContact O-N 2.93Å; I2459-P2461 HydrophobicContact CG2-CB 3.98Å; I2459-P2461 HydrophobicContact CG2-CG 4.47Å; I2459-P2461 WeakPolarHBondContact O-CD 3.27Å
2460	V	31.4	Very low	32.3	Very low	129 Å²	129	163.6 Å²	163.6	78%	0.782	81%	0.805	S	S	*	*			trans	-79.4	111.9	165.8	-178.8	0	0	0	0	108.5	P2458 S2462	P2458-V2460 PolarHBondContact O-N 3.22Å; V2460-S2462 PolarHBondContact O-N 3.03Å; V2460-S2462 VanDerWaalsContact O-N 3.09Å
2461	P	32.7	Very low	32.4	Very low	112 Å²	112	160.8 Å²	160.8	73%	0.727	80%	0.803	S	S	*	*			trans	-86.5	88.3	-170.7	32.7	-32.7	0	0	0	111.5	I2459 L2463	I2459-P2461 HydrophobicContact CG2-CB 3.98Å; I2459-P2461 HydrophobicContact CG2-CG 4.47Å; I2459-P2461 WeakPolarHBondContact O-CD 3.27Å; P2461-L2463 PolarHBondContact O-N 3.27Å
2462	S	32.4	Very low	32.2	Very low	105 Å²	105	158 Å²	158	73%	0.734	81%	0.809	S	S	*	*			trans	-113.8	76.9	168.3	59.2	0	0	0	0	112.7	V2460 H2464	V2460-S2462 PolarHBondContact O-N 3.03Å; V2460-S2462 VanDerWaalsContact O-N 3.09Å; S2462-H2464 PolarHBondContact O-N 3.43Å; S2462-H2464 VanDerWaalsContact O-N 3.08Å
2463	L	32.1	Very low	32.3	Very low	161 Å²	161	162.3 Å²	162.3	84%	0.843	83%	0.825	S	S	*	*	S	Bend	trans	-93	94.9	158.7	-131.4	77.7	0	0	0	110.4	P2461 S2465	P2461-L2463 PolarHBondContact O-N 3.27Å; L2463-S2465 PolarHBondContact O-N 2.97Å; L2463-S2465 VanDerWaalsContact O-N 3.11Å
2464	H	33.9	Very low	32.4	Very low	178 Å²	178	161.8 Å²	161.8	82%	0.824	83%	0.825	S	S	*	*			trans	118.2	65.6	146.1	-85.7	57.6	0	0	0	112.3	S2462 R2466	S2462-H2464 PolarHBondContact O-N 3.43Å; S2462-H2464 VanDerWaalsContact O-N 3.08Å; H2464-R2466 PolarHBondContact O-N 3.21Å
2465	S	34.8	Very low	32.2	Very low	116.5 Å²	116.5	160.3 Å²	160.3	82%	0.815	83%	0.828	S	S	*	*			trans	-60.5	100.6	168	-175.8	0	0	0	0	110	L2463 K2467	L2463-S2465 PolarHBondContact O-N 2.97Å; L2463-S2465 VanDerWaalsContact O-N 3.11Å; S2465-K2467 PolarHBondContact O-N 2.95Å
2466	R	32.2	Very low	32.4	Very low	231.5 Å²	231.5	157.1 Å²	157.1	87%	0.874	83%	0.827	S	S	*	*			trans	-71.3	112.3	167.4	-87.8	-176.3	172.3	175.9	-1.2	108.8	H2464 R2468	H2464-R2466 PolarHBondContact O-N 3.21Å; R2466-R2468 PolarHBondContact O-N 3Å; R2466-R2468 VanDerWaalsContact O-N 3.14Å
2467	K	29.3	Very low	32.5	Very low	204 Å²	204	162.1 Å²	162.1	89%	0.887	83%	0.83	S	S	*	*			trans	-52	109.4	173.5	-74.3	178.1	176.2	176.4	0	110.5	S2465 R2469	S2465-K2467 PolarHBondContact O-N 2.95Å; K2467-R2469 PolarHBondContact O-N 3.2Å
2468	R	34.9	Very low	32.8	Very low	242 Å²	242	164.9 Å²	164.9	91%	0.913	84%	0.836	S	S	*	*			trans	-76.7	126.1	170.3	-129	179.8	-177.7	178.9	0.9	109.8	R2466 R2470	R2466-R2468 PolarHBondContact O-N 3Å; R2466-R2468 VanDerWaalsContact O-N 3.14Å; R2468-R2470 PolarHBondContact O-N 3.15Å
2469	R	31	Very low	32.9	Very low	240 Å²	240	166.4 Å²	166.4	91%	0.906	84%	0.843	S	S	*	*			trans	-61.2	124.7	-178.7	-84.2	174.6	169	150.7	-3.9	110.3	K2467 L2471	K2467-R2469 PolarHBondContact O-N 3.2Å; R2469-L2471 PolarHBondContact O-N 3.08Å
2470	R	29.8	Very low	33.1	Very low	252 Å²	252	163.2 Å²	163.2	95%	0.951	84%	0.838	S	S	*	*			trans	-68.8	102.3	166.6	-73.9	-179.9	175.1	173.1	-2.8	108.5	R2468 A2472	R2468-R2470 PolarHBondContact O-N 3.15Å; R2470-A2472 PolarHBondContact O-N 3.39Å
2471	L	33.6	Very low	33	Very low	159 Å²	159	167 Å²	167	83%	0.832	85%	0.845	S	S	*	*			trans	-77.2	118.1	158.5	-93.7	154.6	0	0	0	107.3	R2469 V2473	R2469-L2471 PolarHBondContact O-N 3.08Å; L2471-V2473 PolarHBondContact O-N 2.88Å; L2471-V2473 VanDerWaalsContact O-N 3.09Å
2472	A	31.3	Very low	33	Very low	96.5 Å²	96.5	167.6 Å²	167.6	80%	0.798	85%	0.846	S	S	*	*			trans	-75	112	174.2	0	0	0	0	0	108.7	R2470	R2470-A2472 PolarHBondContact O-N 3.39Å
2473	V	35.4	Very low	33	Very low	138 Å²	138	170.7 Å²	170.7	84%	0.836	85%	0.849	S	S	*	*			trans	-111.9	118.5	167.1	179	0	0	0	0	107.7	L2471	L2471-V2473 PolarHBondContact O-N 2.88Å; L2471-V2473 VanDerWaalsContact O-N 3.09Å
2474	Q	34	Very low	33	Very low	183.5 Å²	183.5	168.9 Å²	168.9	86%	0.857	85%	0.846	S	S	*	*			trans	-71.2	146	-177.9	-73.3	171.6	-31.3	0	0	111.5
2475	T	31.6	Very low	32.9	Very low	143 Å²	143	165.3 Å²	165.3	88%	0.877	84%	0.839	S	S	*	*			trans	-54.5	129.9	170.1	45.9	0	0	0	0	113.3
2476	S	36.4	Very low	33.1	Very low	119.5 Å²	119.5	168.7 Å²	168.7	84%	0.836	84%	0.842	S	S	*	*			trans	-157.5	120.8	140.3	-174.9	0	0	0	0	110
2477	E	33.6	Very low	33.3	Very low	179.5 Å²	179.5	162 Å²	162	84%	0.839	84%	0.836	S	S	*	*			trans	-67.3	138.3	172.8	-61.7	164.8	131.8	0	0	111.2
2478	K	36.7	Very low	33.6	Very low	206 Å²	206	159 Å²	159	90%	0.896	84%	0.835	S	S	*	*			trans	-173.5	108.5	135.2	-102.6	165.2	-171.7	-179.3	0	109.6	A2480	K2478-A2480 PolarHBondContact O-N 2.93Å
2479	V	32.4	Very low	33.5	Very low	149 Å²	149	150.2 Å²	150.2	90%	0.903	82%	0.82	S	S	*	*			trans	-75.5	99.6	-177.9	178.9	0	0	0	0	109.7
2480	A	36.1	Very low	33.6	Very low	81.5 Å²	81.5	145.1 Å²	145.1	67%	0.674	82%	0.816	S	S	*	*			trans	-102.6	122.2	163.2	0	0	0	0	0	108.7	K2478 V2482	K2478-A2480 PolarHBondContact O-N 2.93Å; A2480-V2482 VanDerWaalsContact C-N 3.33Å; A2480-V2482 PolarHBondContact O-N 3.29Å; A2480-V2482 VanDerWaalsContact O-N 3.09Å
2481	K	29.6	Very low	33.6	Very low	210.5 Å²	210.5	137 Å²	137	92%	0.915	80%	0.798	S	S	*	*			trans	-65.4	95.1	178.7	-70.6	176.4	176.3	177.9	0	110.3
2482	V	32.2	Very low	33.6	Very low	124 Å²	124	138.8 Å²	138.8	75%	0.752	80%	0.799	S	S	*	*			trans	-96.6	127.7	166.1	-178.1	0	0	0	0	107.6	A2480	A2480-V2482 VanDerWaalsContact C-N 3.33Å; A2480-V2482 PolarHBondContact O-N 3.29Å; A2480-V2482 VanDerWaalsContact O-N 3.09Å
2483	Q	31.4	Very low	33.9	Very low	170.5 Å²	170.5	139.5 Å²	139.5	80%	0.797	79%	0.786	S	S	*	*			trans	-53.6	147.9	174.2	-73.9	166.6	-19.7	0	0	110.5	P2485	Q2483-P2485 VanDerWaalsContact O-CD 3.3Å; Q2483-P2485 WeakPolarHBondContact O-CD 3.48Å; Q2483-P2485 VanDerWaalsContact O-N 3.09Å
2484	P	32.1	Very low	34.2	Very low	122 Å²	122	139.3 Å²	139.3	79%	0.792	77%	0.77	S	S	*	*			trans	-59.9	116.2	-170.5	24.6	-33.2	0	0	0	109.8
2485	P	33.1	Very low	34.5	Very low	103.5 Å²	103.5	138.9 Å²	138.9	67%	0.672	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-66.9	141.7	168.3	12.5	-6.2	0	0	0	107.7	Q2483 A2487	Q2483-P2485 VanDerWaalsContact O-CD 3.3Å; Q2483-P2485 WeakPolarHBondContact O-CD 3.48Å; Q2483-P2485 VanDerWaalsContact O-N 3.09Å; P2485-A2487 VanDerWaalsContact C-N 3.29Å; P2485-A2487 PolarHBondContact O-N 2.96Å
2486	E	37.6	Very low	35.1	Very low	186.5 Å²	186.5	134.1 Å²	134.1	87%	0.871	74%	0.736	S	S	*	*			trans	-54.2	93.9	171.1	-67.8	174.5	154.4	0	0	109.1	T2488	E2486-T2488 VanDerWaalsContact C-N 3.27Å; E2486-T2488 PolarHBondContact O-N 3.2Å
2487	A	36.1	Very low	35.4	Very low	92 Å²	92	133.9 Å²	133.9	76%	0.76	73%	0.726	S	S	*	*			trans	-73.5	84.7	-174.1	0	0	0	0	0	109	P2485 G2489	P2485-A2487 VanDerWaalsContact C-N 3.29Å; P2485-A2487 PolarHBondContact O-N 2.96Å; A2487-G2489 PolarHBondContact O-N 2.8Å
2488	T	36.3	Very low	36.2	Very low	139.5 Å²	139.5	126.6 Å²	126.6	86%	0.856	69%	0.693	S	S	*	*			trans	-66.6	31.7	157.5	44.8	0	0	0	0	111.7	E2486 T2490	E2486-T2488 VanDerWaalsContact C-N 3.27Å; E2486-T2488 PolarHBondContact O-N 3.2Å; T2488-T2490 PolarHBondContact O-N 3.34Å; T2488-T2490 VanDerWaalsContact O-N 3.13Å
2489	G	33.3	Very low	37.2	Very low	59 Å²	59	119.1 Å²	119.1	61%	0.608	67%	0.674	S	S	*	*			trans	-86.1	99.4	169.4	0	0	0	0	0	108.5	A2487 S2491	A2487-G2489 PolarHBondContact O-N 2.8Å; G2489-S2491 PolarHBondContact O-N 3.31Å
2490	T	32	Very low	38.7	Very low	133 Å²	133	119 Å²	119	82%	0.816	66%	0.662	S	S	*	*			trans	-62.1	90.4	171.2	48.8	0	0	0	0	109.5	T2488 F2492	T2488-T2490 PolarHBondContact O-N 3.34Å; T2488-T2490 VanDerWaalsContact O-N 3.13Å; T2490-F2492 PolarHBondContact O-N 2.67Å
2491	S	30.9	Very low	40.4	Very low	81 Å²	81	119.9 Å²	119.9	57%	0.566	65%	0.652	S	S	*	*			trans	-64.1	136.8	164.1	58.6	0	0	0	0	108.1	G2489 E2493	G2489-S2491 PolarHBondContact O-N 3.31Å; S2491-E2493 PolarHBondContact O-N 3.01Å
2492	F	32.9	Very low	42.6	Very low	196 Å²	196	110.1 Å²	110.1	86%	0.86	61%	0.61	S	S	*	*	S	Bend	trans	-71.8	35.4	-173.4	-111.7	-95.2	0	0	0	113.4	T2490	T2490-F2492 PolarHBondContact O-N 2.67Å
2493	E	37.6	Very low	44.8	Very low	113 Å²	113	108.5 Å²	108.5	53%	0.528	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-135.5	31.7	-173.1	-67.6	-174.5	169.3	0	0	112.5	S2491 W2495 A2496 N2497	S2491-E2493 PolarHBondContact O-N 3.01Å; E2493-W2495 PolarHBondContact O-N 3.07Å; E2493-W2495 VanDerWaalsContact O-N 3.1Å; E2493-A2496 HydrophobicContact CB-CB 4.28Å; E2493-A2496 PolarHBondContact O-N 3.1Å; E2493-N2497 PolarHBondContact O-N 3.09Å
2494	W	41.3	Very low	47	Very low	132.5 Å²	132.5	103.8 Å²	103.8	50%	0.502	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59	-21.9	179.3	73.7	-79.2	0	0	0	114.3	Y2442 F2444 A2496 N2497 A2883	Y2442-W2494 WeakPolarHBondContact O-CH2 3.19Å; Y2442-W2494 WeakPolarHBondContact O-CZ3 3.4Å; F2444-W2494 HydrophobicContact CB-CZ2 4.22Å; F2444-W2494 AromaticContact CD2-CE2 3.72Å; F2444-W2494 HydrophobicContact CD2-CH2 4.19Å; F2444-W2494 AromaticContact CD2-CZ2 3.49Å; F2444-W2494 HydrophobicContact CD2-CZ2 3.49Å; F2444-W2494 VanDerWaalsContact CD2-CZ2 3.49Å; F2444-W2494 AromaticContact CD2-NE1 3.91Å; F2444-W2494 HydrophobicContact CE2-CZ2 4.35Å; F2444-W2494 HydrophobicContact CG-CZ2 4.31Å; W2494-A2496 VanDerWaalsContact C-N 3.31Å; W2494-A2496 PolarHBondContact O-N 3.09Å; W2494-N2497 PolarHBondContact O-N 2.83Å; W2494-A2883 HydrophobicContact CH2-CB 3.9Å; W2494-A2883 HydrophobicContact CZ2-CB 3.35Å
2495	W	41.8	Very low	49.2	Very low	175 Å²	175	100.5 Å²	100.5	66%	0.663	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-17.6	172.8	55.8	-62.8	0	0	0	114.7	F2444 E2493	F2444-W2495 HydrophobicContact CD2-CE3 4.27Å; F2444-W2495 HydrophobicContact CD2-CZ3 4.47Å; F2444-W2495 AromaticContact CE2-CE3 3.99Å; F2444-W2495 HydrophobicContact CE2-CE3 3.99Å; F2444-W2495 AromaticContact CE2-CZ3 3.84Å; F2444-W2495 HydrophobicContact CE2-CZ3 3.84Å; F2444-W2495 HydrophobicContact CZ-CZ3 4.02Å; E2493-W2495 PolarHBondContact O-N 3.07Å; E2493-W2495 VanDerWaalsContact O-N 3.1Å
2496	A	43.4	Very low	51.6	Low	42.5 Å²	42.5	98.4 Å²	98.4	35%	0.351	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-23.4	177.6	0	0	0	0	0	113	E2493 W2494 V2498	E2493-A2496 HydrophobicContact CB-CB 4.28Å; E2493-A2496 PolarHBondContact O-N 3.1Å; W2494-A2496 VanDerWaalsContact C-N 3.31Å; W2494-A2496 PolarHBondContact O-N 3.09Å; A2496-V2498 VanDerWaalsContact C-N 3.33Å; A2496-V2498 PolarHBondContact O-N 3.17Å; A2496-V2498 VanDerWaalsContact O-N 3.09Å
2497	N	42.7	Very low	54	Low	116 Å²	116	89.5 Å²	89.5	62%	0.62	48%	0.481	S	S	*	.			trans	-87.5	86.7	178.1	-74	-13.2	0	0	0	110.7	E2493 W2494 G2499	E2493-N2497 PolarHBondContact O-N 3.09Å; W2494-N2497 PolarHBondContact O-N 2.83Å; N2497-G2499 PolarHBondContact O-N 2.85Å
2498	V	49.8	Very low	56.7	Low	26.5 Å²	26.5	85.1 Å²	85.1	16%	0.161	45%	0.445	C	S	.	.			trans	-70.2	1.9	171.4	-157.1	0	0	0	0	111.9	A2496 E2501 R2504 Y2505	A2496-V2498 VanDerWaalsContact C-N 3.33Å; A2496-V2498 PolarHBondContact O-N 3.17Å; A2496-V2498 VanDerWaalsContact O-N 3.09Å; V2498-E2501 PolarHBondContact O-N 3.01Å; V2498-R2504 HydrophobicContact CG1-CB 3.45Å; V2498-R2504 HydrophobicContact CG1-CG 4.12Å; V2498-Y2505 HydrophobicContact CB-CE2 4.3Å; V2498-Y2505 HydrophobicContact CG1-CD2 4.36Å; V2498-Y2505 HydrophobicContact CG1-CE2 3.84Å
2499	G	58.4	Low	59.4	Low	48 Å²	48	78.5 Å²	78.5	50%	0.495	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	-144.4	179	0	0	0	0	0	113	N2497 E2501	N2497-G2499 PolarHBondContact O-N 2.85Å; G2499-E2501 VanDerWaalsContact C-N 3.28Å
2500	F	64.9	Low	62.2	Low	147 Å²	147	75.7 Å²	75.7	65%	0.645	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	6.4	168.5	-63.6	-79.8	0	0	0	112.1	A2502 V2536 Y2575	F2500-A2502 PolarHBondContact O-N 2.9Å; F2500-V2536 VanDerWaalsContact O-CG2 3.26Å; F2500-V2536 WeakPolarHBondContact O-CG2 3.35Å; F2500-Y2575 HydrophobicContact CB-CE2 4.48Å; F2500-Y2575 AromaticContact CD1-CD1 4Å; F2500-Y2575 HydrophobicContact CD1-CD1 4.11Å; F2500-Y2575 HydrophobicContact CD1-CD2 4.08Å; F2500-Y2575 HydrophobicContact CD1-CE1 4.24Å; F2500-Y2575 HydrophobicContact CD1-CE2 4.2Å; F2500-Y2575 AromaticContact CD1-CG 3.96Å; F2500-Y2575 HydrophobicContact CD1-CG 4.04Å; F2500-Y2575 HydrophobicContact CE1-CD1 4.24Å; F2500-Y2575 HydrophobicContact CE1-CE1 4.44Å; F2500-Y2575 HydrophobicContact CE1-CG 4.46Å
2501	E	71.7	Confident	65	Low	100 Å²	100	69.4 Å²	69.4	47%	0.467	34%	0.337	S	S	.	.			trans	-79.8	86.1	-174.1	-67.2	175.6	-143.6	0	0	111.1	V2498 G2499 E2503 R2504	V2498-E2501 PolarHBondContact O-N 3.01Å; G2499-E2501 VanDerWaalsContact C-N 3.28Å; E2501-E2503 PolarHBondContact O-N 3.07Å; E2501-E2503 VanDerWaalsContact O-N 3.16Å; E2501-R2504 HydrophobicContact CB-CG 4.18Å; E2501-R2504 PolarHBondContact O-N 3Å; E2501-R2504 VanDerWaalsContact O-N 3.12Å; E2501-R2504 IonicContact OE1-CZ 2.74Å; E2501-R2504 IonicContact OE1-NH2 3.22Å; E2501-R2504 PolarHBondContact OE1-NH2 2.92Å; E2501-R2504 VanDerWaalsContact OE1-NH2 3.1Å; E2501-R2504 IonicContact OE2-CZ 3.56Å; E2501-R2504 IonicContact OE2-NE 2.73Å; E2501-R2504 PolarHBondContact OE2-NE 3.09Å; E2501-R2504 IonicContact OE2-NH2 3.62Å; E2501-R2504 PolarHBondContact OE2-NH2 3.09Å
2502	A	75.7	Confident	67.6	Low	4 Å²	4	66.2 Å²	66.2	3%	0.033	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-58.6	-27	-178.2	0	0	0	0	0	114	F2500 R2504 Y2505 F2510 T2533 T2534 L2576	F2500-A2502 PolarHBondContact O-N 2.9Å; A2502-R2504 VanDerWaalsContact C-N 3.25Å; A2502-R2504 PolarHBondContact O-N 3.12Å; A2502-R2504 VanDerWaalsContact O-N 3.11Å; A2502-Y2505 WeakPolarHBondContact O-CD2 3.36Å; A2502-Y2505 PolarHBondContact O-N 2.84Å; A2502-F2510 HydrophobicContact CB-CE2 4.06Å; A2502-F2510 HydrophobicContact CB-CZ 4.49Å; A2502-T2533 HydrophobicContact CB-CG2 4.5Å; A2502-T2534 WeakPolarHBondContact CB-O 3.23Å; A2502-L2576 HydrophobicContact CB-CD2 3.95Å
2503	E	77.8	Confident	70.1	Confident	90 Å²	90	57 Å²	57	42%	0.421	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-62.9	-20.8	179.2	-67.3	172	-165.7	0	0	113.6	H2410 H2440 E2501 Y2505 F2510	H2410-E2503 PolarHBondContact CE1-O 3.31Å; H2410-E2503 PolarHBondContact NE2-O 2.96Å; H2440-E2503 HydrophobicContact CB-CB 4.4Å; H2440-E2503 PolarHBondContact CD2-O 2.76Å; H2440-E2503 VanDerWaalsContact CD2-O 3.3Å; H2440-E2503 PolarHBondContact N-O 3.36Å; E2501-E2503 PolarHBondContact O-N 3.07Å; E2501-E2503 VanDerWaalsContact O-N 3.16Å; E2503-Y2505 VanDerWaalsContact C-N 3.32Å; E2503-Y2505 PolarHBondContact O-N 2.87Å; E2503-F2510 HydrophobicContact CB-CZ 4.39Å; E2503-F2510 HydrophobicContact CG-CE1 3.71Å; E2503-F2510 HydrophobicContact CG-CE2 4.08Å; E2503-F2510 HydrophobicContact CG-CZ 3.42Å; E2503-F2510 VanDerWaalsContact CG-CZ 3.45Å
2504	R	76.9	Confident	72.1	Confident	73.5 Å²	73.5	51.6 Å²	51.6	28%	0.277	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-74.6	-17.1	-179.8	-63.4	-168.8	-176.1	-171.2	7.9	113.7	H2440 H2443 V2498 E2501 A2502	H2440-R2504 PolarHBondContact N-O 2.92Å; H2440-R2504 VanDerWaalsContact O-CA 3.28Å; H2440-R2504 WeakPolarHBondContact O-CA 3.19Å; H2440-R2504 VanDerWaalsContact O-CB 3.31Å; H2440-R2504 WeakPolarHBondContact O-CB 3.31Å; H2440-R2504 VanDerWaalsContact O-CG 3.25Å; H2440-R2504 WeakPolarHBondContact O-CG 3.4Å; H2443-R2504 PolarHBondContact CE1-O 3.06Å; H2443-R2504 PolarHBondContact NE2-O 2.91Å; V2498-R2504 HydrophobicContact CG1-CB 3.45Å; V2498-R2504 HydrophobicContact CG1-CG 4.12Å; E2501-R2504 HydrophobicContact CB-CG 4.18Å; E2501-R2504 PolarHBondContact O-N 3Å; E2501-R2504 VanDerWaalsContact O-N 3.12Å; E2501-R2504 IonicContact OE1-CZ 2.74Å; E2501-R2504 IonicContact OE1-NH2 3.22Å; E2501-R2504 PolarHBondContact OE1-NH2 2.92Å; E2501-R2504 VanDerWaalsContact OE1-NH2 3.1Å; E2501-R2504 IonicContact OE2-CZ 3.56Å; E2501-R2504 IonicContact OE2-NE 2.73Å; E2501-R2504 PolarHBondContact OE2-NE 3.09Å; E2501-R2504 IonicContact OE2-NH2 3.62Å; E2501-R2504 PolarHBondContact OE2-NH2 3.09Å; A2502-R2504 VanDerWaalsContact C-N 3.25Å; A2502-R2504 PolarHBondContact O-N 3.12Å; A2502-R2504 VanDerWaalsContact O-N 3.11Å
2505	Y	78.8	Confident	74.2	Confident	52.5 Å²	52.5	45.5 Å²	45.5	21%	0.206	23%	0.227	C	C	.	.	S	Bend	trans	-76.9	135.3	-176.9	-71.4	-88.2	0	0	0	112.3	H2410 V2498 A2502 E2503 S2507 F2530 R2568	H2410-Y2505 PolarHBondContact NE2-O 3.01Å; V2498-Y2505 HydrophobicContact CB-CE2 4.3Å; V2498-Y2505 HydrophobicContact CG1-CD2 4.36Å; V2498-Y2505 HydrophobicContact CG1-CE2 3.84Å; A2502-Y2505 WeakPolarHBondContact O-CD2 3.36Å; A2502-Y2505 PolarHBondContact O-N 2.84Å; E2503-Y2505 VanDerWaalsContact C-N 3.32Å; E2503-Y2505 PolarHBondContact O-N 2.87Å; Y2505-S2507 PolarHBondContact O-N 2.79Å; Y2505-S2507 VanDerWaalsContact O-N 3.13Å; Y2505-F2530 HydrophobicContact CD1-CE2 4.18Å; Y2505-R2568 PolarHBondContact OH-NH2 2.84Å
2506	H	83.7	Confident	76.4	Confident	59 Å²	59	37.2 Å²	37.2	27%	0.273	20%	0.196	S	C	.	.			trans	-67.5	104.7	176.8	2.5	-145	0	0	0	112	A2437 T2438 N2529 F2530	A2437-H2506 HydrophobicContact CB-CB 4.22Å; A2437-H2506 WeakPolarHBondContact O-CB 3.38Å; A2437-H2506 PolarHBondContact O-ND1 2.85Å; T2438-H2506 VanDerWaalsContact C-CE1 3.41Å; T2438-H2506 WeakPolarHBondContact CA-ND1 3.15Å; T2438-H2506 PolarHBondContact O-CE1 2.71Å; T2438-H2506 PolarHBondContact O-ND1 3.06Å; T2438-H2506 VanDerWaalsContact O-ND1 3.08Å; H2506-N2529 PolarHBondContact CE1-ND2 2.82Å; H2506-N2529 PolarHBondContact NE2-ND2 2.8Å; H2506-F2530 PolarHBondContact O-N 2.9Å
2507	S	88.7	Confident	78.7	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.2	174.6	59.3	0	0	0	0	113.2	H2410 A2437 Y2505 V2509 F2530 T2533	H2410-S2507 WeakPolarHBondContact CA-O 3.32Å; H2410-S2507 PolarHBondContact CD2-O 3.3Å; H2410-S2507 PolarHBondContact CD2-OG 3.26Å; A2437-S2507 VanDerWaalsContact CB-O 3.29Å; A2437-S2507 WeakPolarHBondContact CB-O 3.37Å; Y2505-S2507 PolarHBondContact O-N 2.79Å; Y2505-S2507 VanDerWaalsContact O-N 3.13Å; S2507-V2509 PolarHBondContact OG-O 3.44Å; S2507-F2530 VanDerWaalsContact CA-O 3.31Å; S2507-F2530 WeakPolarHBondContact CA-O 3.34Å; S2507-T2533 WeakPolarHBondContact CB-OG1 3.49Å; S2507-T2533 WeakPolarHBondContact OG-CB 3Å; S2507-T2533 PolarHBondContact OG-OG1 3.13Å; S2507-T2533 VanDerWaalsContact OG-OG1 3.11Å
2508	T	91.8	Very high	81.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	-45.9	175.3	60.4	0	0	0	0	111.5	I2411 V2412 N2525 N2528 F2530 E2531	I2411-T2508 CarbonylContact C-O 3.51Å; I2411-T2508 WeakPolarHBondContact CA-O 3.41Å; I2411-T2508 VanDerWaalsContact CB-O 3.32Å; I2411-T2508 WeakPolarHBondContact CB-O 3.43Å; I2411-T2508 HydrophobicContact CG1-CG2 4.29Å; I2411-T2508 PolarHBondContact N-O 3.23Å; I2411-T2508 VanDerWaalsContact N-O 3.16Å; V2412-T2508 PolarHBondContact N-O 3.2Å; T2508-N2525 HydrophobicContact CG2-CB 3.9Å; T2508-N2528 HydrophobicContact CG2-CB 4.28Å; T2508-N2528 WeakPolarHBondContact CG2-ND2 3.28Å; T2508-F2530 PolarHBondContact N-O 2.81Å; T2508-E2531 WeakPolarHBondContact CB-OE2 3.37Å; T2508-E2531 WeakPolarHBondContact CG2-OE2 3.32Å; T2508-E2531 PolarHBondContact N-O 2.8Å; T2508-E2531 VanDerWaalsContact OG1-CA 3.29Å; T2508-E2531 WeakPolarHBondContact OG1-CA 3.28Å; T2508-E2531 PolarHBondContact OG1-O 2.86Å; T2508-E2531 PolarHBondContact OG1-OE2 3.02Å
2509	V	93.4	Very high	83.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.6	174.4	-175.8	0	0	0	0	109.8	V2412 L2414 L2432 S2507 F2523 E2531 L2532 T2533	V2412-V2509 HydrophobicContact CB-CG2 4.45Å; V2412-V2509 WeakPolarHBondContact O-CA 3.41Å; L2414-V2509 HydrophobicContact CD1-CG1 4.05Å; L2414-V2509 HydrophobicContact CG-CG1 4.49Å; L2432-V2509 HydrophobicContact CD2-CG2 4.34Å; S2507-V2509 PolarHBondContact OG-O 3.44Å; V2509-F2523 HydrophobicContact CG2-CE1 3.82Å; V2509-F2523 HydrophobicContact CG2-CZ 4.36Å; V2509-E2531 PolarHBondContact N-O 2.81Å; V2509-L2532 HydrophobicContact CB-CD1 4.07Å; V2509-L2532 HydrophobicContact CG1-CD1 3.93Å; V2509-L2532 WeakPolarHBondContact O-CA 3.49Å; V2509-T2533 PolarHBondContact O-N 3.01Å
2510	F	92.3	Very high	84.6	Confident	0.5 Å²	0.5	32.2 Å²	32.2	0%	0.002	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.7	169.2	-179.1	-97.7	0	0	0	109.7	H2410 V2412 H2413 L2414 A2502 E2503 A2512 T2533 A2535	H2410-F2510 AromaticContact CE1-CG 3.96Å; V2412-F2510 PolarHBondContact O-N 3.4Å; H2413-F2510 AromaticContact CD2-CD1 3.35Å; H2413-F2510 WeakPolarHBondContact CD2-CD1 3.33Å; H2413-F2510 AromaticContact NE2-CD1 3.38Å; H2413-F2510 VanDerWaalsContact NE2-CD1 3.28Å; H2413-F2510 WeakPolarHBondContact NE2-CD1 3.47Å; H2413-F2510 AromaticContact NE2-CE1 3.6Å; L2414-F2510 WeakPolarHBondContact CB-O 3.32Å; L2414-F2510 PolarHBondContact N-O 3.07Å; A2502-F2510 HydrophobicContact CB-CE2 4.06Å; A2502-F2510 HydrophobicContact CB-CZ 4.49Å; E2503-F2510 HydrophobicContact CB-CZ 4.39Å; E2503-F2510 HydrophobicContact CG-CE1 3.71Å; E2503-F2510 HydrophobicContact CG-CE2 4.08Å; E2503-F2510 HydrophobicContact CG-CZ 3.42Å; E2503-F2510 VanDerWaalsContact CG-CZ 3.45Å; F2510-A2512 HydrophobicContact CD1-CB 4.4Å; F2510-A2512 HydrophobicContact CE1-CB 3.9Å; F2510-T2533 WeakPolarHBondContact CA-O 3.39Å; F2510-T2533 HydrophobicContact CD2-CG2 4.09Å; F2510-T2533 HydrophobicContact CE2-CG2 4.19Å; F2510-A2535 HydrophobicContact CE1-CB 4.28Å; F2510-A2535 HydrophobicContact CE2-CB 4.46Å; F2510-A2535 HydrophobicContact CZ-CB 3.73Å
2511	A	90.7	Very high	85.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	106.5	179.9	0	0	0	0	0	110.5	S2513 V2516 L2532 T2533 T2534 A2535 V2547	A2511-S2513 VanDerWaalsContact C-N 3.33Å; A2511-S2513 PolarHBondContact O-N 2.81Å; A2511-V2516 HydrophobicContact CB-CG2 4.28Å; A2511-L2532 HydrophobicContact CB-CD1 4.15Å; A2511-T2533 PolarHBondContact N-O 2.79Å; A2511-T2534 WeakPolarHBondContact O-CA 3.43Å; A2511-A2535 PolarHBondContact O-N 3.14Å; A2511-V2547 HydrophobicContact CB-CG2 4.43Å
2512	A	85.9	Confident	86.8	Confident	15 Å²	15	21 Å²	21	12%	0.124	10%	0.097	C	C	.	.			trans	-79.9	-15.1	-175.2	0	0	0	0	0	114.4	L2414 F2510 A2535	L2414-A2512 VanDerWaalsContact O-CB 3.27Å; L2414-A2512 WeakPolarHBondContact O-CB 3.41Å; L2414-A2512 PolarHBondContact O-N 3.18Å; F2510-A2512 HydrophobicContact CD1-CB 4.4Å; F2510-A2512 HydrophobicContact CE1-CB 3.9Å; A2512-A2535 HydrophobicContact CB-CB 4.49Å; A2512-A2535 WeakPolarHBondContact O-CB 3.46Å
2513	S	84	Confident	87.5	Confident	1.5 Å²	1.5	20.9 Å²	20.9	1%	0.01	10%	0.095	C	C	.	.	S	Bend	trans	-142.6	160.1	177.8	129.3	0	0	0	0	111.6	A2511 Q2515 V2516	A2511-S2513 VanDerWaalsContact C-N 3.33Å; A2511-S2513 PolarHBondContact O-N 2.81Å; S2513-Q2515 PolarHBondContact O-N 3.23Å; S2513-Q2515 VanDerWaalsContact O-N 3.15Å; S2513-Q2515 PolarHBondContact OG-N 3.19Å; S2513-V2516 WeakPolarHBondContact O-CG2 3.31Å
2514	G	81.3	Confident	88.1	Confident	0.5 Å²	0.5	17.9 Å²	17.9	1%	0.005	8%	0.084	C	C	.	.	S	Bend	trans	-65.1	-14.2	176.4	0	0	0	0	0	114.4	V2516 Y2543 G2545	G2514-V2516 PolarHBondContact O-N 3.06Å; G2514-V2516 VanDerWaalsContact O-N 3.08Å; G2514-Y2543 WeakPolarHBondContact O-CE1 3.35Å; G2514-G2545 WeakPolarHBondContact CA-O 3.47Å
2515	Q	84.1	Confident	88.8	Confident	5 Å²	5	14.5 Å²	14.5	2%	0.023	7%	0.072	C	C	.	.			trans	-82.9	33.7	-173.3	-59.5	-176.6	-25.7	0	0	114.1	Y2417 V2420 F2424 Q2425 S2513 Y2543	Y2417-Q2515 PolarHBondContact O-OE1 3.13Å; Y2417-Q2515 VanDerWaalsContact O-OE1 3.08Å; V2420-Q2515 PolarHBondContact O-NE2 3.3Å; V2420-Q2515 PolarHBondContact O-OE1 3.03Å; V2420-Q2515 VanDerWaalsContact O-OE1 3.05Å; F2424-Q2515 CarbonylContact C-O 3.6Å; F2424-Q2515 WeakPolarHBondContact CA-O 3.46Å; F2424-Q2515 HydrophobicContact CD1-CB 4.29Å; Q2425-Q2515 PolarHBondContact N-O 2.97Å; S2513-Q2515 PolarHBondContact O-N 3.23Å; S2513-Q2515 VanDerWaalsContact O-N 3.15Å; S2513-Q2515 PolarHBondContact OG-N 3.19Å; Q2515-Y2543 HydrophobicContact CG-CD1 3.68Å; Q2515-Y2543 HydrophobicContact CG-CG 3.91Å
2516	V	89	Confident	89.2	Confident	0.5 Å²	0.5	16.2 Å²	16.2	0%	0.003	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131.2	-179.2	-175.1	0	0	0	0	108.9	L2414 Q2425 A2511 S2513 G2514 I2518 V2547 D2548	L2414-V2516 HydrophobicContact CD1-CG1 3.67Å; Q2425-V2516 HydrophobicContact CB-CG2 4.38Å; A2511-V2516 HydrophobicContact CB-CG2 4.28Å; S2513-V2516 WeakPolarHBondContact O-CG2 3.31Å; G2514-V2516 PolarHBondContact O-N 3.06Å; G2514-V2516 VanDerWaalsContact O-N 3.08Å; V2516-I2518 HydrophobicContact CG1-CD1 4.16Å; V2516-I2518 HydrophobicContact CG1-CG1 3.79Å; V2516-V2547 HydrophobicContact CB-CG1 4.27Å; V2516-V2547 WeakPolarHBondContact O-CG1 3.36Å; V2516-D2548 PolarHBondContact O-N 2.83Å
2517	K	91.5	Very high	89.3	Confident	59 Å²	59	18.6 Å²	18.6	26%	0.257	10%	0.104	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	111.8	177.2	-170.3	173.9	-161	-132	0	110.3	F2424 Q2425 L2426 F2427 E2519 D2548	F2424-K2517 HydrophobicContact CB-CB 4.41Å; Q2425-K2517 PolarHBondContact O-N 3.13Å; L2426-K2517 HydrophobicContact CD1-CB 4.28Å; L2426-K2517 HydrophobicContact CD1-CD 4.48Å; L2426-K2517 HydrophobicContact CD1-CG 4.4Å; L2426-K2517 HydrophobicContact CD2-CB 4.15Å; L2426-K2517 HydrophobicContact CD2-CD 4.14Å; L2426-K2517 HydrophobicContact CD2-CG 4.46Å; F2427-K2517 PolarHBondContact N-O 3.26Å; K2517-E2519 WeakPolarHBondContact CE-OE1 3.4Å; K2517-E2519 WeakPolarHBondContact CE-OE2 3.27Å; K2517-E2519 HydrophobicContact CG-CG 4.16Å; K2517-E2519 IonicContact NZ-OE1 2.72Å; K2517-E2519 PolarHBondContact NZ-OE1 3.05Å; K2517-E2519 IonicContact NZ-OE2 3.2Å; K2517-E2519 PolarHBondContact NZ-OE2 2.95Å; K2517-D2548 CarbonylContact C-O 3.41Å; K2517-D2548 WeakPolarHBondContact CA-O 3.36Å; K2517-D2548 VanDerWaalsContact CE-OD2 3.22Å; K2517-D2548 WeakPolarHBondContact CE-OD2 3.49Å; K2517-D2548 HydrophobicContact CG-CB 4.25Å
2518	I	92.8	Very high	89.3	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	108.2	-174.5	-52.3	-178.9	0	0	0	107.6	F2427 V2516 N2521 F2523 L2532 V2547 D2548 A2549 N2552	F2427-I2518 HydrophobicContact CB-CG1 4.27Å; F2427-I2518 HydrophobicContact CD1-CG2 4.2Å; F2427-I2518 WeakPolarHBondContact O-CA 3.36Å; V2516-I2518 HydrophobicContact CG1-CD1 4.16Å; V2516-I2518 HydrophobicContact CG1-CG1 3.79Å; I2518-N2521 VanDerWaalsContact CG2-ND2 3.27Å; I2518-N2521 WeakPolarHBondContact CG2-ND2 3.3Å; I2518-F2523 HydrophobicContact CG2-CE2 4.09Å; I2518-F2523 HydrophobicContact CG2-CZ 4.03Å; I2518-L2532 HydrophobicContact CD1-CD1 3.89Å; I2518-L2532 HydrophobicContact CD1-CD2 4.08Å; I2518-V2547 HydrophobicContact CD1-CG1 4.43Å; I2518-D2548 PolarHBondContact N-O 3.05Å; I2518-A2549 HydrophobicContact CB-CB 4.26Å; I2518-A2549 CarbonylContact O-C 3.34Å; I2518-A2549 VanDerWaalsContact O-CA 3.31Å; I2518-A2549 WeakPolarHBondContact O-CA 3.26Å; I2518-N2552 PolarHBondContact O-ND2 3.07Å
2519	E	91.6	Very high	89	Confident	30 Å²	30	23.7 Å²	23.7	14%	0.14	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	142.2	-176.9	-70.1	-177.7	144.7	0	0	113.6	F2427 R2428 S2429 K2517 N2521 N2552	F2427-E2519 PolarHBondContact O-N 3.12Å; R2428-E2519 VanDerWaalsContact CA-O 3.28Å; R2428-E2519 WeakPolarHBondContact CA-O 3.16Å; S2429-E2519 PolarHBondContact N-O 3.18Å; K2517-E2519 WeakPolarHBondContact CE-OE1 3.4Å; K2517-E2519 WeakPolarHBondContact CE-OE2 3.27Å; K2517-E2519 HydrophobicContact CG-CG 4.16Å; K2517-E2519 IonicContact NZ-OE1 2.72Å; K2517-E2519 PolarHBondContact NZ-OE1 3.05Å; K2517-E2519 IonicContact NZ-OE2 3.2Å; K2517-E2519 PolarHBondContact NZ-OE2 2.95Å; E2519-N2521 PolarHBondContact N-ND2 3.1Å; E2519-N2521 VanDerWaalsContact N-ND2 3.16Å; E2519-N2521 PolarHBondContact O-N 3.05Å; E2519-N2521 PolarHBondContact O-ND2 2.87Å; E2519-N2521 VanDerWaalsContact O-ND2 3.14Å; E2519-N2552 VanDerWaalsContact C-OD1 3.3Å; E2519-N2552 WeakPolarHBondContact CA-OD1 3.26Å
2520	N	90.5	Very high	88.8	Confident	38 Å²	38	25.8 Å²	25.8	20%	0.203	14%	0.141	C	C	.	.	S	Bend	trans	58.7	25	175	-63	-77.9	0	0	0	114.7	S2429 Q2551 N2552 L2591	S2429-N2520 VanDerWaalsContact CA-O 3.25Å; S2429-N2520 WeakPolarHBondContact CA-O 3.36Å; N2520-Q2551 WeakPolarHBondContact CA-O 3.45Å; N2520-Q2551 PolarHBondContact N-O 2.89Å; N2520-Q2551 PolarHBondContact ND2-OE1 2.97Å; N2520-N2552 PolarHBondContact N-OD1 3.16Å; N2520-L2591 WeakPolarHBondContact O-CD2 3.38Å
2521	N	91.6	Very high	88.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.			trans	-87.6	152.6	178.3	-53.7	-82.4	0	0	0	111.7	F2427 S2429 N2430 I2518 E2519 F2523 N2552 Y2553	F2427-N2521 VanDerWaalsContact CD1-OD1 3.31Å; F2427-N2521 WeakPolarHBondContact CD1-OD1 3.33Å; F2427-N2521 PolarHBondContact O-ND2 2.88Å; F2427-N2521 PolarHBondContact O-OD1 3.41Å; S2429-N2521 PolarHBondContact N-OD1 3.04Å; N2430-N2521 WeakPolarHBondContact CA-OD1 3.44Å; N2430-N2521 VanDerWaalsContact CB-OD1 3.3Å; N2430-N2521 WeakPolarHBondContact CB-OD1 3.25Å; N2430-N2521 PolarHBondContact N-OD1 3.11Å; N2430-N2521 PolarHBondContact ND2-OD1 2.86Å; N2430-N2521 VanDerWaalsContact ND2-OD1 3.11Å; N2430-N2521 CarbonylContact O-C 3.56Å; N2430-N2521 VanDerWaalsContact O-CA 3.28Å; N2430-N2521 WeakPolarHBondContact O-CA 3.42Å; N2430-N2521 WeakPolarHBondContact O-CB 3.46Å; I2518-N2521 VanDerWaalsContact CG2-ND2 3.27Å; I2518-N2521 WeakPolarHBondContact CG2-ND2 3.3Å; E2519-N2521 PolarHBondContact N-ND2 3.1Å; E2519-N2521 VanDerWaalsContact N-ND2 3.16Å; E2519-N2521 PolarHBondContact O-N 3.05Å; E2519-N2521 PolarHBondContact O-ND2 2.87Å; E2519-N2521 VanDerWaalsContact O-ND2 3.14Å; N2521-F2523 HydrophobicContact CB-CD2 4.27Å; N2521-F2523 HydrophobicContact CB-CE2 3.67Å; N2521-F2523 HydrophobicContact CB-CZ 3.97Å; N2521-N2552 WeakPolarHBondContact CB-OD1 3.47Å; N2521-N2552 PolarHBondContact N-OD1 2.73Å; N2521-N2552 PolarHBondContact ND2-OD1 3.09Å; N2521-Y2553 PolarHBondContact O-N 3.04Å
2522	F	90.6	Very high	88.9	Confident	12 Å²	12	25.9 Å²	25.9	5%	0.053	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	110.7	173.4	179.3	-91.3	0	0	0	109.3	N2430 V2431 L2432 Y2553 N2588 L2591 L2592 P2598	N2430-F2522 PolarHBondContact O-N 2.73Å; V2431-F2522 HydrophobicContact CG1-CD1 4.11Å; V2431-F2522 HydrophobicContact CG2-CB 4.4Å; L2432-F2522 PolarHBondContact N-O 2.96Å; F2522-Y2553 AromaticContact CD2-CD1 3.38Å; F2522-Y2553 HydrophobicContact CD2-CD1 3.38Å; F2522-Y2553 AromaticContact CD2-CE1 3.84Å; F2522-Y2553 HydrophobicContact CD2-CE1 3.84Å; F2522-Y2553 HydrophobicContact CD2-CG 4.14Å; F2522-Y2553 AromaticContact CE2-CD1 3.44Å; F2522-Y2553 HydrophobicContact CE2-CD1 3.44Å; F2522-Y2553 VanDerWaalsContact CE2-CD1 3.44Å; F2522-Y2553 AromaticContact CE2-CE1 3.35Å; F2522-Y2553 HydrophobicContact CE2-CE1 3.35Å; F2522-Y2553 HydrophobicContact CE2-CG 4.45Å; F2522-Y2553 HydrophobicContact CG-CD1 4.29Å; F2522-Y2553 HydrophobicContact CZ-CD1 4.37Å; F2522-Y2553 HydrophobicContact CZ-CE1 4.12Å; F2522-N2588 HydrophobicContact CD2-CB 4.32Å; F2522-N2588 HydrophobicContact CE2-CB 4.01Å; F2522-L2591 HydrophobicContact CB-CD1 4.12Å; F2522-L2591 HydrophobicContact CD2-CD1 4.48Å; F2522-L2592 HydrophobicContact CE2-CD1 4.22Å; F2522-L2592 HydrophobicContact CZ-CD1 4.41Å; F2522-P2598 HydrophobicContact CD1-CB 4.34Å; F2522-P2598 HydrophobicContact CD1-CG 4.34Å; F2522-P2598 HydrophobicContact CE1-CB 4.15Å; F2522-P2598 HydrophobicContact CE1-CG 3.66Å; F2522-P2598 HydrophobicContact CZ-CG 4.04Å
2523	F	91.3	Very high	89.1	Confident	1.5 Å²	1.5	25.2 Å²	25.2	1%	0.007	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.8	173.1	-62.5	-78.9	0	0	0	109.7	F2427 L2432 V2509 I2518 N2521 E2531 N2552 Y2553 W2554 G2555	F2427-F2523 HydrophobicContact CE1-CE1 4.46Å; F2427-F2523 HydrophobicContact CE1-CZ 4.28Å; L2432-F2523 HydrophobicContact CB-CD1 4.17Å; L2432-F2523 HydrophobicContact CD1-CD1 4.09Å; L2432-F2523 HydrophobicContact CD1-CE1 3.79Å; L2432-F2523 HydrophobicContact CD1-CZ 4.46Å; L2432-F2523 HydrophobicContact CD2-CD1 4.42Å; L2432-F2523 HydrophobicContact CD2-CE1 4.13Å; L2432-F2523 HydrophobicContact CG-CD1 4.44Å; L2432-F2523 HydrophobicContact CG-CE1 4.38Å; V2509-F2523 HydrophobicContact CG2-CE1 3.82Å; V2509-F2523 HydrophobicContact CG2-CZ 4.36Å; I2518-F2523 HydrophobicContact CG2-CE2 4.09Å; I2518-F2523 HydrophobicContact CG2-CZ 4.03Å; N2521-F2523 HydrophobicContact CB-CD2 4.27Å; N2521-F2523 HydrophobicContact CB-CE2 3.67Å; N2521-F2523 HydrophobicContact CB-CZ 3.97Å; F2523-E2531 HydrophobicContact CB-CG 4.27Å; F2523-N2552 HydrophobicContact CD2-CB 4.32Å; F2523-N2552 HydrophobicContact CE2-CB 4.18Å; F2523-Y2553 WeakPolarHBondContact CB-O 3.22Å; F2523-Y2553 PolarHBondContact N-O 3.12Å; F2523-W2554 HydrophobicContact CB-CE3 4.18Å; F2523-W2554 HydrophobicContact CD2-CD2 4.24Å; F2523-W2554 AromaticContact CD2-CE3 3.76Å; F2523-W2554 HydrophobicContact CD2-CE3 3.76Å; F2523-W2554 HydrophobicContact CD2-CH2 4.04Å; F2523-W2554 HydrophobicContact CD2-CZ2 4.45Å; F2523-W2554 AromaticContact CD2-CZ3 3.65Å; F2523-W2554 HydrophobicContact CD2-CZ3 3.65Å; F2523-W2554 HydrophobicContact CE2-CE3 4.41Å; F2523-W2554 AromaticContact CE2-CH2 3.85Å; F2523-W2554 HydrophobicContact CE2-CH2 3.85Å; F2523-W2554 HydrophobicContact CE2-CZ2 4.35Å; F2523-W2554 AromaticContact CE2-CZ3 3.88Å; F2523-W2554 HydrophobicContact CE2-CZ3 3.88Å; F2523-W2554 HydrophobicContact CG-CE3 4.1Å; F2523-W2554 HydrophobicContact CG-CZ3 4.06Å; F2523-W2554 HydrophobicContact CZ-CH2 4.46Å; F2523-W2554 HydrophobicContact CZ-CZ3 4.41Å; F2523-G2555 WeakPolarHBondContact O-CA 3.42Å; F2523-G2555 PolarHBondContact O-N 3.22Å
2524	S	89	Confident	89.4	Confident	27 Å²	27	25.1 Å²	25.1	19%	0.189	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	71.3	176.6	179.8	0	0	0	0	111.1	L2432 Y2433 D2434 P2526	L2432-S2524 PolarHBondContact O-N 3Å; Y2433-S2524 VanDerWaalsContact CA-O 3.32Å; Y2433-S2524 WeakPolarHBondContact CA-O 3.37Å; D2434-S2524 PolarHBondContact N-O 3.11Å; D2434-S2524 VanDerWaalsContact N-O 3.16Å; S2524-P2526 WeakPolarHBondContact O-CD 3.48Å
2525	N	91.2	Very high	89.7	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.011	14%	0.14	C	C	.	.			trans	-117.8	91	-178.9	-51.9	-80.7	0	0	0	109.5	L2432 Y2433 D2434 N2435 T2508 D2527 N2528 E2531	L2432-N2525 PolarHBondContact O-ND2 2.98Å; Y2433-N2525 VanDerWaalsContact C-OD1 3.24Å; Y2433-N2525 VanDerWaalsContact CA-OD1 3.27Å; Y2433-N2525 WeakPolarHBondContact CA-OD1 3.31Å; Y2433-N2525 PolarHBondContact N-OD1 2.87Å; D2434-N2525 PolarHBondContact N-OD1 2.86Å; N2435-N2525 WeakPolarHBondContact CB-OD1 3.37Å; N2435-N2525 PolarHBondContact N-OD1 3.08Å; N2435-N2525 PolarHBondContact ND2-OD1 2.93Å; T2508-N2525 HydrophobicContact CG2-CB 3.9Å; N2525-D2527 VanDerWaalsContact C-N 3.33Å; N2525-D2527 PolarHBondContact O-N 2.82Å; N2525-N2528 HydrophobicContact CB-CB 4.38Å; N2525-N2528 WeakPolarHBondContact CB-ND2 3.27Å; N2525-N2528 PolarHBondContact O-N 2.88Å; N2525-E2531 WeakPolarHBondContact CA-OE1 3.46Å; N2525-E2531 VanDerWaalsContact CB-OE1 3.3Å; N2525-E2531 WeakPolarHBondContact CB-OE1 3.02Å; N2525-E2531 PolarHBondContact N-OE1 3.07Å; N2525-E2531 VanDerWaalsContact ND2-CD 3.35Å; N2525-E2531 PolarHBondContact ND2-OE1 3.35Å; N2525-E2531 VanDerWaalsContact ND2-OE1 3.1Å; N2525-E2531 PolarHBondContact ND2-OE2 3.03Å
2526	P	87.1	Confident	89.7	Confident	88 Å²	88	28.3 Å²	28.3	57%	0.571	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-31.3	-170.7	26.6	-34.4	0	0	0	113.4	S2524 N2528	S2524-P2526 WeakPolarHBondContact O-CD 3.48Å; P2526-N2528 VanDerWaalsContact C-N 3.27Å; P2526-N2528 PolarHBondContact O-N 2.91Å
2527	D	87.2	Confident	89.4	Confident	110.5 Å²	110.5	30.8 Å²	30.8	59%	0.591	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.5	-177.8	-63.4	-39.1	0	0	0	113.7	I2436 N2525	I2436-D2527 HydrophobicContact CG1-CB 4.23Å; N2525-D2527 VanDerWaalsContact C-N 3.33Å; N2525-D2527 PolarHBondContact O-N 2.82Å
2528	N	88	Confident	88.7	Confident	2 Å²	2	31 Å²	31	1%	0.011	18%	0.175	C	C	.	.			trans	-96.6	134.5	179.5	-60.8	-31.6	0	0	0	111.3	N2435 I2436 A2437 T2508 N2525 P2526 K2566	N2435-N2528 PolarHBondContact O-ND2 2.84Å; I2436-N2528 WeakPolarHBondContact CA-OD1 3.39Å; A2437-N2528 PolarHBondContact N-OD1 2.91Å; T2508-N2528 HydrophobicContact CG2-CB 4.28Å; T2508-N2528 WeakPolarHBondContact CG2-ND2 3.28Å; N2525-N2528 HydrophobicContact CB-CB 4.38Å; N2525-N2528 WeakPolarHBondContact CB-ND2 3.27Å; N2525-N2528 PolarHBondContact O-N 2.88Å; P2526-N2528 VanDerWaalsContact C-N 3.27Å; P2526-N2528 PolarHBondContact O-N 2.91Å; N2528-K2566 PolarHBondContact O-NZ 3.25Å
2529	N	85.3	Confident	87.6	Confident	104 Å²	104	39 Å²	39	56%	0.556	22%	0.217	S	C	*	.	S	Bend	trans	-64.5	-49.5	175.7	-69.8	-24.4	0	0	0	110.7	H2506 K2566	H2506-N2529 PolarHBondContact CE1-ND2 2.82Å; H2506-N2529 PolarHBondContact NE2-ND2 2.8Å; N2529-K2566 WeakPolarHBondContact O-CD 3.49Å
2530	F	89.8	Confident	86.6	Confident	44.5 Å²	44.5	41.6 Å²	41.6	20%	0.195	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142	179.4	-54.7	-72.4	0	0	0	111.2	Y2505 H2506 S2507 T2508 K2566 R2568	Y2505-F2530 HydrophobicContact CD1-CE2 4.18Å; H2506-F2530 PolarHBondContact O-N 2.9Å; S2507-F2530 VanDerWaalsContact CA-O 3.31Å; S2507-F2530 WeakPolarHBondContact CA-O 3.34Å; T2508-F2530 PolarHBondContact N-O 2.81Å; F2530-K2566 CarbonylContact C-O 3.4Å; F2530-R2568 HydrophobicContact CD1-CB 3.86Å; F2530-R2568 HydrophobicContact CE1-CB 4.08Å; F2530-R2568 HydrophobicContact CG-CB 4.17Å
2531	E	91.6	Very high	85.8	Confident	2.5 Å²	2.5	40.6 Å²	40.6	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-41.5	169.1	-67.4	-78.2	-167.8	0	0	110	T2508 V2509 F2523 N2525 W2554 K2566	T2508-E2531 WeakPolarHBondContact CB-OE2 3.37Å; T2508-E2531 WeakPolarHBondContact CG2-OE2 3.32Å; T2508-E2531 PolarHBondContact N-O 2.8Å; T2508-E2531 VanDerWaalsContact OG1-CA 3.29Å; T2508-E2531 WeakPolarHBondContact OG1-CA 3.28Å; T2508-E2531 PolarHBondContact OG1-O 2.86Å; T2508-E2531 PolarHBondContact OG1-OE2 3.02Å; V2509-E2531 PolarHBondContact N-O 2.81Å; F2523-E2531 HydrophobicContact CB-CG 4.27Å; N2525-E2531 WeakPolarHBondContact CA-OE1 3.46Å; N2525-E2531 VanDerWaalsContact CB-OE1 3.3Å; N2525-E2531 WeakPolarHBondContact CB-OE1 3.02Å; N2525-E2531 PolarHBondContact N-OE1 3.07Å; N2525-E2531 VanDerWaalsContact ND2-CD 3.35Å; N2525-E2531 PolarHBondContact ND2-OE1 3.35Å; N2525-E2531 VanDerWaalsContact ND2-OE1 3.1Å; N2525-E2531 PolarHBondContact ND2-OE2 3.03Å; E2531-W2554 HydrophobicContact CB-CE3 3.88Å; E2531-W2554 HydrophobicContact CB-CZ3 3.66Å; E2531-W2554 HydrophobicContact CG-CE3 4.33Å; E2531-K2566 HydrophobicContact CB-CB 4.38Å; E2531-K2566 HydrophobicContact CG-CB 4.15Å; E2531-K2566 HydrophobicContact CG-CD 4.18Å; E2531-K2566 HydrophobicContact CG-CG 4.39Å; E2531-K2566 PolarHBondContact N-O 3.29Å
2532	L	92.9	Very high	84.8	Confident	1 Å²	1	43 Å²	43	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.9	178.3	179.9	63.4	0	0	0	110.4	V2509 A2511 I2518 A2549 W2554 K2566 I2567 R2568 V2579	V2509-L2532 HydrophobicContact CB-CD1 4.07Å; V2509-L2532 HydrophobicContact CG1-CD1 3.93Å; V2509-L2532 WeakPolarHBondContact O-CA 3.49Å; A2511-L2532 HydrophobicContact CB-CD1 4.15Å; I2518-L2532 HydrophobicContact CD1-CD1 3.89Å; I2518-L2532 HydrophobicContact CD1-CD2 4.08Å; L2532-A2549 HydrophobicContact CD2-CB 4.27Å; L2532-W2554 HydrophobicContact CB-CH2 4.06Å; L2532-W2554 HydrophobicContact CB-CZ3 4.22Å; L2532-W2554 HydrophobicContact CD2-CH2 4.24Å; L2532-K2566 PolarHBondContact N-O 2.99Å; L2532-I2567 HydrophobicContact CB-CG1 4.23Å; L2532-I2567 HydrophobicContact CB-CG2 4.45Å; L2532-I2567 HydrophobicContact CD2-CG2 4.3Å; L2532-I2567 CarbonylContact O-C 3.3Å; L2532-I2567 WeakPolarHBondContact O-CA 3.38Å; L2532-R2568 PolarHBondContact O-N 3.23Å; L2532-V2579 HydrophobicContact CD2-CG1 3.9Å; L2532-V2579 HydrophobicContact CD2-CG2 4.06Å
2533	T	91.1	Very high	84.1	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.2	168.2	-61.8	0	0	0	0	109.2	A2502 S2507 V2509 F2510 A2511 R2568	A2502-T2533 HydrophobicContact CB-CG2 4.5Å; S2507-T2533 WeakPolarHBondContact CB-OG1 3.49Å; S2507-T2533 WeakPolarHBondContact OG-CB 3Å; S2507-T2533 PolarHBondContact OG-OG1 3.13Å; S2507-T2533 VanDerWaalsContact OG-OG1 3.11Å; V2509-T2533 PolarHBondContact O-N 3.01Å; F2510-T2533 WeakPolarHBondContact CA-O 3.39Å; F2510-T2533 HydrophobicContact CD2-CG2 4.09Å; F2510-T2533 HydrophobicContact CE2-CG2 4.19Å; A2511-T2533 PolarHBondContact N-O 2.79Å; T2533-R2568 HydrophobicContact CG2-CB 4.31Å; T2533-R2568 HydrophobicContact CG2-CG 4.29Å
2534	T	90.5	Very high	83.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	155.4	173.5	58.8	0	0	0	0	112.4	A2502 A2511 V2547 R2568 L2576 L2577 V2579	A2502-T2534 WeakPolarHBondContact CB-O 3.23Å; A2511-T2534 WeakPolarHBondContact O-CA 3.43Å; T2534-V2547 HydrophobicContact CG2-CG2 4.14Å; T2534-R2568 PolarHBondContact N-O 3.28Å; T2534-R2568 VanDerWaalsContact N-O 3.11Å; T2534-R2568 PolarHBondContact OG1-O 3Å; T2534-L2576 WeakPolarHBondContact O-CD2 3.43Å; T2534-L2577 HydrophobicContact CG2-CB 4.27Å; T2534-L2577 PolarHBondContact OG1-N 3.31Å; T2534-L2577 PolarHBondContact OG1-O 2.73Å; T2534-V2579 HydrophobicContact CG2-CG2 3.45Å
2535	A	87.1	Confident	82.9	Confident	13 Å²	13	48.8 Å²	48.8	11%	0.107	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-75.8	172.1	170.9	0	0	0	0	0	113.1	F2510 A2511 A2512 L2577	F2510-A2535 HydrophobicContact CE1-CB 4.28Å; F2510-A2535 HydrophobicContact CE2-CB 4.46Å; F2510-A2535 HydrophobicContact CZ-CB 3.73Å; A2511-A2535 PolarHBondContact O-N 3.14Å; A2512-A2535 HydrophobicContact CB-CB 4.49Å; A2512-A2535 WeakPolarHBondContact O-CB 3.46Å; A2535-L2577 PolarHBondContact O-N 3.07Å; A2535-L2577 VanDerWaalsContact O-N 3.12Å
2536	V	84.6	Confident	82.8	Confident	58.5 Å²	58.5	50.8 Å²	50.8	36%	0.355	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-62.7	137.6	173.6	-174.4	0	0	0	0	110.2	F2500 N2538 Y2575	F2500-V2536 VanDerWaalsContact O-CG2 3.26Å; F2500-V2536 WeakPolarHBondContact O-CG2 3.35Å; V2536-N2538 PolarHBondContact O-N 2.79Å; V2536-N2538 VanDerWaalsContact O-N 3.13Å; V2536-Y2575 CarbonylContact C-O 3.51Å; V2536-Y2575 VanDerWaalsContact CA-O 3.25Å; V2536-Y2575 WeakPolarHBondContact CA-O 3.45Å; V2536-Y2575 HydrophobicContact CG1-CD2 4.32Å; V2536-Y2575 WeakPolarHBondContact CG1-O 3.29Å; V2536-Y2575 HydrophobicContact CG2-CD2 4.07Å; V2536-Y2575 HydrophobicContact CG2-CE2 4.38Å
2537	V	81.3	Confident	82.9	Confident	54 Å²	54	46.6 Å²	46.6	33%	0.327	27%	0.272	S	S	.	.			trans	-63	114.4	174.1	-175	0	0	0	0	109.4	Y2575 L2576 L2577	V2537-Y2575 PolarHBondContact N-O 3.09Å; V2537-L2576 VanDerWaalsContact CG2-O 3.28Å; V2537-L2576 WeakPolarHBondContact CG2-O 3.32Å; V2537-L2577 HydrophobicContact CB-CD2 4.48Å; V2537-L2577 HydrophobicContact CG1-CD2 4.41Å; V2537-L2577 HydrophobicContact CG2-CD2 4.07Å; V2537-L2577 HydrophobicContact CG2-CG 4.22Å
2538	N	76.6	Confident	83.1	Confident	63 Å²	63	42.5 Å²	42.5	34%	0.337	25%	0.25	S	S	.	.			trans	-105.7	121	175.2	-171.6	15	0	0	0	110.4	V2536 S2540 D2541	V2536-N2538 PolarHBondContact O-N 2.79Å; V2536-N2538 VanDerWaalsContact O-N 3.13Å; N2538-S2540 VanDerWaalsContact CG-OG 3.26Å; N2538-S2540 PolarHBondContact ND2-OG 3.11Å; N2538-S2540 PolarHBondContact O-N 2.82Å; N2538-S2540 VanDerWaalsContact O-N 3.16Å; N2538-S2540 PolarHBondContact OD1-OG 3.06Å; N2538-D2541 PolarHBondContact ND2-OD1 2.72Å; N2538-D2541 WeakPolarHBondContact O-CB 3.45Å; N2538-D2541 PolarHBondContact O-N 2.85Å; N2538-D2541 VanDerWaalsContact O-N 3.12Å
2539	L	70.3	Confident	83.4	Confident	168 Å²	168	42.4 Å²	42.4	88%	0.88	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.5	-177.1	-74.8	159.9	0	0	0	113.6	D2541	L2539-D2541 VanDerWaalsContact C-N 3.32Å
2540	S	71.9	Confident	83.7	Confident	84 Å²	84	42.4 Å²	42.4	59%	0.587	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.5	176.1	66	0	0	0	0	114.2	N2538	N2538-S2540 VanDerWaalsContact CG-OG 3.26Å; N2538-S2540 PolarHBondContact ND2-OG 3.11Å; N2538-S2540 PolarHBondContact O-N 2.82Å; N2538-S2540 VanDerWaalsContact O-N 3.16Å; N2538-S2540 PolarHBondContact OD1-OG 3.06Å
2541	D	72	Confident	83.7	Confident	17 Å²	17	44.2 Å²	44.2	9%	0.091	25%	0.251	C	S	.	.	S	Bend	trans	-74.8	135.3	-174.6	-67.2	-0.2	0	0	0	110.9	N2538 L2539 Y2543	N2538-D2541 PolarHBondContact ND2-OD1 2.72Å; N2538-D2541 WeakPolarHBondContact O-CB 3.45Å; N2538-D2541 PolarHBondContact O-N 2.85Å; N2538-D2541 VanDerWaalsContact O-N 3.12Å; L2539-D2541 VanDerWaalsContact C-N 3.32Å; D2541-Y2543 PolarHBondContact O-N 3.09Å
2542	A	70.3	Confident	83.7	Confident	50.5 Å²	50.5	44.1 Å²	44.1	42%	0.417	25%	0.251	S	S	.	.	S	Bend	trans	-62	-16.7	-177.5	0	0	0	0	0	113.9	R2418 D2419	R2418-A2542 WeakPolarHBondContact O-CB 3.34Å; R2418-A2542 PolarHBondContact O-N 3.01Å; D2419-A2542 VanDerWaalsContact C-CB 3.47Å; D2419-A2542 WeakPolarHBondContact O-CB 3.39Å
2543	Y	76.6	Confident	83.5	Confident	74.5 Å²	74.5	44.5 Å²	44.5	29%	0.292	25%	0.252	S	S	.	.			trans	-140.9	103.5	171.6	-179.5	-94	0	0	0	110.1	F2424 G2514 Q2515 D2541 G2545 P2546	F2424-Y2543 HydrophobicContact CE1-CD1 4.39Å; F2424-Y2543 AromaticContact CE1-CE1 3.94Å; F2424-Y2543 HydrophobicContact CE1-CE1 3.94Å; F2424-Y2543 HydrophobicContact CZ-CD1 4.48Å; F2424-Y2543 HydrophobicContact CZ-CD2 4.4Å; F2424-Y2543 HydrophobicContact CZ-CE1 4.2Å; F2424-Y2543 AromaticContact CZ-CE2 3.99Å; F2424-Y2543 HydrophobicContact CZ-CE2 4.04Å; F2424-Y2543 AromaticContact CZ-CZ 3.89Å; G2514-Y2543 WeakPolarHBondContact O-CE1 3.35Å; Q2515-Y2543 HydrophobicContact CG-CD1 3.68Å; Q2515-Y2543 HydrophobicContact CG-CG 3.91Å; D2541-Y2543 PolarHBondContact O-N 3.09Å; Y2543-G2545 VanDerWaalsContact CE1-CA 3.45Å; Y2543-G2545 PolarHBondContact O-N 3.19Å; Y2543-P2546 PolarHBondContact OH-O 2.81Å
2544	S	73.2	Confident	83.4	Confident	71 Å²	71	44.6 Å²	44.6	50%	0.497	25%	0.253	S	S	.	.			trans	-92.4	17.7	174.3	119.2	0	0	0	0	113.1
2545	G	82.3	Confident	82.9	Confident	16.5 Å²	16.5	45.2 Å²	45.2	17%	0.17	26%	0.258	C	S	.	.	S	Bend	trans	-74.4	168.7	179.6	0	0	0	0	0	113.3	G2514 Y2543	G2514-G2545 WeakPolarHBondContact CA-O 3.47Å; Y2543-G2545 VanDerWaalsContact CE1-CA 3.45Å; Y2543-G2545 PolarHBondContact O-N 3.19Å
2546	P	88.5	Confident	82.2	Confident	44.5 Å²	44.5	53 Å²	53	29%	0.289	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-68.2	147.3	178.9	29.3	-35.1	0	0	0	111.9	Y2543 K2578 N2580	Y2543-P2546 PolarHBondContact OH-O 2.81Å; P2546-K2578 CarbonylContact C-O 3.46Å; P2546-K2578 WeakPolarHBondContact CA-O 3.48Å; P2546-K2578 HydrophobicContact CB-CB 4.11Å; P2546-K2578 VanDerWaalsContact CB-O 3.28Å; P2546-K2578 WeakPolarHBondContact CB-O 3.43Å; P2546-N2580 VanDerWaalsContact CG-ND2 3.3Å; P2546-N2580 WeakPolarHBondContact CG-ND2 3.38Å
2547	V	89.8	Confident	81.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	131.9	171	175.2	0	0	0	0	109	A2511 V2516 I2518 T2534 A2549 K2578 V2579 N2580	A2511-V2547 HydrophobicContact CB-CG2 4.43Å; V2516-V2547 HydrophobicContact CB-CG1 4.27Å; V2516-V2547 WeakPolarHBondContact O-CG1 3.36Å; I2518-V2547 HydrophobicContact CD1-CG1 4.43Å; T2534-V2547 HydrophobicContact CG2-CG2 4.14Å; V2547-A2549 PolarHBondContact O-N 3.17Å; V2547-K2578 PolarHBondContact N-O 3.14Å; V2547-V2579 HydrophobicContact CB-CG2 4.18Å; V2547-N2580 PolarHBondContact O-N 3.11Å
2548	D	91.8	Very high	81.7	Confident	24.5 Å²	24.5	53.9 Å²	53.9	13%	0.131	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	106.2	178.8	-170.1	-2.8	0	0	0	109.9	V2516 K2517 I2518 R2550	V2516-D2548 PolarHBondContact O-N 2.83Å; K2517-D2548 CarbonylContact C-O 3.41Å; K2517-D2548 WeakPolarHBondContact CA-O 3.36Å; K2517-D2548 VanDerWaalsContact CE-OD2 3.22Å; K2517-D2548 WeakPolarHBondContact CE-OD2 3.49Å; K2517-D2548 HydrophobicContact CG-CB 4.25Å; I2518-D2548 PolarHBondContact N-O 3.05Å; D2548-R2550 VanDerWaalsContact OD1-CG 3.29Å; D2548-R2550 WeakPolarHBondContact OD1-CG 3.4Å; D2548-R2550 IonicContact OD1-CZ 3.66Å; D2548-R2550 PolarHBondContact OD1-N 2.68Å; D2548-R2550 IonicContact OD1-NE 3.03Å; D2548-R2550 PolarHBondContact OD1-NE 2.86Å; D2548-R2550 IonicContact OD1-NH2 2.72Å; D2548-R2550 IonicContact OD2-CZ 3.09Å; D2548-R2550 IonicContact OD2-NE 2.77Å; D2548-R2550 PolarHBondContact OD2-NE 3.3Å; D2548-R2550 IonicContact OD2-NH2 3.61Å; D2548-R2550 PolarHBondContact OD2-NH2 3.05Å
2549	A	92.8	Very high	82.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.			trans	-121.3	32.7	-177.1	0	0	0	0	0	112.7	I2518 L2532 V2547 N2552 W2554 V2579 N2580 F2581	I2518-A2549 HydrophobicContact CB-CB 4.26Å; I2518-A2549 CarbonylContact O-C 3.34Å; I2518-A2549 VanDerWaalsContact O-CA 3.31Å; I2518-A2549 WeakPolarHBondContact O-CA 3.26Å; L2532-A2549 HydrophobicContact CD2-CB 4.27Å; V2547-A2549 PolarHBondContact O-N 3.17Å; A2549-N2552 PolarHBondContact O-ND2 3.2Å; A2549-W2554 HydrophobicContact CB-CZ2 4.33Å; A2549-V2579 HydrophobicContact CB-CG1 3.54Å; A2549-N2580 CarbonylContact C-O 3.55Å; A2549-N2580 VanDerWaalsContact C-O 3.28Å; A2549-N2580 WeakPolarHBondContact CA-O 3.24Å; A2549-N2580 PolarHBondContact N-O 2.97Å; A2549-F2581 WeakPolarHBondContact O-CA 3.44Å
2550	R	91.9	Very high	83	Confident	102.5 Å²	102.5	48.5 Å²	48.5	39%	0.387	27%	0.27	S	S	.	.			trans	-73.4	155.8	-178.8	-64.8	-178.7	-78.8	-172.3	-4.5	112.4	D2548 N2552 N2580 L2582	D2548-R2550 VanDerWaalsContact OD1-CG 3.29Å; D2548-R2550 WeakPolarHBondContact OD1-CG 3.4Å; D2548-R2550 IonicContact OD1-CZ 3.66Å; D2548-R2550 PolarHBondContact OD1-N 2.68Å; D2548-R2550 IonicContact OD1-NE 3.03Å; D2548-R2550 PolarHBondContact OD1-NE 2.86Å; D2548-R2550 IonicContact OD1-NH2 2.72Å; D2548-R2550 IonicContact OD2-CZ 3.09Å; D2548-R2550 IonicContact OD2-NE 2.77Å; D2548-R2550 PolarHBondContact OD2-NE 3.3Å; D2548-R2550 IonicContact OD2-NH2 3.61Å; D2548-R2550 PolarHBondContact OD2-NH2 3.05Å; R2550-N2552 VanDerWaalsContact C-N 3.35Å; R2550-N2552 PolarHBondContact O-N 3.29Å; R2550-N2552 PolarHBondContact O-ND2 3.25Å; R2550-N2580 WeakPolarHBondContact CG-O 3.41Å; R2550-N2580 PolarHBondContact N-O 2.94Å; R2550-L2582 WeakPolarHBondContact CD-O 3.42Å; R2550-L2582 VanDerWaalsContact CG-O 3.24Å; R2550-L2582 WeakPolarHBondContact CG-O 3.28Å
2551	Q	90.8	Very high	83.8	Confident	83.5 Å²	83.5	47.8 Å²	47.8	39%	0.39	27%	0.27	S	S	.	.	S	Bend	trans	58.3	40.6	176.3	-55.7	179.4	-19.1	0	0	113.6	N2520 P2583 L2585	N2520-Q2551 WeakPolarHBondContact CA-O 3.45Å; N2520-Q2551 PolarHBondContact N-O 2.89Å; N2520-Q2551 PolarHBondContact ND2-OE1 2.97Å; Q2551-P2583 WeakPolarHBondContact CA-O 3.39Å; Q2551-P2583 HydrophobicContact CG-CG 4.33Å; Q2551-P2583 PolarHBondContact N-O 2.96Å; Q2551-L2585 VanDerWaalsContact O-CD1 3.22Å; Q2551-L2585 WeakPolarHBondContact O-CD1 3.38Å
2552	N	91.3	Very high	84.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.282	C	S	.	.			trans	-108.8	156.6	172	-61.6	-65.1	0	0	0	111.2	I2518 E2519 N2520 N2521 F2523 A2549 R2550 W2554 L2585	I2518-N2552 PolarHBondContact O-ND2 3.07Å; E2519-N2552 VanDerWaalsContact C-OD1 3.3Å; E2519-N2552 WeakPolarHBondContact CA-OD1 3.26Å; N2520-N2552 PolarHBondContact N-OD1 3.16Å; N2521-N2552 WeakPolarHBondContact CB-OD1 3.47Å; N2521-N2552 PolarHBondContact N-OD1 2.73Å; N2521-N2552 PolarHBondContact ND2-OD1 3.09Å; F2523-N2552 HydrophobicContact CD2-CB 4.32Å; F2523-N2552 HydrophobicContact CE2-CB 4.18Å; A2549-N2552 PolarHBondContact O-ND2 3.2Å; R2550-N2552 VanDerWaalsContact C-N 3.35Å; R2550-N2552 PolarHBondContact O-N 3.29Å; R2550-N2552 PolarHBondContact O-ND2 3.25Å; N2552-W2554 HydrophobicContact CB-CZ2 4Å; N2552-L2585 PolarHBondContact O-N 2.9Å
2553	Y	89.7	Confident	85.3	Confident	10.5 Å²	10.5	47.4 Å²	47.4	4%	0.041	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.7	175	-178.8	-95.2	0	0	0	109.5	N2521 F2522 F2523 G2555 Q2556 L2585 N2588	N2521-Y2553 PolarHBondContact O-N 3.04Å; F2522-Y2553 AromaticContact CD2-CD1 3.38Å; F2522-Y2553 HydrophobicContact CD2-CD1 3.38Å; F2522-Y2553 AromaticContact CD2-CE1 3.84Å; F2522-Y2553 HydrophobicContact CD2-CE1 3.84Å; F2522-Y2553 HydrophobicContact CD2-CG 4.14Å; F2522-Y2553 AromaticContact CE2-CD1 3.44Å; F2522-Y2553 HydrophobicContact CE2-CD1 3.44Å; F2522-Y2553 VanDerWaalsContact CE2-CD1 3.44Å; F2522-Y2553 AromaticContact CE2-CE1 3.35Å; F2522-Y2553 HydrophobicContact CE2-CE1 3.35Å; F2522-Y2553 HydrophobicContact CE2-CG 4.45Å; F2522-Y2553 HydrophobicContact CG-CD1 4.29Å; F2522-Y2553 HydrophobicContact CZ-CD1 4.37Å; F2522-Y2553 HydrophobicContact CZ-CE1 4.12Å; F2523-Y2553 WeakPolarHBondContact CB-O 3.22Å; F2523-Y2553 PolarHBondContact N-O 3.12Å; Y2553-G2555 WeakPolarHBondContact CE1-O 3.46Å; Y2553-G2555 WeakPolarHBondContact CE2-O 3.39Å; Y2553-G2555 VanDerWaalsContact CZ-C 3.49Å; Y2553-G2555 PolarHBondContact OH-O 2.94Å; Y2553-G2555 VanDerWaalsContact OH-O 3.12Å; Y2553-Q2556 VanDerWaalsContact OH-C 3.31Å; Y2553-Q2556 VanDerWaalsContact OH-CA 3.23Å; Y2553-Q2556 WeakPolarHBondContact OH-CA 3.36Å; Y2553-Q2556 PolarHBondContact OH-O 3.17Å; Y2553-L2585 HydrophobicContact CD2-CB 4.41Å; Y2553-L2585 WeakPolarHBondContact CD2-O 3.38Å; Y2553-N2588 HydrophobicContact CD2-CB 4.37Å; Y2553-N2588 HydrophobicContact CE1-CB 4.25Å; Y2553-N2588 HydrophobicContact CE2-CB 4.03Å
2554	W	87.7	Confident	85.9	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	58.5	-171.2	-59.5	99.1	0	0	0	113	F2523 E2531 L2532 A2549 N2552 S2558 V2562 A2563 I2567	F2523-W2554 HydrophobicContact CB-CE3 4.18Å; F2523-W2554 HydrophobicContact CD2-CD2 4.24Å; F2523-W2554 AromaticContact CD2-CE3 3.76Å; F2523-W2554 HydrophobicContact CD2-CE3 3.76Å; F2523-W2554 HydrophobicContact CD2-CH2 4.04Å; F2523-W2554 HydrophobicContact CD2-CZ2 4.45Å; F2523-W2554 AromaticContact CD2-CZ3 3.65Å; F2523-W2554 HydrophobicContact CD2-CZ3 3.65Å; F2523-W2554 HydrophobicContact CE2-CE3 4.41Å; F2523-W2554 AromaticContact CE2-CH2 3.85Å; F2523-W2554 HydrophobicContact CE2-CH2 3.85Å; F2523-W2554 HydrophobicContact CE2-CZ2 4.35Å; F2523-W2554 AromaticContact CE2-CZ3 3.88Å; F2523-W2554 HydrophobicContact CE2-CZ3 3.88Å; F2523-W2554 HydrophobicContact CG-CE3 4.1Å; F2523-W2554 HydrophobicContact CG-CZ3 4.06Å; F2523-W2554 HydrophobicContact CZ-CH2 4.46Å; F2523-W2554 HydrophobicContact CZ-CZ3 4.41Å; E2531-W2554 HydrophobicContact CB-CE3 3.88Å; E2531-W2554 HydrophobicContact CB-CZ3 3.66Å; E2531-W2554 HydrophobicContact CG-CE3 4.33Å; L2532-W2554 HydrophobicContact CB-CH2 4.06Å; L2532-W2554 HydrophobicContact CB-CZ3 4.22Å; L2532-W2554 HydrophobicContact CD2-CH2 4.24Å; A2549-W2554 HydrophobicContact CB-CZ2 4.33Å; N2552-W2554 HydrophobicContact CB-CZ2 4Å; W2554-S2558 PolarHBondContact N-OG 3.12Å; W2554-S2558 VanDerWaalsContact N-OG 3.08Å; W2554-V2562 VanDerWaalsContact O-CG1 3.24Å; W2554-V2562 WeakPolarHBondContact O-CG1 3.2Å; W2554-A2563 HydrophobicContact CB-CB 4.27Å; W2554-A2563 VanDerWaalsContact CD1-CB 3.48Å; W2554-A2563 HydrophobicContact CG-CB 3.87Å; W2554-I2567 HydrophobicContact CD2-CD1 4.46Å; W2554-I2567 HydrophobicContact CE3-CG1 4.43Å; W2554-I2567 HydrophobicContact CH2-CD1 4.05Å; W2554-I2567 HydrophobicContact CH2-CG1 3.99Å; W2554-I2567 HydrophobicContact CZ2-CD1 3.74Å; W2554-I2567 HydrophobicContact CZ2-CG1 4.2Å; W2554-I2567 HydrophobicContact CZ3-CD1 4.5Å; W2554-I2567 HydrophobicContact CZ3-CG1 4.15Å
2555	G	79.6	Confident	86.7	Confident	11.5 Å²	11.5	45.4 Å²	45.4	12%	0.119	27%	0.267	C	S	.	.	S	Bend	trans	94.8	-175.9	176.4	0	0	0	0	0	114.9	F2523 Y2553 I2557 S2558	F2523-G2555 WeakPolarHBondContact O-CA 3.42Å; F2523-G2555 PolarHBondContact O-N 3.22Å; Y2553-G2555 WeakPolarHBondContact CE1-O 3.46Å; Y2553-G2555 WeakPolarHBondContact CE2-O 3.39Å; Y2553-G2555 VanDerWaalsContact CZ-C 3.49Å; Y2553-G2555 PolarHBondContact OH-O 2.94Å; Y2553-G2555 VanDerWaalsContact OH-O 3.12Å; G2555-I2557 VanDerWaalsContact C-N 3.28Å; G2555-I2557 CarbonylContact O-C 3.56Å; G2555-I2557 PolarHBondContact O-N 2.97Å; G2555-S2558 PolarHBondContact O-N 2.88Å
2556	Q	72.2	Confident	87.1	Confident	176 Å²	176	46.9 Å²	46.9	82%	0.822	27%	0.269	S	S	*	.	S	Bend	trans	-49.5	-38.3	-165.1	-75.4	-178.6	-8.7	0	0	115.6	Y2553	Y2553-Q2556 VanDerWaalsContact OH-C 3.31Å; Y2553-Q2556 VanDerWaalsContact OH-CA 3.23Å; Y2553-Q2556 WeakPolarHBondContact OH-CA 3.36Å; Y2553-Q2556 PolarHBondContact OH-O 3.17Å
2557	I	77.6	Confident	87.2	Confident	129 Å²	129	44.9 Å²	44.9	66%	0.662	26%	0.256	S	S	*	.	S	Bend	trans	-130.1	97.4	170.7	-51.5	176.3	0	0	0	107.5	G2555 T2559	G2555-I2557 VanDerWaalsContact C-N 3.28Å; G2555-I2557 CarbonylContact O-C 3.56Å; G2555-I2557 PolarHBondContact O-N 2.97Å; I2557-T2559 HydrophobicContact CG2-CG2 4Å; I2557-T2559 PolarHBondContact O-N 3.29Å
2558	S	78.8	Confident	87.2	Confident	2.5 Å²	2.5	45.6 Å²	45.6	2%	0.017	26%	0.259	C	S	.	.			trans	-79.6	94.2	-175.5	175.2	0	0	0	0	110.2	W2554 G2555 V2584 L2585	W2554-S2558 PolarHBondContact N-OG 3.12Å; W2554-S2558 VanDerWaalsContact N-OG 3.08Å; G2555-S2558 PolarHBondContact O-N 2.88Å; S2558-V2584 WeakPolarHBondContact O-CG2 3.29Å; S2558-L2585 WeakPolarHBondContact CB-O 3.38Å; S2558-L2585 PolarHBondContact OG-O 2.93Å
2559	T	87.9	Confident	87.2	Confident	52 Å²	52	44.8 Å²	44.8	32%	0.319	25%	0.254	S	S	.	.			trans	-109.9	159.5	173.5	64.5	0	0	0	0	110.5	I2557 A2561 V2562 A2563	I2557-T2559 HydrophobicContact CG2-CG2 4Å; I2557-T2559 PolarHBondContact O-N 3.29Å; T2559-A2561 PolarHBondContact O-N 3.26Å; T2559-A2561 VanDerWaalsContact O-N 3.15Å; T2559-V2562 PolarHBondContact O-N 3.25Å; T2559-V2562 VanDerWaalsContact O-N 3.12Å; T2559-V2562 VanDerWaalsContact OG1-CG2 3.27Å; T2559-V2562 WeakPolarHBondContact OG1-CG2 3.19Å; T2559-V2562 PolarHBondContact OG1-N 3.25Å; T2559-A2563 PolarHBondContact O-N 3.08Å
2560	P	87	Confident	87	Confident	66.5 Å²	66.5	44.9 Å²	44.9	43%	0.432	26%	0.255	S	S	.	.	H	α-helix	trans	-49.7	-38	172.8	-32.6	38.8	0	0	0	114.4	S2564 F2581 L2582 V2584	P2560-S2564 PolarHBondContact O-N 3.22Å; P2560-S2564 PolarHBondContact O-OG 3.27Å; P2560-F2581 WeakPolarHBondContact O-CE2 3.48Å; P2560-L2582 HydrophobicContact CB-CD2 3.92Å; P2560-L2582 HydrophobicContact CG-CD2 3.97Å; P2560-V2584 HydrophobicContact CG-CG2 4.3Å
2561	A	87.1	Confident	86.8	Confident	70 Å²	70	45.1 Å²	45.1	58%	0.579	26%	0.264	S	S	*	.	H	α-helix	trans	-73	-37.4	179.6	0	0	0	0	0	113	T2559 S2564 G2565	T2559-A2561 PolarHBondContact O-N 3.26Å; T2559-A2561 VanDerWaalsContact O-N 3.15Å; A2561-S2564 WeakPolarHBondContact CA-OG 3.07Å; A2561-S2564 PolarHBondContact O-N 2.9Å; A2561-S2564 PolarHBondContact O-OG 3.1Å; A2561-G2565 PolarHBondContact O-N 3.08Å
2562	V	88.1	Confident	86.6	Confident	57.5 Å²	57.5	45 Å²	45	35%	0.348	27%	0.266	S	S	.	.	H	α-helix	trans	-68.5	-41.3	174.6	172.5	0	0	0	0	110.3	W2554 T2559 G2565 K2566	W2554-V2562 VanDerWaalsContact O-CG1 3.24Å; W2554-V2562 WeakPolarHBondContact O-CG1 3.2Å; T2559-V2562 PolarHBondContact O-N 3.25Å; T2559-V2562 VanDerWaalsContact O-N 3.12Å; T2559-V2562 VanDerWaalsContact OG1-CG2 3.27Å; T2559-V2562 WeakPolarHBondContact OG1-CG2 3.19Å; T2559-V2562 PolarHBondContact OG1-N 3.25Å; V2562-G2565 PolarHBondContact O-N 2.87Å; V2562-K2566 HydrophobicContact CG1-CG 4.43Å; V2562-K2566 WeakPolarHBondContact O-CB 3.34Å; V2562-K2566 WeakPolarHBondContact O-CG 3.32Å; V2562-K2566 PolarHBondContact O-N 3.19Å; V2562-K2566 VanDerWaalsContact O-N 3.12Å
2563	A	87.5	Confident	86.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-49.1	174.2	0	0	0	0	0	111.5	W2554 T2559 G2565 K2566 I2567 F2581 V2584	W2554-A2563 HydrophobicContact CB-CB 4.27Å; W2554-A2563 VanDerWaalsContact CD1-CB 3.48Å; W2554-A2563 HydrophobicContact CG-CB 3.87Å; T2559-A2563 PolarHBondContact O-N 3.08Å; A2563-G2565 VanDerWaalsContact C-N 3.3Å; A2563-G2565 PolarHBondContact O-N 2.98Å; A2563-K2566 PolarHBondContact O-N 2.97Å; A2563-K2566 VanDerWaalsContact O-N 3.17Å; A2563-I2567 HydrophobicContact CB-CD1 4.43Å; A2563-I2567 WeakPolarHBondContact O-CB 3.32Å; A2563-I2567 WeakPolarHBondContact O-CD1 3.22Å; A2563-I2567 VanDerWaalsContact O-CG1 3.25Å; A2563-I2567 WeakPolarHBondContact O-CG1 3.41Å; A2563-I2567 PolarHBondContact O-N 3.27Å; A2563-I2567 VanDerWaalsContact O-N 3.12Å; A2563-F2581 HydrophobicContact CB-CD2 3.7Å; A2563-F2581 HydrophobicContact CB-CE2 3.98Å; A2563-F2581 HydrophobicContact CB-CG 4.45Å; A2563-V2584 HydrophobicContact CB-CG1 3.76Å
2564	S	89	Confident	86	Confident	55.5 Å²	55.5	55.4 Å²	55.4	39%	0.388	32%	0.32	S	S	.	.	H	α-helix	trans	-61.6	-34.9	176.1	59.2	0	0	0	0	113.2	P2560 A2561 K2566 I2567	P2560-S2564 PolarHBondContact O-N 3.22Å; P2560-S2564 PolarHBondContact O-OG 3.27Å; A2561-S2564 WeakPolarHBondContact CA-OG 3.07Å; A2561-S2564 PolarHBondContact O-N 2.9Å; A2561-S2564 PolarHBondContact O-OG 3.1Å; S2564-K2566 VanDerWaalsContact C-N 3.3Å; S2564-K2566 PolarHBondContact O-N 2.94Å; S2564-I2567 VanDerWaalsContact O-O 3.09Å
2565	G	89	Confident	85.8	Confident	49.5 Å²	49.5	58 Å²	58	51%	0.51	33%	0.33	S	S	.	.	H	α-helix	trans	-74.9	-15.5	176.8	0	0	0	0	0	114.7	A2561 V2562 A2563	A2561-G2565 PolarHBondContact O-N 3.08Å; V2562-G2565 PolarHBondContact O-N 2.87Å; A2563-G2565 VanDerWaalsContact C-N 3.3Å; A2563-G2565 PolarHBondContact O-N 2.98Å
2566	K	90.5	Very high	86.2	Confident	47.5 Å²	47.5	57.6 Å²	57.6	21%	0.207	33%	0.325	C	S	.	.	H	α-helix	trans	-103.2	-5.2	178.6	-73.8	-64	-167.3	171	0	113.4	N2528 N2529 F2530 E2531 L2532 V2562 A2563 S2564	N2528-K2566 PolarHBondContact O-NZ 3.25Å; N2529-K2566 WeakPolarHBondContact O-CD 3.49Å; F2530-K2566 CarbonylContact C-O 3.4Å; E2531-K2566 HydrophobicContact CB-CB 4.38Å; E2531-K2566 HydrophobicContact CG-CB 4.15Å; E2531-K2566 HydrophobicContact CG-CD 4.18Å; E2531-K2566 HydrophobicContact CG-CG 4.39Å; E2531-K2566 PolarHBondContact N-O 3.29Å; L2532-K2566 PolarHBondContact N-O 2.99Å; V2562-K2566 HydrophobicContact CG1-CG 4.43Å; V2562-K2566 WeakPolarHBondContact O-CB 3.34Å; V2562-K2566 WeakPolarHBondContact O-CG 3.32Å; V2562-K2566 PolarHBondContact O-N 3.19Å; V2562-K2566 VanDerWaalsContact O-N 3.12Å; A2563-K2566 PolarHBondContact O-N 2.97Å; A2563-K2566 VanDerWaalsContact O-N 3.17Å; S2564-K2566 VanDerWaalsContact C-N 3.3Å; S2564-K2566 PolarHBondContact O-N 2.94Å
2567	I	92	Very high	87	Confident	2.5 Å²	2.5	49.5 Å²	49.5	1%	0.013	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	130.3	179.2	-63.1	166.3	0	0	0	107.7	L2532 W2554 A2563 S2564 D2569 V2579 F2581	L2532-I2567 HydrophobicContact CB-CG1 4.23Å; L2532-I2567 HydrophobicContact CB-CG2 4.45Å; L2532-I2567 HydrophobicContact CD2-CG2 4.3Å; L2532-I2567 CarbonylContact O-C 3.3Å; L2532-I2567 WeakPolarHBondContact O-CA 3.38Å; W2554-I2567 HydrophobicContact CD2-CD1 4.46Å; W2554-I2567 HydrophobicContact CE3-CG1 4.43Å; W2554-I2567 HydrophobicContact CH2-CD1 4.05Å; W2554-I2567 HydrophobicContact CH2-CG1 3.99Å; W2554-I2567 HydrophobicContact CZ2-CD1 3.74Å; W2554-I2567 HydrophobicContact CZ2-CG1 4.2Å; W2554-I2567 HydrophobicContact CZ3-CD1 4.5Å; W2554-I2567 HydrophobicContact CZ3-CG1 4.15Å; A2563-I2567 HydrophobicContact CB-CD1 4.43Å; A2563-I2567 WeakPolarHBondContact O-CB 3.32Å; A2563-I2567 WeakPolarHBondContact O-CD1 3.22Å; A2563-I2567 VanDerWaalsContact O-CG1 3.25Å; A2563-I2567 WeakPolarHBondContact O-CG1 3.41Å; A2563-I2567 PolarHBondContact O-N 3.27Å; A2563-I2567 VanDerWaalsContact O-N 3.12Å; S2564-I2567 VanDerWaalsContact O-O 3.09Å; I2567-D2569 HydrophobicContact CG2-CB 4.06Å; I2567-V2579 HydrophobicContact CD1-CG1 4.39Å; I2567-V2579 HydrophobicContact CG2-CB 3.95Å; I2567-V2579 HydrophobicContact CG2-CG1 4.11Å; I2567-V2579 HydrophobicContact CG2-CG2 3.88Å; I2567-F2581 HydrophobicContact CD1-CB 3.62Å; I2567-F2581 HydrophobicContact CD1-CD1 3.86Å; I2567-F2581 HydrophobicContact CD1-CD2 4.5Å; I2567-F2581 HydrophobicContact CD1-CG 3.76Å
2568	R	89.9	Confident	87.7	Confident	15 Å²	15	49 Å²	49	6%	0.057	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	109	172.7	179	172.7	176.8	70.2	0.9	109.4	Y2505 F2530 L2532 T2533 T2534 D2572 H2573 Y2575 L2576	Y2505-R2568 PolarHBondContact OH-NH2 2.84Å; F2530-R2568 HydrophobicContact CD1-CB 3.86Å; F2530-R2568 HydrophobicContact CE1-CB 4.08Å; F2530-R2568 HydrophobicContact CG-CB 4.17Å; L2532-R2568 PolarHBondContact O-N 3.23Å; T2533-R2568 HydrophobicContact CG2-CB 4.31Å; T2533-R2568 HydrophobicContact CG2-CG 4.29Å; T2534-R2568 PolarHBondContact N-O 3.28Å; T2534-R2568 VanDerWaalsContact N-O 3.11Å; T2534-R2568 PolarHBondContact OG1-O 3Å; R2568-D2572 WeakPolarHBondContact CA-OD2 3.28Å; R2568-H2573 VanDerWaalsContact CZ-CD2 3.45Å; R2568-H2573 PolarHBondContact NH1-CD2 3.13Å; R2568-H2573 PolarHBondContact NH1-NE2 3.1Å; R2568-H2573 PolarHBondContact NH2-CD2 2.94Å; R2568-H2573 PolarHBondContact NH2-NE2 3.12Å; R2568-Y2575 PolarHBondContact NH2-OH 2.94Å; R2568-L2576 HydrophobicContact CG-CD1 3.91Å
2569	D	90.4	Very high	88.3	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.037	28%	0.281	C	S	.	.			trans	-141.5	-173.6	-170.7	89.6	-22.5	0	0	0	115.1	I2567 N2571 D2572 H2573 L2577 V2579	I2567-D2569 HydrophobicContact CG2-CB 4.06Å; D2569-N2571 PolarHBondContact O-N 3.21Å; D2569-N2571 VanDerWaalsContact O-N 3.1Å; D2569-N2571 WeakPolarHBondContact OD1-CA 3.43Å; D2569-N2571 VanDerWaalsContact OD1-CB 3.28Å; D2569-N2571 WeakPolarHBondContact OD1-CB 3.48Å; D2569-N2571 PolarHBondContact OD1-N 3.44Å; D2569-N2571 PolarHBondContact OD2-ND2 3.06Å; D2569-D2572 PolarHBondContact N-OD2 3.26Å; D2569-D2572 VanDerWaalsContact N-OD2 3.12Å; D2569-D2572 PolarHBondContact O-N 3.01Å; D2569-D2572 VanDerWaalsContact O-N 3.07Å; D2569-H2573 PolarHBondContact O-N 3.1Å; D2569-L2577 WeakPolarHBondContact CB-O 3.43Å; D2569-V2579 HydrophobicContact CB-CB 4.05Å; D2569-V2579 HydrophobicContact CB-CG2 3.63Å; D2569-V2579 PolarHBondContact OD2-N 2.88Å
2570	G	88.4	Confident	88.6	Confident	1.5 Å²	1.5	50.4 Å²	50.4	2%	0.015	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-5.4	177.1	0	0	0	0	0	116.7	H2573 L2576 L2577 K2578	G2570-H2573 WeakPolarHBondContact CA-O 3.44Å; G2570-L2576 WeakPolarHBondContact CA-O 3.41Å; G2570-L2577 PolarHBondContact N-O 3.12Å; G2570-K2578 WeakPolarHBondContact O-CE 3.43Å
2571	N	87.8	Confident	88.8	Confident	108.5 Å²	108.5	48.6 Å²	48.6	58%	0.58	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-25.3	170.4	-63.1	-22.6	0	0	0	112.1	D2569	D2569-N2571 PolarHBondContact O-N 3.21Å; D2569-N2571 VanDerWaalsContact O-N 3.1Å; D2569-N2571 WeakPolarHBondContact OD1-CA 3.43Å; D2569-N2571 VanDerWaalsContact OD1-CB 3.28Å; D2569-N2571 WeakPolarHBondContact OD1-CB 3.48Å; D2569-N2571 PolarHBondContact OD1-N 3.44Å; D2569-N2571 PolarHBondContact OD2-ND2 3.06Å
2572	D	86.6	Confident	89	Confident	81 Å²	81	49.9 Å²	49.9	43%	0.433	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-41.4	170.9	-61.9	-45.9	0	0	0	111.1	R2568 D2569	R2568-D2572 WeakPolarHBondContact CA-OD2 3.28Å; D2569-D2572 PolarHBondContact N-OD2 3.26Å; D2569-D2572 VanDerWaalsContact N-OD2 3.12Å; D2569-D2572 PolarHBondContact O-N 3.01Å; D2569-D2572 VanDerWaalsContact O-N 3.07Å
2573	H	85.5	Confident	89.1	Confident	70.5 Å²	70.5	50.9 Å²	50.9	33%	0.326	28%	0.276	S	S	.	.			trans	-143.9	122.9	-179.7	-59.8	-56.4	0	0	0	111.7	R2568 D2569 G2570 Y2575 L2576	R2568-H2573 VanDerWaalsContact CZ-CD2 3.45Å; R2568-H2573 PolarHBondContact NH1-CD2 3.13Å; R2568-H2573 PolarHBondContact NH1-NE2 3.1Å; R2568-H2573 PolarHBondContact NH2-CD2 2.94Å; R2568-H2573 PolarHBondContact NH2-NE2 3.12Å; D2569-H2573 PolarHBondContact O-N 3.1Å; G2570-H2573 WeakPolarHBondContact CA-O 3.44Å; H2573-Y2575 HydrophobicContact CB-CD1 3.72Å; H2573-Y2575 HydrophobicContact CB-CE1 3.42Å; H2573-Y2575 HydrophobicContact CB-CG 4.47Å; H2573-Y2575 AromaticContact CG-CE1 3.75Å; H2573-Y2575 PolarHBondContact O-N 3.08Å; H2573-L2576 HydrophobicContact CB-CD1 4.19Å; H2573-L2576 HydrophobicContact CB-CG 4.26Å; H2573-L2576 PolarHBondContact O-N 3.08Å
2574	D	83.3	Confident	89.2	Confident	158.5 Å²	158.5	51.7 Å²	51.7	85%	0.848	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-21.5	-175.9	-62	-29.1	0	0	0	115.4	L2576	D2574-L2576 VanDerWaalsContact C-N 3.31Å
2575	Y	84.5	Confident	89	Confident	56.5 Å²	56.5	50.8 Å²	50.8	22%	0.222	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.5	179.9	69.6	-95.6	0	0	0	113.9	F2500 V2536 V2537 R2568 H2573	F2500-Y2575 HydrophobicContact CB-CE2 4.48Å; F2500-Y2575 AromaticContact CD1-CD1 4Å; F2500-Y2575 HydrophobicContact CD1-CD1 4.11Å; F2500-Y2575 HydrophobicContact CD1-CD2 4.08Å; F2500-Y2575 HydrophobicContact CD1-CE1 4.24Å; F2500-Y2575 HydrophobicContact CD1-CE2 4.2Å; F2500-Y2575 AromaticContact CD1-CG 3.96Å; F2500-Y2575 HydrophobicContact CD1-CG 4.04Å; F2500-Y2575 HydrophobicContact CE1-CD1 4.24Å; F2500-Y2575 HydrophobicContact CE1-CE1 4.44Å; F2500-Y2575 HydrophobicContact CE1-CG 4.46Å; V2536-Y2575 CarbonylContact C-O 3.51Å; V2536-Y2575 VanDerWaalsContact CA-O 3.25Å; V2536-Y2575 WeakPolarHBondContact CA-O 3.45Å; V2536-Y2575 HydrophobicContact CG1-CD2 4.32Å; V2536-Y2575 WeakPolarHBondContact CG1-O 3.29Å; V2536-Y2575 HydrophobicContact CG2-CD2 4.07Å; V2536-Y2575 HydrophobicContact CG2-CE2 4.38Å; V2537-Y2575 PolarHBondContact N-O 3.09Å; R2568-Y2575 PolarHBondContact NH2-OH 2.94Å; H2573-Y2575 HydrophobicContact CB-CD1 3.72Å; H2573-Y2575 HydrophobicContact CB-CE1 3.42Å; H2573-Y2575 HydrophobicContact CB-CG 4.47Å; H2573-Y2575 AromaticContact CG-CE1 3.75Å; H2573-Y2575 PolarHBondContact O-N 3.08Å
2576	L	87.9	Confident	88.7	Confident	2.5 Å²	2.5	56.1 Å²	56.1	1%	0.013	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-99.3	155.7	-179.7	-63.3	-179.9	0	0	0	112.3	A2502 T2534 V2537 R2568 G2570 H2573 D2574	A2502-L2576 HydrophobicContact CB-CD2 3.95Å; T2534-L2576 WeakPolarHBondContact O-CD2 3.43Å; V2537-L2576 VanDerWaalsContact CG2-O 3.28Å; V2537-L2576 WeakPolarHBondContact CG2-O 3.32Å; R2568-L2576 HydrophobicContact CG-CD1 3.91Å; G2570-L2576 WeakPolarHBondContact CA-O 3.41Å; H2573-L2576 HydrophobicContact CB-CD1 4.19Å; H2573-L2576 HydrophobicContact CB-CG 4.26Å; H2573-L2576 PolarHBondContact O-N 3.08Å; D2574-L2576 VanDerWaalsContact C-N 3.31Å
2577	L	88.1	Confident	88.2	Confident	5.5 Å²	5.5	56.7 Å²	56.7	3%	0.029	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-67.7	138.7	173.6	-64.4	157.6	0	0	0	110.5	T2534 A2535 V2537 D2569 G2570	T2534-L2577 HydrophobicContact CG2-CB 4.27Å; T2534-L2577 PolarHBondContact OG1-N 3.31Å; T2534-L2577 PolarHBondContact OG1-O 2.73Å; A2535-L2577 PolarHBondContact O-N 3.07Å; A2535-L2577 VanDerWaalsContact O-N 3.12Å; V2537-L2577 HydrophobicContact CB-CD2 4.48Å; V2537-L2577 HydrophobicContact CG1-CD2 4.41Å; V2537-L2577 HydrophobicContact CG2-CD2 4.07Å; V2537-L2577 HydrophobicContact CG2-CG 4.22Å; D2569-L2577 WeakPolarHBondContact CB-O 3.43Å; G2570-L2577 PolarHBondContact N-O 3.12Å
2578	K	91.5	Very high	87.4	Confident	119.5 Å²	119.5	59.3 Å²	59.3	52%	0.52	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-74.4	149.4	176.6	-66.9	-175.2	177.7	-171.8	0	111.9	P2546 V2547 G2570	P2546-K2578 CarbonylContact C-O 3.46Å; P2546-K2578 WeakPolarHBondContact CA-O 3.48Å; P2546-K2578 HydrophobicContact CB-CB 4.11Å; P2546-K2578 VanDerWaalsContact CB-O 3.28Å; P2546-K2578 WeakPolarHBondContact CB-O 3.43Å; V2547-K2578 PolarHBondContact N-O 3.14Å; G2570-K2578 WeakPolarHBondContact O-CE 3.43Å
2579	V	93.1	Very high	86.5	Confident	5.5 Å²	5.5	63.6 Å²	63.6	3%	0.033	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.7	179	178.7	0	0	0	0	110.9	L2532 T2534 V2547 A2549 I2567 D2569 F2581	L2532-V2579 HydrophobicContact CD2-CG1 3.9Å; L2532-V2579 HydrophobicContact CD2-CG2 4.06Å; T2534-V2579 HydrophobicContact CG2-CG2 3.45Å; V2547-V2579 HydrophobicContact CB-CG2 4.18Å; A2549-V2579 HydrophobicContact CB-CG1 3.54Å; I2567-V2579 HydrophobicContact CD1-CG1 4.39Å; I2567-V2579 HydrophobicContact CG2-CB 3.95Å; I2567-V2579 HydrophobicContact CG2-CG1 4.11Å; I2567-V2579 HydrophobicContact CG2-CG2 3.88Å; D2569-V2579 HydrophobicContact CB-CB 4.05Å; D2569-V2579 HydrophobicContact CB-CG2 3.63Å; D2569-V2579 PolarHBondContact OD2-N 2.88Å; V2579-F2581 HydrophobicContact CG1-CB 4.41Å; V2579-F2581 PolarHBondContact O-N 2.87Å
2580	N	93.2	Very high	85.6	Confident	78.5 Å²	78.5	67.4 Å²	67.4	42%	0.42	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	96.2	171.9	-73.8	-28.3	0	0	0	110.1	P2546 V2547 A2549 R2550	P2546-N2580 VanDerWaalsContact CG-ND2 3.3Å; P2546-N2580 WeakPolarHBondContact CG-ND2 3.38Å; V2547-N2580 PolarHBondContact O-N 3.11Å; A2549-N2580 CarbonylContact C-O 3.55Å; A2549-N2580 VanDerWaalsContact C-O 3.28Å; A2549-N2580 WeakPolarHBondContact CA-O 3.24Å; A2549-N2580 PolarHBondContact N-O 2.97Å; R2550-N2580 WeakPolarHBondContact CG-O 3.41Å; R2550-N2580 PolarHBondContact N-O 2.94Å
2581	F	91.3	Very high	84.8	Confident	27.5 Å²	27.5	69.6 Å²	69.6	12%	0.121	37%	0.373	C	S	.	.			trans	-102.3	-5	-177.6	61.8	-92.2	0	0	0	115.4	A2549 P2560 A2563 I2567 V2579 P2583 V2584	A2549-F2581 WeakPolarHBondContact O-CA 3.44Å; P2560-F2581 WeakPolarHBondContact O-CE2 3.48Å; A2563-F2581 HydrophobicContact CB-CD2 3.7Å; A2563-F2581 HydrophobicContact CB-CE2 3.98Å; A2563-F2581 HydrophobicContact CB-CG 4.45Å; I2567-F2581 HydrophobicContact CD1-CB 3.62Å; I2567-F2581 HydrophobicContact CD1-CD1 3.86Å; I2567-F2581 HydrophobicContact CD1-CD2 4.5Å; I2567-F2581 HydrophobicContact CD1-CG 3.76Å; V2579-F2581 HydrophobicContact CG1-CB 4.41Å; V2579-F2581 PolarHBondContact O-N 2.87Å; F2581-P2583 CarbonylContact O-C 3.52Å; F2581-V2584 HydrophobicContact CD2-CG1 4.1Å; F2581-V2584 WeakPolarHBondContact O-CG1 3.37Å
2582	L	90.6	Very high	84.2	Confident	98.5 Å²	98.5	66.2 Å²	66.2	52%	0.516	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-96.1	131	-177.9	-64.8	176.5	0	0	0	112.4	R2550 P2560 V2584	R2550-L2582 WeakPolarHBondContact CD-O 3.42Å; R2550-L2582 VanDerWaalsContact CG-O 3.24Å; R2550-L2582 WeakPolarHBondContact CG-O 3.28Å; P2560-L2582 HydrophobicContact CB-CD2 3.92Å; P2560-L2582 HydrophobicContact CG-CD2 3.97Å; L2582-V2584 HydrophobicContact CD2-CG1 4.43Å
2583	P	91.2	Very high	83.4	Confident	77 Å²	77	65.7 Å²	65.7	50%	0.5	35%	0.352	S	S	.	.	S	Bend	cis	-82.2	150.8	5.9	32.9	-35.9	0	0	0	113.7	Q2551 F2581	Q2551-P2583 WeakPolarHBondContact CA-O 3.39Å; Q2551-P2583 HydrophobicContact CG-CG 4.33Å; Q2551-P2583 PolarHBondContact N-O 2.96Å; F2581-P2583 CarbonylContact O-C 3.52Å
2584	V	88.6	Confident	82.8	Confident	18.5 Å²	18.5	64.8 Å²	64.8	11%	0.112	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-90.2	154.4	170.8	-63.3	0	0	0	0	110.9	S2558 P2560 A2563 F2581 L2582	S2558-V2584 WeakPolarHBondContact O-CG2 3.29Å; P2560-V2584 HydrophobicContact CG-CG2 4.3Å; A2563-V2584 HydrophobicContact CB-CG1 3.76Å; F2581-V2584 HydrophobicContact CD2-CG1 4.1Å; F2581-V2584 WeakPolarHBondContact O-CG1 3.37Å; L2582-V2584 HydrophobicContact CD2-CG1 4.43Å
2585	L	86.1	Confident	82.3	Confident	36.5 Å²	36.5	62.5 Å²	62.5	19%	0.191	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-80.3	120.3	169.3	-71.4	171.9	0	0	0	109	Q2551 N2552 Y2553 S2558 L2591	Q2551-L2585 VanDerWaalsContact O-CD1 3.22Å; Q2551-L2585 WeakPolarHBondContact O-CD1 3.38Å; N2552-L2585 PolarHBondContact O-N 2.9Å; Y2553-L2585 HydrophobicContact CD2-CB 4.41Å; Y2553-L2585 WeakPolarHBondContact CD2-O 3.38Å; S2558-L2585 WeakPolarHBondContact CB-O 3.38Å; S2558-L2585 PolarHBondContact OG-O 2.93Å; L2585-L2591 HydrophobicContact CD1-CD1 3.89Å; L2585-L2591 HydrophobicContact CD1-CG 4.46Å
2586	E	81.3	Confident	82	Confident	161 Å²	161	60.3 Å²	60.3	75%	0.752	35%	0.351	S	S	*	.			trans	-79.4	-34.9	-178.4	-64.5	-178.5	171	0	0	113
2587	S	80	Confident	81.5	Confident	59.5 Å²	59.5	61.6 Å²	61.6	42%	0.416	36%	0.36	S	S	.	.			trans	-115.3	150.3	179.3	77.8	0	0	0	0	112.5	T2589	S2587-T2589 PolarHBondContact OG-OG1 2.86Å
2588	N	76.1	Confident	81	Confident	56.5 Å²	56.5	62.3 Å²	62.3	30%	0.302	36%	0.364	S	S	.	.	S	Bend	trans	-88.7	-5.2	176.7	60.2	-1.3	0	0	0	113.6	F2522 Y2553 S2590 L2591 L2592	F2522-N2588 HydrophobicContact CD2-CB 4.32Å; F2522-N2588 HydrophobicContact CE2-CB 4.01Å; Y2553-N2588 HydrophobicContact CD2-CB 4.37Å; Y2553-N2588 HydrophobicContact CE1-CB 4.25Å; Y2553-N2588 HydrophobicContact CE2-CB 4.03Å; N2588-S2590 VanDerWaalsContact C-N 3.26Å; N2588-S2590 PolarHBondContact O-N 2.88Å; N2588-L2591 PolarHBondContact O-N 3.33Å; N2588-L2592 HydrophobicContact CB-CD1 3.95Å; N2588-L2592 HydrophobicContact CB-CG 4.35Å; N2588-L2592 PolarHBondContact O-N 2.91Å; N2588-L2592 VanDerWaalsContact O-N 3.12Å
2589	T	71.1	Confident	80.2	Confident	106 Å²	106	58.3 Å²	58.3	65%	0.65	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-23.5	-171.4	52.6	0	0	0	0	114.3	S2587 L2591	S2587-T2589 PolarHBondContact OG-OG1 2.86Å; T2589-L2591 VanDerWaalsContact C-N 3.34Å
2590	S	70.7	Confident	79.8	Confident	86 Å²	86	58.7 Å²	58.7	60%	0.601	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-13.3	175.7	54.1	0	0	0	0	113.6	N2588	N2588-S2590 VanDerWaalsContact C-N 3.26Å; N2588-S2590 PolarHBondContact O-N 2.88Å
2591	L	73.2	Confident	79.4	Confident	48.5 Å²	48.5	55.7 Å²	55.7	25%	0.254	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-21.9	-175.3	-61.4	177.4	0	0	0	113.1	N2520 F2522 L2585 N2588 T2589	N2520-L2591 WeakPolarHBondContact O-CD2 3.38Å; F2522-L2591 HydrophobicContact CB-CD1 4.12Å; F2522-L2591 HydrophobicContact CD2-CD1 4.48Å; L2585-L2591 HydrophobicContact CD1-CD1 3.89Å; L2585-L2591 HydrophobicContact CD1-CG 4.46Å; N2588-L2591 PolarHBondContact O-N 3.33Å; T2589-L2591 VanDerWaalsContact C-N 3.34Å
2592	L	73.6	Confident	78.9	Confident	37.5 Å²	37.5	56.2 Å²	56.2	20%	0.196	34%	0.344	C	S	.	.	S	Bend	trans	-112	141	-176.8	-59.9	178.1	0	0	0	111.7	F2522 N2588 P2598	F2522-L2592 HydrophobicContact CE2-CD1 4.22Å; F2522-L2592 HydrophobicContact CZ-CD1 4.41Å; N2588-L2592 HydrophobicContact CB-CD1 3.95Å; N2588-L2592 HydrophobicContact CB-CG 4.35Å; N2588-L2592 PolarHBondContact O-N 2.91Å; N2588-L2592 VanDerWaalsContact O-N 3.12Å; L2592-P2598 HydrophobicContact CD2-CB 3.63Å; L2592-P2598 HydrophobicContact CD2-CG 3.86Å
2593	D	71	Confident	78.1	Confident	70 Å²	70	51.9 Å²	51.9	37%	0.374	32%	0.323	S	S	.	.			trans	-96.1	96.7	178.7	-161.6	5.9	0	0	0	110.2	F2601 K2654	D2593-F2601 WeakPolarHBondContact OD2-CB 3.38Å; D2593-K2654 IonicContact OD2-NZ 3.88Å; D2593-K2654 PolarHBondContact OD2-NZ 3.2Å
2594	G	71.7	Confident	77	Confident	52 Å²	52	49.4 Å²	49.4	54%	0.536	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-142	176.6	0	0	0	0	0	114.8
2595	S	72.6	Confident	75.7	Confident	109 Å²	109	53.6 Å²	53.6	76%	0.762	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	10.8	-179.9	-56	0	0	0	0	113.5
2596	C	79.3	Confident	74.5	Confident	10.5 Å²	10.5	59.7 Å²	59.7	7%	0.071	35%	0.353	C	S	.	.	S	Bend	trans	-82.6	158.1	-175.9	-70.2	0	0	0	0	113	W2600 C2614	C2596-W2600 HydrophobicContact CB-CB 3.95Å; C2596-C2614 WeakPolarHBondContact CA-SG 3.48Å; C2596-C2614 HydrophobicContact CB-CB 3.83Å; C2596-C2614 WeakPolarHBondContact CB-SG 3.32Å; C2596-C2614 WeakPolarHBondContact SG-CA 3.03Å; C2596-C2614 WeakPolarHBondContact SG-CB 3.29Å; C2596-C2614 CovalentContact SG-SG 2.04Å; C2596-C2614 PolarHBondContact SG-SG 2.9Å
2597	P	77.6	Confident	73.4	Confident	31 Å²	31	58.6 Å²	58.6	20%	0.201	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-59.5	155.9	172.5	-19.6	31.3	0	0	0	112	G2599 W2600	P2597-G2599 PolarHBondContact O-N 2.98Å; P2597-W2600 HydrophobicContact CB-CG 4.31Å; P2597-W2600 HydrophobicContact CG-CG 4.43Å; P2597-W2600 WeakPolarHBondContact O-CB 3.36Å; P2597-W2600 PolarHBondContact O-N 3.19Å
2598	P	76.2	Confident	71.8	Confident	18.5 Å²	18.5	63.5 Å²	63.5	12%	0.12	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	132.4	-179.8	-20.6	31.2	0	0	0	112.8	V2431 Y2433 F2522 L2592 W2600	V2431-P2598 HydrophobicContact CG1-CB 3.32Å; Y2433-P2598 HydrophobicContact CD1-CB 3.75Å; Y2433-P2598 HydrophobicContact CD1-CG 4.07Å; Y2433-P2598 HydrophobicContact CD2-CG 4.32Å; Y2433-P2598 HydrophobicContact CE1-CB 3.72Å; Y2433-P2598 HydrophobicContact CE1-CG 4.26Å; Y2433-P2598 VanDerWaalsContact CE1-O 3.23Å; Y2433-P2598 WeakPolarHBondContact CE1-O 3.4Å; Y2433-P2598 HydrophobicContact CE2-CG 4.47Å; Y2433-P2598 HydrophobicContact CG-CB 4.3Å; Y2433-P2598 HydrophobicContact CG-CG 4.1Å; Y2433-P2598 VanDerWaalsContact CZ-O 3.32Å; Y2433-P2598 PolarHBondContact OH-O 2.83Å; F2522-P2598 HydrophobicContact CD1-CB 4.34Å; F2522-P2598 HydrophobicContact CD1-CG 4.34Å; F2522-P2598 HydrophobicContact CE1-CB 4.15Å; F2522-P2598 HydrophobicContact CE1-CG 3.66Å; F2522-P2598 HydrophobicContact CZ-CG 4.04Å; L2592-P2598 HydrophobicContact CD2-CB 3.63Å; L2592-P2598 HydrophobicContact CD2-CG 3.86Å; P2598-W2600 VanDerWaalsContact C-N 3.31Å; P2598-W2600 PolarHBondContact O-N 3.38Å
2599	G	76.3	Confident	70.6	Confident	36.5 Å²	36.5	69 Å²	69	38%	0.376	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	-10.8	-175	0	0	0	0	0	115.5	P2597	P2597-G2599 PolarHBondContact O-N 2.98Å
2600	W	84.7	Confident	69.9	Low	14.5 Å²	14.5	68.7 Å²	68.7	6%	0.055	38%	0.381	C	S	.	.			trans	-92.5	151.4	171.7	-62.1	65.1	0	0	0	109.9	C2596 P2597 P2598 C2614 F2615 L2616 Q2634 C2715 K2717	C2596-W2600 HydrophobicContact CB-CB 3.95Å; P2597-W2600 HydrophobicContact CB-CG 4.31Å; P2597-W2600 HydrophobicContact CG-CG 4.43Å; P2597-W2600 WeakPolarHBondContact O-CB 3.36Å; P2597-W2600 PolarHBondContact O-N 3.19Å; P2598-W2600 VanDerWaalsContact C-N 3.31Å; P2598-W2600 PolarHBondContact O-N 3.38Å; W2600-C2614 HydrophobicContact CB-CB 4.4Å; W2600-C2614 HydrophobicContact CE3-CB 4.09Å; W2600-F2615 WeakPolarHBondContact CA-O 3.4Å; W2600-L2616 HydrophobicContact CD2-CB 3.73Å; W2600-L2616 HydrophobicContact CE3-CB 3.63Å; W2600-L2616 HydrophobicContact CG-CB 4.44Å; W2600-L2616 HydrophobicContact CH2-CB 3.76Å; W2600-L2616 HydrophobicContact CH2-CD2 4.33Å; W2600-L2616 HydrophobicContact CZ2-CB 3.88Å; W2600-L2616 HydrophobicContact CZ2-CD2 3.88Å; W2600-L2616 HydrophobicContact CZ2-CG 4.46Å; W2600-L2616 HydrophobicContact CZ3-CB 3.63Å; W2600-Q2634 HydrophobicContact CZ2-CB 4.45Å; W2600-C2715 HydrophobicContact CH2-CB 4.13Å; W2600-C2715 HydrophobicContact CZ3-CB 4.39Å; W2600-K2717 HydrophobicContact CE3-CB 4.01Å; W2600-K2717 HydrophobicContact CH2-CB 3.8Å; W2600-K2717 HydrophobicContact CH2-CD 3.96Å; W2600-K2717 HydrophobicContact CZ2-CD 4.12Å; W2600-K2717 HydrophobicContact CZ3-CB 3.41Å; W2600-K2717 VanDerWaalsContact CZ3-CB 3.41Å; W2600-K2717 HydrophobicContact CZ3-CD 4.3Å
2601	F	84.6	Confident	69.3	Low	14 Å²	14	71.8 Å²	71.8	6%	0.061	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.1	174.8	62.2	-96.8	0	0	0	111.7	D2593 A2603 F2615 F2617 L2651 K2654 L2658	D2593-F2601 WeakPolarHBondContact OD2-CB 3.38Å; F2601-A2603 HydrophobicContact CD2-CB 4.48Å; F2601-A2603 HydrophobicContact CE2-CB 4.35Å; F2601-F2615 WeakPolarHBondContact CD1-O 3.34Å; F2601-F2615 HydrophobicContact CD2-CB 4.17Å; F2601-F2615 HydrophobicContact CE1-CB 4.37Å; F2601-F2615 HydrophobicContact CE2-CB 3.65Å; F2601-F2615 HydrophobicContact CE2-CG 4.46Å; F2601-F2615 HydrophobicContact CZ-CB 3.77Å; F2601-F2615 PolarHBondContact N-O 3.46Å; F2601-F2615 PolarHBondContact O-N 3.26Å; F2601-F2617 HydrophobicContact CE1-CB 3.8Å; F2601-F2617 HydrophobicContact CZ-CB 4.32Å; F2601-L2651 HydrophobicContact CE2-CD1 3.87Å; F2601-L2651 HydrophobicContact CZ-CD1 3.94Å; F2601-K2654 HydrophobicContact CD2-CD 4.37Å; F2601-K2654 HydrophobicContact CD2-CG 3.68Å; F2601-K2654 HydrophobicContact CE2-CB 4.18Å; F2601-K2654 HydrophobicContact CE2-CG 3.68Å; F2601-K2654 HydrophobicContact CG-CG 4.22Å; F2601-K2654 HydrophobicContact CZ-CG 4.22Å; F2601-L2658 HydrophobicContact CD1-CD1 4.02Å; F2601-L2658 HydrophobicContact CE1-CD1 3.69Å; F2601-L2658 HydrophobicContact CZ-CD1 4.34Å
2602	E	79.6	Confident	69.1	Low	38 Å²	38	73.5 Å²	73.5	18%	0.178	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.7	174.7	-161.4	176.9	141.1	0	0	109.9	R2612	E2602-R2612 HydrophobicContact CG-CB 4.42Å; E2602-R2612 WeakPolarHBondContact OE1-CD 3.49Å; E2602-R2612 WeakPolarHBondContact OE1-CG 3.25Å; E2602-R2612 IonicContact OE1-CZ 3.98Å; E2602-R2612 IonicContact OE1-NE 3.93Å; E2602-R2612 IonicContact OE1-NH1 3.93Å; E2602-R2612 PolarHBondContact OE1-NH1 3.38Å; E2602-R2612 IonicContact OE2-NH1 3.51Å
2603	A	74.1	Confident	69.4	Low	8 Å²	8	72.1 Å²	72.1	7%	0.066	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	128.9	163.1	0	0	0	0	0	109.5	F2601 S2613 F2615	F2601-A2603 HydrophobicContact CD2-CB 4.48Å; F2601-A2603 HydrophobicContact CE2-CB 4.35Å; A2603-S2613 PolarHBondContact N-O 3.29Å; A2603-F2615 HydrophobicContact CB-CD2 3.66Å; A2603-F2615 HydrophobicContact CB-CE2 3.83Å; A2603-F2615 WeakPolarHBondContact O-CE2 3.12Å
2604	G	68.4	Low	70.1	Confident	26 Å²	26	68.9 Å²	68.9	27%	0.268	36%	0.36	S	S	.	.			trans	177.7	172.8	-172.5	0	0	0	0	0	111.9
2605	Y	61.8	Low	70.9	Confident	107 Å²	107	66.4 Å²	66.4	42%	0.42	34%	0.335	S	S	.	.			trans	-95.7	133.4	-179.7	-169.5	-116.1	0	0	0	110.4	E2607	Y2605-E2607 HydrophobicContact CD1-CB 4.09Å; Y2605-E2607 HydrophobicContact CD1-CG 4.39Å; Y2605-E2607 HydrophobicContact CE1-CB 3.89Å; Y2605-E2607 HydrophobicContact CE1-CG 3.77Å; Y2605-E2607 WeakPolarHBondContact CE1-OE2 3.43Å; Y2605-E2607 PolarHBondContact O-N 2.81Å
2606	E	60.6	Low	71.6	Confident	163 Å²	163	61.6 Å²	61.6	76%	0.762	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-36.9	-165.3	-66.4	-172.8	156.4	0	0	114.4	W2608	E2606-W2608 VanDerWaalsContact C-N 3.26Å; E2606-W2608 PolarHBondContact O-N 2.92Å
2607	E	57.3	Low	72.1	Confident	139 Å²	139	62.1 Å²	62.1	65%	0.65	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.3	-172.6	-68.6	-173.9	166.3	0	0	114	Y2605	Y2605-E2607 HydrophobicContact CD1-CB 4.09Å; Y2605-E2607 HydrophobicContact CD1-CG 4.39Å; Y2605-E2607 HydrophobicContact CE1-CB 3.89Å; Y2605-E2607 HydrophobicContact CE1-CG 3.77Å; Y2605-E2607 WeakPolarHBondContact CE1-OE2 3.43Å; Y2605-E2607 PolarHBondContact O-N 2.81Å
2608	W	48	Very low	72.6	Confident	161 Å²	161	60.7 Å²	60.7	61%	0.61	29%	0.292	S	S	*	.			trans	-127.6	96.7	-171.7	-62.6	87.2	0	0	0	111.2	E2606 S2610 Y2611	E2606-W2608 VanDerWaalsContact C-N 3.26Å; E2606-W2608 PolarHBondContact O-N 2.92Å; W2608-S2610 PolarHBondContact O-N 2.9Å; W2608-Y2611 HydrophobicContact CB-CD2 3.57Å; W2608-Y2611 HydrophobicContact CB-CE2 4.05Å; W2608-Y2611 HydrophobicContact CG-CD2 4.38Å; W2608-Y2611 HydrophobicContact CG-CE2 4.45Å; W2608-Y2611 PolarHBondContact O-N 2.87Å
2609	K	50.5	Low	72.8	Confident	174 Å²	174	60.1 Å²	60.1	76%	0.757	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-52.1	-26.2	-179.2	-72.2	-175.3	177.4	-178.6	0	114.4	Y2611 R2612	K2609-Y2611 VanDerWaalsContact C-N 3.31Å; K2609-Y2611 PolarHBondContact O-N 3.35Å; K2609-R2612 WeakPolarHBondContact O-CB 3.29Å; K2609-R2612 PolarHBondContact O-N 2.99Å
2610	S	56.4	Low	73.4	Confident	99 Å²	99	58.4 Å²	58.4	69%	0.692	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-72.6	-14.7	179.3	62.6	0	0	0	0	115.2	W2608	W2608-S2610 PolarHBondContact O-N 2.9Å
2611	Y	57.3	Low	73.7	Confident	151 Å²	151	57.7 Å²	57.7	59%	0.592	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-99.8	10.8	177.4	-63.2	-90.2	0	0	0	113	W2608 K2609 S2613	W2608-Y2611 HydrophobicContact CB-CD2 3.57Å; W2608-Y2611 HydrophobicContact CB-CE2 4.05Å; W2608-Y2611 HydrophobicContact CG-CD2 4.38Å; W2608-Y2611 HydrophobicContact CG-CE2 4.45Å; W2608-Y2611 PolarHBondContact O-N 2.87Å; K2609-Y2611 VanDerWaalsContact C-N 3.31Å; K2609-Y2611 PolarHBondContact O-N 3.35Å; Y2611-S2613 PolarHBondContact O-N 2.99Å
2612	R	69.2	Low	74.1	Confident	84 Å²	84	57 Å²	57	32%	0.317	27%	0.265	S	S	.	.			trans	-76.1	116.3	171.9	-67.4	169.9	174.6	-117.7	3	108.3	E2602 K2609 P2719	E2602-R2612 HydrophobicContact CG-CB 4.42Å; E2602-R2612 WeakPolarHBondContact OE1-CD 3.49Å; E2602-R2612 WeakPolarHBondContact OE1-CG 3.25Å; E2602-R2612 IonicContact OE1-CZ 3.98Å; E2602-R2612 IonicContact OE1-NE 3.93Å; E2602-R2612 IonicContact OE1-NH1 3.93Å; E2602-R2612 PolarHBondContact OE1-NH1 3.38Å; E2602-R2612 IonicContact OE2-NH1 3.51Å; K2609-R2612 WeakPolarHBondContact O-CB 3.29Å; K2609-R2612 PolarHBondContact O-N 2.99Å; R2612-P2719 WeakPolarHBondContact O-CD 3.47Å
2613	S	79.9	Confident	74.7	Confident	8 Å²	8	55.4 Å²	55.4	6%	0.056	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.2	177.9	33	0	0	0	0	109	A2603 Y2611 F2615	A2603-S2613 PolarHBondContact N-O 3.29Å; Y2611-S2613 PolarHBondContact O-N 2.99Å; S2613-F2615 WeakPolarHBondContact O-CD2 2.89Å; S2613-F2615 VanDerWaalsContact OG-CE2 3.23Å; S2613-F2615 WeakPolarHBondContact OG-CE2 3.23Å; S2613-F2615 WeakPolarHBondContact OG-CZ 3.47Å
2614	C	86.3	Confident	75.5	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.014	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129	176.7	-63.6	0	0	0	0	108.5	C2596 W2600 K2717	C2596-C2614 WeakPolarHBondContact CA-SG 3.48Å; C2596-C2614 HydrophobicContact CB-CB 3.83Å; C2596-C2614 WeakPolarHBondContact CB-SG 3.32Å; C2596-C2614 WeakPolarHBondContact SG-CA 3.03Å; C2596-C2614 WeakPolarHBondContact SG-CB 3.29Å; C2596-C2614 CovalentContact SG-SG 2.04Å; C2596-C2614 PolarHBondContact SG-SG 2.9Å; W2600-C2614 HydrophobicContact CB-CB 4.4Å; W2600-C2614 HydrophobicContact CE3-CB 4.09Å; C2614-K2717 WeakPolarHBondContact CB-O 3.43Å; C2614-K2717 PolarHBondContact N-O 2.81Å; C2614-K2717 PolarHBondContact O-N 3.48Å
2615	F	88.4	Confident	76.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.4	178.5	-65.4	-81.4	0	0	0	110.9	W2600 F2601 A2603 S2613 P2639 F2641 L2651 V2714 C2715 E2716	W2600-F2615 WeakPolarHBondContact CA-O 3.4Å; F2601-F2615 WeakPolarHBondContact CD1-O 3.34Å; F2601-F2615 HydrophobicContact CD2-CB 4.17Å; F2601-F2615 HydrophobicContact CE1-CB 4.37Å; F2601-F2615 HydrophobicContact CE2-CB 3.65Å; F2601-F2615 HydrophobicContact CE2-CG 4.46Å; F2601-F2615 HydrophobicContact CZ-CB 3.77Å; F2601-F2615 PolarHBondContact N-O 3.46Å; F2601-F2615 PolarHBondContact O-N 3.26Å; A2603-F2615 HydrophobicContact CB-CD2 3.66Å; A2603-F2615 HydrophobicContact CB-CE2 3.83Å; A2603-F2615 WeakPolarHBondContact O-CE2 3.12Å; S2613-F2615 WeakPolarHBondContact O-CD2 2.89Å; S2613-F2615 VanDerWaalsContact OG-CE2 3.23Å; S2613-F2615 WeakPolarHBondContact OG-CE2 3.23Å; S2613-F2615 WeakPolarHBondContact OG-CZ 3.47Å; F2615-P2639 HydrophobicContact CE1-CB 4.14Å; F2615-F2641 HydrophobicContact CE1-CZ 4.26Å; F2615-F2641 HydrophobicContact CZ-CZ 4.42Å; F2615-L2651 HydrophobicContact CB-CD1 4.3Å; F2615-L2651 HydrophobicContact CD1-CD1 4.36Å; F2615-L2651 HydrophobicContact CD2-CD1 4.41Å; F2615-L2651 HydrophobicContact CE1-CD2 4.38Å; F2615-L2651 HydrophobicContact CG-CD1 4.1Å; F2615-V2714 HydrophobicContact CB-CG1 4.02Å; F2615-V2714 HydrophobicContact CD1-CG1 3.58Å; F2615-V2714 HydrophobicContact CG-CG1 4.21Å; F2615-C2715 VanDerWaalsContact CA-O 3.31Å; F2615-C2715 WeakPolarHBondContact CA-O 3.36Å; F2615-E2716 HydrophobicContact CD1-CB 4.01Å; F2615-E2716 HydrophobicContact CD1-CG 4.17Å; F2615-E2716 HydrophobicContact CE1-CB 3.74Å; F2615-E2716 HydrophobicContact CE1-CG 3.59Å; F2615-E2716 HydrophobicContact CZ-CG 4.03Å
2616	L	88	Confident	78	Confident	9 Å²	9	60.5 Å²	60.5	5%	0.047	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	114.3	167.7	179.8	67.8	0	0	0	107.4	Y2377 W2600 V2618 V2714 C2715	Y2377-L2616 HydrophobicContact CE2-CD2 4.24Å; W2600-L2616 HydrophobicContact CD2-CB 3.73Å; W2600-L2616 HydrophobicContact CE3-CB 3.63Å; W2600-L2616 HydrophobicContact CG-CB 4.44Å; W2600-L2616 HydrophobicContact CH2-CB 3.76Å; W2600-L2616 HydrophobicContact CH2-CD2 4.33Å; W2600-L2616 HydrophobicContact CZ2-CB 3.88Å; W2600-L2616 HydrophobicContact CZ2-CD2 3.88Å; W2600-L2616 HydrophobicContact CZ2-CG 4.46Å; W2600-L2616 HydrophobicContact CZ3-CB 3.63Å; L2616-V2618 HydrophobicContact CD2-CG2 3.93Å; L2616-V2618 HydrophobicContact CG-CG2 3.95Å; L2616-V2714 CarbonylContact O-C 3.52Å; L2616-V2714 VanDerWaalsContact O-CA 3.32Å; L2616-V2714 WeakPolarHBondContact O-CA 3.46Å; L2616-C2715 HydrophobicContact CB-CB 4.43Å; L2616-C2715 PolarHBondContact N-O 3.5Å; L2616-C2715 PolarHBondContact O-N 2.87Å
2617	F	88.1	Confident	79.5	Confident	20 Å²	20	52.8 Å²	52.8	9%	0.088	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	119.1	168.4	174	-122.1	0	0	0	108.6	F2601 P2619 V2655 L2658 N2659 T2678 P2712 V2714	F2601-F2617 HydrophobicContact CE1-CB 3.8Å; F2601-F2617 HydrophobicContact CZ-CB 4.32Å; F2617-P2619 HydrophobicContact CD1-CB 4.43Å; F2617-P2619 HydrophobicContact CE1-CB 3.7Å; F2617-P2619 HydrophobicContact CE1-CG 4.36Å; F2617-P2619 HydrophobicContact CZ-CB 3.85Å; F2617-P2619 WeakPolarHBondContact O-CD 3.08Å; F2617-V2655 HydrophobicContact CD2-CG1 4.04Å; F2617-V2655 HydrophobicContact CD2-CG2 4.18Å; F2617-V2655 HydrophobicContact CE1-CG1 4.29Å; F2617-V2655 HydrophobicContact CE2-CG1 3.79Å; F2617-V2655 HydrophobicContact CG-CG1 4.41Å; F2617-V2655 HydrophobicContact CG-CG2 4.32Å; F2617-V2655 HydrophobicContact CZ-CG1 3.93Å; F2617-L2658 HydrophobicContact CB-CD1 4.36Å; F2617-L2658 HydrophobicContact CD1-CD1 4.36Å; F2617-N2659 VanDerWaalsContact CE1-OD1 3.31Å; F2617-N2659 WeakPolarHBondContact CE1-OD1 3.39Å; F2617-T2678 HydrophobicContact CZ-CG2 4.46Å; F2617-P2712 HydrophobicContact CE2-CB 4.05Å; F2617-P2712 HydrophobicContact CZ-CB 4.38Å; F2617-V2714 HydrophobicContact CB-CG2 4.48Å; F2617-V2714 HydrophobicContact CD2-CG2 3.95Å
2618	V	88.9	Confident	81.1	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	104.2	175.3	-175.7	0	0	0	0	107.3	A2351 L2616 G2620 F2630 F2713	A2351-V2618 HydrophobicContact CB-CG1 3.76Å; L2616-V2618 HydrophobicContact CD2-CG2 3.93Å; L2616-V2618 HydrophobicContact CG-CG2 3.95Å; V2618-G2620 PolarHBondContact O-N 3.12Å; V2618-F2630 HydrophobicContact CG2-CE1 3.8Å; V2618-F2630 HydrophobicContact CG2-CZ 4.42Å; V2618-F2713 HydrophobicContact CB-CD1 4.22Å; V2618-F2713 HydrophobicContact CB-CD2 4.25Å; V2618-F2713 HydrophobicContact CB-CE1 3.87Å; V2618-F2713 HydrophobicContact CB-CE2 3.92Å; V2618-F2713 HydrophobicContact CB-CG 4.4Å; V2618-F2713 HydrophobicContact CB-CZ 3.72Å; V2618-F2713 HydrophobicContact CG1-CD1 4.4Å; V2618-F2713 HydrophobicContact CG1-CE1 3.65Å; V2618-F2713 HydrophobicContact CG1-CE2 4.3Å; V2618-F2713 HydrophobicContact CG1-CZ 3.6Å; V2618-F2713 HydrophobicContact CG2-CD2 4.47Å; V2618-F2713 HydrophobicContact CG2-CE2 3.94Å; V2618-F2713 HydrophobicContact CG2-CZ 4.07Å; V2618-F2713 PolarHBondContact N-O 3.09Å; V2618-F2713 PolarHBondContact O-N 2.89Å; V2618-F2713 VanDerWaalsContact O-N 3.09Å
2619	P	81.5	Confident	83.2	Confident	7 Å²	7	44.2 Å²	44.2	5%	0.045	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-7.5	-176.9	29.9	-35.4	0	0	0	114	N2320 N2349 F2617 A2621	N2320-P2619 CarbonylContact C-O 3.49Å; N2320-P2619 WeakPolarHBondContact CA-O 3.22Å; N2349-P2619 HydrophobicContact CB-CB 3.73Å; N2349-P2619 HydrophobicContact CB-CG 3.74Å; N2349-P2619 CarbonylContact O-C 3.48Å; N2349-P2619 WeakPolarHBondContact O-CG 3.45Å; F2617-P2619 HydrophobicContact CD1-CB 4.43Å; F2617-P2619 HydrophobicContact CE1-CB 3.7Å; F2617-P2619 HydrophobicContact CE1-CG 4.36Å; F2617-P2619 HydrophobicContact CZ-CB 3.85Å; F2617-P2619 WeakPolarHBondContact O-CD 3.08Å; P2619-A2621 PolarHBondContact O-N 2.96Å
2620	G	87.9	Confident	85.1	Confident	0 Å²	0	36 Å²	36	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	123.6	173	0	0	0	0	0	111.8	N2349 V2618 F2713	N2349-G2620 PolarHBondContact O-N 2.97Å; V2618-G2620 PolarHBondContact O-N 3.12Å; G2620-F2713 WeakPolarHBondContact O-CE1 3.45Å
2621	A	90.1	Very high	86.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	135.5	-176.3	0	0	0	0	0	113	L2285 S2287 N2320 P2619 V2710 L2711	L2285-A2621 HydrophobicContact CB-CB 4.22Å; L2285-A2621 HydrophobicContact CD2-CB 3.82Å; S2287-A2621 WeakPolarHBondContact CB-O 3.42Å; S2287-A2621 PolarHBondContact OG-O 3.17Å; N2320-A2621 WeakPolarHBondContact O-CB 3.36Å; N2320-A2621 PolarHBondContact O-N 3.5Å; P2619-A2621 PolarHBondContact O-N 2.96Å; A2621-V2710 HydrophobicContact CB-CB 4.07Å; A2621-L2711 WeakPolarHBondContact CA-O 3.23Å
2622	V	92.8	Very high	88.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	164.7	179.3	-62.5	0	0	0	0	111.4	M2322 V2626 A2627 W2681 V2710 L2711 F2713	M2322-V2622 HydrophobicContact CB-CG1 3.54Å; M2322-V2622 HydrophobicContact CG-CG1 3.48Å; M2322-V2622 VanDerWaalsContact CG-CG1 3.48Å; V2622-V2626 HydrophobicContact CB-CB 4.15Å; V2622-V2626 HydrophobicContact CB-CG1 4.26Å; V2622-V2626 HydrophobicContact CG1-CG1 4.18Å; V2622-V2626 HydrophobicContact CG2-CB 4.45Å; V2622-A2627 HydrophobicContact CG2-CB 3.69Å; V2622-W2681 PolarHBondContact O-NE1 2.95Å; V2622-V2710 WeakPolarHBondContact O-CA 3.41Å; V2622-L2711 PolarHBondContact N-O 3.35Å; V2622-L2711 PolarHBondContact O-N 3.06Å; V2622-F2713 HydrophobicContact CG1-CE1 4.31Å; V2622-F2713 HydrophobicContact CG2-CD1 3.56Å; V2622-F2713 HydrophobicContact CG2-CE1 3.49Å; V2622-F2713 VanDerWaalsContact CG2-CE1 3.49Å; V2622-F2713 HydrophobicContact CG2-CG 4.49Å; V2622-F2713 HydrophobicContact CG2-CZ 4.37Å
2623	A	92.2	Very high	89.1	Confident	3 Å²	3	28 Å²	28	3%	0.025	12%	0.122	C	C	.	.			trans	-68.5	151.4	165.2	0	0	0	0	0	111.4	R2625 V2626 A2627 D2709	A2623-R2625 VanDerWaalsContact C-N 3.32Å; A2623-R2625 PolarHBondContact O-N 2.76Å; A2623-V2626 PolarHBondContact O-N 3.02Å; A2623-A2627 PolarHBondContact O-N 3Å; A2623-D2709 WeakPolarHBondContact CA-O 3.31Å
2624	Y	91.7	Very high	89.3	Confident	45 Å²	45	27.8 Å²	27.8	18%	0.176	12%	0.12	C	C	.	.	H	α-helix	trans	-54.5	-42.2	-171.3	-179.5	-89.3	0	0	0	113.8	V2626 A2627 E2628 L2638 W2681 S2683 C2692 C2707	Y2624-V2626 VanDerWaalsContact C-N 3.29Å; Y2624-V2626 PolarHBondContact O-N 3.27Å; Y2624-A2627 WeakPolarHBondContact O-CB 3.48Å; Y2624-A2627 PolarHBondContact O-N 2.93Å; Y2624-E2628 PolarHBondContact O-N 3.07Å; Y2624-L2638 HydrophobicContact CD2-CD2 4.04Å; Y2624-L2638 HydrophobicContact CE1-CD2 4.34Å; Y2624-L2638 HydrophobicContact CE2-CD2 3.3Å; Y2624-L2638 VanDerWaalsContact CZ-CD2 3.48Å; Y2624-W2681 HydrophobicContact CD2-CB 4.15Å; Y2624-W2681 AromaticContact CD2-CD2 3.83Å; Y2624-W2681 HydrophobicContact CD2-CD2 3.83Å; Y2624-W2681 AromaticContact CD2-CE3 3.68Å; Y2624-W2681 HydrophobicContact CD2-CE3 3.68Å; Y2624-W2681 HydrophobicContact CD2-CG 4.06Å; Y2624-W2681 HydrophobicContact CD2-CZ3 4.37Å; Y2624-S2683 WeakPolarHBondContact OH-CB 3.49Å; Y2624-S2683 PolarHBondContact OH-OG 3.4Å; Y2624-C2692 VanDerWaalsContact CB-SG 3.56Å; Y2624-C2692 VanDerWaalsContact CD1-SG 3.51Å; Y2624-C2692 HydrophobicContact CD2-CB 3.69Å; Y2624-C2692 HydrophobicContact CE2-CB 4.19Å; Y2624-C2692 HydrophobicContact CG-CB 3.88Å; Y2624-C2707 PolarHBondContact N-O 3.44Å
2625	R	91	Very high	89.1	Confident	193 Å²	193	30 Å²	30	73%	0.728	14%	0.143	S	C	*	.	H	α-helix	trans	-59.6	-37.4	178.5	-176.2	179.8	178.6	176.5	3.8	112.7	A2623 E2629	A2623-R2625 VanDerWaalsContact C-N 3.32Å; A2623-R2625 PolarHBondContact O-N 2.76Å; R2625-E2629 PolarHBondContact O-N 2.91Å; R2625-E2629 VanDerWaalsContact O-N 3.11Å
2626	V	91.7	Very high	89	Confident	11 Å²	11	30.5 Å²	30.5	7%	0.067	15%	0.149	C	C	.	.	H	α-helix	trans	-76.5	-35.4	-179.3	-177.6	0	0	0	0	110.8	F2324 V2622 A2623 Y2624 E2628 E2629 F2630	F2324-V2626 HydrophobicContact CD1-CG1 3.92Å; F2324-V2626 HydrophobicContact CE1-CG1 4.32Å; V2622-V2626 HydrophobicContact CB-CB 4.15Å; V2622-V2626 HydrophobicContact CB-CG1 4.26Å; V2622-V2626 HydrophobicContact CG1-CG1 4.18Å; V2622-V2626 HydrophobicContact CG2-CB 4.45Å; A2623-V2626 PolarHBondContact O-N 3.02Å; Y2624-V2626 VanDerWaalsContact C-N 3.29Å; Y2624-V2626 PolarHBondContact O-N 3.27Å; V2626-E2628 VanDerWaalsContact C-N 3.33Å; V2626-E2628 PolarHBondContact O-N 3.15Å; V2626-E2629 PolarHBondContact O-N 3.38Å; V2626-F2630 WeakPolarHBondContact O-CB 3.45Å; V2626-F2630 PolarHBondContact O-N 2.81Å
2627	A	91.9	Very high	89.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60	-43.6	170.9	0	0	0	0	0	111.6	V2622 A2623 Y2624 F2630 C2631 L2638 F2713	V2622-A2627 HydrophobicContact CG2-CB 3.69Å; A2623-A2627 PolarHBondContact O-N 3Å; Y2624-A2627 WeakPolarHBondContact O-CB 3.48Å; Y2624-A2627 PolarHBondContact O-N 2.93Å; A2627-F2630 PolarHBondContact O-N 3.35Å; A2627-C2631 PolarHBondContact O-N 2.93Å; A2627-C2631 PolarHBondContact O-SG 3.25Å; A2627-C2631 VanDerWaalsContact O-SG 3.32Å; A2627-L2638 HydrophobicContact CB-CD1 4.33Å; A2627-F2713 HydrophobicContact CB-CB 3.86Å; A2627-F2713 HydrophobicContact CB-CD1 3.9Å; A2627-F2713 HydrophobicContact CB-CD2 3.68Å; A2627-F2713 HydrophobicContact CB-CE1 4.33Å; A2627-F2713 HydrophobicContact CB-CE2 4.11Å; A2627-F2713 HydrophobicContact CB-CG 3.55Å; A2627-F2713 HydrophobicContact CB-CZ 4.42Å
2628	E	91.5	Very high	89.1	Confident	72 Å²	72	34.8 Å²	34.8	34%	0.336	17%	0.166	S	C	.	.	H	α-helix	trans	-63.6	-44.8	177.2	-159.5	-154.9	-176.3	0	0	111.9	Y2624 V2626 C2631 K2632	Y2624-E2628 PolarHBondContact O-N 3.07Å; V2626-E2628 VanDerWaalsContact C-N 3.33Å; V2626-E2628 PolarHBondContact O-N 3.15Å; E2628-C2631 PolarHBondContact O-N 2.9Å; E2628-K2632 VanDerWaalsContact CD-CE 3.46Å; E2628-K2632 HydrophobicContact CG-CD 4.39Å; E2628-K2632 WeakPolarHBondContact O-CB 3.2Å; E2628-K2632 VanDerWaalsContact O-CG 3.29Å; E2628-K2632 WeakPolarHBondContact O-CG 3.45Å; E2628-K2632 PolarHBondContact O-N 3.24Å; E2628-K2632 WeakPolarHBondContact OE1-CE 3.47Å; E2628-K2632 IonicContact OE1-NZ 3.39Å; E2628-K2632 PolarHBondContact OE1-NZ 3.1Å; E2628-K2632 IonicContact OE2-NZ 3.86Å; E2628-K2632 PolarHBondContact OE2-NZ 3Å
2629	E	91.1	Very high	89.1	Confident	49 Å²	49	34.7 Å²	34.7	23%	0.229	17%	0.165	C	C	.	.	H	α-helix	trans	-57.5	-50.5	175	-166.1	-168.7	155.3	0	0	111.2	Y2290 R2325 R2625 V2626 C2631 K2632 E2633	Y2290-E2629 PolarHBondContact OH-OE1 3.24Å; Y2290-E2629 PolarHBondContact OH-OE2 3.16Å; R2325-E2629 IonicContact CZ-OE1 2.66Å; R2325-E2629 IonicContact NE-OE1 3.22Å; R2325-E2629 PolarHBondContact NE-OE1 3.14Å; R2325-E2629 IonicContact NH2-OE1 3.9Å; R2325-E2629 PolarHBondContact NH2-OE1 3.36Å; R2625-E2629 PolarHBondContact O-N 2.91Å; R2625-E2629 VanDerWaalsContact O-N 3.11Å; V2626-E2629 PolarHBondContact O-N 3.38Å; E2629-C2631 PolarHBondContact O-N 3.05Å; E2629-K2632 PolarHBondContact O-N 2.85Å; E2629-E2633 WeakPolarHBondContact O-CG 3.09Å; E2629-E2633 PolarHBondContact O-N 3Å
2630	F	91.1	Very high	89.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-47	179.2	-179.2	-83.7	0	0	0	112.1	M2322 F2324 Y2377 V2618 V2626 A2627 K2632 E2633 Q2634 F2713	M2322-F2630 HydrophobicContact CE-CD2 3.42Å; M2322-F2630 VanDerWaalsContact CE-CD2 3.42Å; M2322-F2630 HydrophobicContact CE-CE2 3.56Å; M2322-F2630 HydrophobicContact CE-CG 4.28Å; M2322-F2630 HydrophobicContact CE-CZ 4.5Å; F2324-F2630 HydrophobicContact CD2-CD2 4.12Å; F2324-F2630 AromaticContact CE2-CD2 3.92Å; F2324-F2630 HydrophobicContact CE2-CD2 3.92Å; Y2377-F2630 HydrophobicContact CD1-CZ 4.17Å; Y2377-F2630 HydrophobicContact CE1-CE2 4.15Å; Y2377-F2630 AromaticContact CE1-CZ 3.6Å; Y2377-F2630 HydrophobicContact CE1-CZ 3.6Å; V2618-F2630 HydrophobicContact CG2-CE1 3.8Å; V2618-F2630 HydrophobicContact CG2-CZ 4.42Å; V2626-F2630 WeakPolarHBondContact O-CB 3.45Å; V2626-F2630 PolarHBondContact O-N 2.81Å; A2627-F2630 PolarHBondContact O-N 3.35Å; F2630-K2632 PolarHBondContact O-N 3.43Å; F2630-E2633 PolarHBondContact O-N 2.85Å; F2630-Q2634 HydrophobicContact CD1-CG 3.96Å; F2630-Q2634 HydrophobicContact CE1-CG 3.55Å; F2630-Q2634 HydrophobicContact CZ-CG 3.92Å; F2630-Q2634 WeakPolarHBondContact O-CG 3.06Å; F2630-Q2634 PolarHBondContact O-N 2.69Å; F2630-F2713 HydrophobicContact CB-CE2 4.22Å; F2630-F2713 HydrophobicContact CB-CZ 4.12Å; F2630-F2713 AromaticContact CD1-CE2 3.56Å; F2630-F2713 HydrophobicContact CD1-CE2 3.56Å; F2630-F2713 AromaticContact CD1-CZ 3.7Å; F2630-F2713 HydrophobicContact CD1-CZ 3.7Å; F2630-F2713 HydrophobicContact CE1-CE2 4.22Å; F2630-F2713 HydrophobicContact CE1-CZ 4.26Å; F2630-F2713 HydrophobicContact CG-CE2 4.12Å; F2630-F2713 AromaticContact CG-CZ 3.93Å; F2630-F2713 HydrophobicContact CG-CZ 3.93Å
2631	C	91.8	Very high	89.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-41.9	-179.7	-67.3	0	0	0	0	112.2	A2627 E2628 E2629 E2633 Q2634 G2636 C2715	A2627-C2631 PolarHBondContact O-N 2.93Å; A2627-C2631 PolarHBondContact O-SG 3.25Å; A2627-C2631 VanDerWaalsContact O-SG 3.32Å; E2628-C2631 PolarHBondContact O-N 2.9Å; E2629-C2631 PolarHBondContact O-N 3.05Å; C2631-E2633 VanDerWaalsContact C-N 3.31Å; C2631-E2633 PolarHBondContact O-N 3.38Å; C2631-Q2634 PolarHBondContact O-N 3.42Å; C2631-G2636 CarbonylContact C-O 3.58Å; C2631-G2636 CarbonylContact O-C 3.56Å; C2631-G2636 VanDerWaalsContact O-C 3.25Å; C2631-G2636 WeakPolarHBondContact O-CA 3.08Å; C2631-G2636 PolarHBondContact O-N 2.79Å; C2631-G2636 VanDerWaalsContact O-O 3.08Å; C2631-C2715 WeakPolarHBondContact CA-SG 3.44Å; C2631-C2715 HydrophobicContact CB-CB 3.73Å; C2631-C2715 WeakPolarHBondContact CB-SG 3.1Å; C2631-C2715 WeakPolarHBondContact SG-CA 3.29Å; C2631-C2715 WeakPolarHBondContact SG-CB 3.09Å; C2631-C2715 CovalentContact SG-SG 2.04Å; C2631-C2715 PolarHBondContact SG-SG 3.36Å
2632	K	90.2	Very high	88.6	Confident	118 Å²	118	48.2 Å²	48.2	51%	0.513	22%	0.218	S	C	.	.	H	α-helix	trans	-56.3	-47.4	173.2	-76.7	169.2	179.7	166.7	0	110.8	E2628 E2629 F2630 Q2634 G2635 G2636	E2628-K2632 VanDerWaalsContact CD-CE 3.46Å; E2628-K2632 HydrophobicContact CG-CD 4.39Å; E2628-K2632 WeakPolarHBondContact O-CB 3.2Å; E2628-K2632 VanDerWaalsContact O-CG 3.29Å; E2628-K2632 WeakPolarHBondContact O-CG 3.45Å; E2628-K2632 PolarHBondContact O-N 3.24Å; E2628-K2632 WeakPolarHBondContact OE1-CE 3.47Å; E2628-K2632 IonicContact OE1-NZ 3.39Å; E2628-K2632 PolarHBondContact OE1-NZ 3.1Å; E2628-K2632 IonicContact OE2-NZ 3.86Å; E2628-K2632 PolarHBondContact OE2-NZ 3Å; E2629-K2632 PolarHBondContact O-N 2.85Å; F2630-K2632 PolarHBondContact O-N 3.43Å; K2632-Q2634 PolarHBondContact O-N 2.89Å; K2632-G2635 PolarHBondContact O-N 3.11Å; K2632-G2635 VanDerWaalsContact O-N 3.1Å; K2632-G2636 WeakPolarHBondContact CA-O 3.01Å
2633	E	85.9	Confident	87.5	Confident	50 Å²	50	52.8 Å²	52.8	23%	0.234	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-45.5	178.5	-76.2	-167.6	134.9	0	0	112.3	F2324 R2325 N2354 R2380 E2629 F2630 C2631 G2635	F2324-E2633 VanDerWaalsContact CZ-OE2 3.3Å; F2324-E2633 WeakPolarHBondContact CZ-OE2 3.43Å; R2325-E2633 IonicContact CZ-OE1 2.94Å; R2325-E2633 IonicContact NH1-OE1 3.56Å; R2325-E2633 PolarHBondContact NH1-OE1 2.96Å; R2325-E2633 IonicContact NH2-OE1 3.98Å; R2325-E2633 PolarHBondContact NH2-OE1 3.16Å; R2325-E2633 IonicContact NH2-OE2 3.97Å; N2354-E2633 VanDerWaalsContact ND2-CD 3.27Å; N2354-E2633 PolarHBondContact ND2-OE1 2.72Å; N2354-E2633 PolarHBondContact ND2-OE2 3.37Å; R2380-E2633 VanDerWaalsContact NH1-C 3.33Å; R2380-E2633 PolarHBondContact NH1-O 3.21Å; R2380-E2633 PolarHBondContact NH2-O 2.86Å; E2629-E2633 WeakPolarHBondContact O-CG 3.09Å; E2629-E2633 PolarHBondContact O-N 3Å; F2630-E2633 PolarHBondContact O-N 2.85Å; C2631-E2633 VanDerWaalsContact C-N 3.31Å; C2631-E2633 PolarHBondContact O-N 3.38Å; E2633-G2635 PolarHBondContact O-N 3.08Å
2634	Q	83.3	Confident	86.6	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.009	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	0.9	177.2	-60.6	-50.8	-25.5	0	0	114.5	Y2377 W2600 F2630 C2631 K2632 G2636 K2717	Y2377-Q2634 VanDerWaalsContact OH-CD 3.29Å; Y2377-Q2634 PolarHBondContact OH-NE2 3.27Å; Y2377-Q2634 PolarHBondContact OH-OE1 2.78Å; W2600-Q2634 HydrophobicContact CZ2-CB 4.45Å; F2630-Q2634 HydrophobicContact CD1-CG 3.96Å; F2630-Q2634 HydrophobicContact CE1-CG 3.55Å; F2630-Q2634 HydrophobicContact CZ-CG 3.92Å; F2630-Q2634 WeakPolarHBondContact O-CG 3.06Å; F2630-Q2634 PolarHBondContact O-N 2.69Å; C2631-Q2634 PolarHBondContact O-N 3.42Å; K2632-Q2634 PolarHBondContact O-N 2.89Å; Q2634-G2636 VanDerWaalsContact C-N 3.33Å; Q2634-K2717 PolarHBondContact O-NZ 2.98Å
2635	G	82.1	Confident	85.9	Confident	48 Å²	48	60.9 Å²	60.9	50%	0.495	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	33.4	-177.8	0	0	0	0	0	111.2	K2632 E2633 K2717	K2632-G2635 PolarHBondContact O-N 3.11Å; K2632-G2635 VanDerWaalsContact O-N 3.1Å; E2633-G2635 PolarHBondContact O-N 3.08Å; G2635-K2717 WeakPolarHBondContact O-CD 3.36Å; G2635-K2717 WeakPolarHBondContact O-CE 3.34Å
2636	G	86.2	Confident	85.3	Confident	12 Å²	12	58.9 Å²	58.9	12%	0.124	28%	0.279	C	S	.	.			trans	-130.3	-160.2	171.9	0	0	0	0	0	110.1	C2631 K2632 Q2634 E2716	C2631-G2636 CarbonylContact C-O 3.58Å; C2631-G2636 CarbonylContact O-C 3.56Å; C2631-G2636 VanDerWaalsContact O-C 3.25Å; C2631-G2636 WeakPolarHBondContact O-CA 3.08Å; C2631-G2636 PolarHBondContact O-N 2.79Å; C2631-G2636 VanDerWaalsContact O-O 3.08Å; K2632-G2636 WeakPolarHBondContact CA-O 3.01Å; Q2634-G2636 VanDerWaalsContact C-N 3.33Å; G2636-E2716 CarbonylContact C-O 3.45Å; G2636-E2716 WeakPolarHBondContact CA-O 3.38Å
2637	Y	89.9	Confident	84.8	Confident	106 Å²	106	60.2 Å²	60.2	42%	0.416	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-145	160.8	176.6	46	-88.5	0	0	0	110	E2716	Y2637-E2716 HydrophobicContact CD2-CB 4.02Å; Y2637-E2716 HydrophobicContact CE2-CB 3.65Å; Y2637-E2716 HydrophobicContact CE2-CG 3.68Å; Y2637-E2716 WeakPolarHBondContact CE2-OE1 3.33Å; Y2637-E2716 PolarHBondContact N-O 2.99Å; Y2637-E2716 PolarHBondContact O-N 3.39Å; Y2637-E2716 VanDerWaalsContact OH-CD 3.26Å; Y2637-E2716 PolarHBondContact OH-OE1 3.35Å
2638	L	89.6	Confident	84.4	Confident	13 Å²	13	60.8 Å²	60.8	7%	0.068	29%	0.286	C	S	.	.			trans	-67	127.1	167.6	-165.5	76.2	0	0	0	107.5	Y2624 A2627 F2640 W2681 F2713 V2714	Y2624-L2638 HydrophobicContact CD2-CD2 4.04Å; Y2624-L2638 HydrophobicContact CE1-CD2 4.34Å; Y2624-L2638 HydrophobicContact CE2-CD2 3.3Å; Y2624-L2638 VanDerWaalsContact CZ-CD2 3.48Å; A2627-L2638 HydrophobicContact CB-CD1 4.33Å; L2638-F2640 PolarHBondContact O-N 3.5Å; L2638-W2681 HydrophobicContact CD1-CB 4.39Å; L2638-F2713 HydrophobicContact CD1-CB 4.45Å; L2638-V2714 WeakPolarHBondContact CD1-O 3.48Å
2639	P	88	Confident	84	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.294	C	S	.	.			trans	-61	133.8	-171.1	23.7	-34.7	0	0	0	111.4	F2615 F2641 I2682 S2683 V2714 E2716	F2615-P2639 HydrophobicContact CE1-CB 4.14Å; P2639-F2641 HydrophobicContact CB-CD2 4.24Å; P2639-F2641 HydrophobicContact CB-CE1 4.49Å; P2639-F2641 HydrophobicContact CB-CE2 3.53Å; P2639-F2641 HydrophobicContact CB-CZ 3.67Å; P2639-F2641 HydrophobicContact CG-CE2 3.85Å; P2639-F2641 HydrophobicContact CG-CZ 4.34Å; P2639-I2682 HydrophobicContact CG-CG2 4.12Å; P2639-S2683 PolarHBondContact O-N 2.77Å; P2639-V2714 WeakPolarHBondContact CD-O 3.29Å; P2639-V2714 HydrophobicContact CG-CB 4.33Å; P2639-V2714 HydrophobicContact CG-CG1 4.28Å; P2639-E2716 HydrophobicContact CB-CB 4.04Å; P2639-E2716 WeakPolarHBondContact CB-OE2 3.33Å
2640	F	85.4	Confident	83.7	Confident	107 Å²	107	60.3 Å²	60.3	47%	0.469	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	109.6	-178.2	-167.2	-90.7	0	0	0	109.9	L2638 R2647 S2683 V2685	L2638-F2640 PolarHBondContact O-N 3.5Å; F2640-R2647 PolarHBondContact O-NH2 3.04Å; F2640-S2683 WeakPolarHBondContact CA-O 3.44Å; F2640-S2683 VanDerWaalsContact CD2-OG 3.24Å; F2640-S2683 WeakPolarHBondContact CD2-OG 3.15Å; F2640-V2685 HydrophobicContact CE1-CG2 3.4Å; F2640-V2685 HydrophobicContact CZ-CB 4.44Å; F2640-V2685 HydrophobicContact CZ-CG2 3.51Å
2641	F	83.8	Confident	83.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	156.6	-175.5	-64.9	-61	0	0	0	112.8	F2615 P2639 D2645 R2647 L2648 L2651 I2682 S2683 S2684 I2702	F2615-F2641 HydrophobicContact CE1-CZ 4.26Å; F2615-F2641 HydrophobicContact CZ-CZ 4.42Å; P2639-F2641 HydrophobicContact CB-CD2 4.24Å; P2639-F2641 HydrophobicContact CB-CE1 4.49Å; P2639-F2641 HydrophobicContact CB-CE2 3.53Å; P2639-F2641 HydrophobicContact CB-CZ 3.67Å; P2639-F2641 HydrophobicContact CG-CE2 3.85Å; P2639-F2641 HydrophobicContact CG-CZ 4.34Å; F2641-D2645 HydrophobicContact CD1-CB 4.21Å; F2641-D2645 WeakPolarHBondContact CD1-OD2 3.25Å; F2641-R2647 HydrophobicContact CE1-CB 3.93Å; F2641-L2648 HydrophobicContact CB-CD2 3.85Å; F2641-L2648 HydrophobicContact CB-CG 4.48Å; F2641-L2648 HydrophobicContact CD1-CD2 4Å; F2641-L2648 HydrophobicContact CD1-CG 4.44Å; F2641-L2648 HydrophobicContact CD2-CD2 3.53Å; F2641-L2648 HydrophobicContact CE1-CD2 4.45Å; F2641-L2648 HydrophobicContact CE2-CD2 4.01Å; F2641-L2648 HydrophobicContact CG-CD2 3.52Å; F2641-L2648 HydrophobicContact CG-CG 4.32Å; F2641-L2648 HydrophobicContact CZ-CD2 4.46Å; F2641-L2651 HydrophobicContact CE2-CD2 3.86Å; F2641-L2651 HydrophobicContact CZ-CD2 3.63Å; F2641-I2682 HydrophobicContact CD2-CB 4.15Å; F2641-I2682 HydrophobicContact CD2-CD1 3.94Å; F2641-I2682 HydrophobicContact CD2-CG2 4.18Å; F2641-I2682 HydrophobicContact CE2-CB 4.44Å; F2641-I2682 HydrophobicContact CE2-CG2 4.01Å; F2641-S2683 PolarHBondContact N-O 2.87Å; F2641-S2684 WeakPolarHBondContact O-CA 3.23Å; F2641-S2684 PolarHBondContact O-OG 3.39Å; F2641-I2702 HydrophobicContact CB-CD1 4.44Å
2642	R	79.4	Confident	83.2	Confident	184 Å²	184	60.3 Å²	60.3	69%	0.694	30%	0.299	S	S	*	.			trans	-105.1	156.8	164.3	-66.9	179.2	176.4	177.3	-1.5	108.5	Q2644 D2645 V2685	R2642-Q2644 PolarHBondContact O-N 2.8Å; R2642-D2645 WeakPolarHBondContact O-CB 2.94Å; R2642-D2645 PolarHBondContact O-N 2.65Å; R2642-V2685 HydrophobicContact CG-CG2 4.25Å
2643	D	70.6	Confident	83	Confident	95 Å²	95	62.4 Å²	62.4	51%	0.508	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-23.2	-173.9	-142.5	47.7	0	0	0	114.9	T2686	D2643-T2686 HydrophobicContact CB-CG2 3.85Å
2644	Q	72.9	Confident	82.9	Confident	179 Å²	179	62.9 Å²	62.9	84%	0.836	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	21.6	-179.8	-64.9	-76.6	-47.3	0	0	112.5	R2642 K2646	R2642-Q2644 PolarHBondContact O-N 2.8Å; Q2644-K2646 PolarHBondContact O-N 2.88Å
2645	D	77.1	Confident	82.9	Confident	39 Å²	39	62.8 Å²	62.8	21%	0.209	31%	0.309	C	S	.	.			trans	-70.4	118.9	179.7	-168.6	-27.2	0	0	0	111.1	F2641 R2642 R2647 L2648	F2641-D2645 HydrophobicContact CD1-CB 4.21Å; F2641-D2645 WeakPolarHBondContact CD1-OD2 3.25Å; R2642-D2645 WeakPolarHBondContact O-CB 2.94Å; R2642-D2645 PolarHBondContact O-N 2.65Å; D2645-R2647 PolarHBondContact O-N 3.15Å; D2645-R2647 VanDerWaalsContact OD1-CB 3.31Å; D2645-R2647 WeakPolarHBondContact OD1-CB 3.3Å; D2645-R2647 VanDerWaalsContact OD1-CG 3.32Å; D2645-R2647 WeakPolarHBondContact OD1-CG 3.49Å; D2645-R2647 PolarHBondContact OD1-N 3.04Å; D2645-R2647 IonicContact OD1-NE 4Å; D2645-R2647 PolarHBondContact OD1-NE 3.24Å; D2645-R2647 IonicContact OD2-CZ 3.95Å; D2645-R2647 IonicContact OD2-NE 4Å; D2645-R2647 PolarHBondContact OD2-NE 3.41Å; D2645-R2647 IonicContact OD2-NH2 3.15Å; D2645-R2647 PolarHBondContact OD2-NH2 2.98Å; D2645-L2648 HydrophobicContact CB-CD1 4.42Å; D2645-L2648 HydrophobicContact CB-CG 4.34Å; D2645-L2648 WeakPolarHBondContact O-CB 3.41Å; D2645-L2648 WeakPolarHBondContact O-CG 3.31Å; D2645-L2648 PolarHBondContact O-N 3.4Å; D2645-L2648 VanDerWaalsContact O-N 3.09Å
2646	K	78.8	Confident	83	Confident	151 Å²	151	61.5 Å²	61.5	66%	0.657	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-17.3	178.9	-66	-175.6	177.7	-177.3	0	113.6	Q2644 P2650	Q2644-K2646 PolarHBondContact O-N 2.88Å; K2646-P2650 WeakPolarHBondContact O-CD 3.32Å
2647	R	79.6	Confident	82.8	Confident	40 Å²	40	66.4 Å²	66.4	15%	0.151	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-21.1	176.9	-63.7	-178.1	-64.1	154.8	4.6	113.9	F2640 F2641 D2645 P2650 L2651 E2716	F2640-R2647 PolarHBondContact O-NH2 3.04Å; F2641-R2647 HydrophobicContact CE1-CB 3.93Å; D2645-R2647 PolarHBondContact O-N 3.15Å; D2645-R2647 VanDerWaalsContact OD1-CB 3.31Å; D2645-R2647 WeakPolarHBondContact OD1-CB 3.3Å; D2645-R2647 VanDerWaalsContact OD1-CG 3.32Å; D2645-R2647 WeakPolarHBondContact OD1-CG 3.49Å; D2645-R2647 PolarHBondContact OD1-N 3.04Å; D2645-R2647 IonicContact OD1-NE 4Å; D2645-R2647 PolarHBondContact OD1-NE 3.24Å; D2645-R2647 IonicContact OD2-CZ 3.95Å; D2645-R2647 IonicContact OD2-NE 4Å; D2645-R2647 PolarHBondContact OD2-NE 3.41Å; D2645-R2647 IonicContact OD2-NH2 3.15Å; D2645-R2647 PolarHBondContact OD2-NH2 2.98Å; R2647-P2650 WeakPolarHBondContact O-CD 3.33Å; R2647-P2650 WeakPolarHBondContact O-CG 3.09Å; R2647-L2651 VanDerWaalsContact O-CB 3.29Å; R2647-L2651 WeakPolarHBondContact O-CB 3.31Å; R2647-L2651 PolarHBondContact O-N 3.07Å; R2647-L2651 VanDerWaalsContact O-N 3.17Å; R2647-E2716 VanDerWaalsContact NH1-CD 3.33Å; R2647-E2716 IonicContact NH1-OE1 3.39Å; R2647-E2716 PolarHBondContact NH1-OE1 2.88Å; R2647-E2716 IonicContact NH1-OE2 2.69Å; R2647-E2716 PolarHBondContact NH1-OE2 3.09Å
2648	L	83.3	Confident	82.2	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.063	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-51.2	-175.3	-68.6	170.4	0	0	0	112.9	F2641 D2645 L2651 A2652 L2695 I2702	F2641-L2648 HydrophobicContact CB-CD2 3.85Å; F2641-L2648 HydrophobicContact CB-CG 4.48Å; F2641-L2648 HydrophobicContact CD1-CD2 4Å; F2641-L2648 HydrophobicContact CD1-CG 4.44Å; F2641-L2648 HydrophobicContact CD2-CD2 3.53Å; F2641-L2648 HydrophobicContact CE1-CD2 4.45Å; F2641-L2648 HydrophobicContact CE2-CD2 4.01Å; F2641-L2648 HydrophobicContact CG-CD2 3.52Å; F2641-L2648 HydrophobicContact CG-CG 4.32Å; F2641-L2648 HydrophobicContact CZ-CD2 4.46Å; D2645-L2648 HydrophobicContact CB-CD1 4.42Å; D2645-L2648 HydrophobicContact CB-CG 4.34Å; D2645-L2648 WeakPolarHBondContact O-CB 3.41Å; D2645-L2648 WeakPolarHBondContact O-CG 3.31Å; D2645-L2648 PolarHBondContact O-N 3.4Å; D2645-L2648 VanDerWaalsContact O-N 3.09Å; L2648-L2651 PolarHBondContact O-N 3.45Å; L2648-A2652 WeakPolarHBondContact O-CB 3.23Å; L2648-A2652 PolarHBondContact O-N 3.24Å; L2648-L2695 HydrophobicContact CD2-CD1 3.97Å; L2648-L2695 HydrophobicContact CD2-CD2 3.73Å; L2648-I2702 HydrophobicContact CD1-CD1 4.21Å; L2648-I2702 HydrophobicContact CD1-CG1 4.35Å
2649	A	84.2	Confident	81.5	Confident	60 Å²	60	63.6 Å²	63.6	50%	0.496	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-49.4	-179.3	0	0	0	0	0	114.6	K2653	A2649-K2653 WeakPolarHBondContact O-CB 3.49Å; A2649-K2653 PolarHBondContact O-N 3.38Å
2650	P	84.2	Confident	80.7	Confident	50 Å²	50	71.7 Å²	71.7	33%	0.325	33%	0.334	S	S	.	.	H	α-helix	trans	-66.5	-35.7	176.8	24.3	-32.4	0	0	0	112.6	K2646 R2647 K2654	K2646-P2650 WeakPolarHBondContact O-CD 3.32Å; R2647-P2650 WeakPolarHBondContact O-CD 3.33Å; R2647-P2650 WeakPolarHBondContact O-CG 3.09Å; P2650-K2654 WeakPolarHBondContact O-CB 3.43Å; P2650-K2654 PolarHBondContact O-N 3.19Å
2651	L	86.1	Confident	79.9	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-52.1	175.1	177.8	61.1	0	0	0	111.5	F2601 F2615 F2641 R2647 L2648 K2653 K2654 V2655 F2680 L2695 V2714	F2601-L2651 HydrophobicContact CE2-CD1 3.87Å; F2601-L2651 HydrophobicContact CZ-CD1 3.94Å; F2615-L2651 HydrophobicContact CB-CD1 4.3Å; F2615-L2651 HydrophobicContact CD1-CD1 4.36Å; F2615-L2651 HydrophobicContact CD2-CD1 4.41Å; F2615-L2651 HydrophobicContact CE1-CD2 4.38Å; F2615-L2651 HydrophobicContact CG-CD1 4.1Å; F2641-L2651 HydrophobicContact CE2-CD2 3.86Å; F2641-L2651 HydrophobicContact CZ-CD2 3.63Å; R2647-L2651 VanDerWaalsContact O-CB 3.29Å; R2647-L2651 WeakPolarHBondContact O-CB 3.31Å; R2647-L2651 PolarHBondContact O-N 3.07Å; R2647-L2651 VanDerWaalsContact O-N 3.17Å; L2648-L2651 PolarHBondContact O-N 3.45Å; L2651-K2653 VanDerWaalsContact C-N 3.32Å; L2651-K2653 PolarHBondContact O-N 2.98Å; L2651-K2654 PolarHBondContact O-N 3.47Å; L2651-K2654 VanDerWaalsContact O-N 3.12Å; L2651-V2655 HydrophobicContact CD1-CG2 4.24Å; L2651-V2655 WeakPolarHBondContact O-CG2 3.49Å; L2651-V2655 PolarHBondContact O-N 2.69Å; L2651-F2680 HydrophobicContact CD2-CE2 4.34Å; L2651-F2680 HydrophobicContact CG-CZ 4.46Å; L2651-L2695 HydrophobicContact CD2-CD2 4.35Å; L2651-V2714 HydrophobicContact CD1-CG1 4.36Å
2652	A	87	Confident	78.8	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-56.7	-45.2	178.3	0	0	0	0	0	111.7	L2648 K2654 V2655 D2656 A2700	L2648-A2652 WeakPolarHBondContact O-CB 3.23Å; L2648-A2652 PolarHBondContact O-N 3.24Å; A2652-K2654 PolarHBondContact O-N 3.36Å; A2652-V2655 PolarHBondContact O-N 2.74Å; A2652-D2656 WeakPolarHBondContact O-CB 3.36Å; A2652-D2656 PolarHBondContact O-N 3.28Å; A2652-A2700 HydrophobicContact CB-CB 3.81Å
2653	K	85.8	Confident	77.7	Confident	162 Å²	162	66 Å²	66	70%	0.704	32%	0.322	S	S	*	.	H	α-helix	trans	-62.1	-39.7	175.8	-175.8	179.8	178	-176.7	0	112.9	A2649 L2651 M2657	A2649-K2653 WeakPolarHBondContact O-CB 3.49Å; A2649-K2653 PolarHBondContact O-N 3.38Å; L2651-K2653 VanDerWaalsContact C-N 3.32Å; L2651-K2653 PolarHBondContact O-N 2.98Å; K2653-M2657 WeakPolarHBondContact O-CB 3.43Å; K2653-M2657 PolarHBondContact O-N 3.11Å
2654	K	83.2	Confident	77	Confident	59 Å²	59	64.8 Å²	64.8	26%	0.257	32%	0.315	S	S	.	.	H	α-helix	trans	-68.6	-41.5	177.7	-169.6	84.4	170.3	-149.3	0	111.2	D2593 F2601 P2650 L2651 A2652 M2657 L2658	D2593-K2654 IonicContact OD2-NZ 3.88Å; D2593-K2654 PolarHBondContact OD2-NZ 3.2Å; F2601-K2654 HydrophobicContact CD2-CD 4.37Å; F2601-K2654 HydrophobicContact CD2-CG 3.68Å; F2601-K2654 HydrophobicContact CE2-CB 4.18Å; F2601-K2654 HydrophobicContact CE2-CG 3.68Å; F2601-K2654 HydrophobicContact CG-CG 4.22Å; F2601-K2654 HydrophobicContact CZ-CG 4.22Å; P2650-K2654 WeakPolarHBondContact O-CB 3.43Å; P2650-K2654 PolarHBondContact O-N 3.19Å; L2651-K2654 PolarHBondContact O-N 3.47Å; L2651-K2654 VanDerWaalsContact O-N 3.12Å; A2652-K2654 PolarHBondContact O-N 3.36Å; K2654-M2657 PolarHBondContact O-N 2.73Å; K2654-L2658 WeakPolarHBondContact O-CB 3.24Å; K2654-L2658 VanDerWaalsContact O-CG 3.31Å; K2654-L2658 WeakPolarHBondContact O-CG 3.21Å; K2654-L2658 PolarHBondContact O-N 3.24Å
2655	V	84.9	Confident	75.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.3	-43	174.9	174.7	0	0	0	0	111.4	F2617 L2651 A2652 M2657 L2658 N2659 F2680 V2714	F2617-V2655 HydrophobicContact CD2-CG1 4.04Å; F2617-V2655 HydrophobicContact CD2-CG2 4.18Å; F2617-V2655 HydrophobicContact CE1-CG1 4.29Å; F2617-V2655 HydrophobicContact CE2-CG1 3.79Å; F2617-V2655 HydrophobicContact CG-CG1 4.41Å; F2617-V2655 HydrophobicContact CG-CG2 4.32Å; F2617-V2655 HydrophobicContact CZ-CG1 3.93Å; L2651-V2655 HydrophobicContact CD1-CG2 4.24Å; L2651-V2655 WeakPolarHBondContact O-CG2 3.49Å; L2651-V2655 PolarHBondContact O-N 2.69Å; A2652-V2655 PolarHBondContact O-N 2.74Å; V2655-M2657 PolarHBondContact O-N 2.84Å; V2655-L2658 PolarHBondContact O-N 3.29Å; V2655-N2659 PolarHBondContact O-N 3Å; V2655-F2680 HydrophobicContact CB-CE1 4.06Å; V2655-F2680 HydrophobicContact CB-CZ 4.4Å; V2655-F2680 HydrophobicContact CG1-CD1 4.06Å; V2655-F2680 HydrophobicContact CG1-CE1 3.8Å; V2655-F2680 HydrophobicContact CG2-CE1 4.13Å; V2655-F2680 HydrophobicContact CG2-CZ 4.04Å; V2655-V2714 HydrophobicContact CG2-CG2 4.43Å
2656	D	83	Confident	74.6	Confident	21 Å²	21	62.2 Å²	62.2	11%	0.112	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-41.3	174.4	-169.2	62.5	0	0	0	111.9	A2652 N2659 R2660	A2652-D2656 WeakPolarHBondContact O-CB 3.36Å; A2652-D2656 PolarHBondContact O-N 3.28Å; D2656-N2659 PolarHBondContact O-N 3.26Å; D2656-R2660 WeakPolarHBondContact O-CB 3.28Å; D2656-R2660 VanDerWaalsContact O-CG 3.28Å; D2656-R2660 WeakPolarHBondContact O-CG 3.43Å; D2656-R2660 PolarHBondContact O-N 3.17Å; D2656-R2660 IonicContact OD1-NE 3.36Å; D2656-R2660 IonicContact OD2-CZ 3.36Å; D2656-R2660 IonicContact OD2-NE 2.79Å; D2656-R2660 PolarHBondContact OD2-NE 3.48Å; D2656-R2660 IonicContact OD2-NH2 3.03Å; D2656-R2660 PolarHBondContact OD2-NH2 2.97Å
2657	M	81.7	Confident	73.3	Confident	115 Å²	115	58.2 Å²	58.2	57%	0.567	31%	0.308	S	S	*	.	H	α-helix	trans	-61.6	-45.6	174	178.5	179.7	172.7	0	0	112.2	K2653 K2654 V2655 R2660 Q2661	K2653-M2657 WeakPolarHBondContact O-CB 3.43Å; K2653-M2657 PolarHBondContact O-N 3.11Å; K2654-M2657 PolarHBondContact O-N 2.73Å; V2655-M2657 PolarHBondContact O-N 2.84Å; M2657-R2660 PolarHBondContact O-N 3.45Å; M2657-Q2661 WeakPolarHBondContact O-CB 3.07Å; M2657-Q2661 PolarHBondContact O-N 2.94Å
2658	L	78.1	Confident	71.9	Confident	33 Å²	33	62.1 Å²	62.1	17%	0.173	33%	0.331	C	S	.	.	H	α-helix	trans	-56.9	-55.4	175.6	-76	169.6	0	0	0	109.9	F2601 F2617 K2654 V2655 R2660 Q2661 F2662	F2601-L2658 HydrophobicContact CD1-CD1 4.02Å; F2601-L2658 HydrophobicContact CE1-CD1 3.69Å; F2601-L2658 HydrophobicContact CZ-CD1 4.34Å; F2617-L2658 HydrophobicContact CB-CD1 4.36Å; F2617-L2658 HydrophobicContact CD1-CD1 4.36Å; K2654-L2658 WeakPolarHBondContact O-CB 3.24Å; K2654-L2658 VanDerWaalsContact O-CG 3.31Å; K2654-L2658 WeakPolarHBondContact O-CG 3.21Å; K2654-L2658 PolarHBondContact O-N 3.24Å; V2655-L2658 PolarHBondContact O-N 3.29Å; L2658-R2660 VanDerWaalsContact C-N 3.35Å; L2658-R2660 PolarHBondContact O-N 3.32Å; L2658-Q2661 WeakPolarHBondContact O-CB 3.48Å; L2658-Q2661 PolarHBondContact O-N 3.49Å; L2658-F2662 HydrophobicContact CB-CE2 3.98Å; L2658-F2662 HydrophobicContact CD2-CE2 4.04Å; L2658-F2662 HydrophobicContact CD2-CZ 4.18Å; L2658-F2662 WeakPolarHBondContact O-CD2 3.04Å; L2658-F2662 VanDerWaalsContact O-CE2 3.28Å; L2658-F2662 WeakPolarHBondContact O-CE2 3.41Å; L2658-F2662 PolarHBondContact O-N 3.19Å
2659	N	74.9	Confident	70.2	Confident	27 Å²	27	65.6 Å²	65.6	14%	0.144	35%	0.353	C	S	.	.	H	α-helix	trans	-59.7	-40.5	-177.7	-71.9	-21.2	0	0	0	113.4	F2617 V2655 D2656 Q2661 F2662 T2678	F2617-N2659 VanDerWaalsContact CE1-OD1 3.31Å; F2617-N2659 WeakPolarHBondContact CE1-OD1 3.39Å; V2655-N2659 PolarHBondContact O-N 3Å; D2656-N2659 PolarHBondContact O-N 3.26Å; N2659-Q2661 VanDerWaalsContact C-N 3.32Å; N2659-Q2661 PolarHBondContact O-N 3Å; N2659-F2662 PolarHBondContact O-N 3.33Å; N2659-T2678 WeakPolarHBondContact ND2-CB 3.42Å; N2659-T2678 WeakPolarHBondContact ND2-CG2 3.44Å; N2659-T2678 PolarHBondContact ND2-OG1 3.05Å
2660	R	70.3	Confident	68.1	Low	170 Å²	170	68 Å²	68	64%	0.642	36%	0.363	S	S	*	.	H	α-helix	trans	-63.6	-35.3	173.3	-70.3	177.4	-164.2	-145.3	10.4	113.1	D2656 M2657 L2658 F2662 S2663	D2656-R2660 WeakPolarHBondContact O-CB 3.28Å; D2656-R2660 VanDerWaalsContact O-CG 3.28Å; D2656-R2660 WeakPolarHBondContact O-CG 3.43Å; D2656-R2660 PolarHBondContact O-N 3.17Å; D2656-R2660 IonicContact OD1-NE 3.36Å; D2656-R2660 IonicContact OD2-CZ 3.36Å; D2656-R2660 IonicContact OD2-NE 2.79Å; D2656-R2660 PolarHBondContact OD2-NE 3.48Å; D2656-R2660 IonicContact OD2-NH2 3.03Å; D2656-R2660 PolarHBondContact OD2-NH2 2.97Å; M2657-R2660 PolarHBondContact O-N 3.45Å; L2658-R2660 VanDerWaalsContact C-N 3.35Å; L2658-R2660 PolarHBondContact O-N 3.32Å; R2660-F2662 PolarHBondContact O-N 3.2Å; R2660-S2663 PolarHBondContact O-N 2.72Å
2661	Q	68.4	Low	66.1	Low	103 Å²	103	71 Å²	71	48%	0.481	38%	0.38	S	S	.	.	H	α-helix	trans	-70.1	-15.9	-179.8	-153.5	-175.1	23.5	0	0	112.8	M2657 L2658 N2659	M2657-Q2661 WeakPolarHBondContact O-CB 3.07Å; M2657-Q2661 PolarHBondContact O-N 2.94Å; L2658-Q2661 WeakPolarHBondContact O-CB 3.48Å; L2658-Q2661 PolarHBondContact O-N 3.49Å; N2659-Q2661 VanDerWaalsContact C-N 3.32Å; N2659-Q2661 PolarHBondContact O-N 3Å
2662	F	61.6	Low	63.8	Low	20 Å²	20	81 Å²	81	9%	0.088	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	7.1	179.5	-52.4	-55.2	0	0	0	114	R2348 V2374 N2375 L2658 N2659 R2660	R2348-F2662 PolarHBondContact NH1-O 3.43Å; V2374-F2662 HydrophobicContact CG1-CD1 4.44Å; N2375-F2662 HydrophobicContact CB-CD1 3.92Å; N2375-F2662 HydrophobicContact CB-CD2 4.27Å; N2375-F2662 HydrophobicContact CB-CE1 3.79Å; N2375-F2662 HydrophobicContact CB-CE2 4.18Å; N2375-F2662 HydrophobicContact CB-CG 4.17Å; N2375-F2662 HydrophobicContact CB-CZ 3.95Å; N2375-F2662 VanDerWaalsContact CG-CE2 3.43Å; N2375-F2662 WeakPolarHBondContact ND2-CD2 3.43Å; N2375-F2662 VanDerWaalsContact ND2-CE2 3.25Å; N2375-F2662 WeakPolarHBondContact ND2-CE2 3.19Å; N2375-F2662 VanDerWaalsContact OD1-CZ 3.29Å; N2375-F2662 WeakPolarHBondContact OD1-CZ 3.49Å; L2658-F2662 HydrophobicContact CB-CE2 3.98Å; L2658-F2662 HydrophobicContact CD2-CE2 4.04Å; L2658-F2662 HydrophobicContact CD2-CZ 4.18Å; L2658-F2662 WeakPolarHBondContact O-CD2 3.04Å; L2658-F2662 VanDerWaalsContact O-CE2 3.28Å; L2658-F2662 WeakPolarHBondContact O-CE2 3.41Å; L2658-F2662 PolarHBondContact O-N 3.19Å; N2659-F2662 PolarHBondContact O-N 3.33Å; R2660-F2662 PolarHBondContact O-N 3.2Å
2663	S	56.9	Low	61.4	Low	49 Å²	49	89.1 Å²	89.1	34%	0.343	46%	0.46	S	S	.	.			trans	-71.8	134.3	170.6	-64.4	0	0	0	0	111.6	R2660	R2660-S2663 PolarHBondContact O-N 2.72Å
2664	I	55.4	Low	59.3	Low	70 Å²	70	88.5 Å²	88.5	36%	0.359	46%	0.457	S	S	.	.			trans	-89.4	153.4	176.9	-61.2	174	0	0	0	109.7	L2346 S2666 E2667 L2668	L2346-I2664 HydrophobicContact CD1-CD1 3.78Å; L2346-I2664 HydrophobicContact CD2-CD1 3.37Å; L2346-I2664 HydrophobicContact CG-CD1 4.22Å; I2664-S2666 PolarHBondContact O-N 3.04Å; I2664-E2667 PolarHBondContact O-N 2.84Å; I2664-L2668 PolarHBondContact O-N 3.01Å; I2664-L2668 VanDerWaalsContact O-N 3.16Å
2665	A	49.6	Very low	57.5	Low	76 Å²	76	90.8 Å²	90.8	63%	0.628	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-33.2	177.6	0	0	0	0	0	114.5	L2668	A2665-L2668 PolarHBondContact O-N 2.81Å
2666	S	50.1	Low	56.2	Low	88 Å²	88	98.7 Å²	98.7	62%	0.615	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-28.6	176.3	54	0	0	0	0	114.1	I2664	I2664-S2666 PolarHBondContact O-N 3.04Å
2667	E	51.7	Low	55.7	Low	66 Å²	66	100.7 Å²	100.7	31%	0.308	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-17.9	175.9	-64.2	-179.9	158.4	0	0	112.4	R2348 I2664 V2669	R2348-E2667 IonicContact CZ-OE1 3.79Å; R2348-E2667 IonicContact CZ-OE2 3.49Å; R2348-E2667 IonicContact NH1-OE1 2.7Å; R2348-E2667 PolarHBondContact NH1-OE1 2.91Å; R2348-E2667 IonicContact NH1-OE2 3.73Å; R2348-E2667 PolarHBondContact NH1-OE2 2.98Å; R2348-E2667 VanDerWaalsContact NH2-CD 3.33Å; R2348-E2667 IonicContact NH2-OE1 3.56Å; R2348-E2667 PolarHBondContact NH2-OE1 3.3Å; R2348-E2667 IonicContact NH2-OE2 3.75Å; R2348-E2667 PolarHBondContact NH2-OE2 2.91Å; R2348-E2667 VanDerWaalsContact NH2-OE2 3.16Å; I2664-E2667 PolarHBondContact O-N 2.84Å; E2667-V2669 PolarHBondContact O-N 3.35Å
2668	L	49.4	Very low	55.6	Low	122 Å²	122	96.5 Å²	96.5	64%	0.639	50%	0.497	S	S	*	.	S	Bend	trans	-74.1	-9.2	170.7	-73.5	163.2	0	0	0	112.5	I2664 A2665 P2670	I2664-L2668 PolarHBondContact O-N 3.01Å; I2664-L2668 VanDerWaalsContact O-N 3.16Å; A2665-L2668 PolarHBondContact O-N 2.81Å; L2668-P2670 VanDerWaalsContact O-CD 3.31Å; L2668-P2670 WeakPolarHBondContact O-CD 3.03Å
2669	V	47.2	Very low	56.1	Low	86 Å²	86	99.2 Å²	99.2	52%	0.521	51%	0.505	S	S	.	.	S	Bend	trans	-72.8	113.3	173.4	-174.7	0	0	0	0	109.3	E2667 T2671	E2667-V2669 PolarHBondContact O-N 3.35Å; V2669-T2671 VanDerWaalsContact C-N 3.28Å; V2669-T2671 PolarHBondContact O-N 3.02Å
2670	P	39.8	Very low	56.9	Low	109 Å²	109	98 Å²	98	71%	0.708	50%	0.498	S	S	*	.			trans	-89	52.8	-165.6	37.4	-37.1	0	0	0	112.3	L2668 Y2672	L2668-P2670 VanDerWaalsContact O-CD 3.31Å; L2668-P2670 WeakPolarHBondContact O-CD 3.03Å; P2670-Y2672 VanDerWaalsContact C-N 3.28Å; P2670-Y2672 PolarHBondContact O-N 3.49Å
2671	T	42.8	Very low	58	Low	113 Å²	113	89.9 Å²	89.9	69%	0.693	47%	0.467	S	S	*	.	S	Bend	trans	-69	-28.3	-177.8	-33.6	0	0	0	0	112.4	V2669	V2669-T2671 VanDerWaalsContact C-N 3.28Å; V2669-T2671 PolarHBondContact O-N 3.02Å
2672	Y	38.4	Very low	59.1	Low	210 Å²	210	85 Å²	85	82%	0.824	45%	0.445	S	S	*	.	S	Bend	trans	-140.4	132.7	163.6	-89.7	-92.6	0	0	0	109	P2670 K2674	P2670-Y2672 VanDerWaalsContact C-N 3.28Å; P2670-Y2672 PolarHBondContact O-N 3.49Å; Y2672-K2674 PolarHBondContact O-N 3.19Å
2673	M	35.3	Very low	60.3	Low	172 Å²	172	85.3 Å²	85.3	85%	0.847	45%	0.449	S	S	*	.			trans	-70.9	65.7	171.8	-69.9	-174.9	175.7	0	0	111.2	T2675	M2673-T2675 VanDerWaalsContact C-N 3.33Å; M2673-T2675 PolarHBondContact O-N 3.11Å
2674	K	42.8	Very low	61.7	Low	150 Å²	150	83.4 Å²	83.4	65%	0.652	44%	0.436	S	S	*	.			trans	-66.5	100.6	160.3	-84.2	-170	175.7	-177.4	0	107	Y2672 Y2676	Y2672-K2674 PolarHBondContact O-N 3.19Å; K2674-Y2676 HydrophobicContact CB-CD1 4.47Å; K2674-Y2676 HydrophobicContact CB-CD2 4.45Å; K2674-Y2676 HydrophobicContact CB-CE1 3.95Å; K2674-Y2676 HydrophobicContact CB-CE2 3.93Å; K2674-Y2676 HydrophobicContact CD-CE1 4.17Å; K2674-Y2676 WeakPolarHBondContact O-CD2 3.31Å; K2674-Y2676 WeakPolarHBondContact O-CE2 3.41Å; K2674-Y2676 PolarHBondContact O-N 2.96Å
2675	T	45.9	Very low	62.9	Low	107 Å²	107	84.7 Å²	84.7	66%	0.656	45%	0.447	S	S	*	.			trans	-73.5	62.5	-179.7	40.4	0	0	0	0	110.8	M2673 E2677 K2698	M2673-T2675 VanDerWaalsContact C-N 3.33Å; M2673-T2675 PolarHBondContact O-N 3.11Å; T2675-E2677 PolarHBondContact O-N 2.89Å; T2675-K2698 PolarHBondContact O-NZ 2.92Å
2676	Y	57	Low	64.5	Low	165 Å²	165	84.6 Å²	84.6	65%	0.647	44%	0.439	S	S	*	.			trans	-43.4	98.9	-177.4	-59.3	-72.7	0	0	0	112.1	K2674 K2698	K2674-Y2676 HydrophobicContact CB-CD1 4.47Å; K2674-Y2676 HydrophobicContact CB-CD2 4.45Å; K2674-Y2676 HydrophobicContact CB-CE1 3.95Å; K2674-Y2676 HydrophobicContact CB-CE2 3.93Å; K2674-Y2676 HydrophobicContact CD-CE1 4.17Å; K2674-Y2676 WeakPolarHBondContact O-CD2 3.31Å; K2674-Y2676 WeakPolarHBondContact O-CE2 3.41Å; K2674-Y2676 PolarHBondContact O-N 2.96Å; Y2676-K2698 VanDerWaalsContact C-NZ 3.35Å; Y2676-K2698 WeakPolarHBondContact O-CE 3.49Å; Y2676-K2698 PolarHBondContact O-NZ 2.89Å
2677	E	73.4	Confident	66.2	Low	63 Å²	63	81.5 Å²	81.5	29%	0.294	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-91.6	118.8	171.7	174.5	-171.4	-138.8	0	0	105.4	T2675 R2679 S2696 K2698	T2675-E2677 PolarHBondContact O-N 2.89Å; E2677-R2679 HydrophobicContact CG-CG 4.33Å; E2677-R2679 PolarHBondContact O-N 3.08Å; E2677-R2679 IonicContact OE2-CZ 2.74Å; E2677-R2679 IonicContact OE2-NE 3.67Å; E2677-R2679 PolarHBondContact OE2-NE 2.79Å; E2677-R2679 IonicContact OE2-NH2 3.97Å; E2677-R2679 PolarHBondContact OE2-NH2 2.94Å; E2677-S2696 WeakPolarHBondContact CG-OG 3.33Å; E2677-S2696 VanDerWaalsContact OE1-CB 3.23Å; E2677-S2696 WeakPolarHBondContact OE1-CB 3.41Å; E2677-S2696 PolarHBondContact OE1-OG 3.1Å; E2677-K2698 HydrophobicContact CB-CD 4.29Å
2678	T	79.1	Confident	67.7	Low	28 Å²	28	81.2 Å²	81.2	17%	0.172	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-86	117.7	175.4	-42.7	0	0	0	0	108.3	F2617 N2659 S2697	F2617-T2678 HydrophobicContact CZ-CG2 4.46Å; N2659-T2678 WeakPolarHBondContact ND2-CB 3.42Å; N2659-T2678 WeakPolarHBondContact ND2-CG2 3.44Å; N2659-T2678 PolarHBondContact ND2-OG1 3.05Å; T2678-S2697 PolarHBondContact N-OG 3Å; T2678-S2697 VanDerWaalsContact N-OG 3.14Å; T2678-S2697 WeakPolarHBondContact O-CB 3.28Å; T2678-S2697 PolarHBondContact O-N 3.4Å; T2678-S2697 PolarHBondContact O-OG 3.31Å
2679	R	88.1	Confident	69.1	Low	90 Å²	90	82 Å²	82	34%	0.34	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	135.7	171.9	-61.8	177.4	-174.2	173.3	3.1	108.1	E2677 Y2694 L2695 L2711	E2677-R2679 HydrophobicContact CG-CG 4.33Å; E2677-R2679 PolarHBondContact O-N 3.08Å; E2677-R2679 IonicContact OE2-CZ 2.74Å; E2677-R2679 IonicContact OE2-NE 3.67Å; E2677-R2679 PolarHBondContact OE2-NE 2.79Å; E2677-R2679 IonicContact OE2-NH2 3.97Å; E2677-R2679 PolarHBondContact OE2-NH2 2.94Å; R2679-Y2694 HydrophobicContact CB-CD2 3.71Å; R2679-Y2694 HydrophobicContact CB-CE2 4.23Å; R2679-Y2694 HydrophobicContact CB-CG 4.39Å; R2679-Y2694 HydrophobicContact CG-CD2 3.7Å; R2679-Y2694 HydrophobicContact CG-CE2 3.69Å; R2679-L2695 WeakPolarHBondContact CA-O 3.29Å; R2679-L2711 HydrophobicContact CB-CD1 4.38Å; R2679-L2711 HydrophobicContact CB-CD2 4.25Å
2680	F	91.2	Very high	70.7	Confident	0 Å²	0	86.2 Å²	86.2	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	148.2	179.7	56.2	-91.4	0	0	0	112.3	L2651 V2655 I2682 Y2694 L2695 P2712 V2714	L2651-F2680 HydrophobicContact CD2-CE2 4.34Å; L2651-F2680 HydrophobicContact CG-CZ 4.46Å; V2655-F2680 HydrophobicContact CB-CE1 4.06Å; V2655-F2680 HydrophobicContact CB-CZ 4.4Å; V2655-F2680 HydrophobicContact CG1-CD1 4.06Å; V2655-F2680 HydrophobicContact CG1-CE1 3.8Å; V2655-F2680 HydrophobicContact CG2-CE1 4.13Å; V2655-F2680 HydrophobicContact CG2-CZ 4.04Å; F2680-I2682 HydrophobicContact CD2-CG2 4.06Å; F2680-I2682 HydrophobicContact CE2-CG2 4.02Å; F2680-Y2694 CarbonylContact O-C 3.56Å; F2680-Y2694 VanDerWaalsContact O-CA 3.29Å; F2680-Y2694 WeakPolarHBondContact O-CA 3.38Å; F2680-L2695 HydrophobicContact CD2-CB 4.24Å; F2680-L2695 HydrophobicContact CE1-CB 4.38Å; F2680-L2695 HydrophobicContact CE2-CB 3.8Å; F2680-L2695 HydrophobicContact CE2-CD2 3.85Å; F2680-L2695 HydrophobicContact CE2-CG 4.21Å; F2680-L2695 HydrophobicContact CZ-CB 3.88Å; F2680-L2695 HydrophobicContact CZ-CD2 3.68Å; F2680-L2695 HydrophobicContact CZ-CG 3.91Å; F2680-L2695 PolarHBondContact N-O 3Å; F2680-L2695 VanDerWaalsContact N-O 3.09Å; F2680-L2695 PolarHBondContact O-N 3.08Å; F2680-P2712 CarbonylContact C-O 3.56Å; F2680-P2712 WeakPolarHBondContact CA-O 3.33Å; F2680-P2712 HydrophobicContact CB-CB 4.22Å; F2680-P2712 VanDerWaalsContact CB-O 3.3Å; F2680-P2712 WeakPolarHBondContact CB-O 3.47Å; F2680-V2714 HydrophobicContact CD2-CB 4.34Å; F2680-V2714 HydrophobicContact CD2-CG2 3.58Å; F2680-V2714 HydrophobicContact CE2-CB 4.45Å; F2680-V2714 HydrophobicContact CE2-CG2 3.64Å; F2680-V2714 HydrophobicContact CG-CG2 4.37Å; F2680-V2714 HydrophobicContact CZ-CG2 4.47Å
2681	W	93.9	Very high	72.8	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	134.5	-177.3	-67.2	125.8	0	0	0	112.5	V2622 Y2624 L2638 C2692 G2693 Y2705 N2706 D2709 L2711 P2712 F2713	V2622-W2681 PolarHBondContact O-NE1 2.95Å; Y2624-W2681 HydrophobicContact CD2-CB 4.15Å; Y2624-W2681 AromaticContact CD2-CD2 3.83Å; Y2624-W2681 HydrophobicContact CD2-CD2 3.83Å; Y2624-W2681 AromaticContact CD2-CE3 3.68Å; Y2624-W2681 HydrophobicContact CD2-CE3 3.68Å; Y2624-W2681 HydrophobicContact CD2-CG 4.06Å; Y2624-W2681 HydrophobicContact CD2-CZ3 4.37Å; L2638-W2681 HydrophobicContact CD1-CB 4.39Å; W2681-C2692 HydrophobicContact CE3-CB 4Å; W2681-C2692 HydrophobicContact CH2-CB 3.93Å; W2681-C2692 HydrophobicContact CZ3-CB 3.4Å; W2681-C2692 VanDerWaalsContact CZ3-CB 3.4Å; W2681-G2693 VanDerWaalsContact CE3-O 3.31Å; W2681-Y2705 AromaticContact CH2-CD1 3.97Å; W2681-Y2705 HydrophobicContact CH2-CD1 3.97Å; W2681-Y2705 HydrophobicContact CH2-CG 4.47Å; W2681-N2706 VanDerWaalsContact CH2-O 3.25Å; W2681-N2706 WeakPolarHBondContact CH2-O 3.43Å; W2681-D2709 WeakPolarHBondContact CZ2-O 3.41Å; W2681-L2711 HydrophobicContact CD2-CB 4.28Å; W2681-L2711 HydrophobicContact CD2-CD1 4.18Å; W2681-L2711 HydrophobicContact CE3-CD1 4.26Å; W2681-L2711 HydrophobicContact CG-CB 4.38Å; W2681-L2711 HydrophobicContact CH2-CD1 3.93Å; W2681-L2711 HydrophobicContact CZ2-CB 4.28Å; W2681-L2711 HydrophobicContact CZ2-CD1 3.85Å; W2681-L2711 HydrophobicContact CZ2-CG 4.09Å; W2681-L2711 HydrophobicContact CZ3-CD1 4.14Å; W2681-P2712 PolarHBondContact N-O 3.18Å; W2681-F2713 HydrophobicContact CB-CB 3.89Å
2682	I	90.8	Very high	75.1	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160.8	170.3	60	156.2	0	0	0	109.3	P2639 F2641 F2680 G2693 L2695 I2702	P2639-I2682 HydrophobicContact CG-CG2 4.12Å; F2641-I2682 HydrophobicContact CD2-CB 4.15Å; F2641-I2682 HydrophobicContact CD2-CD1 3.94Å; F2641-I2682 HydrophobicContact CD2-CG2 4.18Å; F2641-I2682 HydrophobicContact CE2-CB 4.44Å; F2641-I2682 HydrophobicContact CE2-CG2 4.01Å; F2680-I2682 HydrophobicContact CD2-CG2 4.06Å; F2680-I2682 HydrophobicContact CE2-CG2 4.02Å; I2682-G2693 PolarHBondContact N-O 3.19Å; I2682-G2693 CarbonylContact O-C 3.56Å; I2682-L2695 HydrophobicContact CD1-CB 3.87Å; I2682-L2695 HydrophobicContact CG1-CB 4.08Å; I2682-L2695 HydrophobicContact CG2-CB 3.89Å; I2682-L2695 HydrophobicContact CG2-CD2 4.49Å; I2682-I2702 HydrophobicContact CD1-CD1 4.01Å; I2682-I2702 HydrophobicContact CD1-CG1 3.88Å; I2682-I2702 HydrophobicContact CD1-CG2 4.1Å
2683	S	88.3	Confident	77.5	Confident	27 Å²	27	71.7 Å²	71.7	19%	0.189	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.8	168.9	-166.3	0	0	0	0	110.4	Y2624 P2639 F2640 F2641	Y2624-S2683 WeakPolarHBondContact OH-CB 3.49Å; Y2624-S2683 PolarHBondContact OH-OG 3.4Å; P2639-S2683 PolarHBondContact O-N 2.77Å; F2640-S2683 WeakPolarHBondContact CA-O 3.44Å; F2640-S2683 VanDerWaalsContact CD2-OG 3.24Å; F2640-S2683 WeakPolarHBondContact CD2-OG 3.15Å; F2641-S2683 PolarHBondContact N-O 2.87Å
2684	S	85.8	Confident	80.2	Confident	10 Å²	10	65.3 Å²	65.3	7%	0.07	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	149.9	177.1	178.9	0	0	0	0	112.4	F2641 T2686	F2641-S2684 WeakPolarHBondContact O-CA 3.23Å; F2641-S2684 PolarHBondContact O-OG 3.39Å; S2684-T2686 PolarHBondContact O-N 3.29Å; S2684-T2686 PolarHBondContact OG-N 2.78Å; S2684-T2686 PolarHBondContact OG-OG1 3.16Å
2685	V	80.7	Confident	82.5	Confident	96 Å²	96	58.1 Å²	58.1	58%	0.582	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.9	174.3	-170	0	0	0	0	112.2	F2640 R2642 V2687	F2640-V2685 HydrophobicContact CE1-CG2 3.4Å; F2640-V2685 HydrophobicContact CZ-CB 4.44Å; F2640-V2685 HydrophobicContact CZ-CG2 3.51Å; R2642-V2685 HydrophobicContact CG-CG2 4.25Å; V2685-V2687 VanDerWaalsContact C-N 3.3Å; V2685-V2687 PolarHBondContact O-N 3.44Å
2686	T	83.4	Confident	84.5	Confident	74 Å²	74	53 Å²	53	45%	0.454	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-7.5	-173.4	49.3	0	0	0	0	114.4	D2643 S2684	D2643-T2686 HydrophobicContact CB-CG2 3.85Å; S2684-T2686 PolarHBondContact O-N 3.29Å; S2684-T2686 PolarHBondContact OG-N 2.78Å; S2684-T2686 PolarHBondContact OG-OG1 3.16Å
2687	V	85.1	Confident	85.8	Confident	24 Å²	24	45.5 Å²	45.5	15%	0.145	24%	0.244	C	C	.	.	S	Bend	trans	-94	130.2	-175.9	-177	0	0	0	0	109.4	V2685 K2691 I2702 V2704	V2685-V2687 VanDerWaalsContact C-N 3.3Å; V2685-V2687 PolarHBondContact O-N 3.44Å; V2687-K2691 HydrophobicContact CG1-CB 4.41Å; V2687-K2691 WeakPolarHBondContact CG1-O 3.41Å; V2687-I2702 HydrophobicContact CG2-CG2 4.33Å; V2687-V2704 HydrophobicContact CG1-CG1 4.27Å; V2687-V2704 HydrophobicContact CG1-CG2 4.37Å; V2687-V2704 HydrophobicContact CG2-CG2 4.46Å
2688	P	83.6	Confident	86.2	Confident	60 Å²	60	47 Å²	47	39%	0.39	25%	0.25	S	C	.	.			trans	-67.4	149.3	177.5	28.8	-35.2	0	0	0	111.2	E2690 K2691	P2688-E2690 PolarHBondContact O-N 3.38Å; P2688-K2691 HydrophobicContact CG-CB 4.29Å; P2688-K2691 HydrophobicContact CG-CD 4.26Å; P2688-K2691 HydrophobicContact CG-CG 4.32Å; P2688-K2691 PolarHBondContact O-N 2.98Å; P2688-K2691 VanDerWaalsContact O-O 3.11Å
2689	P	78.7	Confident	86.5	Confident	138 Å²	138	49.9 Å²	49.9	90%	0.896	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.8	-168.5	25.6	-36	0	0	0	115.1	K2691	P2689-K2691 VanDerWaalsContact C-N 3.29Å
2690	E	80.4	Confident	86.3	Confident	174 Å²	174	46.9 Å²	46.9	81%	0.813	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.7	176.7	-61.5	176.8	172.6	0	0	113.7	P2688	P2688-E2690 PolarHBondContact O-N 3.38Å
2691	K	84.9	Confident	86	Confident	116 Å²	116	49.8 Å²	49.8	50%	0.504	28%	0.282	S	S	.	.	S	Bend	trans	-136.4	162.6	-172.4	-54.8	-173.6	179.3	-178.4	0	111.5	V2687 P2688 P2689 V2704 C2707	V2687-K2691 HydrophobicContact CG1-CB 4.41Å; V2687-K2691 WeakPolarHBondContact CG1-O 3.41Å; P2688-K2691 HydrophobicContact CG-CB 4.29Å; P2688-K2691 HydrophobicContact CG-CD 4.26Å; P2688-K2691 HydrophobicContact CG-CG 4.32Å; P2688-K2691 PolarHBondContact O-N 2.98Å; P2688-K2691 VanDerWaalsContact O-O 3.11Å; P2689-K2691 VanDerWaalsContact C-N 3.29Å; K2691-V2704 HydrophobicContact CB-CG1 3.32Å; K2691-V2704 HydrophobicContact CD-CG1 3.52Å; K2691-V2704 HydrophobicContact CG-CG1 4.03Å; K2691-C2707 VanDerWaalsContact C-SG 3.52Å
2692	C	90.3	Very high	85.7	Confident	8 Å²	8	51.3 Å²	51.3	5%	0.054	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	144.4	-175	-70.4	0	0	0	0	112	Y2624 W2681 Y2705 C2707	Y2624-C2692 VanDerWaalsContact CB-SG 3.56Å; Y2624-C2692 VanDerWaalsContact CD1-SG 3.51Å; Y2624-C2692 HydrophobicContact CD2-CB 3.69Å; Y2624-C2692 HydrophobicContact CE2-CB 4.19Å; Y2624-C2692 HydrophobicContact CG-CB 3.88Å; W2681-C2692 HydrophobicContact CE3-CB 4Å; W2681-C2692 HydrophobicContact CH2-CB 3.93Å; W2681-C2692 HydrophobicContact CZ3-CB 3.4Å; W2681-C2692 VanDerWaalsContact CZ3-CB 3.4Å; C2692-Y2705 PolarHBondContact N-O 3.1Å; C2692-Y2705 PolarHBondContact O-N 3.47Å; C2692-C2707 HydrophobicContact CB-CB 3.98Å; C2692-C2707 WeakPolarHBondContact CB-SG 3.39Å; C2692-C2707 PolarHBondContact N-SG 3.03Å; C2692-C2707 VanDerWaalsContact SG-CA 3.57Å; C2692-C2707 WeakPolarHBondContact SG-CB 3.5Å; C2692-C2707 CovalentContact SG-SG 2.04Å; C2692-C2707 PolarHBondContact SG-SG 3.31Å
2693	G	89.5	Confident	85.6	Confident	3 Å²	3	52 Å²	52	3%	0.031	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.9	-175.9	0	0	0	0	0	112.7	W2681 I2682 G2703	W2681-G2693 VanDerWaalsContact CE3-O 3.31Å; I2682-G2693 PolarHBondContact N-O 3.19Å; I2682-G2693 CarbonylContact O-C 3.56Å; G2693-G2703 WeakPolarHBondContact CA-O 3.46Å
2694	Y	91.1	Very high	85.6	Confident	38 Å²	38	53.9 Å²	53.9	15%	0.149	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	152.3	169.8	76.3	-88.6	0	0	0	111.3	R2679 F2680 I2702 G2703	R2679-Y2694 HydrophobicContact CB-CD2 3.71Å; R2679-Y2694 HydrophobicContact CB-CE2 4.23Å; R2679-Y2694 HydrophobicContact CB-CG 4.39Å; R2679-Y2694 HydrophobicContact CG-CD2 3.7Å; R2679-Y2694 HydrophobicContact CG-CE2 3.69Å; F2680-Y2694 CarbonylContact O-C 3.56Å; F2680-Y2694 VanDerWaalsContact O-CA 3.29Å; F2680-Y2694 WeakPolarHBondContact O-CA 3.38Å; Y2694-I2702 WeakPolarHBondContact O-CA 3.45Å; Y2694-G2703 WeakPolarHBondContact CD1-O 3.42Å; Y2694-G2703 PolarHBondContact N-O 3.4Å; Y2694-G2703 PolarHBondContact O-N 3.38Å
2695	L	90.5	Very high	85.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	135.8	170.1	-170.7	56	0	0	0	109.5	L2648 L2651 R2679 F2680 I2682 A2700 I2702	L2648-L2695 HydrophobicContact CD2-CD1 3.97Å; L2648-L2695 HydrophobicContact CD2-CD2 3.73Å; L2651-L2695 HydrophobicContact CD2-CD2 4.35Å; R2679-L2695 WeakPolarHBondContact CA-O 3.29Å; F2680-L2695 HydrophobicContact CD2-CB 4.24Å; F2680-L2695 HydrophobicContact CE1-CB 4.38Å; F2680-L2695 HydrophobicContact CE2-CB 3.8Å; F2680-L2695 HydrophobicContact CE2-CD2 3.85Å; F2680-L2695 HydrophobicContact CE2-CG 4.21Å; F2680-L2695 HydrophobicContact CZ-CB 3.88Å; F2680-L2695 HydrophobicContact CZ-CD2 3.68Å; F2680-L2695 HydrophobicContact CZ-CG 3.91Å; F2680-L2695 PolarHBondContact N-O 3Å; F2680-L2695 VanDerWaalsContact N-O 3.09Å; F2680-L2695 PolarHBondContact O-N 3.08Å; I2682-L2695 HydrophobicContact CD1-CB 3.87Å; I2682-L2695 HydrophobicContact CG1-CB 4.08Å; I2682-L2695 HydrophobicContact CG2-CB 3.89Å; I2682-L2695 HydrophobicContact CG2-CD2 4.49Å; L2695-A2700 WeakPolarHBondContact CD1-O 3.3Å; L2695-I2702 HydrophobicContact CD1-CG1 4.44Å
2696	S	88	Confident	85.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.1	169.5	171.3	0	0	0	0	111	E2677 K2698 T2699 A2700 S2701	E2677-S2696 WeakPolarHBondContact CG-OG 3.33Å; E2677-S2696 VanDerWaalsContact OE1-CB 3.23Å; E2677-S2696 WeakPolarHBondContact OE1-CB 3.41Å; E2677-S2696 PolarHBondContact OE1-OG 3.1Å; S2696-K2698 PolarHBondContact O-N 3.28Å; S2696-K2698 PolarHBondContact OG-N 3.49Å; S2696-K2698 VanDerWaalsContact OG-N 3.14Å; S2696-T2699 WeakPolarHBondContact CB-OG1 3.35Å; S2696-T2699 PolarHBondContact OG-N 3.33Å; S2696-T2699 PolarHBondContact OG-OG1 3.5Å; S2696-A2700 WeakPolarHBondContact O-CA 3.5Å; S2696-A2700 PolarHBondContact O-N 3.27Å; S2696-S2701 PolarHBondContact N-O 3.45Å
2697	S	85.3	Confident	86.1	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.042	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.5	172.2	74.2	0	0	0	0	113.8	T2678	T2678-S2697 PolarHBondContact N-OG 3Å; T2678-S2697 VanDerWaalsContact N-OG 3.14Å; T2678-S2697 WeakPolarHBondContact O-CB 3.28Å; T2678-S2697 PolarHBondContact O-N 3.4Å; T2678-S2697 PolarHBondContact O-OG 3.31Å
2698	K	82.2	Confident	86.1	Confident	95 Å²	95	56 Å²	56	41%	0.413	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-48	-173.5	-73	-174.9	179.1	171.2	0	114.2	T2675 Y2676 E2677 S2696	T2675-K2698 PolarHBondContact O-NZ 2.92Å; Y2676-K2698 VanDerWaalsContact C-NZ 3.35Å; Y2676-K2698 WeakPolarHBondContact O-CE 3.49Å; Y2676-K2698 PolarHBondContact O-NZ 2.89Å; E2677-K2698 HydrophobicContact CB-CD 4.29Å; S2696-K2698 PolarHBondContact O-N 3.28Å; S2696-K2698 PolarHBondContact OG-N 3.49Å; S2696-K2698 VanDerWaalsContact OG-N 3.14Å
2699	T	84.1	Confident	86.3	Confident	88 Å²	88	55 Å²	55	54%	0.54	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-14.7	179.8	59.1	0	0	0	0	112.3	S2696 S2701	S2696-T2699 WeakPolarHBondContact CB-OG1 3.35Å; S2696-T2699 PolarHBondContact OG-N 3.33Å; S2696-T2699 PolarHBondContact OG-OG1 3.5Å; T2699-S2701 PolarHBondContact O-N 3.04Å; T2699-S2701 PolarHBondContact OG1-N 2.94Å; T2699-S2701 PolarHBondContact OG1-OG 2.66Å
2700	A	84	Confident	86.9	Confident	27 Å²	27	48.7 Å²	48.7	22%	0.223	26%	0.259	C	S	.	.			trans	52.6	19.4	-169.6	0	0	0	0	0	113.9	A2652 L2695 S2696	A2652-A2700 HydrophobicContact CB-CB 3.81Å; L2695-A2700 WeakPolarHBondContact CD1-O 3.3Å; S2696-A2700 WeakPolarHBondContact O-CA 3.5Å; S2696-A2700 PolarHBondContact O-N 3.27Å
2701	S	86.1	Confident	87.4	Confident	61 Å²	61	41.4 Å²	41.4	43%	0.427	23%	0.226	S	C	.	.			trans	-93.5	143.7	179	65	0	0	0	0	111.2	S2696 T2699	S2696-S2701 PolarHBondContact N-O 3.45Å; T2699-S2701 PolarHBondContact O-N 3.04Å; T2699-S2701 PolarHBondContact OG1-N 2.94Å; T2699-S2701 PolarHBondContact OG1-OG 2.66Å
2702	I	87.1	Confident	87.7	Confident	32 Å²	32	36.2 Å²	36.2	16%	0.164	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.4	171.9	-52	-175.8	0	0	0	108.6	F2641 L2648 I2682 V2687 Y2694 L2695	F2641-I2702 HydrophobicContact CB-CD1 4.44Å; L2648-I2702 HydrophobicContact CD1-CD1 4.21Å; L2648-I2702 HydrophobicContact CD1-CG1 4.35Å; I2682-I2702 HydrophobicContact CD1-CD1 4.01Å; I2682-I2702 HydrophobicContact CD1-CG1 3.88Å; I2682-I2702 HydrophobicContact CD1-CG2 4.1Å; V2687-I2702 HydrophobicContact CG2-CG2 4.33Å; Y2694-I2702 WeakPolarHBondContact O-CA 3.45Å; L2695-I2702 HydrophobicContact CD1-CG1 4.44Å
2703	G	87.6	Confident	87.8	Confident	14 Å²	14	35.9 Å²	35.9	14%	0.144	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	173.9	172.3	0	0	0	0	0	111.5	G2693 Y2694	G2693-G2703 WeakPolarHBondContact CA-O 3.46Å; Y2694-G2703 WeakPolarHBondContact CD1-O 3.42Å; Y2694-G2703 PolarHBondContact N-O 3.4Å; Y2694-G2703 PolarHBondContact O-N 3.38Å
2704	V	88.5	Confident	87.9	Confident	68 Å²	68	35.7 Å²	35.7	41%	0.412	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.3	-178.4	-173.6	0	0	0	0	110	V2687 K2691	V2687-V2704 HydrophobicContact CG1-CG1 4.27Å; V2687-V2704 HydrophobicContact CG1-CG2 4.37Å; V2687-V2704 HydrophobicContact CG2-CG2 4.46Å; K2691-V2704 HydrophobicContact CB-CG1 3.32Å; K2691-V2704 HydrophobicContact CD-CG1 3.52Å; K2691-V2704 HydrophobicContact CG-CG1 4.03Å
2705	Y	86.5	Confident	88	Confident	62 Å²	62	33.9 Å²	33.9	24%	0.243	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	171	-177.5	-149.1	-123	0	0	0	111.8	W2681 C2692 D2709 L2711	W2681-Y2705 AromaticContact CH2-CD1 3.97Å; W2681-Y2705 HydrophobicContact CH2-CD1 3.97Å; W2681-Y2705 HydrophobicContact CH2-CG 4.47Å; C2692-Y2705 PolarHBondContact N-O 3.1Å; C2692-Y2705 PolarHBondContact O-N 3.47Å; Y2705-D2709 HydrophobicContact CD1-CB 3.88Å; Y2705-D2709 HydrophobicContact CE1-CB 3.49Å; Y2705-D2709 VanDerWaalsContact CE1-CB 3.49Å; Y2705-D2709 WeakPolarHBondContact CE1-OD2 3.35Å; Y2705-L2711 HydrophobicContact CD1-CD1 3.76Å; Y2705-L2711 HydrophobicContact CD1-CG 4.31Å; Y2705-L2711 HydrophobicContact CE1-CD1 4.22Å; Y2705-L2711 HydrophobicContact CE1-CD2 4.42Å; Y2705-L2711 HydrophobicContact CE1-CG 4.37Å; Y2705-L2711 HydrophobicContact CG-CD1 4.43Å
2706	N	86.2	Confident	87.9	Confident	58 Å²	58	34.4 Å²	34.4	31%	0.31	20%	0.196	S	C	.	.			trans	-75.5	126.8	177.5	-179.3	23.1	0	0	0	110.4	W2681 D2708 D2709	W2681-N2706 VanDerWaalsContact CH2-O 3.25Å; W2681-N2706 WeakPolarHBondContact CH2-O 3.43Å; N2706-D2708 PolarHBondContact O-N 2.04Å; N2706-D2709 HydrophobicContact CB-CB 4.5Å; N2706-D2709 PolarHBondContact O-N 2.04Å
2707	C	88.4	Confident	87.7	Confident	35 Å²	35	37 Å²	37	24%	0.236	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-26.1	-174.9	-64.2	0	0	0	0	114.7	Y2624 K2691 C2692	Y2624-C2707 PolarHBondContact N-O 3.44Å; K2691-C2707 VanDerWaalsContact C-SG 3.52Å; C2692-C2707 HydrophobicContact CB-CB 3.98Å; C2692-C2707 WeakPolarHBondContact CB-SG 3.39Å; C2692-C2707 PolarHBondContact N-SG 3.03Å; C2692-C2707 VanDerWaalsContact SG-CA 3.57Å; C2692-C2707 WeakPolarHBondContact SG-CB 3.5Å; C2692-C2707 CovalentContact SG-SG 2.04Å; C2692-C2707 PolarHBondContact SG-SG 3.31Å
2708	D	85.8	Confident	87.2	Confident	94 Å²	94	38.8 Å²	38.8	50%	0.503	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.2	179.8	-80.8	-59.5	0	0	0	114.5	R2260 N2706	R2260-D2708 IonicContact CZ-OD1 3.81Å; R2260-D2708 PolarHBondContact NH1-O 2.86Å; R2260-D2708 IonicContact NH1-OD1 2.68Å; R2260-D2708 PolarHBondContact NH1-OD1 3.02Å; R2260-D2708 IonicContact NH2-OD1 3.1Å; N2706-D2708 PolarHBondContact O-N 2.04Å
2709	D	87.1	Confident	86.5	Confident	37 Å²	37	37.1 Å²	37.1	20%	0.198	23%	0.225	C	C	.	.	S	Bend	trans	-71.3	157	175.3	-72	-15.6	0	0	0	110.5	K2078 A2623 W2681 Y2705 N2706	K2078-D2709 IonicContact NZ-OD2 3.2Å; A2623-D2709 WeakPolarHBondContact CA-O 3.31Å; W2681-D2709 WeakPolarHBondContact CZ2-O 3.41Å; Y2705-D2709 HydrophobicContact CD1-CB 3.88Å; Y2705-D2709 HydrophobicContact CE1-CB 3.49Å; Y2705-D2709 VanDerWaalsContact CE1-CB 3.49Å; Y2705-D2709 WeakPolarHBondContact CE1-OD2 3.35Å; N2706-D2709 HydrophobicContact CB-CB 4.5Å; N2706-D2709 PolarHBondContact O-N 2.04Å
2710	V	90.6	Very high	85.3	Confident	7 Å²	7	41 Å²	41	4%	0.042	23%	0.234	C	C	.	.			trans	-96.1	118.7	-176	-70.1	0	0	0	0	111.6	E2258 L2285 A2621 V2622	E2258-V2710 HydrophobicContact CB-CG2 3.89Å; E2258-V2710 HydrophobicContact CG-CG2 4.31Å; L2285-V2710 VanDerWaalsContact O-CG2 3.26Å; L2285-V2710 WeakPolarHBondContact O-CG2 3.35Å; A2621-V2710 HydrophobicContact CB-CB 4.07Å; V2622-V2710 WeakPolarHBondContact O-CA 3.41Å
2711	L	91	Very high	83.9	Confident	20 Å²	20	45 Å²	45	11%	0.105	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	152.1	173.5	-63.9	175.7	0	0	0	111.3	A2621 V2622 R2679 W2681 Y2705	A2621-L2711 WeakPolarHBondContact CA-O 3.23Å; V2622-L2711 PolarHBondContact N-O 3.35Å; V2622-L2711 PolarHBondContact O-N 3.06Å; R2679-L2711 HydrophobicContact CB-CD1 4.38Å; R2679-L2711 HydrophobicContact CB-CD2 4.25Å; W2681-L2711 HydrophobicContact CD2-CB 4.28Å; W2681-L2711 HydrophobicContact CD2-CD1 4.18Å; W2681-L2711 HydrophobicContact CE3-CD1 4.26Å; W2681-L2711 HydrophobicContact CG-CB 4.38Å; W2681-L2711 HydrophobicContact CH2-CD1 3.93Å; W2681-L2711 HydrophobicContact CZ2-CB 4.28Å; W2681-L2711 HydrophobicContact CZ2-CD1 3.85Å; W2681-L2711 HydrophobicContact CZ2-CG 4.09Å; W2681-L2711 HydrophobicContact CZ3-CD1 4.14Å; Y2705-L2711 HydrophobicContact CD1-CD1 3.76Å; Y2705-L2711 HydrophobicContact CD1-CG 4.31Å; Y2705-L2711 HydrophobicContact CE1-CD1 4.22Å; Y2705-L2711 HydrophobicContact CE1-CD2 4.42Å; Y2705-L2711 HydrophobicContact CE1-CG 4.37Å; Y2705-L2711 HydrophobicContact CG-CD1 4.43Å
2712	P	91.9	Very high	82.1	Confident	8 Å²	8	50.5 Å²	50.5	5%	0.052	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	166.5	162.9	-27	36.1	0	0	0	112.8	L2285 F2617 F2680 W2681	L2285-P2712 HydrophobicContact CD2-CG 4.45Å; F2617-P2712 HydrophobicContact CE2-CB 4.05Å; F2617-P2712 HydrophobicContact CZ-CB 4.38Å; F2680-P2712 CarbonylContact C-O 3.56Å; F2680-P2712 WeakPolarHBondContact CA-O 3.33Å; F2680-P2712 HydrophobicContact CB-CB 4.22Å; F2680-P2712 VanDerWaalsContact CB-O 3.3Å; F2680-P2712 WeakPolarHBondContact CB-O 3.47Å; W2681-P2712 PolarHBondContact N-O 3.18Å
2713	F	93.2	Very high	80.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	169.2	-178.2	62.9	-80.3	0	0	0	113.1	V2618 G2620 V2622 A2627 F2630 L2638 W2681	V2618-F2713 HydrophobicContact CB-CD1 4.22Å; V2618-F2713 HydrophobicContact CB-CD2 4.25Å; V2618-F2713 HydrophobicContact CB-CE1 3.87Å; V2618-F2713 HydrophobicContact CB-CE2 3.92Å; V2618-F2713 HydrophobicContact CB-CG 4.4Å; V2618-F2713 HydrophobicContact CB-CZ 3.72Å; V2618-F2713 HydrophobicContact CG1-CD1 4.4Å; V2618-F2713 HydrophobicContact CG1-CE1 3.65Å; V2618-F2713 HydrophobicContact CG1-CE2 4.3Å; V2618-F2713 HydrophobicContact CG1-CZ 3.6Å; V2618-F2713 HydrophobicContact CG2-CD2 4.47Å; V2618-F2713 HydrophobicContact CG2-CE2 3.94Å; V2618-F2713 HydrophobicContact CG2-CZ 4.07Å; V2618-F2713 PolarHBondContact N-O 3.09Å; V2618-F2713 PolarHBondContact O-N 2.89Å; V2618-F2713 VanDerWaalsContact O-N 3.09Å; G2620-F2713 WeakPolarHBondContact O-CE1 3.45Å; V2622-F2713 HydrophobicContact CG1-CE1 4.31Å; V2622-F2713 HydrophobicContact CG2-CD1 3.56Å; V2622-F2713 HydrophobicContact CG2-CE1 3.49Å; V2622-F2713 VanDerWaalsContact CG2-CE1 3.49Å; V2622-F2713 HydrophobicContact CG2-CG 4.49Å; V2622-F2713 HydrophobicContact CG2-CZ 4.37Å; A2627-F2713 HydrophobicContact CB-CB 3.86Å; A2627-F2713 HydrophobicContact CB-CD1 3.9Å; A2627-F2713 HydrophobicContact CB-CD2 3.68Å; A2627-F2713 HydrophobicContact CB-CE1 4.33Å; A2627-F2713 HydrophobicContact CB-CE2 4.11Å; A2627-F2713 HydrophobicContact CB-CG 3.55Å; A2627-F2713 HydrophobicContact CB-CZ 4.42Å; F2630-F2713 HydrophobicContact CB-CE2 4.22Å; F2630-F2713 HydrophobicContact CB-CZ 4.12Å; F2630-F2713 AromaticContact CD1-CE2 3.56Å; F2630-F2713 HydrophobicContact CD1-CE2 3.56Å; F2630-F2713 AromaticContact CD1-CZ 3.7Å; F2630-F2713 HydrophobicContact CD1-CZ 3.7Å; F2630-F2713 HydrophobicContact CE1-CE2 4.22Å; F2630-F2713 HydrophobicContact CE1-CZ 4.26Å; F2630-F2713 HydrophobicContact CG-CE2 4.12Å; F2630-F2713 AromaticContact CG-CZ 3.93Å; F2630-F2713 HydrophobicContact CG-CZ 3.93Å; L2638-F2713 HydrophobicContact CD1-CB 4.45Å; W2681-F2713 HydrophobicContact CB-CB 3.89Å
2714	V	91.2	Very high	79	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.9	176.5	172.9	0	0	0	0	108.7	F2615 L2616 F2617 L2638 P2639 L2651 V2655 F2680	F2615-V2714 HydrophobicContact CB-CG1 4.02Å; F2615-V2714 HydrophobicContact CD1-CG1 3.58Å; F2615-V2714 HydrophobicContact CG-CG1 4.21Å; L2616-V2714 CarbonylContact O-C 3.52Å; L2616-V2714 VanDerWaalsContact O-CA 3.32Å; L2616-V2714 WeakPolarHBondContact O-CA 3.46Å; F2617-V2714 HydrophobicContact CB-CG2 4.48Å; F2617-V2714 HydrophobicContact CD2-CG2 3.95Å; L2638-V2714 WeakPolarHBondContact CD1-O 3.48Å; P2639-V2714 WeakPolarHBondContact CD-O 3.29Å; P2639-V2714 HydrophobicContact CG-CB 4.33Å; P2639-V2714 HydrophobicContact CG-CG1 4.28Å; L2651-V2714 HydrophobicContact CD1-CG1 4.36Å; V2655-V2714 HydrophobicContact CG2-CG2 4.43Å; F2680-V2714 HydrophobicContact CD2-CB 4.34Å; F2680-V2714 HydrophobicContact CD2-CG2 3.58Å; F2680-V2714 HydrophobicContact CE2-CB 4.45Å; F2680-V2714 HydrophobicContact CE2-CG2 3.64Å; F2680-V2714 HydrophobicContact CG-CG2 4.37Å; F2680-V2714 HydrophobicContact CZ-CG2 4.47Å
2715	C	91.8	Very high	77.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139.8	167.1	-55.2	0	0	0	0	110.3	W2600 F2615 L2616 C2631	W2600-C2715 HydrophobicContact CH2-CB 4.13Å; W2600-C2715 HydrophobicContact CZ3-CB 4.39Å; F2615-C2715 VanDerWaalsContact CA-O 3.31Å; F2615-C2715 WeakPolarHBondContact CA-O 3.36Å; L2616-C2715 HydrophobicContact CB-CB 4.43Å; L2616-C2715 PolarHBondContact N-O 3.5Å; L2616-C2715 PolarHBondContact O-N 2.87Å; C2631-C2715 WeakPolarHBondContact CA-SG 3.44Å; C2631-C2715 HydrophobicContact CB-CB 3.73Å; C2631-C2715 WeakPolarHBondContact CB-SG 3.1Å; C2631-C2715 WeakPolarHBondContact SG-CA 3.29Å; C2631-C2715 WeakPolarHBondContact SG-CB 3.09Å; C2631-C2715 CovalentContact SG-SG 2.04Å; C2631-C2715 PolarHBondContact SG-SG 3.36Å
2716	E	88.6	Confident	76.8	Confident	11 Å²	11	62.9 Å²	62.9	5%	0.051	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.6	173.7	-171.8	178.8	148.3	0	0	110.2	F2615 G2636 Y2637 P2639 R2647	F2615-E2716 HydrophobicContact CD1-CB 4.01Å; F2615-E2716 HydrophobicContact CD1-CG 4.17Å; F2615-E2716 HydrophobicContact CE1-CB 3.74Å; F2615-E2716 HydrophobicContact CE1-CG 3.59Å; F2615-E2716 HydrophobicContact CZ-CG 4.03Å; G2636-E2716 CarbonylContact C-O 3.45Å; G2636-E2716 WeakPolarHBondContact CA-O 3.38Å; Y2637-E2716 HydrophobicContact CD2-CB 4.02Å; Y2637-E2716 HydrophobicContact CE2-CB 3.65Å; Y2637-E2716 HydrophobicContact CE2-CG 3.68Å; Y2637-E2716 WeakPolarHBondContact CE2-OE1 3.33Å; Y2637-E2716 PolarHBondContact N-O 2.99Å; Y2637-E2716 PolarHBondContact O-N 3.39Å; Y2637-E2716 VanDerWaalsContact OH-CD 3.26Å; Y2637-E2716 PolarHBondContact OH-OE1 3.35Å; P2639-E2716 HydrophobicContact CB-CB 4.04Å; P2639-E2716 WeakPolarHBondContact CB-OE2 3.33Å; R2647-E2716 VanDerWaalsContact NH1-CD 3.33Å; R2647-E2716 IonicContact NH1-OE1 3.39Å; R2647-E2716 PolarHBondContact NH1-OE1 2.88Å; R2647-E2716 IonicContact NH1-OE2 2.69Å; R2647-E2716 PolarHBondContact NH1-OE2 3.09Å
2717	K	84.9	Confident	76	Confident	54 Å²	54	67.5 Å²	67.5	24%	0.235	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	138.1	175.6	-169.6	165.7	-172.6	164.9	0	109.9	W2600 C2614 Q2634 G2635	W2600-K2717 HydrophobicContact CE3-CB 4.01Å; W2600-K2717 HydrophobicContact CH2-CB 3.8Å; W2600-K2717 HydrophobicContact CH2-CD 3.96Å; W2600-K2717 HydrophobicContact CZ2-CD 4.12Å; W2600-K2717 HydrophobicContact CZ3-CB 3.41Å; W2600-K2717 VanDerWaalsContact CZ3-CB 3.41Å; W2600-K2717 HydrophobicContact CZ3-CD 4.3Å; C2614-K2717 WeakPolarHBondContact CB-O 3.43Å; C2614-K2717 PolarHBondContact N-O 2.81Å; C2614-K2717 PolarHBondContact O-N 3.48Å; Q2634-K2717 PolarHBondContact O-NZ 2.98Å; G2635-K2717 WeakPolarHBondContact O-CD 3.36Å; G2635-K2717 WeakPolarHBondContact O-CE 3.34Å
2718	G	74.4	Confident	74.9	Confident	43 Å²	43	69.9 Å²	69.9	44%	0.443	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-63.4	144.9	171.6	0	0	0	0	0	110.9
2719	P	67.7	Low	74.2	Confident	61 Å²	61	69.7 Å²	69.7	40%	0.396	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-58.1	146.7	169.6	26.7	-33.9	0	0	0	109.4	R2612	R2612-P2719 WeakPolarHBondContact O-CD 3.47Å
2720	K	57.8	Low	73.8	Confident	169 Å²	169	72.8 Å²	72.8	74%	0.735	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-56.7	134.5	171.8	-70.9	-174.3	178.5	-177.3	0	107.9	Y2722	K2720-Y2722 PolarHBondContact O-N 2.85Å
2721	P	54.5	Low	73.3	Confident	110 Å²	110	75.6 Å²	75.6	71%	0.714	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-57.2	139.3	173.9	25.5	-33.4	0	0	0	108.9	E2723	P2721-E2723 PolarHBondContact O-N 3.18Å
2722	Y	48.5	Very low	72.8	Confident	178 Å²	178	76.4 Å²	76.4	70%	0.698	40%	0.4	S	S	*	.			trans	-66	102.4	177.1	176.8	-104	0	0	0	109	K2720 E2724	K2720-Y2722 PolarHBondContact O-N 2.85Å; Y2722-E2724 HydrophobicContact CD1-CG 3.84Å; Y2722-E2724 HydrophobicContact CE1-CB 4.18Å; Y2722-E2724 HydrophobicContact CE1-CG 3.77Å; Y2722-E2724 PolarHBondContact O-N 3.5Å; Y2722-E2724 VanDerWaalsContact O-N 3.13Å
2723	E	54.4	Low	72.3	Confident	173 Å²	173	79.8 Å²	79.8	81%	0.808	42%	0.417	S	S	*	.			trans	-73.4	99.7	168.6	-72.2	-177	179.2	0	0	107.9	P2721	P2721-E2723 PolarHBondContact O-N 3.18Å
2724	E	55	Low	72	Confident	92 Å²	92	82.2 Å²	82.2	43%	0.43	44%	0.437	S	S	.	.			trans	-55.3	129.2	170.8	-45.7	-173.6	-178.4	0	0	108.5	Y2722 I2726	Y2722-E2724 HydrophobicContact CD1-CG 3.84Å; Y2722-E2724 HydrophobicContact CE1-CB 4.18Å; Y2722-E2724 HydrophobicContact CE1-CG 3.77Å; Y2722-E2724 PolarHBondContact O-N 3.5Å; Y2722-E2724 VanDerWaalsContact O-N 3.13Å; E2724-I2726 PolarHBondContact O-N 2.96Å
2725	P	62.1	Low	71.7	Confident	43 Å²	43	86.4 Å²	86.4	28%	0.279	46%	0.463	S	S	.	.			trans	-61	137.8	178.6	26.1	-33.6	0	0	0	109.1	Y2727 L2728	P2725-Y2727 HydrophobicContact CB-CD1 4.15Å; P2725-Y2727 HydrophobicContact CB-CE1 3.59Å; P2725-Y2727 HydrophobicContact CB-CE2 4.17Å; P2725-Y2727 HydrophobicContact CG-CE1 4.13Å; P2725-Y2727 HydrophobicContact CG-CE2 3.8Å; P2725-Y2727 PolarHBondContact O-N 2.99Å; P2725-L2728 HydrophobicContact CG-CB 4.34Å; P2725-L2728 WeakPolarHBondContact O-CB 3.47Å; P2725-L2728 PolarHBondContact O-N 3.33Å
2726	I	66.8	Low	71.4	Confident	128 Å²	128	90.4 Å²	90.4	66%	0.656	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-50.7	-33.8	-163.5	-60.7	170.6	0	0	0	113.3	E2724 L2728 Q2729 V2732	E2724-I2726 PolarHBondContact O-N 2.96Å; I2726-L2728 VanDerWaalsContact C-N 3.27Å; I2726-L2728 PolarHBondContact O-N 3.14Å; I2726-Q2729 PolarHBondContact O-N 3.17Å; I2726-V2732 HydrophobicContact CG2-CG2 4.1Å; I2726-V2732 WeakPolarHBondContact O-CB 3.41Å; I2726-V2732 VanDerWaalsContact O-CG2 3.3Å; I2726-V2732 WeakPolarHBondContact O-CG2 3.48Å
2727	Y	69.2	Low	71.5	Confident	154 Å²	154	93.4 Å²	93.4	60%	0.604	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-68.4	-16.4	178.2	56.5	-104.1	0	0	0	115.3	P2725 I2733	P2725-Y2727 HydrophobicContact CB-CD1 4.15Å; P2725-Y2727 HydrophobicContact CB-CE1 3.59Å; P2725-Y2727 HydrophobicContact CB-CE2 4.17Å; P2725-Y2727 HydrophobicContact CG-CE1 4.13Å; P2725-Y2727 HydrophobicContact CG-CE2 3.8Å; P2725-Y2727 PolarHBondContact O-N 2.99Å; Y2727-I2733 WeakPolarHBondContact O-CG1 3.47Å
2728	L	66.4	Low	71.8	Confident	86 Å²	86	95.3 Å²	95.3	45%	0.45	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-88.5	-16	179.3	-136.5	79.6	0	0	0	113.1	P2725 I2726 I2733	P2725-L2728 HydrophobicContact CG-CB 4.34Å; P2725-L2728 WeakPolarHBondContact O-CB 3.47Å; P2725-L2728 PolarHBondContact O-N 3.33Å; I2726-L2728 VanDerWaalsContact C-N 3.27Å; I2726-L2728 PolarHBondContact O-N 3.14Å; L2728-I2733 WeakPolarHBondContact O-CD1 3.25Å
2729	Q	71.6	Confident	72.6	Confident	89 Å²	89	95.8 Å²	95.8	42%	0.416	51%	0.514	S	S	.	.	S	Bend	trans	-62.6	134	-179.6	-72.5	-172.1	-13.4	0	0	110.6	I2726 A2731 V2732 I2733	I2726-Q2729 PolarHBondContact O-N 3.17Å; Q2729-A2731 PolarHBondContact O-N 2.97Å; Q2729-V2732 HydrophobicContact CB-CG2 4.32Å; Q2729-V2732 PolarHBondContact O-N 3.3Å; Q2729-I2733 PolarHBondContact O-N 3.5Å
2730	P	77.6	Confident	73.7	Confident	102 Å²	102	96.5 Å²	96.5	66%	0.662	52%	0.518	S	S	*	.	H	α-helix	trans	-54.3	-33.3	-177.8	-28.6	34.7	0	0	0	113.9	A2734	P2730-A2734 WeakPolarHBondContact O-CB 3.29Å; P2730-A2734 PolarHBondContact O-N 3Å
2731	A	80.7	Confident	75.4	Confident	66 Å²	66	92.9 Å²	92.9	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-64.8	-43.3	175.5	0	0	0	0	0	112.6	Q2729 A2734 T2735	Q2729-A2731 PolarHBondContact O-N 2.97Å; A2731-A2734 PolarHBondContact O-N 3.34Å; A2731-T2735 WeakPolarHBondContact O-CG2 3.48Å; A2731-T2735 PolarHBondContact O-N 3.45Å; A2731-T2735 PolarHBondContact O-OG1 2.79Å
2732	V	80.3	Confident	77.2	Confident	38 Å²	38	92.7 Å²	92.7	23%	0.23	50%	0.498	C	S	.	.	H	α-helix	trans	-70	-44.9	179.5	178.5	0	0	0	0	110.2	I2726 Q2729 A2734 T2735 I2736	I2726-V2732 HydrophobicContact CG2-CG2 4.1Å; I2726-V2732 WeakPolarHBondContact O-CB 3.41Å; I2726-V2732 VanDerWaalsContact O-CG2 3.3Å; I2726-V2732 WeakPolarHBondContact O-CG2 3.48Å; Q2729-V2732 HydrophobicContact CB-CG2 4.32Å; Q2729-V2732 PolarHBondContact O-N 3.3Å; V2732-A2734 VanDerWaalsContact C-N 3.3Å; V2732-A2734 PolarHBondContact O-N 3.04Å; V2732-T2735 WeakPolarHBondContact CA-OG1 3.38Å; V2732-T2735 PolarHBondContact O-N 3.27Å; V2732-T2735 VanDerWaalsContact O-N 3.13Å; V2732-T2735 PolarHBondContact O-OG1 2.82Å; V2732-I2736 HydrophobicContact CG1-CD1 3.99Å; V2732-I2736 WeakPolarHBondContact O-CG1 3.33Å; V2732-I2736 PolarHBondContact O-N 2.84Å
2733	I	82.4	Confident	79.3	Confident	79 Å²	79	89.6 Å²	89.6	41%	0.405	49%	0.493	S	S	.	.	H	α-helix	trans	-56.4	-46	173.1	-60.8	174.5	0	0	0	110.4	Y2727 L2728 Q2729 T2735 I2736 V2737	Y2727-I2733 WeakPolarHBondContact O-CG1 3.47Å; L2728-I2733 WeakPolarHBondContact O-CD1 3.25Å; Q2729-I2733 PolarHBondContact O-N 3.5Å; I2733-T2735 PolarHBondContact O-N 3.46Å; I2733-I2736 PolarHBondContact O-N 2.97Å; I2733-V2737 HydrophobicContact CG2-CG2 4.34Å; I2733-V2737 WeakPolarHBondContact O-CG2 3.31Å; I2733-V2737 PolarHBondContact O-N 3.12Å
2734	A	85.2	Confident	81.1	Confident	50 Å²	50	87.8 Å²	87.8	41%	0.413	48%	0.483	S	S	.	.	H	α-helix	trans	-61.1	-42.9	176.2	0	0	0	0	0	112.4	P2730 A2731 V2732 I2736 V2737 V2738	P2730-A2734 WeakPolarHBondContact O-CB 3.29Å; P2730-A2734 PolarHBondContact O-N 3Å; A2731-A2734 PolarHBondContact O-N 3.34Å; V2732-A2734 VanDerWaalsContact C-N 3.3Å; V2732-A2734 PolarHBondContact O-N 3.04Å; A2734-I2736 VanDerWaalsContact C-N 3.35Å; A2734-I2736 PolarHBondContact O-N 3.46Å; A2734-V2737 PolarHBondContact O-N 3.43Å; A2734-V2738 WeakPolarHBondContact O-CB 3.41Å; A2734-V2738 VanDerWaalsContact O-CG2 3.25Å; A2734-V2738 WeakPolarHBondContact O-CG2 3.34Å; A2734-V2738 PolarHBondContact O-N 2.99Å
2735	T	86.1	Confident	82.9	Confident	89 Å²	89	87.5 Å²	87.5	55%	0.546	48%	0.483	S	S	.	.	H	α-helix	trans	-64.1	-38.1	175.5	58	0	0	0	0	112.8	A2731 V2732 I2733 S2739	A2731-T2735 WeakPolarHBondContact O-CG2 3.48Å; A2731-T2735 PolarHBondContact O-N 3.45Å; A2731-T2735 PolarHBondContact O-OG1 2.79Å; V2732-T2735 WeakPolarHBondContact CA-OG1 3.38Å; V2732-T2735 PolarHBondContact O-N 3.27Å; V2732-T2735 VanDerWaalsContact O-N 3.13Å; V2732-T2735 PolarHBondContact O-OG1 2.82Å; I2733-T2735 PolarHBondContact O-N 3.46Å; T2735-S2739 VanDerWaalsContact O-CB 3.29Å; T2735-S2739 WeakPolarHBondContact O-CB 3.08Å; T2735-S2739 PolarHBondContact O-N 2.88Å; T2735-S2739 PolarHBondContact O-OG 2.83Å
2736	I	85.9	Confident	84.3	Confident	84 Å²	84	89.8 Å²	89.8	43%	0.431	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-51	175.3	-67.1	166.4	0	0	0	109.5	V2732 I2733 A2734 V2738 S2739 T2740	V2732-I2736 HydrophobicContact CG1-CD1 3.99Å; V2732-I2736 WeakPolarHBondContact O-CG1 3.33Å; V2732-I2736 PolarHBondContact O-N 2.84Å; I2733-I2736 PolarHBondContact O-N 2.97Å; A2734-I2736 VanDerWaalsContact C-N 3.35Å; A2734-I2736 PolarHBondContact O-N 3.46Å; I2736-V2738 PolarHBondContact O-N 3.09Å; I2736-S2739 PolarHBondContact O-N 2.97Å; I2736-S2739 VanDerWaalsContact O-N 3.14Å; I2736-S2739 PolarHBondContact O-OG 2.87Å; I2736-T2740 WeakPolarHBondContact O-CG2 3.35Å; I2736-T2740 PolarHBondContact O-N 3.43Å; I2736-T2740 PolarHBondContact O-OG1 3.42Å
2737	V	90.6	Very high	85.5	Confident	73 Å²	73	85.4 Å²	85.4	44%	0.442	48%	0.478	S	S	.	.	H	α-helix	trans	-61.8	-40.5	179.3	172	0	0	0	0	112.3	I2733 A2734 T2740 L2741	I2733-V2737 HydrophobicContact CG2-CG2 4.34Å; I2733-V2737 WeakPolarHBondContact O-CG2 3.31Å; I2733-V2737 PolarHBondContact O-N 3.12Å; A2734-V2737 PolarHBondContact O-N 3.43Å; V2737-T2740 PolarHBondContact O-OG1 3.39Å; V2737-T2740 VanDerWaalsContact O-OG1 3.08Å; V2737-L2741 HydrophobicContact CG1-CD1 4.02Å; V2737-L2741 VanDerWaalsContact O-CB 3.31Å; V2737-L2741 WeakPolarHBondContact O-CB 3.49Å; V2737-L2741 WeakPolarHBondContact O-CG 3.32Å; V2737-L2741 PolarHBondContact O-N 2.87Å
2738	V	90.8	Very high	86.6	Confident	94 Å²	94	81.9 Å²	81.9	57%	0.57	47%	0.47	S	S	*	.	H	α-helix	trans	-66.5	-40	174.5	170.1	0	0	0	0	110.8	A2734 I2736 L2742	A2734-V2738 WeakPolarHBondContact O-CB 3.41Å; A2734-V2738 VanDerWaalsContact O-CG2 3.25Å; A2734-V2738 WeakPolarHBondContact O-CG2 3.34Å; A2734-V2738 PolarHBondContact O-N 2.99Å; I2736-V2738 PolarHBondContact O-N 3.09Å; V2738-L2742 VanDerWaalsContact O-CB 3.31Å; V2738-L2742 WeakPolarHBondContact O-CB 3.46Å; V2738-L2742 PolarHBondContact O-N 3.05Å
2739	S	90.2	Very high	87.8	Confident	53 Å²	53	83 Å²	83	37%	0.371	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-41	177.4	77.5	0	0	0	0	112.5	T2735 I2736 L2742 I2743	T2735-S2739 VanDerWaalsContact O-CB 3.29Å; T2735-S2739 WeakPolarHBondContact O-CB 3.08Å; T2735-S2739 PolarHBondContact O-N 2.88Å; T2735-S2739 PolarHBondContact O-OG 2.83Å; I2736-S2739 PolarHBondContact O-N 2.97Å; I2736-S2739 VanDerWaalsContact O-N 3.14Å; I2736-S2739 PolarHBondContact O-OG 2.87Å; S2739-L2742 PolarHBondContact O-N 2.92Å; S2739-I2743 WeakPolarHBondContact O-CB 3.15Å; S2739-I2743 WeakPolarHBondContact O-CD1 3.47Å; S2739-I2743 VanDerWaalsContact O-CG1 3.25Å; S2739-I2743 WeakPolarHBondContact O-CG1 3.23Å; S2739-I2743 PolarHBondContact O-N 3.39Å
2740	T	91.7	Very high	88.4	Confident	77 Å²	77	82.5 Å²	82.5	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-71.4	-38	178	55.4	0	0	0	0	111.5	I2736 V2737 I2743 F2744	I2736-T2740 WeakPolarHBondContact O-CG2 3.35Å; I2736-T2740 PolarHBondContact O-N 3.43Å; I2736-T2740 PolarHBondContact O-OG1 3.42Å; V2737-T2740 PolarHBondContact O-OG1 3.39Å; V2737-T2740 VanDerWaalsContact O-OG1 3.08Å; T2740-I2743 PolarHBondContact O-N 2.9Å; T2740-F2744 VanDerWaalsContact O-CB 3.27Å; T2740-F2744 WeakPolarHBondContact O-CB 3.22Å; T2740-F2744 PolarHBondContact O-N 2.04Å
2741	L	93.6	Very high	88.9	Confident	93 Å²	93	82.7 Å²	82.7	49%	0.487	47%	0.469	S	S	.	.	H	α-helix	trans	-61	-44.1	169.3	-82.9	167.6	0	0	0	111.9	V2737 F2744 I2745	V2737-L2741 HydrophobicContact CG1-CD1 4.02Å; V2737-L2741 VanDerWaalsContact O-CB 3.31Å; V2737-L2741 WeakPolarHBondContact O-CB 3.49Å; V2737-L2741 WeakPolarHBondContact O-CG 3.32Å; V2737-L2741 PolarHBondContact O-N 2.87Å; L2741-F2744 PolarHBondContact O-N 2.84Å; L2741-I2745 WeakPolarHBondContact O-CB 3.31Å; L2741-I2745 WeakPolarHBondContact O-CD1 3.25Å; L2741-I2745 VanDerWaalsContact O-CG1 3.23Å; L2741-I2745 WeakPolarHBondContact O-CG1 3.14Å; L2741-I2745 PolarHBondContact O-N 3.02Å
2742	L	92.9	Very high	89.3	Confident	105 Å²	105	85.6 Å²	85.6	55%	0.55	47%	0.473	S	S	.	.	H	α-helix	trans	-62.3	-46.3	177.8	-164.4	86.1	0	0	0	111.1	V2738 S2739 F2744 I2745 I2746	V2738-L2742 VanDerWaalsContact O-CB 3.31Å; V2738-L2742 WeakPolarHBondContact O-CB 3.46Å; V2738-L2742 PolarHBondContact O-N 3.05Å; S2739-L2742 PolarHBondContact O-N 2.92Å; L2742-F2744 VanDerWaalsContact C-N 3.34Å; L2742-F2744 PolarHBondContact O-N 2.93Å; L2742-I2745 PolarHBondContact O-N 2.88Å; L2742-I2746 HydrophobicContact CD2-CD1 4.22Å; L2742-I2746 HydrophobicContact CG-CD1 4.05Å; L2742-I2746 WeakPolarHBondContact O-CB 3.35Å; L2742-I2746 WeakPolarHBondContact O-CD1 3.4Å; L2742-I2746 VanDerWaalsContact O-CG1 3.23Å; L2742-I2746 WeakPolarHBondContact O-CG1 3.2Å; L2742-I2746 PolarHBondContact O-N 2.85Å
2743	I	92.3	Very high	89.6	Confident	114 Å²	114	92.3 Å²	92.3	59%	0.585	50%	0.495	S	S	*	.	H	α-helix	trans	-61.4	-42.2	175.9	-70	164.1	0	0	0	110.8	S2739 T2740 I2746 G2747	S2739-I2743 WeakPolarHBondContact O-CB 3.15Å; S2739-I2743 WeakPolarHBondContact O-CD1 3.47Å; S2739-I2743 VanDerWaalsContact O-CG1 3.25Å; S2739-I2743 WeakPolarHBondContact O-CG1 3.23Å; S2739-I2743 PolarHBondContact O-N 3.39Å; T2740-I2743 PolarHBondContact O-N 2.9Å; I2743-I2746 PolarHBondContact O-N 2.92Å; I2743-G2747 PolarHBondContact O-N 2.84Å
2744	F	92.6	Very high	89.8	Confident	134 Å²	134	95 Å²	95	59%	0.588	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-41	177.1	-174.7	-104.3	0	0	0	112.4	T2740 L2741 L2742 G2747 L2748	T2740-F2744 VanDerWaalsContact O-CB 3.27Å; T2740-F2744 WeakPolarHBondContact O-CB 3.22Å; T2740-F2744 PolarHBondContact O-N 2.04Å; L2741-F2744 PolarHBondContact O-N 2.84Å; L2742-F2744 VanDerWaalsContact C-N 3.34Å; L2742-F2744 PolarHBondContact O-N 2.93Å; F2744-G2747 PolarHBondContact O-N 3.36Å; F2744-L2748 HydrophobicContact CD1-CD1 3.87Å; F2744-L2748 HydrophobicContact CD1-CG 4.44Å; F2744-L2748 HydrophobicContact CE1-CD1 3.42Å; F2744-L2748 VanDerWaalsContact CE1-CD1 3.42Å; F2744-L2748 HydrophobicContact CE1-CG 4.1Å; F2744-L2748 HydrophobicContact CZ-CD1 4Å; F2744-L2748 HydrophobicContact CZ-CG 4.28Å; F2744-L2748 PolarHBondContact O-N 2.64Å
2745	I	92.2	Very high	90	Very high	87 Å²	87	96.3 Å²	96.3	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-42.6	173.9	-70	163.3	0	0	0	110.6	L2741 L2742 G2747 L2748 L2749	L2741-I2745 WeakPolarHBondContact O-CB 3.31Å; L2741-I2745 WeakPolarHBondContact O-CD1 3.25Å; L2741-I2745 VanDerWaalsContact O-CG1 3.23Å; L2741-I2745 WeakPolarHBondContact O-CG1 3.14Å; L2741-I2745 PolarHBondContact O-N 3.02Å; L2742-I2745 PolarHBondContact O-N 2.88Å; I2745-G2747 VanDerWaalsContact C-N 3.33Å; I2745-G2747 PolarHBondContact O-N 2.74Å; I2745-L2748 PolarHBondContact O-N 2.94Å; I2745-L2749 HydrophobicContact CG2-CD1 3.9Å; I2745-L2749 HydrophobicContact CG2-CG 4.33Å; I2745-L2749 WeakPolarHBondContact O-CB 3.38Å; I2745-L2749 VanDerWaalsContact O-CG 3.26Å; I2745-L2749 WeakPolarHBondContact O-CG 3.44Å; I2745-L2749 PolarHBondContact O-N 3.36Å
2746	I	91.1	Very high	89.9	Confident	90 Å²	90	97.9 Å²	97.9	46%	0.462	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-39.8	174.6	-68.1	163	0	0	0	110.7	L2742 I2743 L2749 T2750	L2742-I2746 HydrophobicContact CD2-CD1 4.22Å; L2742-I2746 HydrophobicContact CG-CD1 4.05Å; L2742-I2746 WeakPolarHBondContact O-CB 3.35Å; L2742-I2746 WeakPolarHBondContact O-CD1 3.4Å; L2742-I2746 VanDerWaalsContact O-CG1 3.23Å; L2742-I2746 WeakPolarHBondContact O-CG1 3.2Å; L2742-I2746 PolarHBondContact O-N 2.85Å; I2743-I2746 PolarHBondContact O-N 2.92Å; I2746-L2749 PolarHBondContact O-N 2.93Å; I2746-T2750 HydrophobicContact CG2-CG2 4.49Å; I2746-T2750 WeakPolarHBondContact O-CB 3.44Å; I2746-T2750 WeakPolarHBondContact O-CG2 3.36Å; I2746-T2750 PolarHBondContact O-N 2.88Å; I2746-T2750 PolarHBondContact O-OG1 3.12Å
2747	G	92.7	Very high	89.8	Confident	36 Å²	36	96.8 Å²	96.8	37%	0.371	50%	0.498	S	S	.	.	H	α-helix	trans	-61	-45.6	172.7	0	0	0	0	0	112.8	I2743 F2744 I2745 T2750 F2751	I2743-G2747 PolarHBondContact O-N 2.84Å; F2744-G2747 PolarHBondContact O-N 3.36Å; I2745-G2747 VanDerWaalsContact C-N 3.33Å; I2745-G2747 PolarHBondContact O-N 2.74Å; G2747-T2750 WeakPolarHBondContact CA-OG1 3.43Å; G2747-T2750 PolarHBondContact O-OG1 3.37Å; G2747-F2751 VanDerWaalsContact O-CB 3.25Å; G2747-F2751 WeakPolarHBondContact O-CB 3.17Å; G2747-F2751 PolarHBondContact O-N 2.92Å
2748	L	91.8	Very high	89.3	Confident	81 Å²	81	98.9 Å²	98.9	42%	0.424	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-42.1	174.7	-80.6	174.9	0	0	0	112.4	F2744 I2745 F2751 M2752	F2744-L2748 HydrophobicContact CD1-CD1 3.87Å; F2744-L2748 HydrophobicContact CD1-CG 4.44Å; F2744-L2748 HydrophobicContact CE1-CD1 3.42Å; F2744-L2748 VanDerWaalsContact CE1-CD1 3.42Å; F2744-L2748 HydrophobicContact CE1-CG 4.1Å; F2744-L2748 HydrophobicContact CZ-CD1 4Å; F2744-L2748 HydrophobicContact CZ-CG 4.28Å; F2744-L2748 PolarHBondContact O-N 2.64Å; I2745-L2748 PolarHBondContact O-N 2.94Å; L2748-F2751 PolarHBondContact O-N 3.47Å; L2748-M2752 VanDerWaalsContact O-CB 3.3Å; L2748-M2752 WeakPolarHBondContact O-CB 3.23Å; L2748-M2752 WeakPolarHBondContact O-CG 3.27Å; L2748-M2752 PolarHBondContact O-N 3.14Å
2749	L	90.7	Very high	88.7	Confident	108 Å²	108	100.6 Å²	100.6	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-65.8	-41.9	177.8	-74.1	172.1	0	0	0	111.5	I2745 I2746 W2753	I2745-L2749 HydrophobicContact CG2-CD1 3.9Å; I2745-L2749 HydrophobicContact CG2-CG 4.33Å; I2745-L2749 WeakPolarHBondContact O-CB 3.38Å; I2745-L2749 VanDerWaalsContact O-CG 3.26Å; I2745-L2749 WeakPolarHBondContact O-CG 3.44Å; I2745-L2749 PolarHBondContact O-N 3.36Å; I2746-L2749 PolarHBondContact O-N 2.93Å; L2749-W2753 WeakPolarHBondContact O-CB 3.4Å; L2749-W2753 PolarHBondContact O-N 3.26Å
2750	T	85.5	Confident	88	Confident	79 Å²	79	104.9 Å²	104.9	49%	0.485	51%	0.511	S	S	.	.	H	α-helix	trans	-68.5	-37.3	175.1	50.3	0	0	0	0	112	I2746 G2747 W2753 W2754	I2746-T2750 HydrophobicContact CG2-CG2 4.49Å; I2746-T2750 WeakPolarHBondContact O-CB 3.44Å; I2746-T2750 WeakPolarHBondContact O-CG2 3.36Å; I2746-T2750 PolarHBondContact O-N 2.88Å; I2746-T2750 PolarHBondContact O-OG1 3.12Å; G2747-T2750 WeakPolarHBondContact CA-OG1 3.43Å; G2747-T2750 PolarHBondContact O-OG1 3.37Å; T2750-W2753 PolarHBondContact O-N 3.34Å; T2750-W2754 WeakPolarHBondContact O-CB 3.31Å; T2750-W2754 PolarHBondContact O-N 2.89Å
2751	F	88.5	Confident	87.1	Confident	106 Å²	106	104 Å²	104	47%	0.465	51%	0.512	S	S	.	.	H	α-helix	trans	-67.4	-44.6	173.2	-176.4	-107.2	0	0	0	112.8	G2747 L2748 W2753 W2754 L2755	G2747-F2751 VanDerWaalsContact O-CB 3.25Å; G2747-F2751 WeakPolarHBondContact O-CB 3.17Å; G2747-F2751 PolarHBondContact O-N 2.92Å; L2748-F2751 PolarHBondContact O-N 3.47Å; F2751-W2753 VanDerWaalsContact C-N 3.31Å; F2751-W2753 PolarHBondContact O-N 3.5Å; F2751-W2754 HydrophobicContact CD2-CE3 4.1Å; F2751-W2754 AromaticContact CE2-CE3 3.92Å; F2751-W2754 HydrophobicContact CE2-CE3 3.92Å; F2751-W2754 AromaticContact CE2-CZ3 3.93Å; F2751-W2754 HydrophobicContact CE2-CZ3 3.93Å; F2751-W2754 WeakPolarHBondContact O-CB 3.34Å; F2751-W2754 PolarHBondContact O-N 3.19Å; F2751-L2755 HydrophobicContact CD1-CD1 3.96Å; F2751-L2755 HydrophobicContact CD1-CG 4.44Å; F2751-L2755 HydrophobicContact CE1-CD1 3.54Å; F2751-L2755 HydrophobicContact CE1-CG 4.13Å; F2751-L2755 HydrophobicContact CZ-CD1 4.05Å; F2751-L2755 HydrophobicContact CZ-CD2 4.36Å; F2751-L2755 HydrophobicContact CZ-CG 4.25Å; F2751-L2755 WeakPolarHBondContact O-CG 3.25Å; F2751-L2755 PolarHBondContact O-N 3.22Å
2752	M	89.2	Confident	86.1	Confident	127 Å²	127	106.4 Å²	106.4	63%	0.626	52%	0.519	S	S	*	.	H	α-helix	trans	-62.7	-38.3	172.5	-80.2	-165.5	152.2	0	0	111.8	L2748 L2755 K2756	L2748-M2752 VanDerWaalsContact O-CB 3.3Å; L2748-M2752 WeakPolarHBondContact O-CB 3.23Å; L2748-M2752 WeakPolarHBondContact O-CG 3.27Å; L2748-M2752 PolarHBondContact O-N 3.14Å; M2752-L2755 PolarHBondContact O-N 2.56Å; M2752-K2756 VanDerWaalsContact O-CB 3.24Å; M2752-K2756 WeakPolarHBondContact O-CB 3.27Å; M2752-K2756 PolarHBondContact O-N 3.04Å
2753	W	84.7	Confident	85	Confident	180 Å²	180	106.7 Å²	106.7	68%	0.682	52%	0.517	S	S	*	.	H	α-helix	trans	-65.4	-39	173.9	-173.5	70	0	0	0	111.5	L2749 T2750 F2751 K2756 S2757	L2749-W2753 WeakPolarHBondContact O-CB 3.4Å; L2749-W2753 PolarHBondContact O-N 3.26Å; T2750-W2753 PolarHBondContact O-N 3.34Å; F2751-W2753 VanDerWaalsContact C-N 3.31Å; F2751-W2753 PolarHBondContact O-N 3.5Å; W2753-K2756 PolarHBondContact O-N 2.93Å; W2753-S2757 WeakPolarHBondContact O-CB 3.38Å; W2753-S2757 PolarHBondContact O-N 2.78Å
2754	W	87.8	Confident	84	Confident	134 Å²	134	107.2 Å²	107.2	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-46	173	-177.9	75.3	0	0	0	112.4	T2750 F2751 S2757 K2758	T2750-W2754 WeakPolarHBondContact O-CB 3.31Å; T2750-W2754 PolarHBondContact O-N 2.89Å; F2751-W2754 HydrophobicContact CD2-CE3 4.1Å; F2751-W2754 AromaticContact CE2-CE3 3.92Å; F2751-W2754 HydrophobicContact CE2-CE3 3.92Å; F2751-W2754 AromaticContact CE2-CZ3 3.93Å; F2751-W2754 HydrophobicContact CE2-CZ3 3.93Å; F2751-W2754 WeakPolarHBondContact O-CB 3.34Å; F2751-W2754 PolarHBondContact O-N 3.19Å; W2754-S2757 WeakPolarHBondContact O-CB 3.24Å; W2754-S2757 PolarHBondContact O-N 2.68Å; W2754-K2758 WeakPolarHBondContact O-CB 3.39Å; W2754-K2758 PolarHBondContact O-N 3.32Å
2755	L	88.9	Confident	82.8	Confident	78 Å²	78	108.6 Å²	108.6	41%	0.408	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-46.8	173.8	-71.7	176.8	0	0	0	111.8	F2751 M2752 S2757 K2758 Q2759	F2751-L2755 HydrophobicContact CD1-CD1 3.96Å; F2751-L2755 HydrophobicContact CD1-CG 4.44Å; F2751-L2755 HydrophobicContact CE1-CD1 3.54Å; F2751-L2755 HydrophobicContact CE1-CG 4.13Å; F2751-L2755 HydrophobicContact CZ-CD1 4.05Å; F2751-L2755 HydrophobicContact CZ-CD2 4.36Å; F2751-L2755 HydrophobicContact CZ-CG 4.25Å; F2751-L2755 WeakPolarHBondContact O-CG 3.25Å; F2751-L2755 PolarHBondContact O-N 3.22Å; M2752-L2755 PolarHBondContact O-N 2.56Å; L2755-S2757 VanDerWaalsContact C-N 3.32Å; L2755-S2757 PolarHBondContact O-N 3.37Å; L2755-K2758 WeakPolarHBondContact O-CB 3.44Å; L2755-K2758 PolarHBondContact O-N 3.41Å; L2755-Q2759 PolarHBondContact O-N 3.36Å
2756	K	84.5	Confident	81.7	Confident	123 Å²	123	110.5 Å²	110.5	54%	0.535	53%	0.528	S	S	.	.	H	α-helix	trans	-65.6	-34.9	177.3	-167.1	168.7	-172.2	168.1	0	111.8	M2752 W2753 Q2759 R2760	M2752-K2756 VanDerWaalsContact O-CB 3.24Å; M2752-K2756 WeakPolarHBondContact O-CB 3.27Å; M2752-K2756 PolarHBondContact O-N 3.04Å; W2753-K2756 PolarHBondContact O-N 2.93Å; K2756-Q2759 PolarHBondContact O-N 3.13Å; K2756-R2760 WeakPolarHBondContact O-CG 3.36Å; K2756-R2760 PolarHBondContact O-N 2.68Å
2757	S	83	Confident	80.5	Confident	61 Å²	61	114.6 Å²	114.6	43%	0.427	54%	0.538	S	S	.	.	H	α-helix	trans	-63.4	-45.7	171.7	-179.8	0	0	0	0	110.9	W2753 W2754 L2755 Q2759 R2760 A2761	W2753-S2757 WeakPolarHBondContact O-CB 3.38Å; W2753-S2757 PolarHBondContact O-N 2.78Å; W2754-S2757 WeakPolarHBondContact O-CB 3.24Å; W2754-S2757 PolarHBondContact O-N 2.68Å; L2755-S2757 VanDerWaalsContact C-N 3.32Å; L2755-S2757 PolarHBondContact O-N 3.37Å; S2757-Q2759 VanDerWaalsContact C-N 3.34Å; S2757-Q2759 PolarHBondContact O-N 2.96Å; S2757-R2760 PolarHBondContact O-N 2.95Å; S2757-R2760 VanDerWaalsContact O-N 3.17Å; S2757-A2761 WeakPolarHBondContact O-CB 3.24Å; S2757-A2761 PolarHBondContact O-N 3.49Å
2758	K	80.3	Confident	79.1	Confident	117 Å²	117	118.1 Å²	118.1	51%	0.509	54%	0.543	S	S	.	.	H	α-helix	trans	-62.2	-37.6	176.9	-147.5	172.8	-170.3	173.9	0	112.4	W2754 L2755 K2762	W2754-K2758 WeakPolarHBondContact O-CB 3.39Å; W2754-K2758 PolarHBondContact O-N 3.32Å; L2755-K2758 WeakPolarHBondContact O-CB 3.44Å; L2755-K2758 PolarHBondContact O-N 3.41Å; K2758-K2762 PolarHBondContact O-N 2.92Å
2759	Q	79.4	Confident	77.8	Confident	130 Å²	130	117.5 Å²	117.5	61%	0.607	55%	0.546	S	S	*	.	H	α-helix	trans	-67.7	-45.1	170.8	-83.4	-177.5	-28.1	0	0	112.8	L2755 K2756 S2757 A2761 K2762 Q2763	L2755-Q2759 PolarHBondContact O-N 3.36Å; K2756-Q2759 PolarHBondContact O-N 3.13Å; S2757-Q2759 VanDerWaalsContact C-N 3.34Å; S2757-Q2759 PolarHBondContact O-N 2.96Å; Q2759-A2761 VanDerWaalsContact C-N 3.26Å; Q2759-A2761 PolarHBondContact O-N 2.9Å; Q2759-K2762 PolarHBondContact O-N 3.3Å; Q2759-Q2763 PolarHBondContact O-N 3.24Å
2760	R	74.3	Confident	76.7	Confident	142 Å²	142	115.8 Å²	115.8	54%	0.536	54%	0.542	S	S	.	.	H	α-helix	trans	-59.4	-37.9	174.5	-73.1	-172.7	-135.9	-164.5	6.9	111.8	K2756 S2757 Q2763 F2764	K2756-R2760 WeakPolarHBondContact O-CG 3.36Å; K2756-R2760 PolarHBondContact O-N 2.68Å; S2757-R2760 PolarHBondContact O-N 2.95Å; S2757-R2760 VanDerWaalsContact O-N 3.17Å; R2760-Q2763 PolarHBondContact O-N 3.2Å; R2760-F2764 VanDerWaalsContact O-CB 3.24Å; R2760-F2764 WeakPolarHBondContact O-CB 3.26Å; R2760-F2764 PolarHBondContact O-N 2.9Å
2761	A	72.8	Confident	75.3	Confident	59 Å²	59	117 Å²	117	49%	0.488	55%	0.546	S	S	.	.	H	α-helix	trans	-62.9	-42.5	176.4	0	0	0	0	0	112.1	S2757 Q2759 F2764 F2765	S2757-A2761 WeakPolarHBondContact O-CB 3.24Å; S2757-A2761 PolarHBondContact O-N 3.49Å; Q2759-A2761 VanDerWaalsContact C-N 3.26Å; Q2759-A2761 PolarHBondContact O-N 2.9Å; A2761-F2764 PolarHBondContact O-N 2.8Å; A2761-F2765 PolarHBondContact O-N 3.41Å
2762	K	73.7	Confident	73.9	Confident	144 Å²	144	121 Å²	121	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-60.6	-51.9	173.1	-72.6	-176.2	173.9	-168.9	0	111.8	K2758 Q2759 F2764 F2765 E2766	K2758-K2762 PolarHBondContact O-N 2.92Å; Q2759-K2762 PolarHBondContact O-N 3.3Å; K2762-F2764 VanDerWaalsContact C-N 3.27Å; K2762-F2764 PolarHBondContact O-N 3.41Å; K2762-F2765 WeakPolarHBondContact O-CB 3.37Å; K2762-F2765 PolarHBondContact O-N 3.26Å; K2762-E2766 PolarHBondContact O-N 3.17Å
2763	Q	69.8	Low	72.5	Confident	110 Å²	110	118 Å²	118	51%	0.514	55%	0.553	S	S	.	*	H	α-helix	trans	-61	-34.4	178.5	-69.6	178.1	-17.3	0	0	112.9	Q2759 R2760 R2767	Q2759-Q2763 PolarHBondContact O-N 3.24Å; R2760-Q2763 PolarHBondContact O-N 3.2Å; Q2763-R2767 WeakPolarHBondContact O-CG 3.42Å; Q2763-R2767 PolarHBondContact O-N 2.91Å
2764	F	71.3	Confident	71.5	Confident	126 Å²	126	111.7 Å²	111.7	55%	0.553	54%	0.536	S	S	*	.	H	α-helix	trans	-70.9	-33	175.6	-172.4	-105.8	0	0	0	112.5	R2760 A2761 K2762 K2768	R2760-F2764 VanDerWaalsContact O-CB 3.24Å; R2760-F2764 WeakPolarHBondContact O-CB 3.26Å; R2760-F2764 PolarHBondContact O-N 2.9Å; A2761-F2764 PolarHBondContact O-N 2.8Å; K2762-F2764 VanDerWaalsContact C-N 3.27Å; K2762-F2764 PolarHBondContact O-N 3.41Å; F2764-K2768 HydrophobicContact CD1-CD 4.41Å; F2764-K2768 HydrophobicContact CE1-CD 3.95Å; F2764-K2768 VanDerWaalsContact CE1-CE 3.46Å; F2764-K2768 HydrophobicContact CZ-CD 4.36Å; F2764-K2768 VanDerWaalsContact CZ-CE 3.49Å; F2764-K2768 PolarHBondContact O-N 2.7Å; F2764-K2768 VanDerWaalsContact O-N 3.16Å
2765	F	67.4	Low	70.1	Confident	162 Å²	162	110.4 Å²	110.4	71%	0.711	54%	0.538	S	S	*	.	H	α-helix	trans	-70	-42.6	175	-148.3	-85.8	0	0	0	111.6	A2761 K2762 R2767 K2768 S2769	A2761-F2765 PolarHBondContact O-N 3.41Å; K2762-F2765 WeakPolarHBondContact O-CB 3.37Å; K2762-F2765 PolarHBondContact O-N 3.26Å; F2765-R2767 PolarHBondContact O-N 3.41Å; F2765-K2768 PolarHBondContact O-N 2.95Å; F2765-K2768 VanDerWaalsContact O-N 3.1Å; F2765-S2769 PolarHBondContact O-N 3.18Å
2766	E	68.4	Low	68.6	Low	127 Å²	127	115.9 Å²	115.9	59%	0.593	55%	0.553	S	S	*	*	H	α-helix	trans	-62.1	-40.6	174.2	-71.2	167.3	176.7	0	0	112.3	K2762 K2768 S2769 S2770	K2762-E2766 PolarHBondContact O-N 3.17Å; E2766-K2768 VanDerWaalsContact C-N 3.27Å; E2766-K2768 PolarHBondContact O-N 3.04Å; E2766-S2769 PolarHBondContact O-N 2.75Å; E2766-S2769 PolarHBondContact O-OG 3.46Å; E2766-S2770 PolarHBondContact O-N 3.47Å; E2766-S2770 VanDerWaalsContact O-N 3.09Å; E2766-S2770 PolarHBondContact O-OG 2.91Å
2767	R	66.1	Low	67.4	Low	177 Å²	177	113.7 Å²	113.7	67%	0.668	55%	0.553	S	S	*	*	H	α-helix	trans	-66	-25.9	173	-73.5	177.9	-179	-168.5	-0.2	113.5	Q2763 F2765 S2770 L2771	Q2763-R2767 WeakPolarHBondContact O-CG 3.42Å; Q2763-R2767 PolarHBondContact O-N 2.91Å; F2765-R2767 PolarHBondContact O-N 3.41Å; R2767-S2770 PolarHBondContact O-OG 3.05Å; R2767-L2771 PolarHBondContact O-N 3.39Å
2768	K	62.4	Low	66.1	Low	110 Å²	110	116.8 Å²	116.8	48%	0.478	56%	0.564	S	S	.	*	H	α-helix	trans	-84.3	-29.2	174.6	-82.3	-171.9	172.5	-176.9	0	113.4	F2764 F2765 E2766 R2772	F2764-K2768 HydrophobicContact CD1-CD 4.41Å; F2764-K2768 HydrophobicContact CE1-CD 3.95Å; F2764-K2768 VanDerWaalsContact CE1-CE 3.46Å; F2764-K2768 HydrophobicContact CZ-CD 4.36Å; F2764-K2768 VanDerWaalsContact CZ-CE 3.49Å; F2764-K2768 PolarHBondContact O-N 2.7Å; F2764-K2768 VanDerWaalsContact O-N 3.16Å; F2765-K2768 PolarHBondContact O-N 2.95Å; F2765-K2768 VanDerWaalsContact O-N 3.1Å; E2766-K2768 VanDerWaalsContact C-N 3.27Å; E2766-K2768 PolarHBondContact O-N 3.04Å; K2768-R2772 PolarHBondContact O-N 2.92Å
2769	S	64.8	Low	64.8	Low	68 Å²	68	118.6 Å²	118.6	48%	0.476	57%	0.572	S	S	.	*	H	α-helix	trans	-72.6	-41.2	173.9	59.7	0	0	0	0	111.4	F2765 E2766 R2772 A2773	F2765-S2769 PolarHBondContact O-N 3.18Å; E2766-S2769 PolarHBondContact O-N 2.75Å; E2766-S2769 PolarHBondContact O-OG 3.46Å; S2769-R2772 PolarHBondContact O-N 3.34Å; S2769-A2773 PolarHBondContact O-N 3.39Å
2770	S	67.3	Low	63.6	Low	71 Å²	71	118.5 Å²	118.5	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-63.4	-43.2	175.8	63.1	0	0	0	0	112.8	E2766 R2767 R2772 A2773 S2774	E2766-S2770 PolarHBondContact O-N 3.47Å; E2766-S2770 VanDerWaalsContact O-N 3.09Å; E2766-S2770 PolarHBondContact O-OG 2.91Å; R2767-S2770 PolarHBondContact O-OG 3.05Å; S2770-R2772 VanDerWaalsContact C-N 3.32Å; S2770-R2772 PolarHBondContact O-N 2.73Å; S2770-A2773 WeakPolarHBondContact O-CB 3.48Å; S2770-A2773 PolarHBondContact O-N 3.13Å; S2770-A2773 VanDerWaalsContact O-N 3.14Å; S2770-S2774 PolarHBondContact O-N 3.14Å; S2770-S2774 PolarHBondContact O-OG 3.44Å
2771	L	57.6	Low	62.6	Low	106 Å²	106	113.8 Å²	113.8	56%	0.555	57%	0.572	S	S	*	*	H	α-helix	trans	-62.9	-32.7	174.7	-94.9	166.4	0	0	0	113.6	R2767 S2774 I2775	R2767-L2771 PolarHBondContact O-N 3.39Å; L2771-S2774 PolarHBondContact O-OG 3.4Å; L2771-I2775 WeakPolarHBondContact O-CD1 3.46Å; L2771-I2775 VanDerWaalsContact O-CG1 3.27Å; L2771-I2775 WeakPolarHBondContact O-CG1 3.46Å; L2771-I2775 PolarHBondContact O-N 3.43Å
2772	R	58.9	Low	61.5	Low	189 Å²	189	113.8 Å²	113.8	71%	0.713	57%	0.568	S	S	*	*	H	α-helix	trans	-76.1	-26.8	174.2	-76.7	-179.3	179.1	165.5	-1.2	113	K2768 S2769 S2770 R2776	K2768-R2772 PolarHBondContact O-N 2.92Å; S2769-R2772 PolarHBondContact O-N 3.34Å; S2770-R2772 VanDerWaalsContact C-N 3.32Å; S2770-R2772 PolarHBondContact O-N 2.73Å; R2772-R2776 PolarHBondContact O-N 2.88Å
2773	A	59	Low	60.1	Low	63 Å²	63	111 Å²	111	52%	0.521	57%	0.572	S	S	.	*	H	α-helix	trans	-71.3	-46	173.5	0	0	0	0	0	111.3	S2769 S2770 I2775 R2776 S2777	S2769-A2773 PolarHBondContact O-N 3.39Å; S2770-A2773 WeakPolarHBondContact O-CB 3.48Å; S2770-A2773 PolarHBondContact O-N 3.13Å; S2770-A2773 VanDerWaalsContact O-N 3.14Å; A2773-I2775 PolarHBondContact O-N 2.89Å; A2773-R2776 PolarHBondContact O-N 2.92Å; A2773-R2776 VanDerWaalsContact O-N 3.17Å; A2773-S2777 PolarHBondContact O-N 3.37Å
2774	S	63.4	Low	59	Low	48 Å²	48	109.6 Å²	109.6	34%	0.336	58%	0.579	S	S	.	*	H	α-helix	trans	-67.2	-35.1	179.1	61.3	0	0	0	0	113.4	S2770 L2771 R2776 S2777 L2778	S2770-S2774 PolarHBondContact O-N 3.14Å; S2770-S2774 PolarHBondContact O-OG 3.44Å; L2771-S2774 PolarHBondContact O-OG 3.4Å; S2774-R2776 VanDerWaalsContact C-N 3.29Å; S2774-R2776 PolarHBondContact O-N 3.47Å; S2774-S2777 PolarHBondContact O-N 3.05Å; S2774-S2777 PolarHBondContact O-OG 2.91Å; S2774-S2777 VanDerWaalsContact O-OG 3.06Å; S2774-L2778 WeakPolarHBondContact O-CB 3.45Å; S2774-L2778 PolarHBondContact O-N 3.45Å
2775	I	58.2	Low	57.8	Low	108 Å²	108	108.8 Å²	108.8	55%	0.554	59%	0.585	S	S	*	*	H	α-helix	trans	-65.3	-32.8	173.6	-69.5	169.2	0	0	0	111.4	L2771 A2773 K2779	L2771-I2775 WeakPolarHBondContact O-CD1 3.46Å; L2771-I2775 VanDerWaalsContact O-CG1 3.27Å; L2771-I2775 WeakPolarHBondContact O-CG1 3.46Å; L2771-I2775 PolarHBondContact O-N 3.43Å; A2773-I2775 PolarHBondContact O-N 2.89Å; I2775-K2779 WeakPolarHBondContact O-CB 3.45Å; I2775-K2779 PolarHBondContact O-N 3.22Å
2776	R	57.3	Low	56.1	Low	193 Å²	193	107.7 Å²	107.7	73%	0.728	59%	0.586	S	S	*	*	H	α-helix	trans	-72.8	-37.9	173.9	-77	-177.3	178.4	172	-1.5	112.8	R2772 A2773 S2774 K2779 N2780	R2772-R2776 PolarHBondContact O-N 2.88Å; A2773-R2776 PolarHBondContact O-N 2.92Å; A2773-R2776 VanDerWaalsContact O-N 3.17Å; S2774-R2776 VanDerWaalsContact C-N 3.29Å; S2774-R2776 PolarHBondContact O-N 3.47Å; R2776-K2779 PolarHBondContact O-N 3.02Å; R2776-N2780 PolarHBondContact O-N 3.03Å; R2776-N2780 PolarHBondContact O-OD1 3.25Å
2777	S	59.8	Low	54.4	Low	76 Å²	76	107 Å²	107	53%	0.531	60%	0.595	S	S	.	*	H	α-helix	trans	-68.6	-39	175	65.9	0	0	0	0	112.1	A2773 S2774 N2780 G2781	A2773-S2777 PolarHBondContact O-N 3.37Å; S2774-S2777 PolarHBondContact O-N 3.05Å; S2774-S2777 PolarHBondContact O-OG 2.91Å; S2774-S2777 VanDerWaalsContact O-OG 3.06Å; S2777-N2780 PolarHBondContact O-N 3.36Å; S2777-G2781 PolarHBondContact O-N 2.9Å
2778	L	56.5	Low	52.7	Low	126 Å²	126	107 Å²	107	66%	0.66	60%	0.603	S	S	*	*	H	α-helix	trans	-64	-38.5	173.4	-90.1	159.9	0	0	0	112.8	S2774 G2781 S2782	S2774-L2778 WeakPolarHBondContact O-CB 3.45Å; S2774-L2778 PolarHBondContact O-N 3.45Å; L2778-G2781 PolarHBondContact O-N 3.42Å; L2778-S2782 PolarHBondContact O-N 2.97Å; L2778-S2782 PolarHBondContact O-OG 3.01Å
2779	K	53.1	Low	51.2	Low	156 Å²	156	111.1 Å²	111.1	68%	0.678	62%	0.624	S	S	*	*	H	α-helix	trans	-71.9	-29.6	177	-153.6	177.8	-173.9	-172.9	0	113.1	I2775 R2776 S2782 A2783	I2775-K2779 WeakPolarHBondContact O-CB 3.45Å; I2775-K2779 PolarHBondContact O-N 3.22Å; R2776-K2779 PolarHBondContact O-N 3.02Å; K2779-S2782 PolarHBondContact O-OG 3.09Å; K2779-A2783 PolarHBondContact O-N 2.79Å
2780	N	53.4	Low	49.4	Very low	127 Å²	127	114.3 Å²	114.3	68%	0.679	64%	0.64	S	S	*	*	H	α-helix	trans	-79.6	-27.9	172.3	-72.7	15	0	0	0	112.6	R2776 S2777	R2776-N2780 PolarHBondContact O-N 3.03Å; R2776-N2780 PolarHBondContact O-OD1 3.25Å; S2777-N2780 PolarHBondContact O-N 3.36Å
2781	G	54.1	Low	47.4	Very low	44 Å²	44	116.2 Å²	116.2	45%	0.454	65%	0.654	S	S	.	*	H	α-helix	trans	-73.3	-37.3	174.6	0	0	0	0	0	113.5	S2777 L2778 A2784	S2777-G2781 PolarHBondContact O-N 2.9Å; L2778-G2781 PolarHBondContact O-N 3.42Å; G2781-A2784 PolarHBondContact O-N 2.93Å
2782	S	50	Low	46.1	Very low	59 Å²	59	121 Å²	121	41%	0.413	67%	0.673	S	S	.	*	H	α-helix	trans	-71.8	-30.8	175.1	36.9	0	0	0	0	112.9	L2778 K2779 A2784 V2785	L2778-S2782 PolarHBondContact O-N 2.97Å; L2778-S2782 PolarHBondContact O-OG 3.01Å; K2779-S2782 PolarHBondContact O-OG 3.09Å; S2782-A2784 PolarHBondContact O-N 2.69Å; S2782-V2785 PolarHBondContact O-N 2.86Å
2783	A	43.7	Very low	44.5	Very low	86 Å²	86	116.1 Å²	116.1	71%	0.711	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	0.5	174.4	0	0	0	0	0	115	K2779	K2779-A2783 PolarHBondContact O-N 2.79Å
2784	A	46.9	Very low	43	Very low	80 Å²	80	121.9 Å²	121.9	66%	0.661	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	5.1	-179.4	0	0	0	0	0	114.2	G2781 S2782	G2781-A2784 PolarHBondContact O-N 2.93Å; S2782-A2784 PolarHBondContact O-N 2.69Å
2785	V	45.6	Very low	41.2	Very low	109 Å²	109	126.4 Å²	126.4	66%	0.661	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	-26.5	-179.7	-176.2	0	0	0	0	112.7	S2782 S2787	S2782-V2785 PolarHBondContact O-N 2.86Å; V2785-S2787 PolarHBondContact O-N 3.05Å
2786	D	31.8	Very low	39.7	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	72%	0.723	S	S	*	*			trans	-80.4	47.8	-178.6	-62.6	-12.9	0	0	0	113.4
2787	S	31.6	Very low	38.4	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	72%	0.724	S	S	*	*	S	Bend	trans	-120.3	26.5	167.2	73.8	0	0	0	0	113.3	V2785	V2785-S2787 PolarHBondContact O-N 3.05Å
2788	E	32.1	Very low	36.7	Very low	177 Å²	177	139.4 Å²	139.4	83%	0.827	74%	0.739	S	S	*	*	S	Bend	trans	-144.8	152.4	163.4	-106.4	164.4	179	0	0	109.4
2789	E	29.5	Very low	35.5	Very low	196 Å²	196	145.1 Å²	145.1	92%	0.916	75%	0.752	S	S	*	*			trans	71.1	82.6	-178.9	-54.4	-159.5	151	0	0	118.4
2790	T	26.5	Very low	34.5	Very low	135 Å²	135	142.5 Å²	142.5	83%	0.828	75%	0.752	S	S	*	*			trans	-74	138.7	158.4	45.7	0	0	0	0	113.1
2791	S	26.3	Very low	33.5	Very low	111 Å²	111	142 Å²	142	78%	0.776	76%	0.758	S	S	*	*			trans	117.3	99.4	149.7	-52.3	0	0	0	0	116.1
2792	E	29.4	Very low	32.6	Very low	206 Å²	206	145.2 Å²	145.2	96%	0.963	77%	0.773	S	S	*	*				-169.4	167.2	121.7	-107.9	-179.6	-166.8	0	0	111.5
2793	A	26.1	Very low	32.3	Very low	87 Å²	87	148 Å²	148	72%	0.719	79%	0.79	S	S	*	*			trans	-132.6	166.3	-158.4	0	0	0	0	0	115.1
2794	K	26.9	Very low	32.5	Very low	184 Å²	184	149.7 Å²	149.7	80%	0.8	79%	0.787	S	S	*	*			trans	83.9	107.9	161	-63.8	173.9	177.2	169.9	0	119.5
2795	Q	25.6	Very low	32.8	Very low	143 Å²	143	152.6 Å²	152.6	67%	0.668	79%	0.791	S	S	*	*				66.7	99.4	115.3	-167.5	179.9	26.2	0	0	119.4
2796	W	28.4	Very low	33.1	Very low	258 Å²	258	153.5 Å²	153.5	98%	0.977	79%	0.79	S	S	*	*			trans	-128	142	148.7	-80.2	89.7	0	0	0	111.9
2797	K	28.9	Very low	34	Very low	176 Å²	176	154 Å²	154	77%	0.765	79%	0.788	S	S	*	*			trans	-94.5	146.4	-164.2	-77.9	175.3	174.9	173.2	0	114.1
2798	Y	25.4	Very low	35	Very low	216 Å²	216	151.2 Å²	151.2	85%	0.847	77%	0.772	S	S	*	*			trans	-31.3	134.1	152.6	-133.9	-103	0	0	0	114.9
2799	R	29.7	Very low	36.1	Very low	246 Å²	246	145.6 Å²	145.6	93%	0.928	76%	0.756	S	S	*	*			trans	-144.1	141.4	146.8	-96.1	-169.3	177.8	-179.1	-0.1	110.3
2800	P	33.4	Very low	37.1	Very low	102 Å²	102	142.5 Å²	142.5	66%	0.662	74%	0.741	S	S	*	*			trans	-107.1	166.4	-165.6	37.3	-26.8	0	0	0	114.9
2801	S	31	Very low	38.2	Very low	117 Å²	117	145.1 Å²	145.1	82%	0.818	74%	0.736	S	S	*	*			trans	-19.8	129.7	167.3	53.8	0	0	0	0	119.1
2802	S	36.1	Very low	39.5	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-103.8	143.2	149.6	55.2	0	0	0	0	110
2803	P	44.3	Very low	40.6	Very low	118 Å²	118	141.8 Å²	141.8	77%	0.766	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-77.9	156.5	-169.8	31.7	-35.6	0	0	0	114
2804	D	47.2	Very low	41.9	Very low	121 Å²	121	141.9 Å²	141.9	65%	0.647	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-74.4	134	-171.5	-158.8	-15.3	0	0	0	112.6	I2806 E2807	D2804-I2806 PolarHBondContact O-N 2.84Å; D2804-I2806 VanDerWaalsContact O-N 3.09Å; D2804-E2807 PolarHBondContact O-N 3.2Å
2805	L	54	Low	42.7	Very low	141 Å²	141	141.7 Å²	141.7	74%	0.738	71%	0.706	S	S	*	*	H	α-helix	trans	-66.9	-16	-169.4	-79.8	94.1	0	0	0	114	E2807 A2808 A2809	L2805-E2807 VanDerWaalsContact C-N 3.33Å; L2805-E2807 PolarHBondContact O-N 3.39Å; L2805-A2808 PolarHBondContact O-N 2.89Å; L2805-A2809 PolarHBondContact O-N 2.81Å
2806	I	51.6	Low	43	Very low	128 Å²	128	137.6 Å²	137.6	66%	0.656	70%	0.703	S	S	*	*	H	α-helix	trans	-64.6	-36.4	-177	-61.2	174.2	0	0	0	111.4	D2804 A2809 H2810	D2804-I2806 PolarHBondContact O-N 2.84Å; D2804-I2806 VanDerWaalsContact O-N 3.09Å; I2806-A2809 PolarHBondContact O-N 2.87Å; I2806-H2810 PolarHBondContact O-N 3.31Å; I2806-H2810 VanDerWaalsContact O-N 3.12Å
2807	E	51.1	Low	43.4	Very low	150 Å²	150	129.8 Å²	129.8	70%	0.701	69%	0.688	S	S	*	*	H	α-helix	trans	-74.6	-33.4	179.2	-164.4	170.6	-162.1	0	0	112	D2804 L2805 H2810 R2811	D2804-E2807 PolarHBondContact O-N 3.2Å; L2805-E2807 VanDerWaalsContact C-N 3.33Å; L2805-E2807 PolarHBondContact O-N 3.39Å; E2807-H2810 PolarHBondContact O-N 2.82Å; E2807-R2811 PolarHBondContact O-N 3.41Å; E2807-R2811 VanDerWaalsContact O-N 3.08Å
2808	A	52.7	Low	43.4	Very low	53 Å²	53	130.6 Å²	130.6	44%	0.438	69%	0.691	S	S	.	*	H	α-helix	trans	-66.5	-40.4	171.3	0	0	0	0	0	112	L2805 H2810 R2811 N2812	L2805-A2808 PolarHBondContact O-N 2.89Å; A2808-H2810 VanDerWaalsContact C-N 3.33Å; A2808-H2810 PolarHBondContact O-N 3.41Å; A2808-R2811 PolarHBondContact O-N 3.27Å; A2808-N2812 PolarHBondContact O-N 2.99Å; A2808-N2812 VanDerWaalsContact O-N 3.1Å
2809	A	53.5	Low	43.7	Very low	59 Å²	59	125.6 Å²	125.6	49%	0.488	69%	0.688	S	S	.	*	H	α-helix	trans	-61.5	-40.1	175.2	0	0	0	0	0	112	L2805 I2806 L2813	L2805-A2809 PolarHBondContact O-N 2.81Å; I2806-A2809 PolarHBondContact O-N 2.87Å; A2809-L2813 PolarHBondContact O-N 2.88Å
2810	H	50.4	Low	43.6	Very low	132 Å²	132	120.6 Å²	120.6	61%	0.611	68%	0.678	S	S	*	*	H	α-helix	trans	-70.6	-38.7	177.8	-149.1	77	0	0	0	112.6	I2806 E2807 A2808 N2812 L2813 V2814	I2806-H2810 PolarHBondContact O-N 3.31Å; I2806-H2810 VanDerWaalsContact O-N 3.12Å; E2807-H2810 PolarHBondContact O-N 2.82Å; A2808-H2810 VanDerWaalsContact C-N 3.33Å; A2808-H2810 PolarHBondContact O-N 3.41Å; H2810-N2812 PolarHBondContact O-N 3.34Å; H2810-L2813 WeakPolarHBondContact O-CB 3.3Å; H2810-L2813 PolarHBondContact O-N 3.33Å; H2810-V2814 PolarHBondContact O-N 2.84Å
2811	R	49.4	Very low	43.2	Very low	190 Å²	190	123.7 Å²	123.7	72%	0.717	68%	0.683	S	S	*	*	H	α-helix	trans	-62.9	-40.6	175	-97.8	-174.3	170.6	-167.2	-1.6	113.3	E2807 A2808 L2813 V2814 F2815	E2807-R2811 PolarHBondContact O-N 3.41Å; E2807-R2811 VanDerWaalsContact O-N 3.08Å; A2808-R2811 PolarHBondContact O-N 3.27Å; R2811-L2813 VanDerWaalsContact C-N 3.27Å; R2811-L2813 PolarHBondContact O-N 2.82Å; R2811-V2814 PolarHBondContact O-N 3.49Å; R2811-F2815 PolarHBondContact O-N 3.29Å
2812	N	53.7	Low	43	Very low	99 Å²	99	123.2 Å²	123.2	53%	0.529	68%	0.68	S	S	.	*	H	α-helix	trans	-66.9	-29.6	177.9	-72.9	-17.4	0	0	0	112.5	A2808 H2810 V2814 G2816	A2808-N2812 PolarHBondContact O-N 2.99Å; A2808-N2812 VanDerWaalsContact O-N 3.1Å; H2810-N2812 PolarHBondContact O-N 3.34Å; N2812-V2814 VanDerWaalsContact C-N 3.32Å; N2812-V2814 PolarHBondContact O-N 3.48Å; N2812-G2816 PolarHBondContact O-N 2.86Å; N2812-G2816 VanDerWaalsContact O-N 3.15Å
2813	L	53.2	Low	42.5	Very low	147 Å²	147	125.1 Å²	125.1	77%	0.77	68%	0.681	S	S	*	*	H	α-helix	trans	-69.8	-25.5	175.3	-120.6	160.2	0	0	0	113.4	A2809 H2810 R2811	A2809-L2813 PolarHBondContact O-N 2.88Å; H2810-L2813 WeakPolarHBondContact O-CB 3.3Å; H2810-L2813 PolarHBondContact O-N 3.33Å; R2811-L2813 VanDerWaalsContact C-N 3.27Å; R2811-L2813 PolarHBondContact O-N 2.82Å
2814	V	54.3	Low	41.8	Very low	90 Å²	90	125 Å²	125	55%	0.545	68%	0.678	S	S	.	*	H	α-helix	trans	-96.3	-33.2	-179.5	-176.6	0	0	0	0	112.7	H2810 R2811 N2812	H2810-V2814 PolarHBondContact O-N 2.84Å; R2811-V2814 PolarHBondContact O-N 3.49Å; N2812-V2814 VanDerWaalsContact C-N 3.32Å; N2812-V2814 PolarHBondContact O-N 3.48Å
2815	F	42.9	Very low	40.7	Very low	179 Å²	179	130 Å²	130	79%	0.785	69%	0.688	S	S	*	*	H	α-helix	trans	-123.7	11	-171.1	-66.7	-68.3	0	0	0	116.7	R2811	R2811-F2815 PolarHBondContact O-N 3.29Å
2816	G	32.9	Very low	39.5	Very low	58 Å²	58	129.2 Å²	129.2	60%	0.598	69%	0.689	S	S	*	*			trans	49.5	84.1	154.4	0	0	0	0	0	118	N2812	N2812-G2816 PolarHBondContact O-N 2.86Å; N2812-G2816 VanDerWaalsContact O-N 3.15Å
2817	S	35.6	Very low	38.3	Very low	94 Å²	94	127.1 Å²	127.1	66%	0.657	69%	0.691	S	S	*	*			trans	-85	142.1	170	47.3	0	0	0	0	112.5
2818	K	30.2	Very low	37.2	Very low	193 Å²	193	131.2 Å²	131.2	84%	0.839	70%	0.7	S	S	*	*			trans	-89.6	168.6	-174.2	-64.4	173.4	177.4	175	0	112.2
2819	S	30.1	Very low	35.8	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	71%	0.712	S	S	*	*			trans	79.5	147.2	166.1	81.7	0	0	0	0	116.8
2820	I	27.6	Very low	34.5	Very low	140 Å²	140	135.5 Å²	135.5	72%	0.718	72%	0.723	S	S	*	*			cis	-155.2	139.1	-11	-117.7	164.4	0	0	0	109.8
2821	E	26.3	Very low	33.3	Very low	167 Å²	167	134.7 Å²	134.7	78%	0.78	73%	0.733	S	S	*	*			trans	51.8	155.8	149.8	-59.7	178.8	152.2	0	0	125.9
2822	S	25.5	Very low	32.2	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	74%	0.74	S	S	*	*			trans	76.2	129.4	168.3	85.5	0	0	0	0	115.6
2823	L	26.3	Very low	31	Very low	150 Å²	150	129.7 Å²	129.7	79%	0.785	75%	0.753	S	S	*	*			cis	-143.5	165.4	-6.8	-65.3	100.4	0	0	0	107.4
2824	T	29.2	Very low	29.7	Very low	116 Å²	116	132.7 Å²	132.7	71%	0.712	76%	0.76	S	S	*	*			cis	-159.7	160.3	1.5	-1.2	0	0	0	0	110.9
2825	R	25.3	Very low	28.4	Very low	225 Å²	225	136.3 Å²	136.3	85%	0.849	77%	0.774	S	S	*	*			trans	29.4	123.1	130.3	-147.8	167.9	-172.4	165.8	3.9	117.8
2826	T	28.3	Very low	27.9	Very low	124 Å²	124	133.4 Å²	133.4	76%	0.761	77%	0.773	S	S	*	*			cis	-161.7	148.7	26.8	-14.8	0	0	0	0	114.1
2827	A	26.3	Very low	27.6	Very low	84 Å²	84	136 Å²	136	69%	0.694	78%	0.782	S	S	*	*			trans	58.5	112.4	141.3	0	0	0	0	0	123.9
2828	R	27.3	Very low	27.3	Very low	236 Å²	236	137.8 Å²	137.8	89%	0.891	79%	0.792	S	S	*	*			trans	69.8	87.9	130.2	-69.2	-177.1	176.9	162.6	-0.1	121.6
2829	S	24.8	Very low	27.3	Very low	99 Å²	99	134 Å²	134	69%	0.692	79%	0.79	S	S	*	*				44.1	124.2	111.6	65.1	0	0	0	0	122.1
2830	S	24.8	Very low	27.1	Very low	103 Å²	103	137.1 Å²	137.1	72%	0.72	80%	0.797	S	S	*	*			trans	77.6	99.5	132.2	67.4	0	0	0	0	121.3
2831	S	25.6	Very low	27.2	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	80%	0.798	S	S	*	*				123.2	145.5	105.4	73	0	0	0	0	118.4
2832	A	25.5	Very low	27.2	Very low	106 Å²	106	136.5 Å²	136.5	88%	0.876	80%	0.803	S	S	*	*			trans	64.1	105	156.8	0	0	0	0	0	119.6
2833	G	28.4	Very low	27.2	Very low	77 Å²	77	140.5 Å²	140.5	79%	0.794	81%	0.807	S	S	*	*			trans	-147.3	67.2	161.8	0	0	0	0	0	111
2834	K	27.3	Very low	27.2	Very low	210 Å²	210	139.3 Å²	139.3	91%	0.913	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-83.8	121.4	174.2	-109.3	-175.6	176.2	-176.2	0	109.4
2835	I	27.1	Very low	27.1	Very low	166 Å²	166	140.3 Å²	140.3	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.3	130.6	180	-61.6	170.1	0	0	0	109.1
2836	P	32.2	Very low	27	Very low	118 Å²	118	138.8 Å²	138.8	77%	0.766	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-90	148.6	-174.3	34.9	-34.8	0	0	0	113.4
2837	S	25.8	Very low	27.4	Very low	113 Å²	113	139.2 Å²	139.2	79%	0.79	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-85.6	146.3	172.3	34.5	0	0	0	0	112
2838	P	30.8	Very low	27.1	Very low	131 Å²	131	138.7 Å²	138.7	85%	0.851	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-83	124.3	-171.5	31.8	-34.1	0	0	0	112.7
2839	S	28.9	Very low	27.1	Very low	115 Å²	115	138.4 Å²	138.4	80%	0.804	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-83.2	132.4	172	54.9	0	0	0	0	111.7
2840	L	26.4	Very low	27	Very low	175 Å²	175	141.5 Å²	141.5	92%	0.916	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-57.6	138.7	-178.6	-155.8	73	0	0	0	112.6
2841	A	29.4	Very low	27.1	Very low	89 Å²	89	141.3 Å²	141.3	74%	0.736	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-70.7	133.7	-169.8	0	0	0	0	0	113.7
2842	K	27.1	Very low	27	Very low	206 Å²	206	144 Å²	144	90%	0.896	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-88	132.2	164.6	-79	-175.9	172.3	-176.8	0	109.9
2843	F	24.7	Very low	27	Very low	192 Å²	192	145.2 Å²	145.2	84%	0.842	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-68.8	143.4	172.1	-77	-94.4	0	0	0	111.1
2844	P	27	Very low	26.7	Very low	124 Å²	124	147.8 Å²	147.8	81%	0.805	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-82.8	128.5	176.5	32.8	-31.9	0	0	0	110.9
2845	T	26.2	Very low	26.6	Very low	138 Å²	138	140.8 Å²	140.8	85%	0.847	81%	0.812	S	S	*	*			trans	-107.1	128.1	169.3	47	0	0	0	0	109.6
2846	E	24.5	Very low	26.4	Very low	192 Å²	192	139.3 Å²	139.3	90%	0.897	81%	0.811	S	S	*	*			trans	-71.2	159.1	-179	-64.4	178.4	136.3	0	0	112.7
2847	P	34.7	Very low	26	Very low	133 Å²	133	138.6 Å²	138.6	86%	0.864	80%	0.804	S	S	*	*			trans	-94.4	141.1	-175.2	36	-33.3	0	0	0	114.2
2848	G	21.8	Very low	25.9	Very low	73 Å²	73	141.4 Å²	141.4	75%	0.753	80%	0.799	S	S	*	*			trans	143.4	132	176.9	0	0	0	0	0	108.9
2849	Y	25.4	Very low	25.5	Very low	231 Å²	231	142.8 Å²	142.8	91%	0.906	79%	0.794	S	S	*	*			cis	-140.3	147.2	25.5	-127.1	-109	0	0	0	110.1	S2851	Y2849-S2851 PolarHBondContact O-N 3.45Å
2850	D	23.6	Very low	25.3	Very low	163 Å²	163	145 Å²	145	87%	0.872	80%	0.796	S	S	*	*			trans	-74.6	109.6	175.8	-66.2	-49.4	0	0	0	111.4
2851	S	26.6	Very low	25.1	Very low	99 Å²	99	144.2 Å²	144.2	69%	0.692	79%	0.788	S	S	*	*			trans	-99.5	126.7	164.1	57.1	0	0	0	0	109.9	Y2849 D2853	Y2849-S2851 PolarHBondContact O-N 3.45Å; S2851-D2853 PolarHBondContact O-N 2.95Å
2852	L	23.9	Very low	24.9	Very low	174 Å²	174	145 Å²	145	91%	0.911	79%	0.788	S	S	*	*			trans	-63	101.5	-174.7	-76.4	78.5	0	0	0	112.3	S2854	L2852-S2854 PolarHBondContact O-N 3.08Å
2853	D	25.7	Very low	24.8	Very low	131 Å²	131	143.3 Å²	143.3	70%	0.701	79%	0.788	S	S	*	*			trans	-78.3	98.7	167.4	-97	-37.5	0	0	0	110.7	S2851 S2855	S2851-D2853 PolarHBondContact O-N 2.95Å; D2853-S2855 PolarHBondContact O-N 2.84Å
2854	S	22.8	Very low	24.8	Very low	131 Å²	131	145.6 Å²	145.6	92%	0.916	79%	0.791	S	S	*	*			trans	-77.3	57.1	162.4	55.6	0	0	0	0	111.2	L2852	L2852-S2854 PolarHBondContact O-N 3.08Å
2855	S	24.4	Very low	24.8	Very low	62 Å²	62	145.9 Å²	145.9	43%	0.434	80%	0.796	S	S	.	*			trans	-105.2	115.4	168	63.6	0	0	0	0	110	D2853 V2857	D2853-S2855 PolarHBondContact O-N 2.84Å; S2855-V2857 PolarHBondContact O-N 3.39Å
2856	T	23	Very low	24.7	Very low	136 Å²	136	142.5 Å²	142.5	83%	0.834	79%	0.789	S	S	*	*			trans	-72.4	77.8	170.5	44.4	0	0	0	0	109.1	Y2858	T2856-Y2858 PolarHBondContact O-N 2.9Å
2857	V	23.7	Very low	24.8	Very low	102 Å²	102	144.5 Å²	144.5	62%	0.618	79%	0.788	S	S	*	*			trans	-64	105.5	178.6	176.4	0	0	0	0	109.2	S2855 Q2859	S2855-V2857 PolarHBondContact O-N 3.39Å; V2857-Q2859 PolarHBondContact O-N 2.88Å; V2857-Q2859 VanDerWaalsContact O-N 3.08Å
2858	Y	24.1	Very low	24.4	Very low	173 Å²	173	148.4 Å²	148.4	68%	0.678	79%	0.791	S	S	*	*			trans	-58.4	111.9	155.8	-82.2	-90.4	0	0	0	107.3	T2856 N2860	T2856-Y2858 PolarHBondContact O-N 2.9Å; Y2858-N2860 PolarHBondContact O-N 2.97Å
2859	Q	22.6	Very low	24.5	Very low	160 Å²	160	150.5 Å²	150.5	75%	0.748	79%	0.789	S	S	*	*			trans	-68.2	103.6	-173.4	-71.8	178.8	-39.3	0	0	110	V2857 E2861	V2857-Q2859 PolarHBondContact O-N 2.88Å; V2857-Q2859 VanDerWaalsContact O-N 3.08Å; Q2859-E2861 HydrophobicContact CB-CG 4.44Å; Q2859-E2861 PolarHBondContact O-N 3.3Å
2860	N	23.1	Very low	24.5	Very low	160 Å²	160	148 Å²	148	86%	0.856	78%	0.783	S	S	*	*			trans	-64.1	87.8	152.8	-82	-23.1	0	0	0	107.5	Y2858 S2862	Y2858-N2860 PolarHBondContact O-N 2.97Å; N2860-S2862 PolarHBondContact O-N 3.22Å
2861	E	23.4	Very low	24.5	Very low	159 Å²	159	145.6 Å²	145.6	74%	0.743	78%	0.778	S	S	*	*			trans	-63.1	86.8	169.7	-76	-155.8	139.8	0	0	109.2	Q2859 L2863	Q2859-E2861 HydrophobicContact CB-CG 4.44Å; Q2859-E2861 PolarHBondContact O-N 3.3Å; E2861-L2863 PolarHBondContact O-N 3.39Å
2862	S	24.1	Very low	24.5	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	78%	0.78	S	S	*	*			trans	-56.7	105.3	166.9	53.6	0	0	0	0	108.6	N2860 R2864	N2860-S2862 PolarHBondContact O-N 3.22Å; S2862-R2864 PolarHBondContact O-N 2.75Å
2863	L	25.2	Very low	24.5	Very low	170 Å²	170	145.9 Å²	145.9	89%	0.89	78%	0.778	S	S	*	*			trans	-52.2	104.7	-177.7	-124.8	84.7	0	0	0	109.4	E2861 S2865	E2861-L2863 PolarHBondContact O-N 3.39Å; L2863-S2865 PolarHBondContact O-N 3.41Å
2864	R	25.6	Very low	24.4	Very low	240 Å²	240	144.8 Å²	144.8	91%	0.906	78%	0.78	S	S	*	*			trans	-66.5	98.9	178.2	-86.9	-174.2	171	-176.9	-1.2	109.3	S2862 G2866	S2862-R2864 PolarHBondContact O-N 2.75Å; R2864-G2866 PolarHBondContact O-N 3.4Å
2865	S	26.2	Very low	24.9	Very low	131 Å²	131	143.9 Å²	143.9	92%	0.916	77%	0.771	S	S	*	*			trans	-42.2	107.5	165.3	179.1	0	0	0	0	110.1	L2863	L2863-S2865 PolarHBondContact O-N 3.41Å
2866	G	25.4	Very low	24.9	Very low	67 Å²	67	146.7 Å²	146.7	69%	0.691	79%	0.791	S	S	*	*			trans	-170.1	4	-160.2	0	0	0	0	0	119.3	R2864	R2864-G2866 PolarHBondContact O-N 3.4Å
2867	R	25.1	Very low	25	Very low	234 Å²	234	145.6 Å²	145.6	88%	0.883	79%	0.789	S	S	*	*			trans	-150.2	109.3	166.9	-122.6	170.1	-175.8	170.6	0.6	113.5	V2869	R2867-V2869 VanDerWaalsContact C-N 3.34Å; R2867-V2869 PolarHBondContact O-N 3.42Å
2868	K	26	Very low	25	Very low	214 Å²	214	145.9 Å²	145.9	93%	0.93	80%	0.795	S	S	*	*			trans	-68.1	87.4	169.9	-68.4	178	176.9	178	0	109.7	K2870	K2868-K2870 PolarHBondContact O-N 3.17Å
2869	V	25.4	Very low	25.1	Very low	117 Å²	117	148 Å²	148	71%	0.709	80%	0.804	S	S	*	*			trans	-76	116.4	162	-179.2	0	0	0	0	106.7	R2867 C2871	R2867-V2869 VanDerWaalsContact C-N 3.34Å; R2867-V2869 PolarHBondContact O-N 3.42Å; V2869-C2871 PolarHBondContact O-N 3.42Å
2870	K	23.7	Very low	25.1	Very low	178 Å²	178	144.6 Å²	144.6	77%	0.774	80%	0.796	S	S	*	*			trans	-69	111	170.5	-78.1	179.5	169.5	-174.5	0	107.9	K2868 D2872	K2868-K2870 PolarHBondContact O-N 3.17Å; K2870-D2872 PolarHBondContact O-N 3.05Å
2871	C	25.3	Very low	25.2	Very low	114 Å²	114	143.1 Å²	143.1	77%	0.77	78%	0.784	S	S	*	*			trans	-79.1	94.7	164.2	-61.3	0	0	0	0	107.7	V2869 V2873	V2869-C2871 PolarHBondContact O-N 3.42Å; C2871-V2873 PolarHBondContact O-N 3.26Å
2872	D	24.9	Very low	25.4	Very low	135 Å²	135	138.5 Å²	138.5	72%	0.722	77%	0.77	S	S	*	*			trans	-66.7	130.4	170.3	-75.3	-38	0	0	0	109.2	K2870 S2874	K2870-D2872 PolarHBondContact O-N 3.05Å; D2872-S2874 PolarHBondContact O-N 3.38Å; D2872-S2874 VanDerWaalsContact O-N 3.15Å
2873	V	23.7	Very low	25.5	Very low	144 Å²	144	135.5 Å²	135.5	87%	0.873	75%	0.751	S	S	*	*			trans	-74.8	105.2	-172.7	178.9	0	0	0	0	109.9	C2871	C2871-V2873 PolarHBondContact O-N 3.26Å
2874	S	25.5	Very low	25.6	Very low	108 Å²	108	136.1 Å²	136.1	76%	0.755	74%	0.743	S	S	*	*			trans	-122.6	113.4	165.8	52.7	0	0	0	0	109.7	D2872	D2872-S2874 PolarHBondContact O-N 3.38Å; D2872-S2874 VanDerWaalsContact O-N 3.15Å
2875	P	33.4	Very low	25.5	Very low	111 Å²	111	134.5 Å²	134.5	72%	0.721	74%	0.737	S	S	*	*			trans	-81.9	168.7	-178.5	34.1	-35.3	0	0	0	112.2
2876	S	24.3	Very low	25.6	Very low	121 Å²	121	131.1 Å²	131.1	85%	0.846	71%	0.713	S	S	*	*			trans	72.1	94.6	173.1	71	0	0	0	0	117.9
2877	S	24	Very low	25.5	Very low	113 Å²	113	135 Å²	135	79%	0.79	72%	0.718	S	S	*	*				-145.9	108.9	125.1	62.9	0	0	0	0	108.7	Y2879	S2877-Y2879 PolarHBondContact O-N 3.28Å
2878	S	24.2	Very low	25.7	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	70%	0.701	S	S	*	*			trans	-59.8	128.7	167	48.2	0	0	0	0	109.7
2879	Y	25.2	Very low	25.6	Very low	219 Å²	219	121.3 Å²	121.3	86%	0.859	67%	0.67	S	S	*	*			trans	-120.7	141.1	157.8	-131.3	-90.6	0	0	0	109	S2877	S2877-Y2879 PolarHBondContact O-N 3.28Å
2880	C	23.2	Very low	25.8	Very low	87 Å²	87	119.6 Å²	119.6	59%	0.588	66%	0.662	S	S	*	*			trans	-106.7	-177.2	-163	-63.1	0	0	0	0	111.8
2881	E	25.2	Very low	25.9	Very low	129 Å²	129	115 Å²	115	60%	0.603	65%	0.651	S	S	*	*			trans	76.7	152.1	158.1	-62.8	158.8	117.1	0	0	117.6	L1944	L1944-E2881 HydrophobicContact CD2-CB 3.6Å; L1944-E2881 HydrophobicContact CD2-CG 4.01Å; L1944-E2881 WeakPolarHBondContact CD2-OE1 3.45Å; L1944-E2881 VanDerWaalsContact CD2-OE2 3.32Å; L1944-E2881 WeakPolarHBondContact CD2-OE2 3.39Å
2882	S	27	Very low	26	Very low	63 Å²	63	112.8 Å²	112.8	44%	0.441	64%	0.638	S	S	.	*			cis	-154.8	170.7	-30.2	74.3	0	0	0	0	110.6	D1941	D1941-S2882 PolarHBondContact OD2-OG 3.23Å
2883	A	27.1	Very low	26.3	Very low	42 Å²	42	110.7 Å²	110.7	35%	0.347	62%	0.623	S	S	.	*			trans	-36.2	154.3	179	0	0	0	0	0	119.1	W2494	W2494-A2883 HydrophobicContact CH2-CB 3.9Å; W2494-A2883 HydrophobicContact CZ2-CB 3.35Å
2884	Y	27	Very low	26.3	Very low	184 Å²	184	110 Å²	110	72%	0.722	61%	0.605	S	S	*	*				-176.2	176.4	102.3	-107.4	-92.8	0	0	0	113.3
2885	R	24.4	Very low	26.2	Very low	205 Å²	205	108.2 Å²	108.2	77%	0.774	59%	0.593	S	S	*	*			trans	-73.3	153	-167.9	-70.1	175.6	170.7	161.9	-6	114.4
2886	S	27.2	Very low	25.7	Very low	61 Å²	61	106.8 Å²	106.8	43%	0.427	59%	0.586	S	S	.	*			trans	-127.8	57.1	-169.7	62	0	0	0	0	115.7	F2888	S2886-F2888 VanDerWaalsContact C-N 3.33Å; S2886-F2888 VanDerWaalsContact CB-CE2 3.46Å; S2886-F2888 PolarHBondContact O-N 3.46Å
2887	D	23.4	Very low	25.6	Very low	147 Å²	147	107.7 Å²	107.7	79%	0.786	58%	0.58	S	S	*	*			trans	-89.1	67.6	166.8	-68.9	-33.6	0	0	0	110.3	S2889	D2887-S2889 PolarHBondContact O-N 3.2Å
2888	F	28.9	Very low	25.6	Very low	122 Å²	122	106.8 Å²	106.8	54%	0.535	58%	0.579	S	S	.	*			trans	-82.2	78.3	-166.8	-74.4	-64.2	0	0	0	115	W1938 S2886	W1938-F2888 HydrophobicContact CH2-CZ 4.33Å; S2886-F2888 VanDerWaalsContact C-N 3.33Å; S2886-F2888 VanDerWaalsContact CB-CE2 3.46Å; S2886-F2888 PolarHBondContact O-N 3.46Å
2889	S	25.3	Very low	25.4	Very low	40 Å²	40	105.3 Å²	105.3	28%	0.28	58%	0.582	S	S	.	*			trans	-80.9	124.1	154	-78.4	0	0	0	0	110.6	D2887 R2894	D2887-S2889 PolarHBondContact O-N 3.2Å; S2889-R2894 PolarHBondContact OG-NH1 3.23Å
2890	P	28.2	Very low	25.2	Very low	81 Å²	81	101 Å²	101	53%	0.526	58%	0.578	S	S	.	*			trans	-71.6	130.6	-173.5	28.4	-34.6	0	0	0	112.7
2891	S	26	Very low	25.2	Very low	80 Å²	80	102.3 Å²	102.3	56%	0.559	59%	0.586	S	S	*	*			trans	-146	49.7	-164.5	51.5	0	0	0	0	116.9	R2894	S2891-R2894 WeakPolarHBondContact CB-O 3.46Å
2892	S	28	Very low	25	Very low	69 Å²	69	101.9 Å²	101.9	48%	0.483	60%	0.597	S	S	.	*	S	Bend	trans	-82.3	-2.3	136.7	66.5	0	0	0	0	111.7
2893	E	30.9	Very low	24.8	Very low	91 Å²	91	106.3 Å²	106.3	43%	0.425	62%	0.615	S	S	.	*	S	Bend	trans	-126.9	19.5	179.1	-72.3	-163.1	159.4	0	0	112.1	L2108 H2109	L2108-E2893 WeakPolarHBondContact CD2-O 3.48Å; H2109-E2893 IonicContact CD2-OE1 3.24Å; H2109-E2893 VanDerWaalsContact CE1-CD 3.44Å; H2109-E2893 IonicContact CE1-OE1 3.43Å; H2109-E2893 IonicContact CE1-OE2 3.33Å; H2109-E2893 PolarHBondContact CE1-OE2 3.16Å; H2109-E2893 VanDerWaalsContact NE2-CB 3.25Å; H2109-E2893 WeakPolarHBondContact NE2-CB 3.38Å; H2109-E2893 WeakPolarHBondContact NE2-CG 3.31Å; H2109-E2893 IonicContact NE2-OE1 3.33Å; H2109-E2893 PolarHBondContact NE2-OE1 3.47Å; H2109-E2893 IonicContact NE2-OE2 3.1Å
2894	R	23.8	Very low	24.8	Very low	128 Å²	128	109 Å²	109	48%	0.483	63%	0.629	S	S	.	*			trans	-155.1	93.1	-177.5	-116.6	-175.1	-175.5	-169.6	2.6	113	L2108 S2889 S2891 S2896	L2108-R2894 HydrophobicContact CD2-CG 4.21Å; S2889-R2894 PolarHBondContact OG-NH1 3.23Å; S2891-R2894 WeakPolarHBondContact CB-O 3.46Å; R2894-S2896 PolarHBondContact O-N 3.1Å
2895	S	22.7	Very low	24.6	Very low	71 Å²	71	105.6 Å²	105.6	50%	0.497	63%	0.632	S	S	.	*			trans	-75.6	128	179.9	49.3	0	0	0	0	112.8	R2206	R2206-S2895 PolarHBondContact NH2-O 3.36Å; R2206-S2895 PolarHBondContact NH2-OG 3.14Å
2896	S	23.4	Very low	24.5	Very low	82 Å²	82	105.3 Å²	105.3	57%	0.573	64%	0.637	S	S	*	*			trans	50.1	103.2	166.8	71.9	0	0	0	0	119	R2206 R2894	R2206-S2896 VanDerWaalsContact CZ-OG 3.31Å; R2206-S2896 PolarHBondContact NH1-OG 2.86Å; R2206-S2896 PolarHBondContact NH2-OG 3.29Å; R2894-S2896 PolarHBondContact O-N 3.1Å
2897	L	22	Very low	24.4	Very low	139 Å²	139	110.9 Å²	110.9	73%	0.728	66%	0.656	S	S	*	*			trans	-88.7	131.1	157.1	-86.1	153	0	0	0	110.2
2898	A	24	Very low	24.4	Very low	94 Å²	94	108.7 Å²	108.7	78%	0.777	66%	0.658	S	S	*	*			trans	-157.7	75.7	163.8	0	0	0	0	0	109.7	T2900	A2898-T2900 PolarHBondContact O-N 3.42Å; A2898-T2900 VanDerWaalsContact O-N 3.16Å
2899	G	21.5	Very low	24.2	Very low	78 Å²	78	108.4 Å²	108.4	80%	0.804	67%	0.666	S	S	*	*			trans	-76.8	95.5	175.6	0	0	0	0	0	111.4
2900	T	21	Very low	24.2	Very low	128 Å²	128	112 Å²	112	79%	0.785	69%	0.691	S	S	*	*			trans	-76.6	125	160	47.1	0	0	0	0	108.7	A2898	A2898-T2900 PolarHBondContact O-N 3.42Å; A2898-T2900 VanDerWaalsContact O-N 3.16Å
2901	P	22.2	Very low	24	Very low	115 Å²	115	117.9 Å²	117.9	75%	0.747	70%	0.702	S	S	*	*			trans	-62.4	146	179.5	26.8	-34.5	0	0	0	110.7	L2903	P2901-L2903 PolarHBondContact O-N 3.43Å
2902	S	22.1	Very low	23.8	Very low	120 Å²	120	125.7 Å²	125.7	84%	0.839	72%	0.72	S	S	*	*			trans	-61.7	96	-175.8	54	0	0	0	0	112.4
2903	L	21.9	Very low	23.6	Very low	155 Å²	155	133.7 Å²	133.7	81%	0.812	74%	0.739	S	S	*	*			trans	-63.8	130.3	164.8	-84.1	158.1	0	0	0	108.9	P2901 S2905	P2901-L2903 PolarHBondContact O-N 3.43Å; L2903-S2905 PolarHBondContact O-N 3.35Å
2904	P	26.9	Very low	23.3	Very low	100 Å²	100	133.4 Å²	133.4	65%	0.649	75%	0.748	S	S	*	*			trans	-70.7	126.4	-169.8	27	-34.2	0	0	0	111.9	F2906	P2904-F2906 PolarHBondContact O-N 2.93Å
2905	S	22.6	Very low	23.8	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	76%	0.763	S	S	*	*			trans	34.9	60	148.3	53.7	0	0	0	0	117.6	L2903 Q2907	L2903-S2905 PolarHBondContact O-N 3.35Å; S2905-Q2907 PolarHBondContact O-N 3.03Å
2906	F	23.1	Very low	24	Very low	200 Å²	200	140.7 Å²	140.7	88%	0.877	78%	0.78	S	S	*	*			trans	-62.7	111	160	-97.6	-82.6	0	0	0	109.6	P2904 A2908	P2904-F2906 PolarHBondContact O-N 2.93Å; F2906-A2908 PolarHBondContact O-N 3.05Å
2907	Q	25.4	Very low	24.1	Very low	178 Å²	178	141 Å²	141	83%	0.832	78%	0.783	S	S	*	*			trans	-53.7	134.9	-179.4	-71.9	178.2	-36	0	0	111.1	S2905 V2909	S2905-Q2907 PolarHBondContact O-N 3.03Å; Q2907-V2909 VanDerWaalsContact C-N 3.35Å; Q2907-V2909 PolarHBondContact O-N 3.2Å
2908	A	23.4	Very low	24.4	Very low	100 Å²	100	141.7 Å²	141.7	83%	0.826	79%	0.786	S	S	*	*			trans	-67.1	85.5	-177.2	0	0	0	0	0	112.3	F2906 S2910	F2906-A2908 PolarHBondContact O-N 3.05Å; A2908-S2910 VanDerWaalsContact C-N 3.34Å; A2908-S2910 PolarHBondContact O-N 3.22Å
2909	V	24.2	Very low	24.4	Very low	117 Å²	117	144.3 Å²	144.3	71%	0.709	79%	0.787	S	S	*	*			trans	-75.6	92.1	165	-176.6	0	0	0	0	107.8	Q2907 R2911	Q2907-V2909 VanDerWaalsContact C-N 3.35Å; Q2907-V2909 PolarHBondContact O-N 3.2Å; V2909-R2911 HydrophobicContact CG1-CG 4.27Å; V2909-R2911 PolarHBondContact O-N 2.83Å
2910	S	24.5	Very low	24.7	Very low	114 Å²	114	146 Å²	146	80%	0.797	78%	0.782	S	S	*	*			trans	-66.7	71.2	-178.5	50.6	0	0	0	0	112.8	A2908 R2912	A2908-S2910 VanDerWaalsContact C-N 3.34Å; A2908-S2910 PolarHBondContact O-N 3.22Å; S2910-R2912 PolarHBondContact O-N 3.35Å
2911	R	23.7	Very low	24.9	Very low	205 Å²	205	148.9 Å²	148.9	77%	0.774	78%	0.783	S	S	*	*			trans	-70.3	107.5	168.5	-73	-166.3	174.7	-170.2	-0.5	109.3	V2909 W2913	V2909-R2911 HydrophobicContact CG1-CG 4.27Å; V2909-R2911 PolarHBondContact O-N 2.83Å; R2911-W2913 PolarHBondContact O-N 3.17Å
2912	R	22.5	Very low	25.2	Very low	245 Å²	245	151.7 Å²	151.7	93%	0.925	79%	0.791	S	S	*	*			trans	-73.9	91.2	174.9	-163	-176.9	-156.5	177.2	6.1	108.9	S2910 S2914	S2910-R2912 PolarHBondContact O-N 3.35Å; R2912-S2914 PolarHBondContact O-N 2.94Å
2913	W	23.1	Very low	25.5	Very low	236 Å²	236	151.5 Å²	151.5	89%	0.894	79%	0.785	S	S	*	*			trans	-77.8	109.5	178.3	-78.5	55.5	0	0	0	110.1	R2911	R2911-W2913 PolarHBondContact O-N 3.17Å
2914	S	25.4	Very low	25.6	Very low	85 Å²	85	147.8 Å²	147.8	59%	0.594	78%	0.784	S	S	*	*			trans	-80.1	146.9	170.1	57.2	0	0	0	0	110.7	R2912 W2916	R2912-S2914 PolarHBondContact O-N 2.94Å; S2914-W2916 PolarHBondContact O-N 3.4Å
2915	P	34.3	Very low	25.5	Very low	125 Å²	125	151.8 Å²	151.8	81%	0.812	79%	0.794	S	S	*	*			trans	-78.4	122	-175.3	30.6	-33.6	0	0	0	110.9
2916	W	27.1	Very low	25.6	Very low	227 Å²	227	153.6 Å²	153.6	86%	0.86	80%	0.801	S	S	*	*			trans	-126.2	130.4	163.6	-76.7	84.6	0	0	0	110.6	S2914	S2914-W2916 PolarHBondContact O-N 3.4Å
2917	S	25.4	Very low	25.8	Very low	90 Å²	90	148.3 Å²	148.3	63%	0.629	79%	0.794	S	S	*	*			trans	-67.9	138.9	-174.1	53.7	0	0	0	0	113.4
2918	I	27.5	Very low	25.9	Very low	152 Å²	152	144.5 Å²	144.5	78%	0.779	79%	0.793	S	S	*	*			trans	-115.3	96.1	151.9	-68.4	168.2	0	0	0	107.9	T2920	I2918-T2920 HydrophobicContact CG2-CG2 3.96Å; I2918-T2920 PolarHBondContact O-N 3.49Å; I2918-T2920 VanDerWaalsContact O-N 3.16Å
2919	N	24.9	Very low	26.1	Very low	149 Å²	149	148.7 Å²	148.7	80%	0.797	80%	0.798	S	S	*	*			trans	-79.7	80.8	173.2	-91.7	-33.7	0	0	0	110.2	K2921	N2919-K2921 PolarHBondContact O-N 2.96Å
2920	T	27.9	Very low	26.1	Very low	115 Å²	115	148.3 Å²	148.3	71%	0.706	80%	0.8	S	S	*	*			trans	-82	94.7	166.2	41.6	0	0	0	0	110.1	I2918 L2922	I2918-T2920 HydrophobicContact CG2-CG2 3.96Å; I2918-T2920 PolarHBondContact O-N 3.49Å; I2918-T2920 VanDerWaalsContact O-N 3.16Å; T2920-L2922 PolarHBondContact O-N 3.2Å
2921	K	25.9	Very low	26.2	Very low	187 Å²	187	146.3 Å²	146.3	81%	0.813	80%	0.797	S	S	*	*			trans	-59.1	104.3	169.2	-71.1	179.3	176.3	178.5	0	109.8	N2919 T2923	N2919-K2921 PolarHBondContact O-N 2.96Å; K2921-T2923 VanDerWaalsContact C-N 3.28Å; K2921-T2923 PolarHBondContact O-N 2.87Å
2922	L	28.5	Very low	26.4	Very low	175 Å²	175	142.3 Å²	142.3	92%	0.916	80%	0.795	S	S	*	*			trans	-71.2	87.4	164.3	-93.2	153.1	0	0	0	108.9	T2920	T2920-L2922 PolarHBondContact O-N 3.2Å
2923	T	27.1	Very low	26.6	Very low	115 Å²	115	137 Å²	137	71%	0.706	79%	0.79	S	S	*	*			trans	-70.5	127	169.2	44.8	0	0	0	0	109.5	K2921 Q2925	K2921-T2923 VanDerWaalsContact C-N 3.28Å; K2921-T2923 PolarHBondContact O-N 2.87Å; T2923-Q2925 PolarHBondContact O-N 3.46Å
2924	G	23.6	Very low	26.8	Very low	77 Å²	77	136 Å²	136	79%	0.794	79%	0.788	S	S	*	*			trans	-66.2	128.8	177.4	0	0	0	0	0	111.9
2925	Q	25.7	Very low	26.9	Very low	185 Å²	185	136.2 Å²	136.2	86%	0.864	80%	0.795	S	S	*	*			trans	-126.6	102.5	157	-76.8	-169	-15.1	0	0	108.6	T2923 A2927	T2923-Q2925 PolarHBondContact O-N 3.46Å; Q2925-A2927 PolarHBondContact O-N 2.77Å
2926	T	25.7	Very low	26.7	Very low	149 Å²	149	133.9 Å²	133.9	91%	0.914	79%	0.793	S	S	*	*			trans	-69.6	82.7	167.5	44.9	0	0	0	0	109	A2928	T2926-A2928 PolarHBondContact O-N 3.27Å; T2926-A2928 VanDerWaalsContact O-N 3.08Å
2927	A	27.1	Very low	26.7	Very low	88 Å²	88	132.5 Å²	132.5	73%	0.727	79%	0.793	S	S	*	*			trans	-70.5	99.9	171.7	0	0	0	0	0	109.3	Q2925 M2929	Q2925-A2927 PolarHBondContact O-N 2.77Å; A2927-M2929 PolarHBondContact O-N 3.46Å
2928	A	26.4	Very low	26.9	Very low	98 Å²	98	135.5 Å²	135.5	81%	0.81	80%	0.802	S	S	*	*			trans	-64.4	102.7	172.4	0	0	0	0	0	109.5	T2926 S2930	T2926-A2928 PolarHBondContact O-N 3.27Å; T2926-A2928 VanDerWaalsContact O-N 3.08Å; A2928-S2930 PolarHBondContact O-N 2.87Å
2929	M	27.4	Very low	26.8	Very low	189 Å²	189	138 Å²	138	93%	0.931	81%	0.808	S	S	*	*			trans	-71.4	98	171.6	-86.5	-171	152.4	0	0	109.7	A2927	A2927-M2929 PolarHBondContact O-N 3.46Å
2930	S	25.7	Very low	27.1	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	81%	0.808	S	S	*	*			trans	-56	138	169.5	43.7	0	0	0	0	111.1	A2928	A2928-S2930 PolarHBondContact O-N 2.87Å
2931	G	25.3	Very low	27.3	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	81%	0.812	S	S	*	*			trans	-67.4	137.3	-173.6	0	0	0	0	0	113.4
2932	V	28.1	Very low	27.3	Very low	121 Å²	121	137.5 Å²	137.5	73%	0.733	81%	0.813	S	S	*	*			trans	-104.4	95.1	167	-178	0	0	0	0	108.5	Y2934	V2932-Y2934 HydrophobicContact CG1-CD2 3.76Å; V2932-Y2934 HydrophobicContact CG1-CE2 3.68Å; V2932-Y2934 PolarHBondContact O-N 3.45Å
2933	T	25.8	Very low	27.3	Very low	133 Å²	133	137.3 Å²	137.3	82%	0.816	81%	0.807	S	S	*	*			trans	-80.5	92.7	178.2	39.3	0	0	0	0	111.3	A2935	T2933-A2935 PolarHBondContact O-N 2.86Å
2934	Y	29.2	Very low	27.4	Very low	216 Å²	216	141 Å²	141	85%	0.847	81%	0.814	S	S	*	*			trans	-75.8	91	168.5	-93.8	-79.8	0	0	0	111.3	V2932 G2936	V2932-Y2934 HydrophobicContact CG1-CD2 3.76Å; V2932-Y2934 HydrophobicContact CG1-CE2 3.68Å; V2932-Y2934 PolarHBondContact O-N 3.45Å; Y2934-G2936 PolarHBondContact O-N 2.82Å
2935	A	27.4	Very low	27.7	Very low	90 Å²	90	144.4 Å²	144.4	74%	0.744	82%	0.818	S	S	*	*			trans	-75.3	68.1	176.3	0	0	0	0	0	112.7	T2933 K2937	T2933-A2935 PolarHBondContact O-N 2.86Å; A2935-K2937 PolarHBondContact O-N 3.46Å
2936	G	29.3	Very low	28	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	82%	0.82	S	S	*	*			trans	-74.2	82.2	174.4	0	0	0	0	0	113	Y2934 N2938	Y2934-G2936 PolarHBondContact O-N 2.82Å; G2936-N2938 PolarHBondContact O-N 2.78Å
2937	K	27.4	Very low	28.4	Very low	199 Å²	199	141.7 Å²	141.7	87%	0.865	81%	0.809	S	S	*	*			trans	-68.9	93.5	174.4	-74	178.5	178.8	170.5	0	111.9	A2935	A2935-K2937 PolarHBondContact O-N 3.46Å
2938	N	29.3	Very low	28.9	Very low	153 Å²	153	143.2 Å²	143.2	82%	0.818	81%	0.81	S	S	*	*			trans	-111.2	88.7	158.8	-87.9	-14.3	0	0	0	110.5	G2936 V2940	G2936-N2938 PolarHBondContact O-N 2.78Å; N2938-V2940 PolarHBondContact O-N 2.82Å
2939	K	26.5	Very low	29.2	Very low	205 Å²	205	149 Å²	149	89%	0.891	81%	0.81	S	S	*	*			trans	-69.3	93.6	164	-78.1	-174.4	172.6	-173.6	0	108.7
2940	V	30.5	Very low	29.8	Very low	131 Å²	131	143.3 Å²	143.3	79%	0.794	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-96.6	116.7	159.4	-178.7	0	0	0	0	107	N2938 E2942	N2938-V2940 PolarHBondContact O-N 2.82Å; V2940-E2942 PolarHBondContact O-N 2.87Å
2941	T	31.3	Very low	30.5	Very low	130 Å²	130	142.9 Å²	142.9	80%	0.798	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-66	126.6	-170	44.5	0	0	0	0	112.6	H2943	T2941-H2943 PolarHBondContact O-N 3.37Å
2942	E	25.7	Very low	31.3	Very low	178 Å²	178	146.3 Å²	146.3	83%	0.832	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.2	128.9	160.9	-60.1	174.4	118.3	0	0	110	V2940	V2940-E2942 PolarHBondContact O-N 2.87Å
2943	H	29.3	Very low	31.8	Very low	171 Å²	171	146 Å²	146	79%	0.792	78%	0.777	S	S	*	*			trans	-168.4	129.4	141.1	-97.5	-47	0	0	0	112.5	T2941	T2941-H2943 PolarHBondContact O-N 3.37Å
2944	K	29	Very low	32.5	Very low	194 Å²	194	149.2 Å²	149.2	84%	0.843	77%	0.774	S	S	*	*			trans	64.6	68	150.5	-59.6	179.8	177.3	177.7	0	119.8
2945	V	29.4	Very low	33.2	Very low	148 Å²	148	143.9 Å²	143.9	90%	0.897	76%	0.757	S	S	*	*			trans	-136.5	36	152.3	-155.6	0	0	0	0	113.5
2946	Q	31.5	Very low	34	Very low	193 Å²	193	145.5 Å²	145.5	90%	0.902	75%	0.752	S	S	*	*			trans	-116.6	10.3	-180	-92.9	-172.3	-10.7	0	0	116
2947	A	35.4	Very low	34.5	Very low	83 Å²	83	146.8 Å²	146.8	69%	0.686	74%	0.741	S	S	*	*	S	Bend	trans	-93.6	-21.1	-177.2	0	0	0	0	0	115.8
2948	V	36.5	Very low	35.3	Very low	121 Å²	121	143.4 Å²	143.4	73%	0.733	73%	0.726	S	S	*	*	S	Bend	trans	-88.7	-33.9	-168.5	-177.4	0	0	0	0	113.5	A2950	V2948-A2950 VanDerWaalsContact C-N 3.33Å; V2948-A2950 PolarHBondContact O-N 3.03Å
2949	R	34.2	Very low	36	Very low	219 Å²	219	139 Å²	139	83%	0.826	71%	0.711	S	S	*	*	H	α-helix	trans	-74.5	-18	-172.9	-134.1	175.3	-170.8	177.3	2.2	114.6
2950	A	38.4	Very low	36.9	Very low	70 Å²	70	133.5 Å²	133.5	58%	0.579	70%	0.695	S	S	*	*	H	α-helix	trans	-78.4	-24.4	-179.6	0	0	0	0	0	114	V2948	V2948-A2950 VanDerWaalsContact C-N 3.33Å; V2948-A2950 PolarHBondContact O-N 3.03Å
2951	V	42.1	Very low	37.5	Very low	99 Å²	99	132.7 Å²	132.7	60%	0.6	69%	0.685	S	S	*	*	H	α-helix	trans	-78.7	-42.8	-176.5	-178.7	0	0	0	0	111.5	L2953 R2954	V2951-L2953 VanDerWaalsContact C-N 3.33Å; V2951-L2953 PolarHBondContact O-N 3.43Å; V2951-R2954 PolarHBondContact O-N 3.03Å; V2951-R2954 VanDerWaalsContact O-N 3.16Å
2952	Q	40.5	Very low	38.3	Very low	143 Å²	143	130 Å²	130	67%	0.668	67%	0.671	S	S	*	*	H	α-helix	trans	-63.3	-34.2	180	-92.3	174.9	-35.8	0	0	113.7	R2954 L2956	Q2952-R2954 VanDerWaalsContact C-N 3.31Å; Q2952-R2954 PolarHBondContact O-N 3.38Å; Q2952-L2956 PolarHBondContact O-N 3.44Å
2953	L	40	Very low	39	Very low	116 Å²	116	131 Å²	131	61%	0.607	67%	0.668	S	S	*	*	H	α-helix	trans	-69.9	-24.1	176.7	-88.8	159	0	0	0	113.6	V2951	V2951-L2953 VanDerWaalsContact C-N 3.33Å; V2951-L2953 PolarHBondContact O-N 3.43Å
2954	R	40.5	Very low	39.5	Very low	200 Å²	200	133.1 Å²	133.1	76%	0.755	67%	0.669	S	S	*	*	H	α-helix	trans	-78.8	-33.1	177.3	-102.1	-176.8	172.8	-178.6	-1.3	113.6	V2951 Q2952	V2951-R2954 PolarHBondContact O-N 3.03Å; V2951-R2954 VanDerWaalsContact O-N 3.16Å; Q2952-R2954 VanDerWaalsContact C-N 3.31Å; Q2952-R2954 PolarHBondContact O-N 3.38Å
2955	E	42.9	Very low	40.1	Very low	104 Å²	104	133.2 Å²	133.2	49%	0.486	66%	0.664	S	S	.	*	H	α-helix	trans	-76.3	-36.6	177	-70.2	-55.1	130.6	0	0	112.4	N2957 K2958 A2959	E2955-N2957 VanDerWaalsContact C-N 3.31Å; E2955-N2957 PolarHBondContact O-N 2.95Å; E2955-K2958 PolarHBondContact O-N 2.87Å; E2955-K2958 VanDerWaalsContact O-N 3.14Å; E2955-K2958 IonicContact OE1-NZ 3.98Å; E2955-K2958 PolarHBondContact OE1-NZ 3.03Å; E2955-K2958 IonicContact OE2-NZ 2.72Å; E2955-A2959 PolarHBondContact O-N 3.35Å
2956	L	43.6	Very low	40.9	Very low	123 Å²	123	130.9 Å²	130.9	64%	0.644	65%	0.65	S	S	*	*	H	α-helix	trans	-59.3	-38.9	175.6	-111.3	146.1	0	0	0	112.9	Q2952 A2959 T2960	Q2952-L2956 PolarHBondContact O-N 3.44Å; L2956-A2959 PolarHBondContact O-N 3.06Å; L2956-T2960 PolarHBondContact O-N 3.44Å; L2956-T2960 PolarHBondContact O-OG1 3.46Å
2957	N	40.9	Very low	41.6	Very low	103 Å²	103	128 Å²	128	55%	0.551	64%	0.639	S	S	*	*	H	α-helix	trans	-72.7	-26.4	177	-78.9	-5.5	0	0	0	113.8	E2955 T2960 I2961	E2955-N2957 VanDerWaalsContact C-N 3.31Å; E2955-N2957 PolarHBondContact O-N 2.95Å; N2957-T2960 PolarHBondContact O-OG1 3.06Å; N2957-I2961 WeakPolarHBondContact O-CG1 3.35Å; N2957-I2961 PolarHBondContact O-N 3.02Å
2958	K	43.3	Very low	41.9	Very low	127 Å²	127	132.1 Å²	132.1	55%	0.552	64%	0.644	S	S	*	*	H	α-helix	trans	-70.5	-38.5	173.2	-74	177.7	-175.8	164.8	0	111.7	E2955 T2960 I2961 S2962	E2955-K2958 PolarHBondContact O-N 2.87Å; E2955-K2958 VanDerWaalsContact O-N 3.14Å; E2955-K2958 IonicContact OE1-NZ 3.98Å; E2955-K2958 PolarHBondContact OE1-NZ 3.03Å; E2955-K2958 IonicContact OE2-NZ 2.72Å; K2958-T2960 VanDerWaalsContact C-N 3.33Å; K2958-T2960 PolarHBondContact O-N 3.49Å; K2958-I2961 PolarHBondContact O-N 3.14Å; K2958-S2962 PolarHBondContact O-N 3.33Å
2959	A	45.2	Very low	42.1	Very low	61 Å²	61	137.6 Å²	137.6	50%	0.504	65%	0.652	S	S	.	*	H	α-helix	trans	-65.4	-32.5	178.4	0	0	0	0	0	113.1	E2955 L2956 S2962	E2955-A2959 PolarHBondContact O-N 3.35Å; L2956-A2959 PolarHBondContact O-N 3.06Å; A2959-S2962 PolarHBondContact O-OG 3.28Å
2960	T	44.3	Very low	42.1	Very low	90 Å²	90	138 Å²	138	55%	0.552	66%	0.663	S	S	*	*	H	α-helix	trans	-72.8	-36.2	176.7	1	0	0	0	0	112.4	L2956 N2957 K2958 R2964	L2956-T2960 PolarHBondContact O-N 3.44Å; L2956-T2960 PolarHBondContact O-OG1 3.46Å; N2957-T2960 PolarHBondContact O-OG1 3.06Å; K2958-T2960 VanDerWaalsContact C-N 3.33Å; K2958-T2960 PolarHBondContact O-N 3.49Å; T2960-R2964 PolarHBondContact O-N 3.05Å
2961	I	44.6	Very low	42.3	Very low	113 Å²	113	141.5 Å²	141.5	58%	0.579	67%	0.667	S	S	*	*	H	α-helix	trans	-72.3	-37.2	-178.8	-66.4	170.3	0	0	0	111.8	N2957 K2958 R2963 R2964	N2957-I2961 WeakPolarHBondContact O-CG1 3.35Å; N2957-I2961 PolarHBondContact O-N 3.02Å; K2958-I2961 PolarHBondContact O-N 3.14Å; I2961-R2963 PolarHBondContact O-N 3.5Å; I2961-R2964 PolarHBondContact O-N 3.04Å
2962	S	46.6	Very low	42.3	Very low	73 Å²	73	143.7 Å²	143.7	51%	0.51	67%	0.67	S	S	.	*	H	α-helix	trans	-65.1	-39.2	176.4	67.8	0	0	0	0	112.1	K2958 A2959 R2964 R2965	K2958-S2962 PolarHBondContact O-N 3.33Å; A2959-S2962 PolarHBondContact O-OG 3.28Å; S2962-R2964 VanDerWaalsContact C-N 3.34Å; S2962-R2964 PolarHBondContact O-N 3.09Å; S2962-R2965 PolarHBondContact O-N 2.97Å
2963	R	40.5	Very low	42.4	Very low	201 Å²	201	143.7 Å²	143.7	76%	0.758	67%	0.671	S	S	*	*	H	α-helix	trans	-65.5	-32.9	-179.2	-131.3	177.2	-172.7	-178.1	1.4	113.4	I2961	I2961-R2963 PolarHBondContact O-N 3.5Å
2964	R	39.7	Very low	42.5	Very low	214 Å²	214	145.4 Å²	145.4	81%	0.808	67%	0.674	S	S	*	*	H	α-helix	trans	-69.1	-28.9	175.1	-101	-174.6	174.7	179.8	-1.2	113.9	T2960 I2961 S2962	T2960-R2964 PolarHBondContact O-N 3.05Å; I2961-R2964 PolarHBondContact O-N 3.04Å; S2962-R2964 VanDerWaalsContact C-N 3.34Å; S2962-R2964 PolarHBondContact O-N 3.09Å
2965	R	42.2	Very low	42.6	Very low	197 Å²	197	141.9 Å²	141.9	74%	0.743	67%	0.669	S	S	*	*	H	α-helix	trans	-78.4	-22	179.3	-77.1	-170.2	177.5	-178	-0.1	114.6	S2962	S2962-R2965 PolarHBondContact O-N 2.97Å
2966	V	46.2	Very low	42.6	Very low	99 Å²	99	144.5 Å²	144.5	60%	0.6	68%	0.681	S	S	*	*	H	α-helix	trans	-76.7	-37.9	177.8	179.6	0	0	0	0	111.3	Q2968 R2969	V2966-Q2968 PolarHBondContact O-N 3.04Å; V2966-R2969 PolarHBondContact O-N 3.04Å
2967	I	46	Very low	42.5	Very low	133 Å²	133	146 Å²	146	68%	0.682	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-15.6	-178.8	-61.4	173.8	0	0	0	112.3
2968	Q	42.6	Very low	42.7	Very low	169 Å²	169	149.3 Å²	149.3	79%	0.79	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	12.3	178	-133.9	176.4	4.4	0	0	113.8	V2966	V2966-Q2968 PolarHBondContact O-N 3.04Å
2969	R	41.1	Very low	42.6	Very low	235 Å²	235	151.2 Å²	151.2	89%	0.887	71%	0.706	S	S	*	*			trans	-128.5	6.9	174.9	-97.5	-170.8	176.7	-170.4	-1.2	114.1	V2966	V2966-R2969 PolarHBondContact O-N 3.04Å
2970	H	32.6	Very low	42.4	Very low	229 Å²	229	159.4 Å²	159.4	100%	1.06	73%	0.725	S	S	*	*			trans	-111.2	0	156.2	-82	-41.5	0	0	0	107.8

Retrieved 2,970 of 2,970 residues in 1642.1 ms (Link to these results)

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