A0A087YAQ4_POEFO Loading...

Mast/stem cell growth factor receptor

AlphaFold DB , UniProt , Accession A0A087YAQ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 956 aa.

						>A0A087YAQ4_POEFO|A0A087YAQ4
MRCPWVICTSYFIFLPITAWSKPVIFPSEPHIVVPKKGKLQLRCHDNATASGAPFLLRWQREKNRKLEGEVEEGKVASLSLSGVQAQQMGWYVCVNNNTQENSSIFVYVKDPHSAFQQTMMSSILVRAGEDCIIPCLVTDPDVANLSLETCDGRPLPSGMVYSGNLQRGIIIRNAREEVKGCYRCVGQLGGNRVTSVSYSVDVRPVPELRPEVILSHKDTVILKTGEAFELTCNSTNINSEFSLTWDVPSAANPVKSQISHILPSSRGYLRSTKLSIATVVQLDSGIYRCHAHNEKGHSDAAMQLDVRDQGFITPLGNHSPIQEVKEGESLTLRVEFDAYPAPRSIFWSYNKEHLLNTTEHVITVRPVKHRKYRFTSQLRLVRVLSSEGGVYTFSVSNGDASVERSFHVYVNSKPVIIAQDGPVDGQVRCIAAGYPVPKISWYFCELPRTRCSNLPNATQWESPEVTVLSESAFGRSEVESRLNVSNEHAQYHTLECVASTQGEEAYILFTIRERIVPHKLFTPLLTGMLATGVFLSVILVVLVYKYMQKPKFQIQWKVIESINGNNYIYIDPLQLPYDLKWEFPRQKLRFGKTLGSGAFGKVVRATAYGLCSADTVTTVAVKMLKPNAHSTEKEALMSELKVLSYLGNHVNIVNLLGACTVGGPILVITEYCCYGDLLNFLRRKRESFLNSQVGDGYYRNVPKQSEPTRDATGTGYIPMRPSEKERSSQSDCIDELSLDAEDLLSFSYQVAKGMEYITSKNCIHRDLAARNVLLTHGRVAKICDFGLARDITTDSSYVLRGNARLPVKWMSPESIFDCVYTFESDVWSYGILLWEIFSLGNSPYPGMQVGSAFYKMIQDGRRMSRPEFAPIEMYDMMLCCWNDDPLKRPSFRKLVERTELLLSENTKNVYLTLSNTPNASEQQRAPSRRLSSVCSTTAPTQPLLQNSVDVFLDYV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	38.2	Very low	253 Å²	253	166.3 Å²	166.3	100%	1.246	86%	0.856	S	S	*	*				0	175.5	0	-81.6	171.1	164	0	0	109.2
2	R	32.3	Very low	38.2	Very low	248 Å²	248	168.2 Å²	168.2	94%	0.936	85%	0.853	S	S	*	*			trans	-85.6	165.6	-172.8	-70.4	178.5	173.7	167	-2.8	113.1
3	C	36	Very low	38.6	Very low	115 Å²	115	166.5 Å²	166.5	78%	0.777	85%	0.845	S	S	*	*			trans	-44.6	164.8	159.1	-100.1	0	0	0	0	114
4	P	48.8	Very low	38.8	Very low	122 Å²	122	169.4 Å²	169.4	79%	0.792	85%	0.85	S	S	*	*			cis	-147.2	-175.1	49.3	42.8	-22.7	0	0	0	118.5
5	W	41	Very low	38.7	Very low	225 Å²	225	167.4 Å²	167.4	85%	0.852	84%	0.842	S	S	*	*			trans	-73.3	156.2	168.8	-60	5.8	0	0	0	112.7
6	V	36.6	Very low	38.9	Very low	134 Å²	134	164 Å²	164	81%	0.812	84%	0.835	S	S	*	*			trans	-139.8	140.8	150.5	177.8	0	0	0	0	109
7	I	43.1	Very low	38.9	Very low	142 Å²	142	163.7 Å²	163.7	73%	0.728	83%	0.834	S	S	*	*			trans	-96.5	136.8	173.7	-62.8	165.8	0	0	0	108.6
8	C	33.6	Very low	39.3	Very low	124 Å²	124	160.1 Å²	160.1	84%	0.838	82%	0.821	S	S	*	*			trans	-139	137.2	161	-94.2	0	0	0	0	111.5
9	T	39.2	Very low	39.5	Very low	134 Å²	134	156.3 Å²	156.3	82%	0.822	82%	0.816	S	S	*	*			trans	-84.4	138.7	179	48.3	0	0	0	0	111.9
10	S	36.3	Very low	40.4	Very low	100 Å²	100	157.5 Å²	157.5	70%	0.699	81%	0.81	S	S	*	*			trans	-115	135.8	164.6	50.3	0	0	0	0	110.7	F12	S10-F12 PolarHBondContact O-N 3.14Å
11	Y	39	Very low	41.4	Very low	232 Å²	232	151.7 Å²	151.7	91%	0.91	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-64.3	131.4	174.2	-89.1	-118.8	0	0	0	110.1
12	F	38.4	Very low	43.3	Very low	189 Å²	189	145.7 Å²	145.7	83%	0.829	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-101.2	127.1	157.9	-96.5	-86.2	0	0	0	109.9	S10	S10-F12 PolarHBondContact O-N 3.14Å
13	I	43.9	Very low	45.5	Very low	146 Å²	146	133.9 Å²	133.9	75%	0.749	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-73.7	134.9	177.7	-63.9	167.5	0	0	0	108.4	L15	I13-L15 PolarHBondContact O-N 3.48Å
14	F	40.7	Very low	47.7	Very low	207 Å²	207	130.9 Å²	130.9	91%	0.908	68%	0.683	S	S	*	*			trans	-66.7	95.3	170.6	-88.7	-89.5	0	0	0	110.4
15	L	37.4	Very low	49.5	Very low	140 Å²	140	125.7 Å²	125.7	73%	0.733	65%	0.649	S	S	*	*			trans	-83.5	135.1	153.9	-75.3	168.1	0	0	0	108.4	I13 I17	I13-L15 PolarHBondContact O-N 3.48Å; L15-I17 PolarHBondContact O-N 3.08Å; L15-I17 VanDerWaalsContact O-N 3.15Å
16	P	41.8	Very low	51.5	Low	113 Å²	113	120 Å²	120	73%	0.734	63%	0.63	S	S	*	*			trans	-67.3	114.4	173.4	27.9	-32.6	0	0	0	109	T18	P16-T18 PolarHBondContact O-N 2.91Å
17	I	39.2	Very low	53.7	Low	159 Å²	159	115.9 Å²	115.9	82%	0.815	61%	0.606	S	S	*	*			trans	-69.4	99.8	174.7	-59.3	174.6	0	0	0	107.7	L15 A19	L15-I17 PolarHBondContact O-N 3.08Å; L15-I17 VanDerWaalsContact O-N 3.15Å; I17-A19 VanDerWaalsContact C-N 3.26Å; I17-A19 PolarHBondContact O-N 2.97Å
18	T	46	Very low	55.4	Low	98 Å²	98	113 Å²	113	60%	0.601	60%	0.599	S	S	*	*			trans	-69.1	89.4	165.3	54	0	0	0	0	108.1	P16 W20	P16-T18 PolarHBondContact O-N 2.91Å; T18-W20 PolarHBondContact O-N 3.39Å
19	A	43.7	Very low	57.8	Low	88 Å²	88	112.2 Å²	112.2	73%	0.727	58%	0.583	S	S	*	*			trans	-65	98.5	174.5	0	0	0	0	0	109.2	I17 S21	I17-A19 VanDerWaalsContact C-N 3.26Å; I17-A19 PolarHBondContact O-N 2.97Å; A19-S21 PolarHBondContact O-N 3.27Å
20	W	56.1	Low	59.8	Low	181 Å²	181	111.3 Å²	111.3	69%	0.686	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-67	131.1	171	-59.5	-30.7	0	0	0	108.9	T18	T18-W20 PolarHBondContact O-N 3.39Å
21	S	61.8	Low	62.2	Low	36 Å²	36	109.3 Å²	109.3	25%	0.252	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-87.6	128.3	-179.9	45.6	0	0	0	0	110.3	A19 D46 A48	A19-S21 PolarHBondContact O-N 3.27Å; S21-D46 PolarHBondContact OG-OD1 3.42Å; S21-A48 PolarHBondContact OG-N 3.04Å; S21-A48 VanDerWaalsContact OG-N 3.16Å
22	K	73.6	Confident	64.7	Low	126 Å²	126	98.9 Å²	98.9	55%	0.548	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-53.8	140.9	165.9	-70	-174.2	178.7	-172.4	0	109.8	V24 E101	K22-V24 PolarHBondContact O-N 2.98Å; K22-E101 WeakPolarHBondContact CA-OE2 3.48Å; K22-E101 WeakPolarHBondContact CG-OE2 3.32Å; K22-E101 PolarHBondContact N-OE2 2.94Å
23	P	80.2	Confident	67.1	Low	0 Å²	0	92.8 Å²	92.8	0%	0	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-59.5	134.3	177.7	24.7	-33.4	0	0	0	110.1	L57 S103	P23-L57 HydrophobicContact CB-CD2 4.02Å; P23-S103 WeakPolarHBondContact O-CB 3.4Å; P23-S103 PolarHBondContact O-OG 3.36Å
24	V	81.6	Confident	69.3	Low	52 Å²	52	86.1 Å²	86.1	32%	0.315	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.6	-175.6	176.2	0	0	0	0	109.3	K22 C44 H45	K22-V24 PolarHBondContact O-N 2.98Å; V24-C44 WeakPolarHBondContact O-CA 3.41Å; V24-H45 WeakPolarHBondContact CB-NE2 3.14Å; V24-H45 PolarHBondContact N-O 2.93Å; V24-H45 PolarHBondContact O-CD2 2.71Å; V24-H45 PolarHBondContact O-N 3.34Å
25	I	85.8	Confident	71.7	Confident	14 Å²	14	80.3 Å²	80.3	7%	0.072	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	136.5	-179	-65.8	171.7	0	0	0	109.8	S28 R43 W59 C94 I105	I25-S28 WeakPolarHBondContact O-CA 3.3Å; I25-S28 PolarHBondContact O-OG 3.49Å; I25-R43 WeakPolarHBondContact CA-O 3.44Å; I25-W59 HydrophobicContact CB-CH2 4.47Å; I25-W59 HydrophobicContact CD1-CH2 3.72Å; I25-W59 HydrophobicContact CD1-CZ3 4.01Å; I25-W59 HydrophobicContact CG1-CH2 3.78Å; I25-W59 HydrophobicContact CG1-CZ2 4.45Å; I25-W59 HydrophobicContact CG2-CH2 3.9Å; I25-C94 HydrophobicContact CD1-CB 4.25Å; I25-C94 HydrophobicContact CG1-CB 4.28Å; I25-I105 HydrophobicContact CD1-CB 4.28Å; I25-I105 HydrophobicContact CD1-CG2 4.29Å; I25-I105 HydrophobicContact CG2-CB 4.38Å; I25-I105 HydrophobicContact CG2-CD1 3.92Å; I25-I105 HydrophobicContact CG2-CG2 4.14Å
26	F	82.8	Confident	74	Confident	105 Å²	105	77 Å²	77	46%	0.461	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.1	169.2	-77.9	-57.7	0	0	0	111.4	S28 R43 H45	F26-S28 VanDerWaalsContact CD1-OG 3.24Å; F26-S28 WeakPolarHBondContact CD1-OG 3.15Å; F26-S28 WeakPolarHBondContact CE1-OG 3.44Å; F26-R43 HydrophobicContact CB-CB 4.38Å; F26-R43 PolarHBondContact N-O 3.5Å; F26-R43 PolarHBondContact O-N 2.91Å; F26-H45 AromaticContact CD2-CD2 3.65Å; F26-H45 AromaticContact CD2-NE2 3.69Å; F26-H45 AromaticContact CE2-CD2 3.56Å; F26-H45 AromaticContact CE2-NE2 3.12Å; F26-H45 WeakPolarHBondContact CE2-NE2 3.29Å; F26-H45 AromaticContact CZ-NE2 3.87Å
27	P	83.2	Confident	76.1	Confident	47 Å²	47	79.3 Å²	79.3	31%	0.305	42%	0.424	S	S	.	.	S	Bend	cis	-66.7	146.2	-5.5	30	-34.9	0	0	0	111.7	E29 I32	P27-E29 HydrophobicContact CB-CG 4.29Å; P27-E29 PolarHBondContact O-N 2.84Å; P27-I32 HydrophobicContact CG-CD1 3.9Å; P27-I32 HydrophobicContact CG-CG1 3.7Å
28	S	80.3	Confident	78.3	Confident	82 Å²	82	72.7 Å²	72.7	57%	0.573	40%	0.395	S	S	*	.			trans	-85.5	51.7	-173.9	-51.4	0	0	0	0	111.7	I25 F26	I25-S28 WeakPolarHBondContact O-CA 3.3Å; I25-S28 PolarHBondContact O-OG 3.49Å; F26-S28 VanDerWaalsContact CD1-OG 3.24Å; F26-S28 WeakPolarHBondContact CD1-OG 3.15Å; F26-S28 WeakPolarHBondContact CE1-OG 3.44Å
29	E	82.7	Confident	80.2	Confident	108 Å²	108	73.6 Å²	73.6	51%	0.505	39%	0.39	S	S	.	.	S	Bend	trans	-97	156.1	-179.1	-71.6	171	-172.5	0	0	110.6	P27 H31 I105	P27-E29 HydrophobicContact CB-CG 4.29Å; P27-E29 PolarHBondContact O-N 2.84Å; E29-H31 WeakPolarHBondContact CB-O 3.3Å; E29-H31 PolarHBondContact O-N 3.1Å; E29-I105 VanDerWaalsContact O-CD1 3.24Å; E29-I105 WeakPolarHBondContact O-CD1 3.47Å
30	P	80.9	Confident	82.3	Confident	114 Å²	114	69.4 Å²	69.4	74%	0.74	36%	0.356	S	S	*	.	S	Bend	trans	-65.8	-21.4	178.6	27.2	-35.5	0	0	0	113.3
31	H	88.3	Confident	83.8	Confident	58 Å²	58	65.9 Å²	65.9	27%	0.269	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	161.8	172.5	58	-94.5	0	0	0	108.4	E29 F106 Y108 P141	E29-H31 WeakPolarHBondContact CB-O 3.3Å; E29-H31 PolarHBondContact O-N 3.1Å; H31-F106 CarbonylContact C-O 3.58Å; H31-F106 VanDerWaalsContact CA-O 3.28Å; H31-F106 WeakPolarHBondContact CA-O 3.13Å; H31-F106 HydrophobicContact CB-CB 4.45Å; H31-F106 WeakPolarHBondContact CB-O 3.42Å; H31-Y108 HydrophobicContact CB-CD2 3.96Å; H31-Y108 HydrophobicContact CB-CE2 3.79Å; H31-Y108 AromaticContact CD2-CD2 3.68Å; H31-Y108 AromaticContact CD2-CE2 3.83Å; H31-Y108 AromaticContact CG-CD2 3.94Å; H31-Y108 AromaticContact CG-CE2 3.72Å; H31-P141 WeakPolarHBondContact NE2-CG 3.31Å
32	I	90.8	Very high	85	Confident	14 Å²	14	64.2 Å²	64.2	7%	0.072	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.4	170.9	-77.6	105.2	0	0	0	109.9	P27 V34 L40 L42 I105 F106 V107 Y108	P27-I32 HydrophobicContact CG-CD1 3.9Å; P27-I32 HydrophobicContact CG-CG1 3.7Å; I32-V34 HydrophobicContact CG2-CG2 3.75Å; I32-L40 HydrophobicContact CG2-CD1 4.01Å; I32-L42 HydrophobicContact CD1-CD2 3.69Å; I32-L42 HydrophobicContact CG1-CD2 4.49Å; I32-I105 HydrophobicContact CD1-CD1 3.22Å; I32-I105 HydrophobicContact CD1-CG1 3.71Å; I32-I105 HydrophobicContact CD1-CG2 4.41Å; I32-F106 PolarHBondContact N-O 3.37Å; I32-V107 WeakPolarHBondContact O-CA 3.15Å; I32-Y108 PolarHBondContact O-N 2.94Å
33	V	89.3	Confident	85.6	Confident	60 Å²	60	65.6 Å²	65.6	36%	0.364	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	122.7	172.5	-169.5	0	0	0	0	110	K110 P141	V33-K110 HydrophobicContact CG1-CB 3.88Å; V33-K110 HydrophobicContact CG1-CD 3.9Å; V33-P141 HydrophobicContact CG2-CG 3.48Å; V33-P141 VanDerWaalsContact CG2-CG 3.48Å
34	V	90.3	Very high	85.8	Confident	6 Å²	6	65.6 Å²	65.6	4%	0.036	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.1	175.3	-172.7	0	0	0	0	109.2	I32 L40 V107 Y108 V109 K110	I32-V34 HydrophobicContact CG2-CG2 3.75Å; V34-L40 HydrophobicContact CG2-CB 4.1Å; V34-L40 HydrophobicContact CG2-CD1 3.68Å; V34-L40 HydrophobicContact CG2-CG 4.5Å; V34-V107 HydrophobicContact CG2-CG1 4.2Å; V34-Y108 PolarHBondContact N-O 2.9Å; V34-V109 CarbonylContact O-C 3.46Å; V34-V109 VanDerWaalsContact O-CA 3.27Å; V34-V109 WeakPolarHBondContact O-CA 3.47Å; V34-K110 PolarHBondContact O-N 2.88Å
35	P	89.2	Confident	85.7	Confident	85 Å²	85	64.6 Å²	64.6	55%	0.552	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	145.5	172.4	27.8	-34	0	0	0	110.7	K37 G38	P35-K37 PolarHBondContact O-N 3.16Å; P35-G38 VanDerWaalsContact O-CA 3.29Å; P35-G38 WeakPolarHBondContact O-CA 3.27Å; P35-G38 PolarHBondContact O-N 3.46Å
36	K	86.8	Confident	85.1	Confident	71 Å²	71	64.4 Å²	64.4	31%	0.309	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	136.1	173.3	-176.9	175	174.1	-175.6	0	111.1	G38 V109 K110 D111	K36-G38 PolarHBondContact O-N 3.1Å; K36-V109 HydrophobicContact CB-CG1 4.36Å; K36-K110 PolarHBondContact N-O 3.3Å; K36-D111 HydrophobicContact CD-CB 3.94Å; K36-D111 WeakPolarHBondContact CD-OD1 3.25Å; K36-D111 WeakPolarHBondContact CD-OD2 3.36Å; K36-D111 WeakPolarHBondContact CE-OD2 3.45Å; K36-D111 IonicContact NZ-OD1 3.2Å; K36-D111 PolarHBondContact NZ-OD1 3.17Å; K36-D111 IonicContact NZ-OD2 3.75Å; K36-D111 PolarHBondContact NZ-OD2 3.07Å
37	K	84.9	Confident	84.1	Confident	162 Å²	162	64.2 Å²	64.2	70%	0.704	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	1.3	-165.7	-55.1	179.5	179.9	178.1	0	115.8	P35 G83 V84	P35-K37 PolarHBondContact O-N 3.16Å; K37-G83 WeakPolarHBondContact O-CA 3.39Å; K37-V84 PolarHBondContact N-O 2.96Å
38	G	86	Confident	82.9	Confident	19 Å²	19	62.6 Å²	62.6	20%	0.196	32%	0.322	C	S	.	.			trans	-71.8	-169.1	175.8	0	0	0	0	0	114.1	P35 K36 G83 V84	P35-G38 VanDerWaalsContact O-CA 3.29Å; P35-G38 WeakPolarHBondContact O-CA 3.27Å; P35-G38 PolarHBondContact O-N 3.46Å; K36-G38 PolarHBondContact O-N 3.1Å; G38-G83 PolarHBondContact O-N 2.95Å; G38-V84 PolarHBondContact O-N 2.92Å; G38-V84 VanDerWaalsContact O-N 3.07Å
39	K	87.3	Confident	81.6	Confident	117 Å²	117	65.9 Å²	65.9	51%	0.509	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.9	178.2	-166	-170.5	-173.9	-166.1	0	110.1	Q41 S80 L81	K39-Q41 HydrophobicContact CD-CG 4.08Å; K39-Q41 VanDerWaalsContact CE-CD 3.47Å; K39-Q41 HydrophobicContact CG-CG 4.19Å; K39-Q41 VanDerWaalsContact NZ-NE2 3.12Å; K39-S80 WeakPolarHBondContact CE-OG 3.44Å; K39-L81 CarbonylContact C-O 3.51Å; K39-L81 VanDerWaalsContact CA-O 3.27Å; K39-L81 WeakPolarHBondContact CA-O 3.5Å; K39-L81 WeakPolarHBondContact CG-O 3.38Å
40	L	87.2	Confident	80.1	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.8	168.1	174.9	67.9	0	0	0	108.3	I32 V34 L42 S80 L81 V84 Y92 V107	I32-L40 HydrophobicContact CG2-CD1 4.01Å; V34-L40 HydrophobicContact CG2-CB 4.1Å; V34-L40 HydrophobicContact CG2-CD1 3.68Å; V34-L40 HydrophobicContact CG2-CG 4.5Å; L40-L42 HydrophobicContact CD1-CD2 3.87Å; L40-L42 HydrophobicContact CD1-CG 3.99Å; L40-L42 HydrophobicContact CD2-CD1 4.33Å; L40-L42 HydrophobicContact CD2-CG 4.34Å; L40-L42 HydrophobicContact CG-CG 4.14Å; L40-S80 CarbonylContact O-C 3.49Å; L40-S80 WeakPolarHBondContact O-CA 3.45Å; L40-L81 HydrophobicContact CB-CB 4.31Å; L40-L81 HydrophobicContact CD2-CD1 4.16Å; L40-L81 PolarHBondContact N-O 2.98Å; L40-L81 PolarHBondContact O-N 3.01Å; L40-V84 HydrophobicContact CB-CG2 3.91Å; L40-Y92 HydrophobicContact CD2-CE1 4.23Å; L40-Y92 HydrophobicContact CD2-CE2 4.46Å; L40-V107 HydrophobicContact CD1-CG1 3.87Å; L40-V107 HydrophobicContact CD1-CG2 4.08Å; L40-V107 HydrophobicContact CD2-CG1 4.15Å; L40-V107 HydrophobicContact CD2-CG2 4.26Å
41	Q	86.8	Confident	78.7	Confident	106 Å²	106	64.6 Å²	64.6	50%	0.495	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.8	166.1	-59.6	-160.9	-86	0	0	109.4	K39 L79 S80	K39-Q41 HydrophobicContact CD-CG 4.08Å; K39-Q41 VanDerWaalsContact CE-CD 3.47Å; K39-Q41 HydrophobicContact CG-CG 4.19Å; K39-Q41 VanDerWaalsContact NZ-NE2 3.12Å; Q41-L79 WeakPolarHBondContact CA-O 3.46Å; Q41-S80 PolarHBondContact NE2-OG 2.76Å
42	L	86.9	Confident	77.1	Confident	1 Å²	1	65 Å²	65	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.5	172	-57	179.2	0	0	0	108.8	I32 L40 W59 L79 Y92 I105 V107	I32-L42 HydrophobicContact CD1-CD2 3.69Å; I32-L42 HydrophobicContact CG1-CD2 4.49Å; L40-L42 HydrophobicContact CD1-CD2 3.87Å; L40-L42 HydrophobicContact CD1-CG 3.99Å; L40-L42 HydrophobicContact CD2-CD1 4.33Å; L40-L42 HydrophobicContact CD2-CG 4.34Å; L40-L42 HydrophobicContact CG-CG 4.14Å; L42-W59 HydrophobicContact CB-CH2 3.81Å; L42-W59 HydrophobicContact CB-CZ2 3.54Å; L42-W59 HydrophobicContact CD1-CE3 4.38Å; L42-W59 HydrophobicContact CD1-CH2 3.75Å; L42-W59 HydrophobicContact CD1-CZ2 4.26Å; L42-W59 HydrophobicContact CD1-CZ3 3.84Å; L42-W59 HydrophobicContact CG-CH2 4.36Å; L42-L79 HydrophobicContact CB-CB 4.37Å; L42-L79 HydrophobicContact CD1-CD2 4.21Å; L42-L79 PolarHBondContact N-O 2.92Å; L42-L79 PolarHBondContact O-N 3.09Å; L42-Y92 HydrophobicContact CD1-CD1 4.1Å; L42-Y92 HydrophobicContact CD1-CG 3.98Å; L42-I105 HydrophobicContact CD1-CG2 4.14Å; L42-I105 HydrophobicContact CD2-CG2 4.39Å; L42-V107 HydrophobicContact CD1-CG2 4.32Å
43	R	85.6	Confident	75.3	Confident	155 Å²	155	68.3 Å²	68.3	59%	0.585	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.5	168.9	-68.6	-177.4	173.3	154.5	-2.8	109.4	I25 F26 V76	I25-R43 WeakPolarHBondContact CA-O 3.44Å; F26-R43 HydrophobicContact CB-CB 4.38Å; F26-R43 PolarHBondContact N-O 3.5Å; F26-R43 PolarHBondContact O-N 2.91Å; R43-V76 HydrophobicContact CB-CG1 4.28Å
44	C	84.5	Confident	73.7	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.7	172.5	-177.2	0	0	0	0	109.3	V24 L57 W59 V76 A77 C94	V24-C44 WeakPolarHBondContact O-CA 3.41Å; C44-L57 WeakPolarHBondContact O-CD1 3.17Å; C44-W59 HydrophobicContact CB-CH2 4.43Å; C44-W59 HydrophobicContact CB-CZ2 3.61Å; C44-V76 CarbonylContact O-C 3.59Å; C44-V76 VanDerWaalsContact O-CA 3.3Å; C44-V76 WeakPolarHBondContact O-CA 3.44Å; C44-V76 WeakPolarHBondContact O-CG1 3.04Å; C44-A77 HydrophobicContact CB-CB 4.49Å; C44-A77 PolarHBondContact N-O 2.87Å; C44-A77 PolarHBondContact O-N 2.88Å; C44-C94 HydrophobicContact CB-CB 3.65Å; C44-C94 WeakPolarHBondContact CB-SG 2.96Å; C44-C94 WeakPolarHBondContact SG-CB 3.43Å; C44-C94 CovalentContact SG-SG 2.02Å; C44-C94 PolarHBondContact SG-SG 3.01Å
45	H	81	Confident	72.3	Confident	32 Å²	32	71 Å²	71	15%	0.148	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	156.8	177.3	74.3	108.3	0	0	0	111.2	V24 F26 N47 V76	V24-H45 WeakPolarHBondContact CB-NE2 3.14Å; V24-H45 PolarHBondContact N-O 2.93Å; V24-H45 PolarHBondContact O-CD2 2.71Å; V24-H45 PolarHBondContact O-N 3.34Å; F26-H45 AromaticContact CD2-CD2 3.65Å; F26-H45 AromaticContact CD2-NE2 3.69Å; F26-H45 AromaticContact CE2-CD2 3.56Å; F26-H45 AromaticContact CE2-NE2 3.12Å; F26-H45 WeakPolarHBondContact CE2-NE2 3.29Å; F26-H45 AromaticContact CZ-NE2 3.87Å; H45-N47 PolarHBondContact CE1-OD1 2.99Å; H45-N47 PolarHBondContact ND1-OD1 2.91Å; H45-V76 HydrophobicContact CB-CG2 4.17Å
46	D	72.6	Confident	71.3	Confident	10 Å²	10	70.8 Å²	70.8	5%	0.053	41%	0.407	C	S	.	.			trans	-114.2	131	173.8	-158.6	-33.3	0	0	0	109.8	S21 A48 L57 N96	S21-D46 PolarHBondContact OG-OD1 3.42Å; D46-A48 VanDerWaalsContact C-N 3.34Å; D46-A48 VanDerWaalsContact OD1-CB 3.27Å; D46-A48 WeakPolarHBondContact OD1-CB 3.42Å; D46-A48 PolarHBondContact OD1-N 2.74Å; D46-L57 HydrophobicContact CB-CD1 4.35Å; D46-L57 HydrophobicContact CB-CD2 4.36Å; D46-N96 PolarHBondContact OD2-ND2 2.8Å
47	N	62.3	Low	70.8	Confident	100 Å²	100	67.7 Å²	67.7	54%	0.535	39%	0.394	S	S	.	.			trans	-90.6	3.7	178.8	-83.5	-3.2	0	0	0	113	H45 T49	H45-N47 PolarHBondContact CE1-OD1 2.99Å; H45-N47 PolarHBondContact ND1-OD1 2.91Å; N47-T49 PolarHBondContact O-N 3.43Å
48	A	57.6	Low	70.5	Confident	13 Å²	13	64.3 Å²	64.3	11%	0.107	38%	0.377	C	S	.	.			trans	-54.6	110.3	179.9	0	0	0	0	0	112.7	S21 D46 A50 F55	S21-A48 PolarHBondContact OG-N 3.04Å; S21-A48 VanDerWaalsContact OG-N 3.16Å; D46-A48 VanDerWaalsContact C-N 3.34Å; D46-A48 VanDerWaalsContact OD1-CB 3.27Å; D46-A48 WeakPolarHBondContact OD1-CB 3.42Å; D46-A48 PolarHBondContact OD1-N 2.74Å; A48-A50 VanDerWaalsContact C-N 3.35Å; A48-A50 PolarHBondContact O-N 3.36Å; A48-F55 HydrophobicContact CB-CD2 4.45Å; A48-F55 HydrophobicContact CB-CE2 3.66Å; A48-F55 HydrophobicContact CB-CZ 3.71Å
49	T	53.4	Low	70.3	Confident	151 Å²	151	63.7 Å²	63.7	93%	0.926	37%	0.368	S	S	*	.			trans	-90.4	66.9	178.2	29.2	0	0	0	0	110.7	N47	N47-T49 PolarHBondContact O-N 3.43Å
50	A	49.9	Very low	70	Confident	63 Å²	63	59.9 Å²	59.9	52%	0.521	35%	0.352	S	S	.	.			trans	-124.1	141.3	170.5	0	0	0	0	0	110.7	A48 G52	A48-A50 VanDerWaalsContact C-N 3.35Å; A48-A50 PolarHBondContact O-N 3.36Å; A50-G52 PolarHBondContact O-N 2.03Å
51	S	51.9	Low	69.6	Low	132 Å²	132	62.1 Å²	62.1	92%	0.923	36%	0.361	S	S	*	.	S	Bend	trans	-77.4	101.5	177.7	52.2	0	0	0	0	110.8
52	G	54.2	Low	68.7	Low	67 Å²	67	62.3 Å²	62.3	69%	0.691	36%	0.362	S	S	*	.	S	Bend	trans	-166	178.1	178.9	0	0	0	0	0	112.2	A50	A50-G52 PolarHBondContact O-N 2.03Å
53	A	53.6	Low	67.2	Low	84 Å²	84	71 Å²	71	69%	0.694	40%	0.399	S	S	*	.	S	Bend	trans	-58.4	151.1	173.8	0	0	0	0	0	111.4	F55	A53-F55 PolarHBondContact O-N 2.78Å
54	P	55.9	Low	65.7	Low	88 Å²	88	69.7 Å²	69.7	57%	0.571	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-57.4	136.3	-175.6	22.6	-33.7	0	0	0	112.4	L56	P54-L56 PolarHBondContact O-N 2.55Å
55	F	60.9	Low	64.4	Low	35 Å²	35	77.7 Å²	77.7	15%	0.154	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-69.4	122.9	178.6	-57.6	-76.1	0	0	0	110.4	A48 A53 L57	A48-F55 HydrophobicContact CB-CD2 4.45Å; A48-F55 HydrophobicContact CB-CE2 3.66Å; A48-F55 HydrophobicContact CB-CZ 3.71Å; A53-F55 PolarHBondContact O-N 2.78Å; F55-L57 PolarHBondContact O-N 2.82Å; F55-L57 VanDerWaalsContact O-N 3.12Å
56	L	68.2	Low	63.3	Low	80 Å²	80	85.9 Å²	85.9	42%	0.419	47%	0.469	S	S	.	.			trans	-77.2	99.9	175.6	-162	77.9	0	0	0	109.7	P54 N97	P54-L56 PolarHBondContact O-N 2.55Å; L56-N97 HydrophobicContact CB-CB 4.38Å; L56-N97 HydrophobicContact CD2-CB 4.5Å; L56-N97 VanDerWaalsContact O-CB 3.27Å; L56-N97 WeakPolarHBondContact O-CB 3.37Å; L56-N97 PolarHBondContact O-N 2.91Å
57	L	75.9	Confident	63	Low	6 Å²	6	86.9 Å²	86.9	3%	0.031	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	138.3	169.2	-65.1	176.3	0	0	0	109.1	P23 C44 D46 F55 A77 N96	P23-L57 HydrophobicContact CB-CD2 4.02Å; C44-L57 WeakPolarHBondContact O-CD1 3.17Å; D46-L57 HydrophobicContact CB-CD1 4.35Å; D46-L57 HydrophobicContact CB-CD2 4.36Å; F55-L57 PolarHBondContact O-N 2.82Å; F55-L57 VanDerWaalsContact O-N 3.12Å; L57-A77 HydrophobicContact CB-CB 3.75Å; L57-N96 HydrophobicContact CD2-CB 3.88Å
58	R	78.1	Confident	62.8	Low	90 Å²	90	90.5 Å²	90.5	34%	0.34	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	145.2	174	77.7	-176.8	-154.4	-151	7.3	112.2	C94 V95 N97	R58-C94 WeakPolarHBondContact O-CA 3.4Å; R58-V95 HydrophobicContact CG-CB 4.29Å; R58-V95 PolarHBondContact N-O 2.89Å; R58-V95 PolarHBondContact O-N 2.91Å; R58-N97 PolarHBondContact NH1-OD1 2.83Å
59	W	82.2	Confident	62.8	Low	6 Å²	6	91.9 Å²	91.9	2%	0.023	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	136.2	166.6	-73.9	99.4	0	0	0	111.3	I25 L42 C44 L67 E70 A77 L79 C94	I25-W59 HydrophobicContact CB-CH2 4.47Å; I25-W59 HydrophobicContact CD1-CH2 3.72Å; I25-W59 HydrophobicContact CD1-CZ3 4.01Å; I25-W59 HydrophobicContact CG1-CH2 3.78Å; I25-W59 HydrophobicContact CG1-CZ2 4.45Å; I25-W59 HydrophobicContact CG2-CH2 3.9Å; L42-W59 HydrophobicContact CB-CH2 3.81Å; L42-W59 HydrophobicContact CB-CZ2 3.54Å; L42-W59 HydrophobicContact CD1-CE3 4.38Å; L42-W59 HydrophobicContact CD1-CH2 3.75Å; L42-W59 HydrophobicContact CD1-CZ2 4.26Å; L42-W59 HydrophobicContact CD1-CZ3 3.84Å; L42-W59 HydrophobicContact CG-CH2 4.36Å; C44-W59 HydrophobicContact CB-CH2 4.43Å; C44-W59 HydrophobicContact CB-CZ2 3.61Å; W59-L67 HydrophobicContact CB-CD1 3.87Å; W59-E70 WeakPolarHBondContact CB-OE1 3.13Å; W59-E70 PolarHBondContact N-OE1 2.86Å; W59-A77 PolarHBondContact NE1-O 2.04Å; W59-L79 HydrophobicContact CG-CB 4.24Å; W59-C94 HydrophobicContact CD2-CB 4.28Å; W59-C94 HydrophobicContact CE3-CB 4.09Å; W59-C94 HydrophobicContact CH2-CB 4.14Å; W59-C94 HydrophobicContact CZ2-CB 4.31Å; W59-C94 HydrophobicContact CZ3-CB 4.01Å
60	Q	81.6	Confident	63.2	Low	37 Å²	37	87.5 Å²	87.5	17%	0.173	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.7	169.1	66.1	-175.9	20.6	0	0	110.3	V93 V95	Q60-V93 HydrophobicContact CG-CB 3.99Å; Q60-V93 PolarHBondContact N-O 2.91Å; Q60-V93 PolarHBondContact O-N 2.96Å; Q60-V95 HydrophobicContact CG-CG2 4.07Å
61	R	79.1	Confident	63.8	Low	49 Å²	49	88.1 Å²	88.1	19%	0.185	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	155.2	171.6	-165.5	168.3	170.1	-137.1	-7.6	110.4	K63 N64 R65 L67 Q87 Q88 M89	R61-K63 PolarHBondContact O-N 2.94Å; R61-N64 PolarHBondContact O-N 2.98Å; R61-R65 PolarHBondContact N-O 2.84Å; R61-R65 PolarHBondContact O-N 3.25Å; R61-L67 HydrophobicContact CB-CD1 4.4Å; R61-L67 HydrophobicContact CB-CD2 4.17Å; R61-L67 HydrophobicContact CB-CG 4.36Å; R61-Q87 VanDerWaalsContact CZ-O 3.31Å; R61-Q87 PolarHBondContact NH1-O 2.71Å; R61-Q87 PolarHBondContact NH2-O 3.16Å; R61-Q88 PolarHBondContact NE-O 2.79Å; R61-Q88 VanDerWaalsContact NH2-C 3.33Å; R61-Q88 PolarHBondContact NH2-O 3.48Å; R61-M89 PolarHBondContact NH2-O 3.42Å
62	E	66.8	Low	64.2	Low	109 Å²	109	87.5 Å²	87.5	51%	0.509	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.5	132.2	175.6	-165.2	169.8	-173.9	0	0	112.8	W91	E62-W91 HydrophobicContact CB-CB 4.47Å; E62-W91 PolarHBondContact N-O 2.7Å
63	K	56.2	Low	64.3	Low	184 Å²	184	91 Å²	91	80%	0.8	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	38	-168.8	-51.4	180	-177.3	-180	0	115.1	R61 R65	R61-K63 PolarHBondContact O-N 2.94Å; K63-R65 PolarHBondContact O-N 2.83Å; K63-R65 VanDerWaalsContact O-N 3.12Å
64	N	53.4	Low	64.7	Low	127 Å²	127	89.7 Å²	89.7	68%	0.679	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	31.1	169.9	-64.5	-4	0	0	0	115.3	R61 K66	R61-N64 PolarHBondContact O-N 2.98Å; N64-K66 PolarHBondContact O-N 3Å
65	R	58.7	Low	65.1	Low	169 Å²	169	90.5 Å²	90.5	64%	0.638	44%	0.44	S	S	*	.	B	Isolated β-bridge	trans	-77.4	125.4	174.5	-67.4	-176.9	174.5	-172.1	-3.1	109.3	R61 K63	R61-R65 PolarHBondContact N-O 2.84Å; R61-R65 PolarHBondContact O-N 3.25Å; K63-R65 PolarHBondContact O-N 2.83Å; K63-R65 VanDerWaalsContact O-N 3.12Å
66	K	57.2	Low	65.6	Low	204 Å²	204	91.1 Å²	91.1	89%	0.887	45%	0.447	S	S	*	.			trans	-58.2	149.7	167.4	-74.3	-169.6	172.2	-169.2	0	109.8	N64	N64-K66 PolarHBondContact O-N 3Å
67	L	66.2	Low	66.2	Low	30 Å²	30	87.3 Å²	87.3	16%	0.157	43%	0.427	C	S	.	.			trans	-110.2	137.5	178.4	-72.6	160.9	0	0	0	109.4	W59 R61 L79 Y92	W59-L67 HydrophobicContact CB-CD1 3.87Å; R61-L67 HydrophobicContact CB-CD1 4.4Å; R61-L67 HydrophobicContact CB-CD2 4.17Å; R61-L67 HydrophobicContact CB-CG 4.36Å; L67-L79 HydrophobicContact CB-CD1 3.94Å; L67-L79 HydrophobicContact CD1-CD1 4.32Å; L67-L79 HydrophobicContact CD1-CD2 4.01Å; L67-Y92 HydrophobicContact CD1-CD1 3.87Å; L67-Y92 HydrophobicContact CD1-CE1 4Å; L67-Y92 HydrophobicContact CD2-CD1 4.48Å; L67-Y92 HydrophobicContact CD2-CE1 3.78Å
68	E	57.3	Low	66.3	Low	177 Å²	177	88 Å²	88	83%	0.827	43%	0.432	S	S	*	.	S	Bend	trans	-87.1	143.4	170.7	-64.9	172.2	167.7	0	0	108.5	L81	E68-L81 WeakPolarHBondContact O-CD2 3.1Å
69	G	57.5	Low	66.6	Low	42 Å²	42	83.8 Å²	83.8	43%	0.433	42%	0.416	S	S	.	.	S	Bend	trans	83.3	23.9	-177.9	0	0	0	0	0	115.3	S80	G69-S80 PolarHBondContact O-N 2.96Å
70	E	62.8	Low	66.6	Low	59 Å²	59	85.5 Å²	85.5	28%	0.276	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	137.8	161.7	-179.7	159.9	-134	0	0	110.3	W59 S78 L79	W59-E70 WeakPolarHBondContact CB-OE1 3.13Å; W59-E70 PolarHBondContact N-OE1 2.86Å; E70-S78 CarbonylContact C-O 3.58Å; E70-S78 WeakPolarHBondContact CA-O 3.33Å; E70-L79 HydrophobicContact CB-CD1 4.48Å
71	V	61.8	Low	66.7	Low	76 Å²	76	84.6 Å²	84.6	46%	0.461	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	117.8	177.2	-176.4	0	0	0	0	108.2	E73 S78	V71-E73 HydrophobicContact CG1-CG 4.32Å; V71-S78 PolarHBondContact N-O 2.86Å; V71-S78 PolarHBondContact O-N 3.09Å
72	E	60.4	Low	66.8	Low	118 Å²	118	87.1 Å²	87.1	55%	0.551	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	112.8	177.4	-65.7	-178.2	162.7	0	0	110.2
73	E	56.9	Low	67.5	Low	141 Å²	141	83.5 Å²	83.5	66%	0.659	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	79.1	172.3	-75.2	-173.7	159.6	0	0	110	V71 K75 V76	V71-E73 HydrophobicContact CG1-CG 4.32Å; E73-K75 PolarHBondContact O-N 2.98Å; E73-V76 PolarHBondContact N-O 2.84Å; E73-V76 PolarHBondContact O-N 2.84Å; E73-V76 VanDerWaalsContact O-N 3.15Å
74	G	62.1	Low	68.9	Low	57 Å²	57	74.8 Å²	74.8	59%	0.588	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	-98.4	171.9	0	0	0	0	0	114
75	K	63.3	Low	70.4	Confident	104 Å²	104	72.1 Å²	72.1	45%	0.452	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	5.7	178.5	-69.1	-163.6	174.7	-165.5	0	113.5	E73	E73-K75 PolarHBondContact O-N 2.98Å
76	V	72.8	Confident	71.3	Confident	48 Å²	48	64.5 Å²	64.5	29%	0.291	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	123.8	-175.5	-174.4	0	0	0	0	110.7	R43 C44 H45 E73	R43-V76 HydrophobicContact CB-CG1 4.28Å; C44-V76 CarbonylContact O-C 3.59Å; C44-V76 VanDerWaalsContact O-CA 3.3Å; C44-V76 WeakPolarHBondContact O-CA 3.44Å; C44-V76 WeakPolarHBondContact O-CG1 3.04Å; H45-V76 HydrophobicContact CB-CG2 4.17Å; E73-V76 PolarHBondContact N-O 2.84Å; E73-V76 PolarHBondContact O-N 2.84Å; E73-V76 VanDerWaalsContact O-N 3.15Å
77	A	79.5	Confident	72.2	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.008	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	112.4	168.1	0	0	0	0	0	109.4	C44 L57 W59	C44-A77 HydrophobicContact CB-CB 4.49Å; C44-A77 PolarHBondContact N-O 2.87Å; C44-A77 PolarHBondContact O-N 2.88Å; L57-A77 HydrophobicContact CB-CB 3.75Å; W59-A77 PolarHBondContact NE1-O 2.04Å
78	S	79.4	Confident	73	Confident	20 Å²	20	62.1 Å²	62.1	14%	0.14	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.5	-179.9	-66.9	0	0	0	0	110.8	E70 V71	E70-S78 CarbonylContact C-O 3.58Å; E70-S78 WeakPolarHBondContact CA-O 3.33Å; V71-S78 PolarHBondContact N-O 2.86Å; V71-S78 PolarHBondContact O-N 3.09Å
79	L	83.9	Confident	74.3	Confident	1 Å²	1	54 Å²	54	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.8	171.9	-179.3	72.9	0	0	0	109.2	Q41 L42 W59 L67 E70 L81 Y92	Q41-L79 WeakPolarHBondContact CA-O 3.46Å; L42-L79 HydrophobicContact CB-CB 4.37Å; L42-L79 HydrophobicContact CD1-CD2 4.21Å; L42-L79 PolarHBondContact N-O 2.92Å; L42-L79 PolarHBondContact O-N 3.09Å; W59-L79 HydrophobicContact CG-CB 4.24Å; L67-L79 HydrophobicContact CB-CD1 3.94Å; L67-L79 HydrophobicContact CD1-CD1 4.32Å; L67-L79 HydrophobicContact CD1-CD2 4.01Å; E70-L79 HydrophobicContact CB-CD1 4.48Å; L79-L81 HydrophobicContact CD1-CD2 4.29Å; L79-L81 HydrophobicContact CD1-CG 4.45Å; L79-L81 HydrophobicContact CG-CG 4.36Å; L79-Y92 HydrophobicContact CD2-CD1 3.6Å; L79-Y92 HydrophobicContact CD2-CE1 3.63Å
80	S	82.2	Confident	75.7	Confident	43 Å²	43	52.3 Å²	52.3	30%	0.301	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	91.5	-178.5	177.6	0	0	0	0	112.2	K39 L40 Q41 G69	K39-S80 WeakPolarHBondContact CE-OG 3.44Å; L40-S80 CarbonylContact O-C 3.49Å; L40-S80 WeakPolarHBondContact O-CA 3.45Å; Q41-S80 PolarHBondContact NE2-OG 2.76Å; G69-S80 PolarHBondContact O-N 2.96Å
81	L	83.8	Confident	76.9	Confident	17 Å²	17	52.6 Å²	52.6	9%	0.089	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.6	177.5	-56	179.8	0	0	0	111.2	K39 L40 E68 L79 V84 Y92	K39-L81 CarbonylContact C-O 3.51Å; K39-L81 VanDerWaalsContact CA-O 3.27Å; K39-L81 WeakPolarHBondContact CA-O 3.5Å; K39-L81 WeakPolarHBondContact CG-O 3.38Å; L40-L81 HydrophobicContact CB-CB 4.31Å; L40-L81 HydrophobicContact CD2-CD1 4.16Å; L40-L81 PolarHBondContact N-O 2.98Å; L40-L81 PolarHBondContact O-N 3.01Å; E68-L81 WeakPolarHBondContact O-CD2 3.1Å; L79-L81 HydrophobicContact CD1-CD2 4.29Å; L79-L81 HydrophobicContact CD1-CG 4.45Å; L79-L81 HydrophobicContact CG-CG 4.36Å; L81-V84 HydrophobicContact CB-CG2 3.84Å; L81-Y92 HydrophobicContact CD1-CE1 4.45Å
82	S	80.7	Confident	78.1	Confident	102 Å²	102	49 Å²	49	71%	0.713	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	141	171.9	54.5	0	0	0	0	111.3
83	G	82.2	Confident	79.3	Confident	33 Å²	33	44.4 Å²	44.4	34%	0.34	25%	0.254	S	S	.	.	S	Bend	trans	81	31.1	-180	0	0	0	0	0	113.4	K37 G38 Q85	K37-G83 WeakPolarHBondContact O-CA 3.39Å; G38-G83 PolarHBondContact O-N 2.95Å; G83-Q85 PolarHBondContact O-N 2.82Å; G83-Q85 PolarHBondContact O-NE2 2.89Å
84	V	84.7	Confident	80.7	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	22%	0.223	C	C	.	.			trans	-58.1	129.2	-167.4	-178.1	0	0	0	0	112.8	K37 G38 L40 L81 Q88 V109	K37-V84 PolarHBondContact N-O 2.96Å; G38-V84 PolarHBondContact O-N 2.92Å; G38-V84 VanDerWaalsContact O-N 3.07Å; L40-V84 HydrophobicContact CB-CG2 3.91Å; L81-V84 HydrophobicContact CB-CG2 3.84Å; V84-Q88 HydrophobicContact CG1-CB 4.05Å; V84-V109 HydrophobicContact CG1-CG1 4.08Å; V84-V109 HydrophobicContact CG1-CG2 3.72Å
85	Q	84.1	Confident	81.7	Confident	72 Å²	72	35.2 Å²	35.2	34%	0.336	20%	0.196	S	C	.	.			trans	-100.7	157.2	-178.9	-59.6	-55.5	-44.2	0	0	112.4	G83 Q87 Q88	G83-Q85 PolarHBondContact O-N 2.82Å; G83-Q85 PolarHBondContact O-NE2 2.89Å; Q85-Q87 PolarHBondContact O-N 3.36Å; Q85-Q87 VanDerWaalsContact O-N 3.11Å; Q85-Q88 WeakPolarHBondContact O-CB 3.37Å; Q85-Q88 PolarHBondContact O-N 2.84Å
86	A	77.9	Confident	82.5	Confident	9 Å²	9	30.2 Å²	30.2	7%	0.074	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-56.9	-30.7	-178.9	0	0	0	0	0	113	Q88 M89 Q117	A86-Q88 PolarHBondContact O-N 2.82Å; A86-M89 VanDerWaalsContact O-CB 3.24Å; A86-M89 WeakPolarHBondContact O-CB 3.02Å; A86-M89 PolarHBondContact O-N 3.22Å; A86-Q117 PolarHBondContact O-NE2 3.44Å
87	Q	77.1	Confident	82.5	Confident	122 Å²	122	30.5 Å²	30.5	57%	0.57	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-72.2	-4.6	176.3	-58.6	83.6	-8	0	0	113.9	R61 Q85	R61-Q87 VanDerWaalsContact CZ-O 3.31Å; R61-Q87 PolarHBondContact NH1-O 2.71Å; R61-Q87 PolarHBondContact NH2-O 3.16Å; Q85-Q87 PolarHBondContact O-N 3.36Å; Q85-Q87 VanDerWaalsContact O-N 3.11Å
88	Q	81.7	Confident	82.1	Confident	61 Å²	61	35.5 Å²	35.5	29%	0.285	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-94.1	-7.4	173.6	-70.8	169.3	-51.5	0	0	113.4	R61 V84 Q85 A86 Y92	R61-Q88 PolarHBondContact NE-O 2.79Å; R61-Q88 VanDerWaalsContact NH2-C 3.33Å; R61-Q88 PolarHBondContact NH2-O 3.48Å; V84-Q88 HydrophobicContact CG1-CB 4.05Å; Q85-Q88 WeakPolarHBondContact O-CB 3.37Å; Q85-Q88 PolarHBondContact O-N 2.84Å; A86-Q88 PolarHBondContact O-N 2.82Å; Q88-Y92 WeakPolarHBondContact O-CE2 3.36Å; Q88-Y92 PolarHBondContact O-OH 3.2Å
89	M	85	Confident	81.9	Confident	6 Å²	6	36.9 Å²	36.9	3%	0.03	21%	0.209	C	C	.	.			trans	-59.6	144.6	173.7	-164.3	178.8	87.6	0	0	113	R61 A86 F106 V107 Y108 V109 Q117 L137 V138 T139	R61-M89 PolarHBondContact NH2-O 3.42Å; A86-M89 VanDerWaalsContact O-CB 3.24Å; A86-M89 WeakPolarHBondContact O-CB 3.02Å; A86-M89 PolarHBondContact O-N 3.22Å; M89-F106 HydrophobicContact CE-CZ 4.43Å; M89-F106 HydrophobicContact CG-CE1 4.19Å; M89-F106 HydrophobicContact CG-CZ 4.41Å; M89-V107 WeakPolarHBondContact CA-O 3.32Å; M89-V107 WeakPolarHBondContact CG-O 3.16Å; M89-Y108 HydrophobicContact SD-CD1 4.49Å; M89-V109 HydrophobicContact CB-CB 4.21Å; M89-V109 HydrophobicContact CB-CG2 3.9Å; M89-V109 HydrophobicContact CG-CG2 4.37Å; M89-Q117 HydrophobicContact CE-CB 4.23Å; M89-L137 HydrophobicContact CE-CB 3.62Å; M89-V138 VanDerWaalsContact CE-O 3.28Å; M89-V138 WeakPolarHBondContact CE-O 3.38Å; M89-V138 VanDerWaalsContact SD-O 3.35Å; M89-T139 HydrophobicContact SD-CG2 4.34Å
90	G	86.9	Confident	81.5	Confident	7 Å²	7	42.2 Å²	42.2	7%	0.072	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.9	-162.5	175.6	0	0	0	0	0	114.2	Y92 V107	G90-Y92 WeakPolarHBondContact O-CD2 3.3Å; G90-V107 PolarHBondContact N-O 3.45Å; G90-V107 PolarHBondContact O-N 3.16Å
91	W	87.4	Confident	81.5	Confident	65 Å²	65	42.9 Å²	42.9	25%	0.246	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.1	177.9	-69.8	102.8	0	0	0	112.9	E62 F106	E62-W91 HydrophobicContact CB-CB 4.47Å; E62-W91 PolarHBondContact N-O 2.7Å; W91-F106 AromaticContact CD1-CD2 3.88Å; W91-F106 HydrophobicContact CD2-CB 4.27Å; W91-F106 AromaticContact CD2-CD2 3.86Å; W91-F106 HydrophobicContact CD2-CD2 3.86Å; W91-F106 AromaticContact CE2-CD2 3.71Å; W91-F106 HydrophobicContact CE3-CB 4.04Å; W91-F106 HydrophobicContact CE3-CD2 4.49Å; W91-F106 AromaticContact CG-CD2 4Å; W91-F106 HydrophobicContact CG-CD2 4Å; W91-F106 HydrophobicContact CH2-CB 4.22Å; W91-F106 HydrophobicContact CZ2-CB 4.42Å; W91-F106 HydrophobicContact CZ2-CD2 4.25Å; W91-F106 HydrophobicContact CZ3-CB 4.02Å; W91-F106 AromaticContact NE1-CD2 3.69Å
92	Y	87.5	Confident	81.5	Confident	1 Å²	1	46 Å²	46	0%	0.004	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.3	167	-72.9	-103.1	0	0	0	108.2	L40 L42 L67 L79 L81 Q88 G90 S104 I105 V107	L40-Y92 HydrophobicContact CD2-CE1 4.23Å; L40-Y92 HydrophobicContact CD2-CE2 4.46Å; L42-Y92 HydrophobicContact CD1-CD1 4.1Å; L42-Y92 HydrophobicContact CD1-CG 3.98Å; L67-Y92 HydrophobicContact CD1-CD1 3.87Å; L67-Y92 HydrophobicContact CD1-CE1 4Å; L67-Y92 HydrophobicContact CD2-CD1 4.48Å; L67-Y92 HydrophobicContact CD2-CE1 3.78Å; L79-Y92 HydrophobicContact CD2-CD1 3.6Å; L79-Y92 HydrophobicContact CD2-CE1 3.63Å; L81-Y92 HydrophobicContact CD1-CE1 4.45Å; Q88-Y92 WeakPolarHBondContact O-CE2 3.36Å; Q88-Y92 PolarHBondContact O-OH 3.2Å; G90-Y92 WeakPolarHBondContact O-CD2 3.3Å; Y92-S104 WeakPolarHBondContact O-CA 3.39Å; Y92-I105 PolarHBondContact N-O 3.46Å; Y92-I105 PolarHBondContact O-N 2.84Å; Y92-V107 HydrophobicContact CD2-CB 3.84Å; Y92-V107 HydrophobicContact CD2-CG2 3.48Å; Y92-V107 VanDerWaalsContact CD2-CG2 3.48Å; Y92-V107 HydrophobicContact CE2-CB 3.81Å; Y92-V107 HydrophobicContact CE2-CG2 3.86Å; Y92-V107 HydrophobicContact CG-CG2 4.2Å
93	V	87	Confident	81.8	Confident	22 Å²	22	42.8 Å²	42.8	13%	0.133	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.8	-174.7	-172.2	0	0	0	0	108.7	Q60 V95 N102 S103	Q60-V93 HydrophobicContact CG-CB 3.99Å; Q60-V93 PolarHBondContact N-O 2.91Å; Q60-V93 PolarHBondContact O-N 2.96Å; V93-V95 HydrophobicContact CG1-CG2 3.97Å; V93-N102 HydrophobicContact CG1-CB 3.87Å; V93-S103 WeakPolarHBondContact CA-O 3.37Å
94	C	85.3	Confident	82.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131	166.1	-179.9	0	0	0	0	109.1	I25 C44 R58 W59 N102 S103	I25-C94 HydrophobicContact CD1-CB 4.25Å; I25-C94 HydrophobicContact CG1-CB 4.28Å; C44-C94 HydrophobicContact CB-CB 3.65Å; C44-C94 WeakPolarHBondContact CB-SG 2.96Å; C44-C94 WeakPolarHBondContact SG-CB 3.43Å; C44-C94 CovalentContact SG-SG 2.02Å; C44-C94 PolarHBondContact SG-SG 3.01Å; R58-C94 WeakPolarHBondContact O-CA 3.4Å; W59-C94 HydrophobicContact CD2-CB 4.28Å; W59-C94 HydrophobicContact CE3-CB 4.09Å; W59-C94 HydrophobicContact CH2-CB 4.14Å; W59-C94 HydrophobicContact CZ2-CB 4.31Å; W59-C94 HydrophobicContact CZ3-CB 4.01Å; C94-N102 WeakPolarHBondContact O-CA 3.45Å; C94-N102 VanDerWaalsContact O-CB 3.23Å; C94-N102 WeakPolarHBondContact O-CB 3.36Å; C94-S103 PolarHBondContact N-O 2.84Å; C94-S103 PolarHBondContact O-N 3.27Å; C94-S103 VanDerWaalsContact O-N 3.07Å
95	V	83.3	Confident	82.3	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.1	180	-171.5	0	0	0	0	109.3	R58 Q60 V93 N97 N102	R58-V95 HydrophobicContact CG-CB 4.29Å; R58-V95 PolarHBondContact N-O 2.89Å; R58-V95 PolarHBondContact O-N 2.91Å; Q60-V95 HydrophobicContact CG-CG2 4.07Å; V93-V95 HydrophobicContact CG1-CG2 3.97Å; V95-N97 PolarHBondContact O-N 2.83Å; V95-N102 HydrophobicContact CB-CB 4.39Å; V95-N102 HydrophobicContact CG1-CB 4.44Å; V95-N102 HydrophobicContact CG2-CB 3.97Å
96	N	79.8	Confident	82.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	114.1	163.8	176.9	-35.9	0	0	0	107.9	D46 L57 N98 T99 Q100 E101	D46-N96 PolarHBondContact OD2-ND2 2.8Å; L57-N96 HydrophobicContact CD2-CB 3.88Å; N96-N98 PolarHBondContact O-N 3.46Å; N96-N98 WeakPolarHBondContact OD1-CB 3.43Å; N96-N98 PolarHBondContact OD1-N 2.96Å; N96-T99 WeakPolarHBondContact CB-OG1 3.34Å; N96-T99 VanDerWaalsContact CG-OG1 3.25Å; N96-T99 PolarHBondContact OD1-N 3.06Å; N96-Q100 VanDerWaalsContact O-CA 3.3Å; N96-Q100 WeakPolarHBondContact O-CA 3.01Å; N96-Q100 PolarHBondContact O-N 2.76Å; N96-E101 PolarHBondContact N-O 3.41Å
97	N	73.8	Confident	83.1	Confident	54 Å²	54	40.9 Å²	40.9	29%	0.289	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.2	-171.8	-161.9	73.8	0	0	0	113	L56 R58 V95 Q100	L56-N97 HydrophobicContact CB-CB 4.38Å; L56-N97 HydrophobicContact CD2-CB 4.5Å; L56-N97 VanDerWaalsContact O-CB 3.27Å; L56-N97 WeakPolarHBondContact O-CB 3.37Å; L56-N97 PolarHBondContact O-N 2.91Å; R58-N97 PolarHBondContact NH1-OD1 2.83Å; V95-N97 PolarHBondContact O-N 2.83Å; N97-Q100 PolarHBondContact O-NE2 3.18Å
98	N	71.3	Confident	83.7	Confident	106 Å²	106	35.4 Å²	35.4	57%	0.567	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-41	-179.9	-63.1	-9.1	0	0	0	112.4	N96	N96-N98 PolarHBondContact O-N 3.46Å; N96-N98 WeakPolarHBondContact OD1-CB 3.43Å; N96-N98 PolarHBondContact OD1-N 2.96Å
99	T	73.7	Confident	84.1	Confident	48 Å²	48	32.5 Å²	32.5	29%	0.294	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-16	179.3	64.1	0	0	0	0	113.6	N96 E101	N96-T99 WeakPolarHBondContact CB-OG1 3.34Å; N96-T99 VanDerWaalsContact CG-OG1 3.25Å; N96-T99 PolarHBondContact OD1-N 3.06Å; T99-E101 PolarHBondContact O-N 2.95Å; T99-E101 VanDerWaalsContact O-N 3.09Å; T99-E101 PolarHBondContact OG1-N 3.45Å
100	Q	76.3	Confident	84.3	Confident	113 Å²	113	35.4 Å²	35.4	53%	0.528	19%	0.187	S	C	.	.			trans	59.8	4.7	-168.5	-58.9	-65.1	-53.1	0	0	114.7	N96 N97 N102	N96-Q100 VanDerWaalsContact O-CA 3.3Å; N96-Q100 WeakPolarHBondContact O-CA 3.01Å; N96-Q100 PolarHBondContact O-N 2.76Å; N97-Q100 PolarHBondContact O-NE2 3.18Å; Q100-N102 PolarHBondContact O-ND2 3.12Å
101	E	81.1	Confident	84.3	Confident	58 Å²	58	35.8 Å²	35.8	27%	0.271	19%	0.188	S	C	.	.			trans	-66.6	146.9	168.6	-66.9	-147.6	120.5	0	0	110.8	K22 N96 T99	K22-E101 WeakPolarHBondContact CA-OE2 3.48Å; K22-E101 WeakPolarHBondContact CG-OE2 3.32Å; K22-E101 PolarHBondContact N-OE2 2.94Å; N96-E101 PolarHBondContact N-O 3.41Å; T99-E101 PolarHBondContact O-N 2.95Å; T99-E101 VanDerWaalsContact O-N 3.09Å; T99-E101 PolarHBondContact OG1-N 3.45Å
102	N	85.1	Confident	84	Confident	82 Å²	82	38 Å²	38	44%	0.439	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	157	-176.9	61.3	83.6	0	0	0	111.9	V93 C94 V95 Q100	V93-N102 HydrophobicContact CG1-CB 3.87Å; C94-N102 WeakPolarHBondContact O-CA 3.45Å; C94-N102 VanDerWaalsContact O-CB 3.23Å; C94-N102 WeakPolarHBondContact O-CB 3.36Å; V95-N102 HydrophobicContact CB-CB 4.39Å; V95-N102 HydrophobicContact CG1-CB 4.44Å; V95-N102 HydrophobicContact CG2-CB 3.97Å; Q100-N102 PolarHBondContact O-ND2 3.12Å
103	S	85.8	Confident	83.8	Confident	35 Å²	35	45.9 Å²	45.9	25%	0.245	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.9	168.4	-75.6	0	0	0	0	108.3	P23 V93 C94	P23-S103 WeakPolarHBondContact O-CB 3.4Å; P23-S103 PolarHBondContact O-OG 3.36Å; V93-S103 WeakPolarHBondContact CA-O 3.37Å; C94-S103 PolarHBondContact N-O 2.84Å; C94-S103 PolarHBondContact O-N 3.27Å; C94-S103 VanDerWaalsContact O-N 3.07Å
104	S	88.8	Confident	83.8	Confident	63 Å²	63	46.4 Å²	46.4	44%	0.441	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	136	-174.9	60	0	0	0	0	111.6	Y92	Y92-S104 WeakPolarHBondContact O-CA 3.39Å
105	I	89.2	Confident	83.9	Confident	8 Å²	8	47 Å²	47	4%	0.041	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	140.3	175.9	-159.9	151.1	0	0	0	110	I25 E29 I32 L42 Y92	I25-I105 HydrophobicContact CD1-CB 4.28Å; I25-I105 HydrophobicContact CD1-CG2 4.29Å; I25-I105 HydrophobicContact CG2-CB 4.38Å; I25-I105 HydrophobicContact CG2-CD1 3.92Å; I25-I105 HydrophobicContact CG2-CG2 4.14Å; E29-I105 VanDerWaalsContact O-CD1 3.24Å; E29-I105 WeakPolarHBondContact O-CD1 3.47Å; I32-I105 HydrophobicContact CD1-CD1 3.22Å; I32-I105 HydrophobicContact CD1-CG1 3.71Å; I32-I105 HydrophobicContact CD1-CG2 4.41Å; L42-I105 HydrophobicContact CD1-CG2 4.14Å; L42-I105 HydrophobicContact CD2-CG2 4.39Å; Y92-I105 PolarHBondContact N-O 3.46Å; Y92-I105 PolarHBondContact O-N 2.84Å
106	F	89	Confident	84.2	Confident	3 Å²	3	47 Å²	47	1%	0.013	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.3	175.1	-165.5	-85.2	0	0	0	109.6	H31 I32 M89 W91 Y108 Q167	H31-F106 CarbonylContact C-O 3.58Å; H31-F106 VanDerWaalsContact CA-O 3.28Å; H31-F106 WeakPolarHBondContact CA-O 3.13Å; H31-F106 HydrophobicContact CB-CB 4.45Å; H31-F106 WeakPolarHBondContact CB-O 3.42Å; I32-F106 PolarHBondContact N-O 3.37Å; M89-F106 HydrophobicContact CE-CZ 4.43Å; M89-F106 HydrophobicContact CG-CE1 4.19Å; M89-F106 HydrophobicContact CG-CZ 4.41Å; W91-F106 AromaticContact CD1-CD2 3.88Å; W91-F106 HydrophobicContact CD2-CB 4.27Å; W91-F106 AromaticContact CD2-CD2 3.86Å; W91-F106 HydrophobicContact CD2-CD2 3.86Å; W91-F106 AromaticContact CE2-CD2 3.71Å; W91-F106 HydrophobicContact CE3-CB 4.04Å; W91-F106 HydrophobicContact CE3-CD2 4.49Å; W91-F106 AromaticContact CG-CD2 4Å; W91-F106 HydrophobicContact CG-CD2 4Å; W91-F106 HydrophobicContact CH2-CB 4.22Å; W91-F106 HydrophobicContact CZ2-CB 4.42Å; W91-F106 HydrophobicContact CZ2-CD2 4.25Å; W91-F106 HydrophobicContact CZ3-CB 4.02Å; W91-F106 AromaticContact NE1-CD2 3.69Å; F106-Y108 HydrophobicContact CD1-CD1 4.23Å; F106-Y108 AromaticContact CD1-CD2 3.72Å; F106-Y108 HydrophobicContact CD1-CD2 3.72Å; F106-Y108 HydrophobicContact CD1-CE1 4.09Å; F106-Y108 AromaticContact CD1-CE2 3.57Å; F106-Y108 HydrophobicContact CD1-CE2 3.57Å; F106-Y108 HydrophobicContact CD1-CG 4.05Å; F106-Y108 AromaticContact CD1-CZ 3.76Å; F106-Y108 AromaticContact CE1-CD1 3.74Å; F106-Y108 HydrophobicContact CE1-CD1 3.74Å; F106-Y108 HydrophobicContact CE1-CD2 4.1Å; F106-Y108 AromaticContact CE1-CE1 3.62Å; F106-Y108 HydrophobicContact CE1-CE1 3.62Å; F106-Y108 AromaticContact CE1-CE2 3.99Å; F106-Y108 HydrophobicContact CE1-CE2 3.99Å; F106-Y108 AromaticContact CE1-CG 3.97Å; F106-Y108 HydrophobicContact CE1-CG 3.97Å; F106-Y108 AromaticContact CE1-CZ 3.76Å; F106-Q167 HydrophobicContact CD1-CG 4.06Å; F106-Q167 HydrophobicContact CD2-CB 3.94Å; F106-Q167 HydrophobicContact CD2-CG 3.75Å; F106-Q167 HydrophobicContact CE1-CG 4.11Å; F106-Q167 HydrophobicContact CE2-CB 3.62Å; F106-Q167 HydrophobicContact CE2-CG 3.79Å; F106-Q167 HydrophobicContact CG-CG 3.88Å; F106-Q167 HydrophobicContact CZ-CB 4Å; F106-Q167 HydrophobicContact CZ-CG 3.97Å
107	V	89.4	Confident	84.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	114.7	176	-179.8	0	0	0	0	109	I32 V34 L40 L42 M89 G90 Y92	I32-V107 WeakPolarHBondContact O-CA 3.15Å; V34-V107 HydrophobicContact CG2-CG1 4.2Å; L40-V107 HydrophobicContact CD1-CG1 3.87Å; L40-V107 HydrophobicContact CD1-CG2 4.08Å; L40-V107 HydrophobicContact CD2-CG1 4.15Å; L40-V107 HydrophobicContact CD2-CG2 4.26Å; L42-V107 HydrophobicContact CD1-CG2 4.32Å; M89-V107 WeakPolarHBondContact CA-O 3.32Å; M89-V107 WeakPolarHBondContact CG-O 3.16Å; G90-V107 PolarHBondContact N-O 3.45Å; G90-V107 PolarHBondContact O-N 3.16Å; Y92-V107 HydrophobicContact CD2-CB 3.84Å; Y92-V107 HydrophobicContact CD2-CG2 3.48Å; Y92-V107 VanDerWaalsContact CD2-CG2 3.48Å; Y92-V107 HydrophobicContact CE2-CB 3.81Å; Y92-V107 HydrophobicContact CE2-CG2 3.86Å; Y92-V107 HydrophobicContact CG-CG2 4.2Å
108	Y	89.9	Confident	84.8	Confident	7 Å²	7	53 Å²	53	3%	0.027	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	139.4	168.1	-71.2	-83	0	0	0	110.4	H31 I32 V34 M89 F106 V138 P141 Q167	H31-Y108 HydrophobicContact CB-CD2 3.96Å; H31-Y108 HydrophobicContact CB-CE2 3.79Å; H31-Y108 AromaticContact CD2-CD2 3.68Å; H31-Y108 AromaticContact CD2-CE2 3.83Å; H31-Y108 AromaticContact CG-CD2 3.94Å; H31-Y108 AromaticContact CG-CE2 3.72Å; I32-Y108 PolarHBondContact O-N 2.94Å; V34-Y108 PolarHBondContact N-O 2.9Å; M89-Y108 HydrophobicContact SD-CD1 4.49Å; F106-Y108 HydrophobicContact CD1-CD1 4.23Å; F106-Y108 AromaticContact CD1-CD2 3.72Å; F106-Y108 HydrophobicContact CD1-CD2 3.72Å; F106-Y108 HydrophobicContact CD1-CE1 4.09Å; F106-Y108 AromaticContact CD1-CE2 3.57Å; F106-Y108 HydrophobicContact CD1-CE2 3.57Å; F106-Y108 HydrophobicContact CD1-CG 4.05Å; F106-Y108 AromaticContact CD1-CZ 3.76Å; F106-Y108 AromaticContact CE1-CD1 3.74Å; F106-Y108 HydrophobicContact CE1-CD1 3.74Å; F106-Y108 HydrophobicContact CE1-CD2 4.1Å; F106-Y108 AromaticContact CE1-CE1 3.62Å; F106-Y108 HydrophobicContact CE1-CE1 3.62Å; F106-Y108 AromaticContact CE1-CE2 3.99Å; F106-Y108 HydrophobicContact CE1-CE2 3.99Å; F106-Y108 AromaticContact CE1-CG 3.97Å; F106-Y108 HydrophobicContact CE1-CG 3.97Å; F106-Y108 AromaticContact CE1-CZ 3.76Å; Y108-V138 WeakPolarHBondContact CD1-O 3.44Å; Y108-V138 WeakPolarHBondContact CE1-O 3.45Å; Y108-P141 HydrophobicContact CD2-CB 4.12Å; Y108-P141 HydrophobicContact CD2-CG 4.11Å; Y108-P141 HydrophobicContact CE1-CB 4.43Å; Y108-P141 HydrophobicContact CE2-CB 3.87Å; Y108-P141 HydrophobicContact CE2-CG 4.36Å; Y108-P141 HydrophobicContact CG-CG 4.35Å; Y108-Q167 WeakPolarHBondContact OH-CG 3.27Å
109	V	90.2	Very high	85	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	91.5	175.4	-175.6	0	0	0	0	108.9	V34 K36 V84 M89 D111 T139	V34-V109 CarbonylContact O-C 3.46Å; V34-V109 VanDerWaalsContact O-CA 3.27Å; V34-V109 WeakPolarHBondContact O-CA 3.47Å; K36-V109 HydrophobicContact CB-CG1 4.36Å; V84-V109 HydrophobicContact CG1-CG1 4.08Å; V84-V109 HydrophobicContact CG1-CG2 3.72Å; M89-V109 HydrophobicContact CB-CB 4.21Å; M89-V109 HydrophobicContact CB-CG2 3.9Å; M89-V109 HydrophobicContact CG-CG2 4.37Å; V109-D111 PolarHBondContact O-N 2.85Å; V109-T139 CarbonylContact C-O 3.43Å; V109-T139 WeakPolarHBondContact O-CB 3.35Å
110	K	88.9	Confident	84.7	Confident	67 Å²	67	57.4 Å²	57.4	29%	0.291	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	109.5	-171.7	-170.8	158.6	177.3	142	0	109.9	V33 V34 K36 T139 D140 D142	V33-K110 HydrophobicContact CG1-CB 3.88Å; V33-K110 HydrophobicContact CG1-CD 3.9Å; V34-K110 PolarHBondContact O-N 2.88Å; K36-K110 PolarHBondContact N-O 3.3Å; K110-T139 WeakPolarHBondContact CA-O 3.41Å; K110-T139 PolarHBondContact N-O 2.85Å; K110-D140 HydrophobicContact CD-CB 4.42Å; K110-D140 WeakPolarHBondContact CD-OD1 3.17Å; K110-D140 VanDerWaalsContact CE-CG 3.4Å; K110-D140 WeakPolarHBondContact CE-OD1 3.14Å; K110-D140 WeakPolarHBondContact CE-OD2 3.44Å; K110-D140 HydrophobicContact CG-CB 4.27Å; K110-D140 IonicContact NZ-OD1 2.62Å; K110-D140 PolarHBondContact NZ-OD1 2.81Å; K110-D140 IonicContact NZ-OD2 2.72Å; K110-D140 PolarHBondContact NZ-OD2 2.78Å; K110-D142 IonicContact NZ-OD2 2.83Å; K110-D142 PolarHBondContact NZ-OD2 2.87Å
111	D	86.9	Confident	84.6	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.08	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-101.1	110.2	179.9	-171.1	-9.9	0	0	0	109.3	K36 V109 H113 S114 T139	K36-D111 HydrophobicContact CD-CB 3.94Å; K36-D111 WeakPolarHBondContact CD-OD1 3.25Å; K36-D111 WeakPolarHBondContact CD-OD2 3.36Å; K36-D111 WeakPolarHBondContact CE-OD2 3.45Å; K36-D111 IonicContact NZ-OD1 3.2Å; K36-D111 PolarHBondContact NZ-OD1 3.17Å; K36-D111 IonicContact NZ-OD2 3.75Å; K36-D111 PolarHBondContact NZ-OD2 3.07Å; V109-D111 PolarHBondContact O-N 2.85Å; D111-H113 PolarHBondContact O-N 3.02Å; D111-H113 IonicContact OD1-CD2 3.6Å; D111-H113 PolarHBondContact OD1-N 2.74Å; D111-S114 CarbonylContact O-C 3.51Å; D111-S114 PolarHBondContact O-N 2.89Å; D111-S114 VanDerWaalsContact O-O 3.13Å; D111-T139 HydrophobicContact CB-CG2 4.36Å
112	P	81.8	Confident	84.6	Confident	111 Å²	111	58.4 Å²	58.4	72%	0.721	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-9.5	-175.5	28.3	-36	0	0	0	113.5
113	H	83.8	Confident	84.8	Confident	167 Å²	167	58.7 Å²	58.7	77%	0.773	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-8.2	176.4	-53.8	-67.5	0	0	0	113.7	D111	D111-H113 PolarHBondContact O-N 3.02Å; D111-H113 IonicContact OD1-CD2 3.6Å; D111-H113 PolarHBondContact OD1-N 2.74Å
114	S	85.7	Confident	85	Confident	33 Å²	33	58.5 Å²	58.5	23%	0.231	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-160.9	124.4	176.4	-152.2	0	0	0	0	113.6	D111 F116 T139	D111-S114 CarbonylContact O-C 3.51Å; D111-S114 PolarHBondContact O-N 2.89Å; D111-S114 VanDerWaalsContact O-O 3.13Å; S114-F116 PolarHBondContact O-N 3.09Å; S114-F116 PolarHBondContact OG-O 2.87Å; S114-T139 PolarHBondContact O-OG1 2.92Å
115	A	87.5	Confident	85.1	Confident	11 Å²	11	61.5 Å²	61.5	9%	0.091	33%	0.329	C	S	.	.	S	Bend	trans	-71.1	-7.2	174.2	0	0	0	0	0	114	V138 T139 V143 L189 V194	A115-V138 WeakPolarHBondContact O-CA 3.32Å; A115-V138 WeakPolarHBondContact O-CG1 3.49Å; A115-T139 VanDerWaalsContact CA-OG1 3.24Å; A115-T139 WeakPolarHBondContact CA-OG1 3.5Å; A115-T139 PolarHBondContact O-N 3.11Å; A115-T139 PolarHBondContact O-OG1 2.98Å; A115-V143 HydrophobicContact CB-CG2 4.28Å; A115-L189 HydrophobicContact CB-CD2 4.28Å; A115-V194 HydrophobicContact CB-CB 3.84Å; A115-V194 HydrophobicContact CB-CG1 4.01Å; A115-V194 HydrophobicContact CB-CG2 3.78Å
116	F	90.1	Very high	85.1	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.026	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-126.4	143.2	-179.6	-68.4	-83.5	0	0	0	111	S114 Q118 C136 L137 V138 L146 C185 V194 T195	S114-F116 PolarHBondContact O-N 3.09Å; S114-F116 PolarHBondContact OG-O 2.87Å; F116-Q118 PolarHBondContact O-N 2.74Å; F116-C136 HydrophobicContact CD1-CB 4.13Å; F116-C136 HydrophobicContact CE1-CB 4.32Å; F116-L137 CarbonylContact C-O 3.57Å; F116-L137 WeakPolarHBondContact CA-O 3.4Å; F116-V138 HydrophobicContact CD1-CG2 4.09Å; F116-V138 HydrophobicContact CE1-CG2 3.8Å; F116-L146 HydrophobicContact CE1-CD1 3.75Å; F116-L146 HydrophobicContact CZ-CD1 3.98Å; F116-C185 HydrophobicContact CE1-CB 4.01Å; F116-C185 HydrophobicContact CZ-CB 4.26Å; F116-V194 HydrophobicContact CE2-CB 4.43Å; F116-V194 HydrophobicContact CE2-CG2 4.14Å; F116-T195 VanDerWaalsContact CD2-C 3.42Å; F116-T195 VanDerWaalsContact CE2-C 3.49Å
117	Q	86.8	Confident	85.1	Confident	36 Å²	36	66 Å²	66	17%	0.168	35%	0.347	C	S	.	.			trans	-69.8	129	176.5	-166.8	-174.1	59.4	0	0	110.1	A86 M89 L137 T139	A86-Q117 PolarHBondContact O-NE2 3.44Å; M89-Q117 HydrophobicContact CE-CB 4.23Å; Q117-L137 HydrophobicContact CB-CB 4.2Å; Q117-L137 PolarHBondContact N-O 2.89Å; Q117-T139 HydrophobicContact CB-CG2 4.47Å
118	Q	79.6	Confident	85	Confident	142 Å²	142	67.6 Å²	67.6	66%	0.664	36%	0.36	S	S	*	.			trans	-72.1	132.1	175.3	-66.4	-179.4	-11.9	0	0	110.9	F116	F116-Q118 PolarHBondContact O-N 2.74Å
119	T	75.3	Confident	84.8	Confident	52 Å²	52	69.5 Å²	69.5	32%	0.319	38%	0.381	S	S	.	.			trans	-118.1	147.4	177.2	176.8	0	0	0	0	110.9	M121 V197 Y199	T119-M121 WeakPolarHBondContact CG2-O 3.34Å; T119-M121 PolarHBondContact OG1-N 3.39Å; T119-M121 PolarHBondContact OG1-O 2.97Å; T119-M121 VanDerWaalsContact OG1-O 3.09Å; T119-V197 HydrophobicContact CG2-CG2 4.16Å; T119-Y199 HydrophobicContact CG2-CE1 3.76Å
120	M	68.4	Low	84.8	Confident	196 Å²	196	73.8 Å²	73.8	97%	0.966	40%	0.401	S	S	*	.	S	Bend	trans	-85	-12.7	170.6	-63.9	-62.6	-165.6	0	0	112.8
121	M	73	Confident	85	Confident	138 Å²	138	74 Å²	74	68%	0.68	41%	0.406	S	S	*	.			trans	-111.9	108.9	178.7	-67.1	-179.7	69.8	0	0	109.7	T119	T119-M121 WeakPolarHBondContact CG2-O 3.34Å; T119-M121 PolarHBondContact OG1-N 3.39Å; T119-M121 PolarHBondContact OG1-O 2.97Å; T119-M121 VanDerWaalsContact OG1-O 3.09Å
122	S	82.4	Confident	85.3	Confident	53 Å²	53	73.4 Å²	73.4	37%	0.371	40%	0.403	S	S	.	.			trans	-107.4	-18.6	175.8	52.5	0	0	0	0	113.4	S198 Y199 S200	S122-S198 WeakPolarHBondContact CB-O 3.19Å; S122-Y199 CarbonylContact O-C 3.59Å; S122-Y199 VanDerWaalsContact O-CA 3.27Å; S122-Y199 WeakPolarHBondContact O-CA 3.12Å; S122-S200 PolarHBondContact O-N 3.1Å
123	S	88.2	Confident	85.8	Confident	88 Å²	88	72.1 Å²	72.1	62%	0.615	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	132.3	173.5	46.3	0	0	0	0	111.3	S200	S123-S200 WeakPolarHBondContact CA-O 3.09Å
124	I	90.9	Very high	86.3	Confident	31 Å²	31	64.2 Å²	64.2	16%	0.159	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	126	-178.9	-57.6	167.2	0	0	0	107.4	I134 Y199 S200 V201 D202	I124-I134 HydrophobicContact CD1-CB 4.31Å; I124-I134 HydrophobicContact CD1-CG1 3.91Å; I124-I134 HydrophobicContact CD1-CG2 4.49Å; I124-Y199 HydrophobicContact CD1-CD1 4.03Å; I124-S200 PolarHBondContact N-O 3.21Å; I124-V201 HydrophobicContact CB-CG2 4.39Å; I124-V201 HydrophobicContact CD1-CG2 4.28Å; I124-V201 WeakPolarHBondContact O-CA 3.34Å; I124-D202 PolarHBondContact O-N 3.47Å
125	L	89.9	Confident	86.5	Confident	127 Å²	127	64.9 Å²	64.9	67%	0.665	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.1	172.4	-179.2	65.5	0	0	0	108.5	D202 R204	L125-D202 WeakPolarHBondContact CA-O 2.93Å; L125-D202 HydrophobicContact CD1-CB 4.06Å; L125-R204 HydrophobicContact CD1-CB 4.21Å
126	V	90.3	Very high	86.6	Confident	13 Å²	13	64.4 Å²	64.4	8%	0.079	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.7	178.3	64.2	0	0	0	0	110.4	E130 C132 A175 V201 D202 V203 R204	V126-E130 HydrophobicContact CG2-CB 4.28Å; V126-C132 HydrophobicContact CB-CB 4.07Å; V126-C132 HydrophobicContact CG1-CB 3.98Å; V126-C132 HydrophobicContact CG2-CB 3.95Å; V126-A175 HydrophobicContact CB-CB 4.41Å; V126-A175 HydrophobicContact CG1-CB 3.57Å; V126-A175 HydrophobicContact CG2-CB 3.91Å; V126-V201 HydrophobicContact CG1-CG1 4.25Å; V126-D202 PolarHBondContact N-O 3.44Å; V126-V203 HydrophobicContact CG1-CB 4.48Å; V126-V203 HydrophobicContact CG1-CG1 4.45Å; V126-V203 HydrophobicContact CG1-CG2 3.91Å; V126-V203 CarbonylContact O-C 3.57Å; V126-V203 WeakPolarHBondContact O-CA 3.34Å; V126-R204 PolarHBondContact O-N 3.16Å
127	R	88.1	Confident	86.6	Confident	92 Å²	92	66 Å²	66	35%	0.347	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	137.7	174.6	-177.5	164.7	172.3	-114.4	7.7	110.2	G129 E130 V206 E295	R127-G129 PolarHBondContact O-N 2.87Å; R127-E130 HydrophobicContact CB-CG 4.36Å; R127-E130 WeakPolarHBondContact CD-OE1 3.39Å; R127-E130 IonicContact CZ-OE1 3.75Å; R127-E130 IonicContact NH1-OE1 2.64Å; R127-E130 PolarHBondContact NH1-OE1 2.85Å; R127-E130 WeakPolarHBondContact O-CB 3.33Å; R127-E130 PolarHBondContact O-N 3.33Å; R127-V206 HydrophobicContact CG-CG2 3.45Å; R127-V206 VanDerWaalsContact CG-CG2 3.45Å; R127-E295 IonicContact CZ-OE2 3.53Å; R127-E295 IonicContact NE-OE2 3.67Å; R127-E295 IonicContact NH2-OE1 3.85Å; R127-E295 PolarHBondContact NH2-OE1 3.03Å; R127-E295 IonicContact NH2-OE2 3.67Å; R127-E295 PolarHBondContact NH2-OE2 2.6Å
128	A	87.4	Confident	86.9	Confident	33 Å²	33	64.2 Å²	64.2	27%	0.273	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	130.9	179.4	0	0	0	0	0	110.8	A175 V203 R204 V206	A128-A175 CarbonylContact C-O 3.59Å; A128-A175 VanDerWaalsContact CA-O 3.32Å; A128-A175 WeakPolarHBondContact CA-O 3.38Å; A128-V203 HydrophobicContact CB-CG1 4.07Å; A128-R204 WeakPolarHBondContact CB-O 3.28Å; A128-R204 PolarHBondContact N-O 3.1Å; A128-V206 HydrophobicContact CB-CG2 4.19Å
129	G	85.2	Confident	87.3	Confident	47 Å²	47	57.5 Å²	57.5	49%	0.485	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.5	-17.1	-172.8	0	0	0	0	0	115.6	R127 N174 A175	R127-G129 PolarHBondContact O-N 2.87Å; G129-N174 WeakPolarHBondContact CA-OD1 3.29Å; G129-A175 PolarHBondContact N-O 2.85Å
130	E	91.5	Very high	88	Confident	91 Å²	91	55.4 Å²	55.4	43%	0.425	31%	0.308	S	S	.	.	S	Bend	trans	-94.5	160.7	-179.9	-66.2	170.9	-160.4	0	0	111.8	V126 R127 A175	V126-E130 HydrophobicContact CG2-CB 4.28Å; R127-E130 HydrophobicContact CB-CG 4.36Å; R127-E130 WeakPolarHBondContact CD-OE1 3.39Å; R127-E130 IonicContact CZ-OE1 3.75Å; R127-E130 IonicContact NH1-OE1 2.64Å; R127-E130 PolarHBondContact NH1-OE1 2.85Å; R127-E130 WeakPolarHBondContact O-CB 3.33Å; R127-E130 PolarHBondContact O-N 3.33Å; E130-A175 VanDerWaalsContact O-CB 3.25Å; E130-A175 WeakPolarHBondContact O-CB 3.43Å; E130-A175 PolarHBondContact O-N 2.74Å
131	D	93.1	Very high	89	Confident	73 Å²	73	47.3 Å²	47.3	39%	0.39	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-80.4	128.8	179.7	-76.5	-6.5	0	0	0	111.3	I171 I172 R173 N174	D131-I171 HydrophobicContact CB-CG2 4.38Å; D131-I172 CarbonylContact C-O 3.15Å; D131-I172 WeakPolarHBondContact CA-O 3.35Å; D131-R173 VanDerWaalsContact CG-CD 3.47Å; D131-R173 VanDerWaalsContact OD1-CA 3.24Å; D131-R173 WeakPolarHBondContact OD1-CA 3.41Å; D131-R173 WeakPolarHBondContact OD1-CD 3.46Å; D131-R173 WeakPolarHBondContact OD2-CD 3.33Å; D131-R173 IonicContact OD2-CZ 2.81Å; D131-R173 IonicContact OD2-NE 3.19Å; D131-R173 IonicContact OD2-NH1 3.82Å; D131-R173 PolarHBondContact OD2-NH1 3.44Å; D131-N174 PolarHBondContact OD1-N 2.87Å
132	C	93.1	Very high	89.8	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.007	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.9	179.5	-173.8	0	0	0	0	110.8	V126 I172 A175	V126-C132 HydrophobicContact CB-CB 4.07Å; V126-C132 HydrophobicContact CG1-CB 3.98Å; V126-C132 HydrophobicContact CG2-CB 3.95Å; C132-I172 HydrophobicContact CB-CB 4.22Å; C132-I172 HydrophobicContact CB-CD1 4.45Å; C132-I172 PolarHBondContact N-O 2.69Å; C132-I172 PolarHBondContact O-N 3.36Å; C132-A175 HydrophobicContact CB-CB 4.31Å
133	I	92.4	Very high	90.2	Very high	85 Å²	85	43.4 Å²	43.4	44%	0.436	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	116.7	178.3	-53.5	-179.6	0	0	0	109.3	P135 I171	I133-P135 WeakPolarHBondContact O-CD 3.46Å; I133-I171 HydrophobicContact CG1-CG1 4.31Å; I133-I171 HydrophobicContact CG1-CG2 4.4Å
134	I	92.8	Very high	90.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	108.7	170.3	-62.3	177.6	0	0	0	107.4	I124 C136 L148 G169 I170 I172 Y183 Y199 V201	I124-I134 HydrophobicContact CD1-CB 4.31Å; I124-I134 HydrophobicContact CD1-CG1 3.91Å; I124-I134 HydrophobicContact CD1-CG2 4.49Å; I134-C136 HydrophobicContact CG2-CB 4.46Å; I134-C136 PolarHBondContact O-N 3.15Å; I134-C136 PolarHBondContact O-SG 2.93Å; I134-L148 HydrophobicContact CD1-CD1 3.7Å; I134-L148 HydrophobicContact CD1-CD2 4.14Å; I134-G169 WeakPolarHBondContact O-CA 3.5Å; I134-I170 HydrophobicContact CB-CB 4.37Å; I134-I170 PolarHBondContact N-O 3.24Å; I134-I170 PolarHBondContact O-N 2.9Å; I134-I172 HydrophobicContact CD1-CD1 3.7Å; I134-I172 HydrophobicContact CG1-CD1 4.24Å; I134-Y183 HydrophobicContact CD1-CD2 4.3Å; I134-Y183 HydrophobicContact CD1-CG 4.33Å; I134-Y199 HydrophobicContact CG2-CD1 4Å; I134-Y199 HydrophobicContact CG2-CD2 3.56Å; I134-Y199 HydrophobicContact CG2-CE1 4.34Å; I134-Y199 HydrophobicContact CG2-CE2 3.95Å; I134-Y199 HydrophobicContact CG2-CG 3.59Å; I134-V201 HydrophobicContact CD1-CG2 4.06Å; I134-V201 HydrophobicContact CG1-CG2 4.2Å
135	P	90.4	Very high	90	Very high	48 Å²	48	45.5 Å²	45.5	31%	0.312	26%	0.259	S	S	.	.			trans	-83.4	50.6	-166.6	36.2	-38.1	0	0	0	112.6	I133 L137 Y199	I133-P135 WeakPolarHBondContact O-CD 3.46Å; P135-L137 PolarHBondContact O-N 3.03Å; P135-Y199 HydrophobicContact CG-CE1 3.92Å; P135-Y199 PolarHBondContact O-OH 2.89Å
136	C	90.3	Very high	90.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.233	C	C	.	.			trans	-79.1	65.6	174.8	54	0	0	0	0	110.8	F116 I134 C185 Y199	F116-C136 HydrophobicContact CD1-CB 4.13Å; F116-C136 HydrophobicContact CE1-CB 4.32Å; I134-C136 HydrophobicContact CG2-CB 4.46Å; I134-C136 PolarHBondContact O-N 3.15Å; I134-C136 PolarHBondContact O-SG 2.93Å; C136-C185 HydrophobicContact CB-CB 3.5Å; C136-C185 VanDerWaalsContact CB-CB 3.5Å; C136-C185 WeakPolarHBondContact CB-SG 3.2Å; C136-C185 WeakPolarHBondContact SG-CB 3.42Å; C136-C185 CovalentContact SG-SG 2.02Å; C136-C185 PolarHBondContact SG-SG 2.9Å; C136-Y199 WeakPolarHBondContact CA-OH 3.31Å; C136-Y199 HydrophobicContact CB-CE2 3.94Å
137	L	90.4	Very high	90.3	Very high	39 Å²	39	41.6 Å²	41.6	20%	0.204	24%	0.241	C	C	.	.			trans	-63.5	135.5	-179.5	-59.9	177.2	0	0	0	110.8	M89 F116 Q117 P135 Q167 R168	M89-L137 HydrophobicContact CE-CB 3.62Å; F116-L137 CarbonylContact C-O 3.57Å; F116-L137 WeakPolarHBondContact CA-O 3.4Å; Q117-L137 HydrophobicContact CB-CB 4.2Å; Q117-L137 PolarHBondContact N-O 2.89Å; P135-L137 PolarHBondContact O-N 3.03Å; L137-Q167 VanDerWaalsContact CD2-C 3.43Å; L137-Q167 VanDerWaalsContact CD2-O 3.28Å; L137-Q167 WeakPolarHBondContact CD2-O 3.49Å; L137-R168 VanDerWaalsContact CD2-CA 3.47Å
138	V	91.4	Very high	90.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-92.2	134.8	-173.8	178.8	0	0	0	0	110.1	M89 Y108 A115 F116 D140 V143 L146 L166	M89-V138 VanDerWaalsContact CE-O 3.28Å; M89-V138 WeakPolarHBondContact CE-O 3.38Å; M89-V138 VanDerWaalsContact SD-O 3.35Å; Y108-V138 WeakPolarHBondContact CD1-O 3.44Å; Y108-V138 WeakPolarHBondContact CE1-O 3.45Å; A115-V138 WeakPolarHBondContact O-CA 3.32Å; A115-V138 WeakPolarHBondContact O-CG1 3.49Å; F116-V138 HydrophobicContact CD1-CG2 4.09Å; F116-V138 HydrophobicContact CE1-CG2 3.8Å; V138-D140 WeakPolarHBondContact CG1-O 3.41Å; V138-V143 HydrophobicContact CG1-CB 3.81Å; V138-V143 HydrophobicContact CG1-CG1 4.44Å; V138-V143 HydrophobicContact CG1-CG2 3.62Å; V138-L146 HydrophobicContact CG2-CD1 4.32Å; V138-L146 HydrophobicContact CG2-CD2 4.17Å; V138-L166 HydrophobicContact CB-CB 4.4Å; V138-L166 HydrophobicContact CB-CD2 4.32Å; V138-L166 HydrophobicContact CG1-CD2 4.42Å; V138-L166 HydrophobicContact CG2-CD2 3.92Å; V138-L166 PolarHBondContact N-O 3.16Å
139	T	89.6	Confident	90.8	Very high	1 Å²	1	39 Å²	39	1%	0.006	23%	0.227	C	C	.	.	S	Bend	trans	-82.6	-16.1	-178.4	54.7	0	0	0	0	113.9	M89 V109 K110 D111 S114 A115 Q117	M89-T139 HydrophobicContact SD-CG2 4.34Å; V109-T139 CarbonylContact C-O 3.43Å; V109-T139 WeakPolarHBondContact O-CB 3.35Å; K110-T139 WeakPolarHBondContact CA-O 3.41Å; K110-T139 PolarHBondContact N-O 2.85Å; D111-T139 HydrophobicContact CB-CG2 4.36Å; S114-T139 PolarHBondContact O-OG1 2.92Å; A115-T139 VanDerWaalsContact CA-OG1 3.24Å; A115-T139 WeakPolarHBondContact CA-OG1 3.5Å; A115-T139 PolarHBondContact O-N 3.11Å; A115-T139 PolarHBondContact O-OG1 2.98Å; Q117-T139 HydrophobicContact CB-CG2 4.47Å
140	D	88.8	Confident	91.1	Very high	8 Å²	8	37.4 Å²	37.4	4%	0.043	21%	0.208	C	C	.	.			trans	-138	116.3	-168.3	-168.7	-4.1	0	0	0	110.6	K110 V138 D142 V143 L189	K110-D140 HydrophobicContact CD-CB 4.42Å; K110-D140 WeakPolarHBondContact CD-OD1 3.17Å; K110-D140 VanDerWaalsContact CE-CG 3.4Å; K110-D140 WeakPolarHBondContact CE-OD1 3.14Å; K110-D140 WeakPolarHBondContact CE-OD2 3.44Å; K110-D140 HydrophobicContact CG-CB 4.27Å; K110-D140 IonicContact NZ-OD1 2.62Å; K110-D140 PolarHBondContact NZ-OD1 2.81Å; K110-D140 IonicContact NZ-OD2 2.72Å; K110-D140 PolarHBondContact NZ-OD2 2.78Å; V138-D140 WeakPolarHBondContact CG1-O 3.41Å; D140-D142 PolarHBondContact O-N 3.21Å; D140-D142 VanDerWaalsContact O-N 3.16Å; D140-D142 PolarHBondContact OD1-N 3.18Å; D140-V143 HydrophobicContact CB-CG2 4.39Å; D140-V143 WeakPolarHBondContact O-CG2 3.32Å; D140-V143 PolarHBondContact O-N 3.48Å; D140-L189 WeakPolarHBondContact OD2-CD1 3.48Å
141	P	89.1	Confident	91.1	Very high	25 Å²	25	34.3 Å²	34.3	16%	0.162	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.5	-176.3	28.9	-35.9	0	0	0	113.8	H31 V33 Y108 V143	H31-P141 WeakPolarHBondContact NE2-CG 3.31Å; V33-P141 HydrophobicContact CG2-CG 3.48Å; V33-P141 VanDerWaalsContact CG2-CG 3.48Å; Y108-P141 HydrophobicContact CD2-CB 4.12Å; Y108-P141 HydrophobicContact CD2-CG 4.11Å; Y108-P141 HydrophobicContact CE1-CB 4.43Å; Y108-P141 HydrophobicContact CE2-CB 3.87Å; Y108-P141 HydrophobicContact CE2-CG 4.36Å; Y108-P141 HydrophobicContact CG-CG 4.35Å; P141-V143 PolarHBondContact O-N 2.94Å; P141-V143 VanDerWaalsContact O-N 3.16Å
142	D	89.9	Confident	90.8	Very high	105 Å²	105	35.4 Å²	35.4	56%	0.561	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-3.6	177	-62.7	-31	0	0	0	113.4	K110 D140 A144 L189	K110-D142 IonicContact NZ-OD2 2.83Å; K110-D142 PolarHBondContact NZ-OD2 2.87Å; D140-D142 PolarHBondContact O-N 3.21Å; D140-D142 VanDerWaalsContact O-N 3.16Å; D140-D142 PolarHBondContact OD1-N 3.18Å; D142-A144 PolarHBondContact O-N 2.86Å; D142-L189 HydrophobicContact CB-CD1 3.59Å
143	V	90.4	Very high	90.3	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.03	23%	0.233	C	C	.	.			trans	-75.3	107	177.5	179.8	0	0	0	0	111.2	A115 V138 D140 P141 Q188 L189 V194	A115-V143 HydrophobicContact CB-CG2 4.28Å; V138-V143 HydrophobicContact CG1-CB 3.81Å; V138-V143 HydrophobicContact CG1-CG1 4.44Å; V138-V143 HydrophobicContact CG1-CG2 3.62Å; D140-V143 HydrophobicContact CB-CG2 4.39Å; D140-V143 WeakPolarHBondContact O-CG2 3.32Å; D140-V143 PolarHBondContact O-N 3.48Å; P141-V143 PolarHBondContact O-N 2.94Å; P141-V143 VanDerWaalsContact O-N 3.16Å; V143-Q188 CarbonylContact C-O 3.57Å; V143-Q188 WeakPolarHBondContact CA-O 3.29Å; V143-L189 HydrophobicContact CG2-CB 4.19Å; V143-L189 HydrophobicContact CG2-CD1 4.04Å; V143-L189 HydrophobicContact CG2-CD2 4.43Å; V143-L189 HydrophobicContact CG2-CG 4.45Å; V143-V194 HydrophobicContact CG1-CG2 4.28Å; V143-V194 HydrophobicContact CG2-CG2 4.49Å
144	A	87.9	Confident	90.1	Very high	48 Å²	48	42.8 Å²	42.8	40%	0.397	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	162.9	170.7	0	0	0	0	0	112.2	D142 L146 Q188	D142-A144 PolarHBondContact O-N 2.86Å; A144-L146 PolarHBondContact O-N 2.93Å; A144-Q188 PolarHBondContact N-O 3.15Å; A144-Q188 PolarHBondContact O-N 3.34Å
145	N	88.4	Confident	89.9	Confident	115 Å²	115	48.4 Å²	48.4	62%	0.615	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.3	47.1	166.6	-62.4	-31.7	0	0	0	115	S147 Q188	N145-S147 PolarHBondContact O-N 3.24Å; N145-Q188 PolarHBondContact ND2-OE1 3.43Å
146	L	92.9	Very high	89.8	Confident	23 Å²	23	48.2 Å²	48.2	12%	0.12	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	105.3	174.9	178.9	62.8	0	0	0	111.2	F116 V138 A144 L166 I170 C185 V186	F116-L146 HydrophobicContact CE1-CD1 3.75Å; F116-L146 HydrophobicContact CZ-CD1 3.98Å; V138-L146 HydrophobicContact CG2-CD1 4.32Å; V138-L146 HydrophobicContact CG2-CD2 4.17Å; A144-L146 PolarHBondContact O-N 2.93Å; L146-L166 HydrophobicContact CB-CD2 4.13Å; L146-L166 HydrophobicContact CD2-CD2 4.08Å; L146-I170 HydrophobicContact CD1-CD1 4.44Å; L146-I170 HydrophobicContact CD2-CD1 4.38Å; L146-I170 HydrophobicContact CG-CD1 3.88Å; L146-C185 HydrophobicContact CD1-CB 4.13Å; L146-V186 CarbonylContact C-O 3.6Å; L146-V186 WeakPolarHBondContact CA-O 3.43Å
147	S	92.6	Very high	89.6	Confident	35 Å²	35	50 Å²	50	25%	0.245	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	176.6	-176.1	69.1	0	0	0	0	112.2	N145 C185 V186	N145-S147 PolarHBondContact O-N 3.24Å; S147-C185 WeakPolarHBondContact O-CA 3.48Å; S147-V186 PolarHBondContact N-O 3.06Å; S147-V186 PolarHBondContact O-N 2.87Å
148	L	93.6	Very high	89.1	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.031	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.6	176.6	-165	75	0	0	0	110.8	I134 L156 M160 Y162 I170 I172 Y183	I134-L148 HydrophobicContact CD1-CD1 3.7Å; I134-L148 HydrophobicContact CD1-CD2 4.14Å; L148-L156 HydrophobicContact CB-CD1 4.46Å; L148-L156 HydrophobicContact CD2-CD2 4.31Å; L148-L156 HydrophobicContact CG-CD2 4.46Å; L148-M160 HydrophobicContact CD2-CE 3.48Å; L148-M160 VanDerWaalsContact CD2-CE 3.48Å; L148-Y162 HydrophobicContact CB-CD2 4.28Å; L148-Y162 HydrophobicContact CB-CE1 4.25Å; L148-Y162 HydrophobicContact CB-CE2 3.87Å; L148-Y162 PolarHBondContact N-OH 2.58Å; L148-Y162 VanDerWaalsContact N-OH 3.13Å; L148-I170 HydrophobicContact CB-CG1 4.35Å; L148-I170 HydrophobicContact CB-CG2 4.31Å; L148-I170 HydrophobicContact CD1-CB 4.22Å; L148-I170 HydrophobicContact CD1-CG1 4Å; L148-I170 HydrophobicContact CD1-CG2 4.19Å; L148-I170 HydrophobicContact CD2-CG2 4.24Å; L148-I170 HydrophobicContact CG-CG2 4.49Å; L148-I172 HydrophobicContact CD2-CD1 4.16Å; L148-I172 HydrophobicContact CD2-CG1 4.38Å; L148-Y183 HydrophobicContact CD1-CG 4.46Å; L148-Y183 HydrophobicContact CD2-CD1 3.69Å; L148-Y183 HydrophobicContact CD2-CE1 4.18Å; L148-Y183 HydrophobicContact CD2-CG 4.13Å; L148-Y183 HydrophobicContact CG-CD1 3.99Å; L148-Y183 HydrophobicContact CG-CG 4.36Å
149	E	92.8	Very high	88.5	Confident	63 Å²	63	57.4 Å²	57.4	29%	0.294	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	159.6	172.8	-67	-179.3	-159.9	0	0	110.3	Y183 R184 V186 R193	E149-Y183 CarbonylContact O-C 3.59Å; E149-Y183 WeakPolarHBondContact O-CA 3.42Å; E149-Y183 WeakPolarHBondContact O-CB 3.33Å; E149-R184 PolarHBondContact N-O 2.73Å; E149-R184 PolarHBondContact O-N 2.9Å; E149-V186 HydrophobicContact CB-CG2 4.19Å; E149-V186 HydrophobicContact CG-CG2 3.83Å; E149-V186 WeakPolarHBondContact OE1-CG2 3.37Å; E149-R193 IonicContact OE1-CZ 2.71Å; E149-R193 IonicContact OE1-NE 3.95Å; E149-R193 IonicContact OE1-NH2 3.26Å; E149-R193 PolarHBondContact OE1-NH2 3.18Å; E149-R193 IonicContact OE2-CZ 3.01Å; E149-R193 IonicContact OE2-NH2 3.88Å; E149-R193 PolarHBondContact OE2-NH2 3.26Å
150	T	91.8	Very high	88.5	Confident	15 Å²	15	58.8 Å²	58.8	9%	0.092	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	156.8	170.6	74.1	0	0	0	0	111.3	D152 G153 R154 L156 C182 Y183	T150-D152 VanDerWaalsContact CB-OD1 3.27Å; T150-D152 WeakPolarHBondContact CB-OD1 3.49Å; T150-D152 PolarHBondContact O-N 2.85Å; T150-D152 PolarHBondContact OG1-OD1 2.8Å; T150-G153 PolarHBondContact O-N 2.79Å; T150-G153 PolarHBondContact OG1-N 2.81Å; T150-R154 PolarHBondContact OG1-N 3.16Å; T150-R154 PolarHBondContact OG1-O 2.89Å; T150-L156 HydrophobicContact CG2-CD2 4.1Å; T150-C182 CarbonylContact C-O 3.54Å; T150-C182 WeakPolarHBondContact CA-O 3.48Å; T150-Y183 HydrophobicContact CG2-CD1 4.34Å; T150-Y183 HydrophobicContact CG2-CE1 4.19Å
151	C	91.3	Very high	88.6	Confident	26 Å²	26	62.9 Å²	62.9	18%	0.176	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.5	178.8	-67	0	0	0	0	114.1	C182 Y183 R184 S198	C151-C182 HydrophobicContact CB-CB 3.57Å; C151-C182 WeakPolarHBondContact CB-SG 3.45Å; C151-C182 PolarHBondContact N-O 2.74Å; C151-C182 WeakPolarHBondContact SG-CB 3.07Å; C151-C182 PolarHBondContact SG-O 3.21Å; C151-C182 CovalentContact SG-SG 2.04Å; C151-C182 PolarHBondContact SG-SG 2.61Å; C151-Y183 PolarHBondContact SG-N 2.84Å; C151-R184 PolarHBondContact O-NH1 2.98Å; C151-R184 PolarHBondContact O-NH2 2.9Å; C151-S198 VanDerWaalsContact SG-CB 3.53Å
152	D	87.6	Confident	88.8	Confident	95 Å²	95	65.3 Å²	65.3	51%	0.508	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	5.8	-178.4	66.1	-16.8	0	0	0	113.8	T150 R154	T150-D152 VanDerWaalsContact CB-OD1 3.27Å; T150-D152 WeakPolarHBondContact CB-OD1 3.49Å; T150-D152 PolarHBondContact O-N 2.85Å; T150-D152 PolarHBondContact OG1-OD1 2.8Å; D152-R154 VanDerWaalsContact C-N 3.3Å; D152-R154 PolarHBondContact O-N 2.81Å; D152-R154 WeakPolarHBondContact OD2-CD 3.43Å; D152-R154 WeakPolarHBondContact OD2-CG 3.5Å; D152-R154 IonicContact OD2-CZ 2.91Å; D152-R154 VanDerWaalsContact OD2-CZ 3.26Å; D152-R154 IonicContact OD2-NE 2.67Å; D152-R154 PolarHBondContact OD2-NE 2.86Å; D152-R154 IonicContact OD2-NH1 2.69Å; D152-R154 IonicContact OD2-NH2 2.77Å
153	G	82.8	Confident	88.9	Confident	63 Å²	63	62.5 Å²	62.5	65%	0.649	38%	0.382	S	S	*	.			trans	73.2	16	175.3	0	0	0	0	0	115.2	T150	T150-G153 PolarHBondContact O-N 2.79Å; T150-G153 PolarHBondContact OG1-N 2.81Å
154	R	87.6	Confident	89	Confident	178 Å²	178	64.2 Å²	64.2	67%	0.672	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-75.3	157.2	172.4	-69.4	-176.4	-174.8	165.8	6.1	111	T150 D152	T150-R154 PolarHBondContact OG1-N 3.16Å; T150-R154 PolarHBondContact OG1-O 2.89Å; D152-R154 VanDerWaalsContact C-N 3.3Å; D152-R154 PolarHBondContact O-N 2.81Å; D152-R154 WeakPolarHBondContact OD2-CD 3.43Å; D152-R154 WeakPolarHBondContact OD2-CG 3.5Å; D152-R154 IonicContact OD2-CZ 2.91Å; D152-R154 VanDerWaalsContact OD2-CZ 3.26Å; D152-R154 IonicContact OD2-NE 2.67Å; D152-R154 PolarHBondContact OD2-NE 2.86Å; D152-R154 IonicContact OD2-NH1 2.69Å; D152-R154 IonicContact OD2-NH2 2.77Å
155	P	87.6	Confident	89.1	Confident	119 Å²	119	64.9 Å²	64.9	77%	0.773	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-60	148.4	168.4	27.3	-35.5	0	0	0	110.9
156	L	89.6	Confident	89.1	Confident	44 Å²	44	61.6 Å²	61.6	23%	0.23	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-62.8	153.6	173	-64.2	176.2	0	0	0	111.2	L148 T150 S158 M160 Y162 Y183	L148-L156 HydrophobicContact CB-CD1 4.46Å; L148-L156 HydrophobicContact CD2-CD2 4.31Å; L148-L156 HydrophobicContact CG-CD2 4.46Å; T150-L156 HydrophobicContact CG2-CD2 4.1Å; L156-S158 PolarHBondContact O-N 3.42Å; L156-M160 HydrophobicContact CB-SD 4.05Å; L156-M160 HydrophobicContact CD1-SD 4.29Å; L156-M160 HydrophobicContact CD2-SD 4.1Å; L156-M160 HydrophobicContact CG-SD 4.38Å; L156-Y162 HydrophobicContact CD1-CD1 4.1Å; L156-Y162 HydrophobicContact CD1-CE1 3.41Å; L156-Y162 VanDerWaalsContact CD1-CE1 3.41Å; L156-Y183 HydrophobicContact CD2-CD1 3.96Å; L156-Y183 HydrophobicContact CD2-CE1 3.77Å
157	P	86	Confident	88.9	Confident	38 Å²	38	62.8 Å²	62.8	25%	0.247	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-50.9	136.7	174.9	-26.7	32.7	0	0	0	113.6	G159 M160 E178	P157-G159 PolarHBondContact O-N 2.89Å; P157-M160 HydrophobicContact CB-CB 4.31Å; P157-M160 HydrophobicContact CG-SD 4.39Å; P157-M160 WeakPolarHBondContact O-CB 3.43Å; P157-M160 PolarHBondContact O-N 3.03Å; P157-M160 VanDerWaalsContact O-N 3.09Å; P157-E178 HydrophobicContact CB-CB 4.39Å; P157-E178 WeakPolarHBondContact CG-O 3.03Å
158	S	79.4	Confident	88.6	Confident	116 Å²	116	68.2 Å²	68.2	81%	0.811	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	121.1	-177.4	-67.6	0	0	0	0	111.3	L156	L156-S158 PolarHBondContact O-N 3.42Å
159	G	79.9	Confident	88.4	Confident	77 Å²	77	68 Å²	68	79%	0.794	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.4	2.8	-175.7	0	0	0	0	0	114.9	P157 V161	P157-G159 PolarHBondContact O-N 2.89Å; G159-V161 PolarHBondContact O-N 2.95Å
160	M	88.3	Confident	88.5	Confident	30 Å²	30	65 Å²	65	15%	0.148	39%	0.385	C	S	.	.			trans	-64.1	115.5	170.5	-177.4	-177.5	-173.6	0	0	111	L148 L156 P157 I172 V179 Y183	L148-M160 HydrophobicContact CD2-CE 3.48Å; L148-M160 VanDerWaalsContact CD2-CE 3.48Å; L156-M160 HydrophobicContact CB-SD 4.05Å; L156-M160 HydrophobicContact CD1-SD 4.29Å; L156-M160 HydrophobicContact CD2-SD 4.1Å; L156-M160 HydrophobicContact CG-SD 4.38Å; P157-M160 HydrophobicContact CB-CB 4.31Å; P157-M160 HydrophobicContact CG-SD 4.39Å; P157-M160 WeakPolarHBondContact O-CB 3.43Å; P157-M160 PolarHBondContact O-N 3.03Å; P157-M160 VanDerWaalsContact O-N 3.09Å; M160-I172 HydrophobicContact CE-CB 4.34Å; M160-I172 HydrophobicContact CE-CD1 3.43Å; M160-I172 VanDerWaalsContact CE-CD1 3.43Å; M160-I172 HydrophobicContact CE-CG1 3.63Å; M160-I172 HydrophobicContact CE-CG2 3.74Å; M160-I172 HydrophobicContact CG-CG2 4.18Å; M160-V179 HydrophobicContact CE-CG1 4.19Å; M160-Y183 HydrophobicContact CE-CE1 4.12Å; M160-Y183 HydrophobicContact SD-CE1 4.46Å
161	V	90.6	Very high	88.6	Confident	95 Å²	95	65.2 Å²	65.2	58%	0.576	39%	0.385	S	S	*	.			trans	-98.9	123.7	175.2	179.9	0	0	0	0	109.6	G159 R173	G159-V161 PolarHBondContact O-N 2.95Å; V161-R173 HydrophobicContact CB-CB 4.46Å; V161-R173 HydrophobicContact CG1-CB 4.4Å; V161-R173 HydrophobicContact CG1-CG 4.37Å; V161-R173 PolarHBondContact O-N 3.09Å
162	Y	93.4	Very high	88.7	Confident	75 Å²	75	64 Å²	64	29%	0.294	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	160.1	173.9	76.2	-90.4	0	0	0	112.2	L148 L156 I170 I171	L148-Y162 HydrophobicContact CB-CD2 4.28Å; L148-Y162 HydrophobicContact CB-CE1 4.25Å; L148-Y162 HydrophobicContact CB-CE2 3.87Å; L148-Y162 PolarHBondContact N-OH 2.58Å; L148-Y162 VanDerWaalsContact N-OH 3.13Å; L156-Y162 HydrophobicContact CD1-CD1 4.1Å; L156-Y162 HydrophobicContact CD1-CE1 3.41Å; L156-Y162 VanDerWaalsContact CD1-CE1 3.41Å; Y162-I170 HydrophobicContact CD2-CD1 4.11Å; Y162-I170 HydrophobicContact CD2-CG2 3.62Å; Y162-I170 HydrophobicContact CE2-CD1 4.09Å; Y162-I170 HydrophobicContact CE2-CG2 4.43Å; Y162-I170 HydrophobicContact CG-CG2 4.09Å; Y162-I171 CarbonylContact C-O 3.49Å; Y162-I171 WeakPolarHBondContact CA-O 3.26Å; Y162-I171 WeakPolarHBondContact CB-O 3.38Å
163	S	93.3	Very high	88.9	Confident	47 Å²	47	65.3 Å²	65.3	33%	0.329	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	127.4	177.2	57	0	0	0	0	110.3	I171	S163-I171 PolarHBondContact N-O 2.99Å; S163-I171 PolarHBondContact O-N 2.9Å
164	G	90.9	Very high	89.2	Confident	40 Å²	40	66.2 Å²	66.2	41%	0.412	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	143.6	175.7	0	0	0	0	0	113.2
165	N	90.6	Very high	89.3	Confident	63 Å²	63	57.7 Å²	57.7	34%	0.337	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	119	175	178.2	-71.5	0	0	0	109.3	Q167 R168 G169	N165-Q167 PolarHBondContact O-N 2.84Å; N165-Q167 WeakPolarHBondContact OD1-CA 3.43Å; N165-Q167 WeakPolarHBondContact OD1-CB 3.31Å; N165-Q167 PolarHBondContact OD1-N 3.18Å; N165-R168 HydrophobicContact CB-CB 4.24Å; N165-R168 PolarHBondContact O-N 3.21Å; N165-R168 PolarHBondContact OD1-N 3.21Å; N165-G169 PolarHBondContact N-O 2.78Å; N165-G169 PolarHBondContact O-N 3.22Å; N165-G169 VanDerWaalsContact O-O 3.13Å
166	L	88.9	Confident	89.3	Confident	46 Å²	46	58.5 Å²	58.5	24%	0.241	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.3	-174	-56.8	177.5	0	0	0	113.8	V138 L146	V138-L166 HydrophobicContact CB-CB 4.4Å; V138-L166 HydrophobicContact CB-CD2 4.32Å; V138-L166 HydrophobicContact CG1-CD2 4.42Å; V138-L166 HydrophobicContact CG2-CD2 3.92Å; V138-L166 PolarHBondContact N-O 3.16Å; L146-L166 HydrophobicContact CB-CD2 4.13Å; L146-L166 HydrophobicContact CD2-CD2 4.08Å
167	Q	87.8	Confident	89.1	Confident	48 Å²	48	59.8 Å²	59.8	22%	0.224	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-4.3	-176.6	-58.9	172.7	-23.4	0	0	113.7	F106 Y108 L137 N165	F106-Q167 HydrophobicContact CD1-CG 4.06Å; F106-Q167 HydrophobicContact CD2-CB 3.94Å; F106-Q167 HydrophobicContact CD2-CG 3.75Å; F106-Q167 HydrophobicContact CE1-CG 4.11Å; F106-Q167 HydrophobicContact CE2-CB 3.62Å; F106-Q167 HydrophobicContact CE2-CG 3.79Å; F106-Q167 HydrophobicContact CG-CG 3.88Å; F106-Q167 HydrophobicContact CZ-CB 4Å; F106-Q167 HydrophobicContact CZ-CG 3.97Å; Y108-Q167 WeakPolarHBondContact OH-CG 3.27Å; L137-Q167 VanDerWaalsContact CD2-C 3.43Å; L137-Q167 VanDerWaalsContact CD2-O 3.28Å; L137-Q167 WeakPolarHBondContact CD2-O 3.49Å; N165-Q167 PolarHBondContact O-N 2.84Å; N165-Q167 WeakPolarHBondContact OD1-CA 3.43Å; N165-Q167 WeakPolarHBondContact OD1-CB 3.31Å; N165-Q167 PolarHBondContact OD1-N 3.18Å
168	R	85.9	Confident	89.1	Confident	149 Å²	149	63.4 Å²	63.4	56%	0.562	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	-14.1	179.7	-67.8	-171.9	174.1	-170.9	-1	115	L137 N165	L137-R168 VanDerWaalsContact CD2-CA 3.47Å; N165-R168 HydrophobicContact CB-CB 4.24Å; N165-R168 PolarHBondContact O-N 3.21Å; N165-R168 PolarHBondContact OD1-N 3.21Å
169	G	90.8	Very high	89.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.5	-150.4	-171.8	0	0	0	0	0	112.5	I134 N165	I134-G169 WeakPolarHBondContact O-CA 3.5Å; N165-G169 PolarHBondContact N-O 2.78Å; N165-G169 PolarHBondContact O-N 3.22Å; N165-G169 VanDerWaalsContact O-O 3.13Å
170	I	93.9	Very high	90	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.4	176.5	-63.4	-62.7	0	0	0	109.6	I134 L146 L148 Y162 I172 C185	I134-I170 HydrophobicContact CB-CB 4.37Å; I134-I170 PolarHBondContact N-O 3.24Å; I134-I170 PolarHBondContact O-N 2.9Å; L146-I170 HydrophobicContact CD1-CD1 4.44Å; L146-I170 HydrophobicContact CD2-CD1 4.38Å; L146-I170 HydrophobicContact CG-CD1 3.88Å; L148-I170 HydrophobicContact CB-CG1 4.35Å; L148-I170 HydrophobicContact CB-CG2 4.31Å; L148-I170 HydrophobicContact CD1-CB 4.22Å; L148-I170 HydrophobicContact CD1-CG1 4Å; L148-I170 HydrophobicContact CD1-CG2 4.19Å; L148-I170 HydrophobicContact CD2-CG2 4.24Å; L148-I170 HydrophobicContact CG-CG2 4.49Å; Y162-I170 HydrophobicContact CD2-CD1 4.11Å; Y162-I170 HydrophobicContact CD2-CG2 3.62Å; Y162-I170 HydrophobicContact CE2-CD1 4.09Å; Y162-I170 HydrophobicContact CE2-CG2 4.43Å; Y162-I170 HydrophobicContact CG-CG2 4.09Å; I170-I172 HydrophobicContact CG2-CG1 4.19Å; I170-C185 HydrophobicContact CG1-CB 4.34Å; I170-C185 VanDerWaalsContact CG1-SG 3.54Å
171	I	94.3	Very high	90.1	Very high	20 Å²	20	59 Å²	59	10%	0.103	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	114.1	172.2	-52.6	176.4	0	0	0	108.3	D131 I133 Y162 S163	D131-I171 HydrophobicContact CB-CG2 4.38Å; I133-I171 HydrophobicContact CG1-CG1 4.31Å; I133-I171 HydrophobicContact CG1-CG2 4.4Å; Y162-I171 CarbonylContact C-O 3.49Å; Y162-I171 WeakPolarHBondContact CA-O 3.26Å; Y162-I171 WeakPolarHBondContact CB-O 3.38Å; S163-I171 PolarHBondContact N-O 2.99Å; S163-I171 PolarHBondContact O-N 2.9Å
172	I	93.4	Very high	90.1	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.5	173	-51.4	162.7	0	0	0	107.5	D131 C132 I134 L148 M160 I170 V179	D131-I172 CarbonylContact C-O 3.15Å; D131-I172 WeakPolarHBondContact CA-O 3.35Å; C132-I172 HydrophobicContact CB-CB 4.22Å; C132-I172 HydrophobicContact CB-CD1 4.45Å; C132-I172 PolarHBondContact N-O 2.69Å; C132-I172 PolarHBondContact O-N 3.36Å; I134-I172 HydrophobicContact CD1-CD1 3.7Å; I134-I172 HydrophobicContact CG1-CD1 4.24Å; L148-I172 HydrophobicContact CD2-CD1 4.16Å; L148-I172 HydrophobicContact CD2-CG1 4.38Å; M160-I172 HydrophobicContact CE-CB 4.34Å; M160-I172 HydrophobicContact CE-CD1 3.43Å; M160-I172 VanDerWaalsContact CE-CD1 3.43Å; M160-I172 HydrophobicContact CE-CG1 3.63Å; M160-I172 HydrophobicContact CE-CG2 3.74Å; M160-I172 HydrophobicContact CG-CG2 4.18Å; I170-I172 HydrophobicContact CG2-CG1 4.19Å; I172-V179 HydrophobicContact CD1-CG1 3.92Å; I172-V179 HydrophobicContact CG2-CG1 4.13Å; I172-V179 HydrophobicContact CG2-CG2 4.43Å
173	R	92.3	Very high	90.2	Very high	122 Å²	122	53.2 Å²	53.2	46%	0.46	27%	0.265	S	S	.	.	S	Bend	trans	-89.6	140.3	-176.4	-60.2	-58.9	-172.3	146.1	8.8	111.6	D131 V161	D131-R173 VanDerWaalsContact CG-CD 3.47Å; D131-R173 VanDerWaalsContact OD1-CA 3.24Å; D131-R173 WeakPolarHBondContact OD1-CA 3.41Å; D131-R173 WeakPolarHBondContact OD1-CD 3.46Å; D131-R173 WeakPolarHBondContact OD2-CD 3.33Å; D131-R173 IonicContact OD2-CZ 2.81Å; D131-R173 IonicContact OD2-NE 3.19Å; D131-R173 IonicContact OD2-NH1 3.82Å; D131-R173 PolarHBondContact OD2-NH1 3.44Å; V161-R173 HydrophobicContact CB-CB 4.46Å; V161-R173 HydrophobicContact CG1-CB 4.4Å; V161-R173 HydrophobicContact CG1-CG 4.37Å; V161-R173 PolarHBondContact O-N 3.09Å
174	N	88.8	Confident	90.2	Very high	82 Å²	82	55.4 Å²	55.4	44%	0.439	27%	0.266	S	S	.	.	S	Bend	trans	49.7	70.7	174.5	-175.7	-1.1	0	0	0	112.5	G129 D131 R176	G129-N174 WeakPolarHBondContact CA-OD1 3.29Å; D131-N174 PolarHBondContact OD1-N 2.87Å; N174-R176 PolarHBondContact O-N 2.91Å
175	A	90	Very high	90.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.247	C	C	.	.			trans	-60.8	134	-175.5	0	0	0	0	0	112.2	V126 A128 G129 E130 C132	V126-A175 HydrophobicContact CB-CB 4.41Å; V126-A175 HydrophobicContact CG1-CB 3.57Å; V126-A175 HydrophobicContact CG2-CB 3.91Å; A128-A175 CarbonylContact C-O 3.59Å; A128-A175 VanDerWaalsContact CA-O 3.32Å; A128-A175 WeakPolarHBondContact CA-O 3.38Å; G129-A175 PolarHBondContact N-O 2.85Å; E130-A175 VanDerWaalsContact O-CB 3.25Å; E130-A175 WeakPolarHBondContact O-CB 3.43Å; E130-A175 PolarHBondContact O-N 2.74Å; C132-A175 HydrophobicContact CB-CB 4.31Å
176	R	88.3	Confident	90.4	Very high	136 Å²	136	50.8 Å²	50.8	51%	0.513	23%	0.233	S	C	.	.			trans	-125.5	163.6	177.6	-62.5	-178.7	-178.4	-170.2	-1.1	110	N174 E178 V179 V203	N174-R176 PolarHBondContact O-N 2.91Å; R176-E178 PolarHBondContact O-N 2.4Å; R176-E178 VanDerWaalsContact O-N 3.09Å; R176-V179 WeakPolarHBondContact O-CA 3.25Å; R176-V179 VanDerWaalsContact O-CB 3.24Å; R176-V179 WeakPolarHBondContact O-CB 3.3Å; R176-V179 PolarHBondContact O-N 3.46Å; R176-V203 WeakPolarHBondContact O-CG2 3.42Å
177	E	84.4	Confident	90.6	Very high	71 Å²	71	48.7 Å²	48.7	33%	0.332	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-51.7	-34.2	175.9	-176.6	64.4	-122.6	0	0	113	V179 K180 R267	E177-V179 PolarHBondContact O-N 2.73Å; E177-V179 VanDerWaalsContact O-N 3.14Å; E177-K180 WeakPolarHBondContact O-CB 3.39Å; E177-K180 PolarHBondContact O-N 2.91Å; E177-K180 WeakPolarHBondContact OE1-CD 3.11Å; E177-R267 IonicContact OE1-CZ 2.83Å; E177-R267 IonicContact OE1-NH1 2.62Å; E177-R267 PolarHBondContact OE1-NH1 2.98Å; E177-R267 IonicContact OE2-NH1 3.61Å; E177-R267 PolarHBondContact OE2-NH1 2.94Å
178	E	86.1	Confident	90.8	Very high	114 Å²	114	50.8 Å²	50.8	53%	0.533	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-57.8	-23.5	173.9	-63.3	157.5	-119.9	0	0	114.1	P157 R176 K180	P157-E178 HydrophobicContact CB-CB 4.39Å; P157-E178 WeakPolarHBondContact CG-O 3.03Å; R176-E178 PolarHBondContact O-N 2.4Å; R176-E178 VanDerWaalsContact O-N 3.09Å; E178-K180 VanDerWaalsContact C-N 3.3Å
179	V	87.7	Confident	91	Very high	9 Å²	9	45.7 Å²	45.7	6%	0.055	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-80.1	-11.4	177.4	-175.7	0	0	0	0	111.6	M160 I172 R176 E177 G181 Y183 V201 V203	M160-V179 HydrophobicContact CE-CG1 4.19Å; I172-V179 HydrophobicContact CD1-CG1 3.92Å; I172-V179 HydrophobicContact CG2-CG1 4.13Å; I172-V179 HydrophobicContact CG2-CG2 4.43Å; R176-V179 WeakPolarHBondContact O-CA 3.25Å; R176-V179 VanDerWaalsContact O-CB 3.24Å; R176-V179 WeakPolarHBondContact O-CB 3.3Å; R176-V179 PolarHBondContact O-N 3.46Å; E177-V179 PolarHBondContact O-N 2.73Å; E177-V179 VanDerWaalsContact O-N 3.14Å; V179-G181 PolarHBondContact O-N 2.98Å; V179-Y183 VanDerWaalsContact O-CE2 3.23Å; V179-Y183 WeakPolarHBondContact O-CE2 3.19Å; V179-Y183 PolarHBondContact O-OH 2.88Å; V179-V201 HydrophobicContact CG1-CG1 4.35Å; V179-V203 HydrophobicContact CB-CG2 4.45Å
180	K	89.6	Confident	90.7	Very high	90 Å²	90	49.3 Å²	49.3	39%	0.391	25%	0.252	S	S	.	.			trans	-61.9	117.8	177.1	-178.5	169.5	-174.2	145.4	0	110.9	E177 E178 V201 D202 V203	E177-K180 WeakPolarHBondContact O-CB 3.39Å; E177-K180 PolarHBondContact O-N 2.91Å; E177-K180 WeakPolarHBondContact OE1-CD 3.11Å; E178-K180 VanDerWaalsContact C-N 3.3Å; K180-V201 WeakPolarHBondContact CA-O 3.42Å; K180-D202 WeakPolarHBondContact CD-OD1 3.39Å; K180-D202 VanDerWaalsContact CE-CG 3.49Å; K180-D202 WeakPolarHBondContact CE-OD1 3.46Å; K180-D202 WeakPolarHBondContact CE-OD2 3.47Å; K180-D202 IonicContact NZ-OD1 3.63Å; K180-D202 PolarHBondContact NZ-OD1 3.46Å; K180-D202 IonicContact NZ-OD2 3.18Å; K180-D202 PolarHBondContact NZ-OD2 2.84Å; K180-V203 HydrophobicContact CB-CG2 4.42Å
181	G	90.5	Very high	90.1	Very high	30 Å²	30	52.8 Å²	52.8	31%	0.309	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	172.8	-179.8	-174.2	0	0	0	0	0	114.4	V179 V201	V179-G181 PolarHBondContact O-N 2.98Å; G181-V201 PolarHBondContact N-O 2.82Å; G181-V201 PolarHBondContact O-N 2.94Å
182	C	92.4	Very high	89.8	Confident	46 Å²	46	57.4 Å²	57.4	31%	0.311	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	130.3	173.9	-175.3	0	0	0	0	109.1	T150 C151 Y199	T150-C182 CarbonylContact C-O 3.54Å; T150-C182 WeakPolarHBondContact CA-O 3.48Å; C151-C182 HydrophobicContact CB-CB 3.57Å; C151-C182 WeakPolarHBondContact CB-SG 3.45Å; C151-C182 PolarHBondContact N-O 2.74Å; C151-C182 WeakPolarHBondContact SG-CB 3.07Å; C151-C182 PolarHBondContact SG-O 3.21Å; C151-C182 CovalentContact SG-SG 2.04Å; C151-C182 PolarHBondContact SG-SG 2.61Å; C182-Y199 CarbonylContact C-O 3.59Å; C182-Y199 VanDerWaalsContact CA-O 3.31Å; C182-Y199 WeakPolarHBondContact CA-O 3.45Å
183	Y	93.6	Very high	89.7	Confident	4 Å²	4	65 Å²	65	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	159.1	-177.7	-57.2	-87.5	0	0	0	113.1	I134 L148 E149 T150 C151 L156 M160 V179 S198 Y199 V201	I134-Y183 HydrophobicContact CD1-CD2 4.3Å; I134-Y183 HydrophobicContact CD1-CG 4.33Å; L148-Y183 HydrophobicContact CD1-CG 4.46Å; L148-Y183 HydrophobicContact CD2-CD1 3.69Å; L148-Y183 HydrophobicContact CD2-CE1 4.18Å; L148-Y183 HydrophobicContact CD2-CG 4.13Å; L148-Y183 HydrophobicContact CG-CD1 3.99Å; L148-Y183 HydrophobicContact CG-CG 4.36Å; E149-Y183 CarbonylContact O-C 3.59Å; E149-Y183 WeakPolarHBondContact O-CA 3.42Å; E149-Y183 WeakPolarHBondContact O-CB 3.33Å; T150-Y183 HydrophobicContact CG2-CD1 4.34Å; T150-Y183 HydrophobicContact CG2-CE1 4.19Å; C151-Y183 PolarHBondContact SG-N 2.84Å; L156-Y183 HydrophobicContact CD2-CD1 3.96Å; L156-Y183 HydrophobicContact CD2-CE1 3.77Å; M160-Y183 HydrophobicContact CE-CE1 4.12Å; M160-Y183 HydrophobicContact SD-CE1 4.46Å; V179-Y183 VanDerWaalsContact O-CE2 3.23Å; V179-Y183 WeakPolarHBondContact O-CE2 3.19Å; V179-Y183 PolarHBondContact O-OH 2.88Å; Y183-S198 CarbonylContact O-C 3.27Å; Y183-S198 WeakPolarHBondContact O-CA 3.32Å; Y183-Y199 PolarHBondContact N-O 3.03Å; Y183-Y199 PolarHBondContact O-N 2.98Å; Y183-V201 HydrophobicContact CD2-CB 4.36Å; Y183-V201 HydrophobicContact CD2-CG2 3.92Å; Y183-V201 HydrophobicContact CE2-CB 4.14Å; Y183-V201 HydrophobicContact CE2-CG2 4.12Å
184	R	93.3	Very high	89.7	Confident	92 Å²	92	60.6 Å²	60.6	35%	0.347	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.7	165	-61.1	-175	-171.8	100.8	6.1	108.8	E149 C151	E149-R184 PolarHBondContact N-O 2.73Å; E149-R184 PolarHBondContact O-N 2.9Å; C151-R184 PolarHBondContact O-NH1 2.98Å; C151-R184 PolarHBondContact O-NH2 2.9Å
185	C	93.6	Very high	89.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	144.8	167.3	-54.4	0	0	0	0	109.5	F116 C136 L146 S147 I170 T195 S196	F116-C185 HydrophobicContact CE1-CB 4.01Å; F116-C185 HydrophobicContact CZ-CB 4.26Å; C136-C185 HydrophobicContact CB-CB 3.5Å; C136-C185 VanDerWaalsContact CB-CB 3.5Å; C136-C185 WeakPolarHBondContact CB-SG 3.2Å; C136-C185 WeakPolarHBondContact SG-CB 3.42Å; C136-C185 CovalentContact SG-SG 2.02Å; C136-C185 PolarHBondContact SG-SG 2.9Å; L146-C185 HydrophobicContact CD1-CB 4.13Å; S147-C185 WeakPolarHBondContact O-CA 3.48Å; I170-C185 HydrophobicContact CG1-CB 4.34Å; I170-C185 VanDerWaalsContact CG1-SG 3.54Å; C185-T195 CarbonylContact O-C 3.59Å; C185-T195 WeakPolarHBondContact O-CA 3.25Å; C185-S196 PolarHBondContact N-OG 3.08Å; C185-S196 PolarHBondContact O-N 2.76Å
186	V	93	Very high	89.9	Confident	7 Å²	7	60.6 Å²	60.6	4%	0.042	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148	-174.5	-178.3	0	0	0	0	109	L146 S147 E149 R193 V194 T195	L146-V186 CarbonylContact C-O 3.6Å; L146-V186 WeakPolarHBondContact CA-O 3.43Å; S147-V186 PolarHBondContact N-O 3.06Å; S147-V186 PolarHBondContact O-N 2.87Å; E149-V186 HydrophobicContact CB-CG2 4.19Å; E149-V186 HydrophobicContact CG-CG2 3.83Å; E149-V186 WeakPolarHBondContact OE1-CG2 3.37Å; V186-R193 HydrophobicContact CG1-CG 3.83Å; V186-V194 CarbonylContact C-O 3.57Å; V186-V194 WeakPolarHBondContact CA-O 3.43Å; V186-T195 HydrophobicContact CG1-CG2 4.26Å; V186-T195 HydrophobicContact CG2-CG2 3.95Å
187	G	92.4	Very high	90	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	-178.8	176.7	0	0	0	0	0	111.9	R193 V194	G187-R193 WeakPolarHBondContact O-CA 3.31Å; G187-V194 PolarHBondContact N-O 3.14Å; G187-V194 WeakPolarHBondContact O-CG2 3.42Å; G187-V194 PolarHBondContact O-N 3.4Å
188	Q	92.1	Very high	90.4	Very high	92 Å²	92	56.4 Å²	56.4	43%	0.43	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	119.8	-178.9	-69.3	173.7	-20	0	0	110.4	V143 A144 N145 N192	V143-Q188 CarbonylContact C-O 3.57Å; V143-Q188 WeakPolarHBondContact CA-O 3.29Å; A144-Q188 PolarHBondContact N-O 3.15Å; A144-Q188 PolarHBondContact O-N 3.34Å; N145-Q188 PolarHBondContact ND2-OE1 3.43Å; Q188-N192 CarbonylContact C-O 3.57Å; Q188-N192 WeakPolarHBondContact CA-O 3.34Å
189	L	90.2	Very high	90.7	Very high	42 Å²	42	51 Å²	51	22%	0.22	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	115.1	179.5	-175.6	58.5	0	0	0	109.5	A115 D140 D142 V143 G191 N192 V194	A115-L189 HydrophobicContact CB-CD2 4.28Å; D140-L189 WeakPolarHBondContact OD2-CD1 3.48Å; D142-L189 HydrophobicContact CB-CD1 3.59Å; V143-L189 HydrophobicContact CG2-CB 4.19Å; V143-L189 HydrophobicContact CG2-CD1 4.04Å; V143-L189 HydrophobicContact CG2-CD2 4.43Å; V143-L189 HydrophobicContact CG2-CG 4.45Å; L189-G191 PolarHBondContact O-N 2.68Å; L189-N192 PolarHBondContact N-O 3.32Å; L189-N192 WeakPolarHBondContact O-CB 3.49Å; L189-N192 PolarHBondContact O-N 2.96Å; L189-V194 HydrophobicContact CB-CG1 4.07Å; L189-V194 HydrophobicContact CB-CG2 4.3Å
190	G	84.5	Confident	91	Very high	76 Å²	76	53.5 Å²	53.5	78%	0.784	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	33.8	-176.3	0	0	0	0	0	113.6	N192	G190-N192 VanDerWaalsContact C-N 3.25Å; G190-N192 PolarHBondContact O-N 2.84Å
191	G	81.4	Confident	91.1	Very high	74 Å²	74	49.4 Å²	49.4	76%	0.763	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-15.8	-173.9	0	0	0	0	0	115.4	L189	L189-G191 PolarHBondContact O-N 2.68Å
192	N	87.9	Confident	91.1	Very high	117 Å²	117	51 Å²	51	63%	0.626	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	139.2	178.4	-66.7	-65.8	0	0	0	111.7	Q188 L189 G190	Q188-N192 CarbonylContact C-O 3.57Å; Q188-N192 WeakPolarHBondContact CA-O 3.34Å; L189-N192 PolarHBondContact N-O 3.32Å; L189-N192 WeakPolarHBondContact O-CB 3.49Å; L189-N192 PolarHBondContact O-N 2.96Å; G190-N192 VanDerWaalsContact C-N 3.25Å; G190-N192 PolarHBondContact O-N 2.84Å
193	R	91.6	Very high	90.9	Very high	159 Å²	159	49 Å²	49	60%	0.6	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	125.9	176.9	-175.5	177.3	176.7	-137.7	6.5	110.4	E149 V186 G187	E149-R193 IonicContact OE1-CZ 2.71Å; E149-R193 IonicContact OE1-NE 3.95Å; E149-R193 IonicContact OE1-NH2 3.26Å; E149-R193 PolarHBondContact OE1-NH2 3.18Å; E149-R193 IonicContact OE2-CZ 3.01Å; E149-R193 IonicContact OE2-NH2 3.88Å; E149-R193 PolarHBondContact OE2-NH2 3.26Å; V186-R193 HydrophobicContact CG1-CG 3.83Å; G187-R193 WeakPolarHBondContact O-CA 3.31Å
194	V	92.1	Very high	90.5	Very high	30 Å²	30	52.3 Å²	52.3	18%	0.182	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	147.4	177.8	-66.9	0	0	0	0	110.6	A115 F116 V143 V186 G187 L189	A115-V194 HydrophobicContact CB-CB 3.84Å; A115-V194 HydrophobicContact CB-CG1 4.01Å; A115-V194 HydrophobicContact CB-CG2 3.78Å; F116-V194 HydrophobicContact CE2-CB 4.43Å; F116-V194 HydrophobicContact CE2-CG2 4.14Å; V143-V194 HydrophobicContact CG1-CG2 4.28Å; V143-V194 HydrophobicContact CG2-CG2 4.49Å; V186-V194 CarbonylContact C-O 3.57Å; V186-V194 WeakPolarHBondContact CA-O 3.43Å; G187-V194 PolarHBondContact N-O 3.14Å; G187-V194 WeakPolarHBondContact O-CG2 3.42Å; G187-V194 PolarHBondContact O-N 3.4Å; L189-V194 HydrophobicContact CB-CG1 4.07Å; L189-V194 HydrophobicContact CB-CG2 4.3Å
195	T	91.8	Very high	90	Very high	72 Å²	72	50 Å²	50	44%	0.442	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.3	-173.7	61.9	0	0	0	0	112.6	F116 C185 V186	F116-T195 VanDerWaalsContact CD2-C 3.42Å; F116-T195 VanDerWaalsContact CE2-C 3.49Å; C185-T195 CarbonylContact O-C 3.59Å; C185-T195 WeakPolarHBondContact O-CA 3.25Å; V186-T195 HydrophobicContact CG1-CG2 4.26Å; V186-T195 HydrophobicContact CG2-CG2 3.95Å
196	S	92.1	Very high	89.5	Confident	10 Å²	10	51.4 Å²	51.4	7%	0.07	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-82.9	173.9	175.6	75.9	0	0	0	0	113.3	C185	C185-S196 PolarHBondContact N-OG 3.08Å; C185-S196 PolarHBondContact O-N 2.76Å
197	V	90.4	Very high	89.1	Confident	68 Å²	68	51.4 Å²	51.4	41%	0.412	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-57.8	161	158.8	-62.1	0	0	0	0	111.3	T119 Y199	T119-V197 HydrophobicContact CG2-CG2 4.16Å; V197-Y199 HydrophobicContact CG2-CE2 3.84Å; V197-Y199 VanDerWaalsContact O-CD2 3.28Å; V197-Y199 WeakPolarHBondContact O-CD2 3.4Å; V197-Y199 WeakPolarHBondContact O-CE2 3.39Å
198	S	91.8	Very high	88.7	Confident	51 Å²	51	60 Å²	60	36%	0.357	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-78.1	136	175.2	46.8	0	0	0	0	112.6	S122 C151 Y183	S122-S198 WeakPolarHBondContact CB-O 3.19Å; C151-S198 VanDerWaalsContact SG-CB 3.53Å; Y183-S198 CarbonylContact O-C 3.27Å; Y183-S198 WeakPolarHBondContact O-CA 3.32Å
199	Y	93.5	Very high	88.3	Confident	1 Å²	1	62.1 Å²	62.1	0%	0.004	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.4	175.8	-64.6	-94.1	0	0	0	110.4	T119 S122 I124 I134 P135 C136 C182 Y183 V197	T119-Y199 HydrophobicContact CG2-CE1 3.76Å; S122-Y199 CarbonylContact O-C 3.59Å; S122-Y199 VanDerWaalsContact O-CA 3.27Å; S122-Y199 WeakPolarHBondContact O-CA 3.12Å; I124-Y199 HydrophobicContact CD1-CD1 4.03Å; I134-Y199 HydrophobicContact CG2-CD1 4Å; I134-Y199 HydrophobicContact CG2-CD2 3.56Å; I134-Y199 HydrophobicContact CG2-CE1 4.34Å; I134-Y199 HydrophobicContact CG2-CE2 3.95Å; I134-Y199 HydrophobicContact CG2-CG 3.59Å; P135-Y199 HydrophobicContact CG-CE1 3.92Å; P135-Y199 PolarHBondContact O-OH 2.89Å; C136-Y199 WeakPolarHBondContact CA-OH 3.31Å; C136-Y199 HydrophobicContact CB-CE2 3.94Å; C182-Y199 CarbonylContact C-O 3.59Å; C182-Y199 VanDerWaalsContact CA-O 3.31Å; C182-Y199 WeakPolarHBondContact CA-O 3.45Å; Y183-Y199 PolarHBondContact N-O 3.03Å; Y183-Y199 PolarHBondContact O-N 2.98Å; V197-Y199 HydrophobicContact CG2-CE2 3.84Å; V197-Y199 VanDerWaalsContact O-CD2 3.28Å; V197-Y199 WeakPolarHBondContact O-CD2 3.4Å; V197-Y199 WeakPolarHBondContact O-CE2 3.39Å
200	S	92.4	Very high	88.3	Confident	61 Å²	61	68 Å²	68	43%	0.427	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	109.7	176	-63.1	0	0	0	0	109.5	S122 S123 I124	S122-S200 PolarHBondContact O-N 3.1Å; S123-S200 WeakPolarHBondContact CA-O 3.09Å; I124-S200 PolarHBondContact N-O 3.21Å
201	V	92.4	Very high	88.6	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.024	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.9	174.5	-179.1	0	0	0	0	109	I124 V126 I134 V179 K180 G181 Y183 V203	I124-V201 HydrophobicContact CB-CG2 4.39Å; I124-V201 HydrophobicContact CD1-CG2 4.28Å; I124-V201 WeakPolarHBondContact O-CA 3.34Å; V126-V201 HydrophobicContact CG1-CG1 4.25Å; I134-V201 HydrophobicContact CD1-CG2 4.06Å; I134-V201 HydrophobicContact CG1-CG2 4.2Å; V179-V201 HydrophobicContact CG1-CG1 4.35Å; K180-V201 WeakPolarHBondContact CA-O 3.42Å; G181-V201 PolarHBondContact N-O 2.82Å; G181-V201 PolarHBondContact O-N 2.94Å; Y183-V201 HydrophobicContact CD2-CB 4.36Å; Y183-V201 HydrophobicContact CD2-CG2 3.92Å; Y183-V201 HydrophobicContact CE2-CB 4.14Å; Y183-V201 HydrophobicContact CE2-CG2 4.12Å; V201-V203 HydrophobicContact CG1-CG2 4.35Å
202	D	90.8	Very high	88.9	Confident	64 Å²	64	67.3 Å²	67.3	34%	0.342	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149.7	165.8	-155.1	-24.9	0	0	0	109.7	I124 L125 V126 K180	I124-D202 PolarHBondContact O-N 3.47Å; L125-D202 WeakPolarHBondContact CA-O 2.93Å; L125-D202 HydrophobicContact CD1-CB 4.06Å; V126-D202 PolarHBondContact N-O 3.44Å; K180-D202 WeakPolarHBondContact CD-OD1 3.39Å; K180-D202 VanDerWaalsContact CE-CG 3.49Å; K180-D202 WeakPolarHBondContact CE-OD1 3.46Å; K180-D202 WeakPolarHBondContact CE-OD2 3.47Å; K180-D202 IonicContact NZ-OD1 3.63Å; K180-D202 PolarHBondContact NZ-OD1 3.46Å; K180-D202 IonicContact NZ-OD2 3.18Å; K180-D202 PolarHBondContact NZ-OD2 2.84Å
203	V	88.3	Confident	89.2	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.4	-173.7	-174.8	0	0	0	0	109.4	V126 A128 R176 V179 K180 V201 P205	V126-V203 HydrophobicContact CG1-CB 4.48Å; V126-V203 HydrophobicContact CG1-CG1 4.45Å; V126-V203 HydrophobicContact CG1-CG2 3.91Å; V126-V203 CarbonylContact O-C 3.57Å; V126-V203 WeakPolarHBondContact O-CA 3.34Å; A128-V203 HydrophobicContact CB-CG1 4.07Å; R176-V203 WeakPolarHBondContact O-CG2 3.42Å; V179-V203 HydrophobicContact CB-CG2 4.45Å; K180-V203 HydrophobicContact CB-CG2 4.42Å; V201-V203 HydrophobicContact CG1-CG2 4.35Å; V203-P205 WeakPolarHBondContact O-CD 2.97Å
204	R	84.7	Confident	89.2	Confident	75 Å²	75	58.8 Å²	58.8	28%	0.283	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	119.2	178.2	-175.4	-170.6	-177.9	150.9	26.8	109.8	L125 V126 A128 E241	L125-R204 HydrophobicContact CD1-CB 4.21Å; V126-R204 PolarHBondContact O-N 3.16Å; A128-R204 WeakPolarHBondContact CB-O 3.28Å; A128-R204 PolarHBondContact N-O 3.1Å; R204-E241 VanDerWaalsContact CZ-CD 3.47Å; R204-E241 IonicContact CZ-OE1 2.67Å; R204-E241 IonicContact CZ-OE2 2.64Å; R204-E241 VanDerWaalsContact CZ-OE2 3.27Å; R204-E241 IonicContact NH1-OE1 2.71Å; R204-E241 PolarHBondContact NH1-OE1 3.35Å; R204-E241 IonicContact NH1-OE2 2.67Å; R204-E241 PolarHBondContact NH1-OE2 3.12Å; R204-E241 IonicContact NH2-OE1 3.78Å; R204-E241 PolarHBondContact NH2-OE1 3.37Å; R204-E241 IonicContact NH2-OE2 2.77Å; R204-E241 PolarHBondContact NH2-OE2 2.94Å
205	P	82.1	Confident	89.3	Confident	42 Å²	42	57.9 Å²	57.9	27%	0.273	30%	0.299	S	S	.	.			trans	-70.4	143.6	176.9	28.9	-34.7	0	0	0	112	V203 I238 N239	V203-P205 WeakPolarHBondContact O-CD 2.97Å; P205-I238 HydrophobicContact CB-CG1 3.85Å; P205-I238 HydrophobicContact CB-CG2 4.22Å; P205-I238 HydrophobicContact CG-CG1 4.31Å; P205-N239 PolarHBondContact O-ND2 3.42Å
206	V	84.5	Confident	89.2	Confident	31 Å²	31	57.4 Å²	57.4	19%	0.188	30%	0.299	C	S	.	.			trans	-111.7	133.4	179.4	177.1	0	0	0	0	107.9	R127 A128 E295	R127-V206 HydrophobicContact CG-CG2 3.45Å; R127-V206 VanDerWaalsContact CG-CG2 3.45Å; A128-V206 HydrophobicContact CB-CG2 4.19Å; V206-E295 WeakPolarHBondContact CG1-OE1 3.43Å
207	P	83.6	Confident	88.9	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.039	31%	0.313	C	S	.	.			trans	-64.3	136.9	176.4	-14.9	28.1	0	0	0	110.5	N237 I238 N294 E295 K296	P207-N237 WeakPolarHBondContact CB-OD1 3.35Å; P207-N237 WeakPolarHBondContact CG-OD1 3.49Å; P207-I238 HydrophobicContact CB-CG2 4.1Å; P207-I238 HydrophobicContact CG-CG2 3.97Å; P207-N294 WeakPolarHBondContact CB-ND2 3.44Å; P207-E295 HydrophobicContact CG-CG 4.04Å; P207-K296 HydrophobicContact CB-CG 4.32Å; P207-K296 WeakPolarHBondContact O-CE 3.29Å; P207-K296 WeakPolarHBondContact O-CG 3.31Å
208	E	83.5	Confident	88.4	Confident	181 Å²	181	65 Å²	65	85%	0.846	33%	0.326	S	S	*	.	S	Bend	trans	-91.5	-23.4	172	-63.9	-172.7	159.6	0	0	112.4
209	L	85.3	Confident	88	Confident	137 Å²	137	68.1 Å²	68.1	72%	0.717	34%	0.339	S	S	*	.	S	Bend	trans	-120.4	157.3	-175.7	-60.1	175.7	0	0	0	111.4	N294	L209-N294 PolarHBondContact O-ND2 3.16Å
210	R	89.4	Confident	87.7	Confident	167 Å²	167	71.4 Å²	71.4	63%	0.63	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-61.6	153.4	162	66.7	177.5	176.1	179.1	-1.9	110.1	H298	R210-H298 WeakPolarHBondContact CD-O 3.46Å
211	P	90.1	Very high	87.6	Confident	6 Å²	6	69 Å²	69	4%	0.039	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-69.9	157.3	-177.7	28.6	-31	0	0	0	111.5	A292 S299	P211-A292 HydrophobicContact CB-CB 4.04Å; P211-A292 HydrophobicContact CG-CB 3.62Å; P211-S299 VanDerWaalsContact O-CB 3.29Å; P211-S299 WeakPolarHBondContact O-CB 3.41Å; P211-S299 PolarHBondContact O-OG 3.42Å
212	E	89.4	Confident	87.6	Confident	129 Å²	129	69.7 Å²	69.7	60%	0.603	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	143.8	170.6	-170.9	177	175.6	0	0	110.4	I214 S235	E212-I214 HydrophobicContact CG-CG1 4.35Å; E212-S235 VanDerWaalsContact O-CA 3.31Å; E212-S235 WeakPolarHBondContact O-CA 3.43Å; E212-S235 WeakPolarHBondContact O-CB 3.14Å; E212-S235 PolarHBondContact O-OG 2.89Å
213	V	93.2	Very high	87.6	Confident	20 Å²	20	67.5 Å²	67.5	12%	0.121	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.6	178.8	-174.9	0	0	0	0	110.3	C290 A292 S299 A301	V213-C290 HydrophobicContact CG1-CB 4.02Å; V213-A292 HydrophobicContact CG2-CB 3.59Å; V213-S299 WeakPolarHBondContact CG2-OG 3.42Å; V213-A301 HydrophobicContact CB-CB 4Å; V213-A301 HydrophobicContact CG1-CB 3.64Å
214	I	92.7	Very high	87.7	Confident	77 Å²	77	69.5 Å²	69.5	40%	0.395	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	109.8	-178.2	-57.2	174.6	0	0	0	109.2	E212 N234	E212-I214 HydrophobicContact CG-CG1 4.35Å; I214-N234 HydrophobicContact CB-CB 4.44Å; I214-N234 PolarHBondContact N-O 3.36Å; I214-N234 PolarHBondContact O-N 2.85Å
215	L	92.8	Very high	88	Confident	11 Å²	11	68.6 Å²	68.6	6%	0.058	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	147.5	171.5	-61.7	-176.6	0	0	0	111.8	H217 T232 C233 W246 C290 A301 M303	L215-H217 VanDerWaalsContact CB-O 3.25Å; L215-H217 WeakPolarHBondContact CB-O 3.27Å; L215-H217 PolarHBondContact O-N 2.76Å; L215-T232 CarbonylContact C-O 3.59Å; L215-T232 WeakPolarHBondContact CA-O 3.44Å; L215-C233 HydrophobicContact CD2-CB 3.79Å; L215-W246 HydrophobicContact CD2-CH2 3.77Å; L215-W246 HydrophobicContact CD2-CZ3 4.13Å; L215-C290 HydrophobicContact CD2-CB 3.81Å; L215-A301 HydrophobicContact CD1-CB 4.05Å; L215-A301 HydrophobicContact CG-CB 3.91Å; L215-M303 HydrophobicContact CD1-CB 4.2Å; L215-M303 HydrophobicContact CD1-CG 4.13Å
216	S	90.2	Very high	88.4	Confident	62 Å²	62	69 Å²	69	43%	0.434	36%	0.356	S	S	.	.	S	Bend	trans	-65.1	-25.3	171	60.3	0	0	0	0	113.2	T232	S216-T232 PolarHBondContact N-O 2.88Å; S216-T232 PolarHBondContact OG-N 3.33Å
217	H	86.4	Confident	88.7	Confident	78 Å²	78	70.1 Å²	70.1	36%	0.361	36%	0.359	S	S	.	.			trans	-130.5	128.4	174.2	-60.5	-32.7	0	0	0	109.6	L215 V221 L231	L215-H217 VanDerWaalsContact CB-O 3.25Å; L215-H217 WeakPolarHBondContact CB-O 3.27Å; L215-H217 PolarHBondContact O-N 2.76Å; H217-V221 HydrophobicContact CB-CG2 4.06Å; H217-L231 HydrophobicContact CB-CD1 3.91Å
218	K	78.8	Confident	89.2	Confident	158 Å²	158	73 Å²	73	69%	0.687	38%	0.383	S	S	*	.			trans	-105.3	-28.7	178.8	-63.7	-172.3	177	-172.3	0	112.8
219	D	83.9	Confident	89.7	Confident	117 Å²	117	64.5 Å²	64.5	63%	0.626	34%	0.344	S	S	*	.	S	Bend	trans	-88.6	165.6	176.2	-52.4	-59.4	0	0	0	111.5	V221	D219-V221 PolarHBondContact O-N 2.83Å
220	T	87.6	Confident	90	Very high	71 Å²	71	62.6 Å²	62.6	44%	0.436	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-53.8	131.6	169	-54.5	0	0	0	0	111.1	Q304 D306	T220-Q304 CarbonylContact C-O 3.54Å; T220-Q304 VanDerWaalsContact CA-O 3.29Å; T220-Q304 WeakPolarHBondContact CA-O 3.41Å; T220-Q304 HydrophobicContact CG2-CB 4.05Å; T220-Q304 HydrophobicContact CG2-CG 3.95Å; T220-D306 HydrophobicContact CG2-CB 4.28Å
221	V	90.4	Very high	90.2	Very high	9 Å²	9	54.6 Å²	54.6	6%	0.055	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.5	169.1	177.1	0	0	0	0	108.4	H217 D219 L223 M303 Q304 L305 D306	H217-V221 HydrophobicContact CB-CG2 4.06Å; D219-V221 PolarHBondContact O-N 2.83Å; V221-L223 HydrophobicContact CG1-CD2 4.24Å; V221-L223 HydrophobicContact CG1-CG 4.06Å; V221-M303 HydrophobicContact CB-CE 3.67Å; V221-M303 HydrophobicContact CG2-CE 3.46Å; V221-M303 VanDerWaalsContact CG2-CE 3.46Å; V221-Q304 PolarHBondContact N-O 2.8Å; V221-L305 HydrophobicContact CB-CD1 4.44Å; V221-L305 HydrophobicContact CG1-CD1 4.36Å; V221-L305 WeakPolarHBondContact O-CA 3.38Å; V221-D306 PolarHBondContact O-N 2.91Å
222	I	90.9	Very high	90.4	Very high	19 Å²	19	55.9 Å²	55.9	10%	0.097	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	133.8	166.4	-52.5	175.9	0	0	0	108.1	D306 R308 F312 Y340 Y373	I222-D306 VanDerWaalsContact CA-O 3.32Å; I222-D306 WeakPolarHBondContact CA-O 3.32Å; I222-D306 HydrophobicContact CG1-CB 4.34Å; I222-R308 HydrophobicContact CG2-CG 4.45Å; I222-F312 HydrophobicContact CD1-CE1 4.16Å; I222-F312 HydrophobicContact CD1-CZ 4.04Å; I222-F312 HydrophobicContact CG2-CE1 4.26Å; I222-Y340 HydrophobicContact CB-CD1 4.45Å; I222-Y340 HydrophobicContact CB-CG 4.35Å; I222-Y340 HydrophobicContact CG2-CD1 3.71Å; I222-Y340 HydrophobicContact CG2-CE1 4.3Å; I222-Y340 HydrophobicContact CG2-CG 3.95Å; I222-Y373 HydrophobicContact CB-CE1 4.2Å; I222-Y373 HydrophobicContact CB-CE2 4.08Å; I222-Y373 HydrophobicContact CD1-CD2 3.87Å; I222-Y373 HydrophobicContact CD1-CE2 4.16Å; I222-Y373 HydrophobicContact CD1-CG 4.14Å; I222-Y373 HydrophobicContact CG1-CD2 4.12Å; I222-Y373 HydrophobicContact CG1-CE2 3.88Å; I222-Y373 PolarHBondContact N-OH 3.5Å; I222-Y373 PolarHBondContact O-OH 2.98Å
223	L	91.8	Very high	90.6	Very high	18 Å²	18	49.8 Å²	49.8	9%	0.094	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	167.2	169.9	-67.7	-177.8	0	0	0	110	V221 F229 V280 L305 D306 V307 R308	V221-L223 HydrophobicContact CG1-CD2 4.24Å; V221-L223 HydrophobicContact CG1-CG 4.06Å; L223-F229 HydrophobicContact CD1-CB 3.66Å; L223-F229 HydrophobicContact CD1-CD2 4.11Å; L223-F229 HydrophobicContact CD1-CG 4.28Å; L223-V280 HydrophobicContact CB-CG2 4.08Å; L223-V280 HydrophobicContact CD1-CG1 4.06Å; L223-V280 HydrophobicContact CD1-CG2 4.14Å; L223-L305 HydrophobicContact CD1-CD1 4.03Å; L223-L305 HydrophobicContact CG-CD1 4.19Å; L223-D306 PolarHBondContact N-O 3.34Å; L223-V307 WeakPolarHBondContact O-CA 3.39Å; L223-R308 PolarHBondContact O-N 2.87Å
224	K	91	Very high	90.5	Very high	46 Å²	46	51.4 Å²	51.4	20%	0.2	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	157.3	165.5	58.8	168	172.8	-175	0	112.9	G226 E227 V280 R308 Y340 P341 D400	K224-G226 PolarHBondContact O-N 3.3Å; K224-E227 WeakPolarHBondContact CE-OE1 3.28Å; K224-E227 HydrophobicContact CG-CG 3.96Å; K224-E227 WeakPolarHBondContact CG-OE1 3.26Å; K224-E227 VanDerWaalsContact CG-OE2 3.29Å; K224-E227 WeakPolarHBondContact CG-OE2 3.17Å; K224-E227 PolarHBondContact N-OE2 3.18Å; K224-E227 WeakPolarHBondContact O-CB 3.24Å; K224-E227 PolarHBondContact O-N 3.09Å; K224-V280 WeakPolarHBondContact O-CG2 3.17Å; K224-R308 CarbonylContact C-O 3.57Å; K224-R308 WeakPolarHBondContact CA-O 3.36Å; K224-R308 WeakPolarHBondContact CB-O 3.47Å; K224-Y340 HydrophobicContact CG-CE1 4.46Å; K224-P341 HydrophobicContact CD-CG 4.4Å; K224-D400 IonicContact NZ-OD1 3.66Å; K224-D400 PolarHBondContact NZ-OD1 3.29Å; K224-D400 IonicContact NZ-OD2 2.76Å; K224-D400 PolarHBondContact NZ-OD2 2.8Å
225	T	90.9	Very high	90.5	Very high	56 Å²	56	47.9 Å²	47.9	34%	0.344	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	131.7	-179.3	49.9	0	0	0	0	112.1	V280 V307 R308	T225-V280 CarbonylContact C-O 3.57Å; T225-V280 WeakPolarHBondContact CA-O 3.23Å; T225-V307 HydrophobicContact CG2-CG1 3.97Å; T225-R308 PolarHBondContact N-O 2.93Å
226	G	89.8	Confident	90.3	Very high	49 Å²	49	50.3 Å²	50.3	51%	0.505	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-7.5	-177.6	0	0	0	0	0	115.5	K224 V280	K224-G226 PolarHBondContact O-N 3.3Å; G226-V280 PolarHBondContact N-O 2.85Å
227	E	91.9	Very high	90.2	Very high	55 Å²	55	48 Å²	48	26%	0.257	27%	0.269	S	S	.	.			trans	-82.4	162.1	173.6	-69.4	175.6	154.3	0	0	112.5	K224 T279 V280 Y340	K224-E227 WeakPolarHBondContact CE-OE1 3.28Å; K224-E227 HydrophobicContact CG-CG 3.96Å; K224-E227 WeakPolarHBondContact CG-OE1 3.26Å; K224-E227 VanDerWaalsContact CG-OE2 3.29Å; K224-E227 WeakPolarHBondContact CG-OE2 3.17Å; K224-E227 PolarHBondContact N-OE2 3.18Å; K224-E227 WeakPolarHBondContact O-CB 3.24Å; K224-E227 PolarHBondContact O-N 3.09Å; E227-T279 CarbonylContact O-C 3.42Å; E227-T279 WeakPolarHBondContact O-CA 3.32Å; E227-V280 WeakPolarHBondContact O-CG2 3.21Å; E227-V280 PolarHBondContact O-N 2.93Å; E227-Y340 PolarHBondContact OE2-OH 3.37Å
228	A	93.3	Very high	90	Very high	66 Å²	66	47.7 Å²	47.7	55%	0.545	27%	0.269	S	S	.	.			trans	-88.3	137.2	176	0	0	0	0	0	111.7	I277	A228-I277 CarbonylContact C-O 3.5Å; A228-I277 WeakPolarHBondContact CA-O 3.32Å
229	F	93.6	Very high	90.2	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.1	171.5	176.7	-126.8	0	0	0	110.1	L223 L231 L275 S276 I277 V280 Y288 M303 L305	L223-F229 HydrophobicContact CD1-CB 3.66Å; L223-F229 HydrophobicContact CD1-CD2 4.11Å; L223-F229 HydrophobicContact CD1-CG 4.28Å; F229-L231 HydrophobicContact CE1-CB 4.26Å; F229-L231 HydrophobicContact CE2-CB 4.36Å; F229-L231 HydrophobicContact CZ-CB 3.85Å; F229-L231 HydrophobicContact CZ-CD2 4.22Å; F229-L231 HydrophobicContact CZ-CG 4.47Å; F229-L275 HydrophobicContact CD1-CD2 4.11Å; F229-L275 HydrophobicContact CE1-CD2 3.91Å; F229-S276 CarbonylContact O-C 3.45Å; F229-S276 VanDerWaalsContact O-CA 3.24Å; F229-S276 WeakPolarHBondContact O-CA 3.42Å; F229-I277 HydrophobicContact CB-CB 4.28Å; F229-I277 HydrophobicContact CD1-CD1 4.04Å; F229-I277 HydrophobicContact CD1-CG1 4.29Å; F229-I277 PolarHBondContact N-O 3.08Å; F229-I277 PolarHBondContact O-N 2.75Å; F229-V280 HydrophobicContact CB-CG1 3.59Å; F229-Y288 HydrophobicContact CE1-CD1 4.09Å; F229-Y288 HydrophobicContact CE1-CD2 4.27Å; F229-Y288 HydrophobicContact CE1-CE1 4.03Å; F229-Y288 HydrophobicContact CE1-CE2 4.22Å; F229-Y288 HydrophobicContact CE1-CG 4.21Å; F229-M303 HydrophobicContact CE2-CE 4.32Å; F229-M303 HydrophobicContact CE2-SD 4.48Å; F229-M303 HydrophobicContact CZ-CE 4.37Å; F229-M303 HydrophobicContact CZ-SD 3.95Å; F229-L305 HydrophobicContact CD1-CD2 3.89Å; F229-L305 HydrophobicContact CD2-CD1 3.88Å; F229-L305 HydrophobicContact CE1-CD2 4.05Å; F229-L305 HydrophobicContact CE2-CD1 3.98Å; F229-L305 HydrophobicContact CG-CD1 4.25Å; F229-L305 HydrophobicContact CG-CD2 4.14Å; F229-L305 HydrophobicContact CZ-CD1 4.4Å; F229-L305 HydrophobicContact CZ-CD2 4.45Å
230	E	92.9	Very high	90.1	Very high	96 Å²	96	37.4 Å²	37.4	45%	0.449	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	137.3	170.4	-58.1	-158.2	128.5	0	0	110.9	K274 L275	E230-K274 VanDerWaalsContact OE1-CE 3.23Å; E230-K274 WeakPolarHBondContact OE1-CE 3.25Å; E230-K274 IonicContact OE1-NZ 3.35Å; E230-K274 PolarHBondContact OE1-NZ 2.98Å; E230-K274 WeakPolarHBondContact OE2-CE 3.46Å; E230-K274 IonicContact OE2-NZ 2.74Å; E230-K274 PolarHBondContact OE2-NZ 2.79Å; E230-L275 CarbonylContact C-O 3.3Å; E230-L275 WeakPolarHBondContact CA-O 3.49Å
231	L	93.1	Very high	89.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	128.6	177.8	-172	69.6	0	0	0	109.5	H217 F229 W246 L275 M303	H217-L231 HydrophobicContact CB-CD1 3.91Å; F229-L231 HydrophobicContact CE1-CB 4.26Å; F229-L231 HydrophobicContact CE2-CB 4.36Å; F229-L231 HydrophobicContact CZ-CB 3.85Å; F229-L231 HydrophobicContact CZ-CD2 4.22Å; F229-L231 HydrophobicContact CZ-CG 4.47Å; L231-W246 HydrophobicContact CB-CH2 4.35Å; L231-W246 HydrophobicContact CD2-CH2 3.46Å; L231-W246 VanDerWaalsContact CD2-CH2 3.46Å; L231-W246 HydrophobicContact CD2-CZ3 3.54Å; L231-W246 HydrophobicContact CG-CH2 3.68Å; L231-W246 HydrophobicContact CG-CZ2 4.49Å; L231-W246 HydrophobicContact CG-CZ3 4.29Å; L231-L275 PolarHBondContact N-O 3.49Å; L231-L275 PolarHBondContact O-N 2.86Å; L231-M303 HydrophobicContact CD1-CG 3.85Å; L231-M303 HydrophobicContact CD1-SD 4.36Å; L231-M303 HydrophobicContact CD2-CG 3.7Å; L231-M303 HydrophobicContact CD2-SD 3.96Å; L231-M303 HydrophobicContact CG-CG 4.47Å
232	T	93.2	Very high	89.9	Confident	33 Å²	33	39.2 Å²	39.2	20%	0.202	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.3	178.3	-54.1	0	0	0	0	110	L215 S216 S272 T273	L215-T232 CarbonylContact C-O 3.59Å; L215-T232 WeakPolarHBondContact CA-O 3.44Å; S216-T232 PolarHBondContact N-O 2.88Å; S216-T232 PolarHBondContact OG-N 3.33Å; T232-S272 WeakPolarHBondContact CG2-OG 3.46Å; T232-T273 WeakPolarHBondContact CA-O 3.25Å
233	C	93.5	Very high	89.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.7	173.2	172.9	0	0	0	0	109.8	L215 W246 S272 T273 C290	L215-C233 HydrophobicContact CD2-CB 3.79Å; C233-W246 HydrophobicContact CB-CH2 3.6Å; C233-W246 HydrophobicContact CB-CZ2 3.41Å; C233-W246 VanDerWaalsContact CB-CZ2 3.41Å; C233-W246 HydrophobicContact CB-CZ3 4.49Å; C233-S272 CarbonylContact O-C 3.59Å; C233-S272 WeakPolarHBondContact O-CA 3.4Å; C233-T273 HydrophobicContact CB-CG2 4.03Å; C233-T273 PolarHBondContact N-O 3.36Å; C233-T273 PolarHBondContact O-N 3.44Å; C233-C290 HydrophobicContact CB-CB 3.53Å; C233-C290 WeakPolarHBondContact CB-SG 3.5Å; C233-C290 WeakPolarHBondContact SG-CB 3.37Å; C233-C290 CovalentContact SG-SG 2.02Å; C233-C290 PolarHBondContact SG-SG 2.75Å
234	N	92.8	Very high	89.9	Confident	55 Å²	55	40.2 Å²	40.2	29%	0.294	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.6	177.7	-67.3	-21.2	0	0	0	110.1	I214 L270 R271 S272	I214-N234 HydrophobicContact CB-CB 4.44Å; I214-N234 PolarHBondContact N-O 3.36Å; I214-N234 PolarHBondContact O-N 2.85Å; N234-L270 HydrophobicContact CB-CD1 4.29Å; N234-R271 WeakPolarHBondContact CA-O 3.46Å; N234-S272 WeakPolarHBondContact OD1-CB 3.27Å; N234-S272 PolarHBondContact OD1-OG 3.29Å
235	S	91.8	Very high	89.9	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	148.2	174.5	-175.3	0	0	0	0	111.4	E212 F242 R271	E212-S235 VanDerWaalsContact O-CA 3.31Å; E212-S235 WeakPolarHBondContact O-CA 3.43Å; E212-S235 WeakPolarHBondContact O-CB 3.14Å; E212-S235 PolarHBondContact O-OG 2.89Å; S235-F242 WeakPolarHBondContact O-CE2 3.47Å; S235-R271 PolarHBondContact N-O 2.92Å; S235-R271 PolarHBondContact O-N 3.17Å
236	T	89.3	Confident	90	Very high	62 Å²	62	40.1 Å²	40.1	38%	0.38	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	150.3	-176.5	51.5	0	0	0	0	112.2	L263 Y269 L270	T236-L263 HydrophobicContact CG2-CD1 4.11Å; T236-Y269 WeakPolarHBondContact CA-O 3.29Å; T236-L270 HydrophobicContact CG2-CB 4.39Å; T236-L270 HydrophobicContact CG2-CD1 3.82Å
237	N	86.5	Confident	90.2	Very high	14 Å²	14	40.8 Å²	40.8	8%	0.075	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	155.3	176.7	-171.9	55.4	0	0	0	110.3	P207 N239 F242 G268 Y269 N294	P207-N237 WeakPolarHBondContact CB-OD1 3.35Å; P207-N237 WeakPolarHBondContact CG-OD1 3.49Å; N237-N239 PolarHBondContact ND2-N 2.84Å; N237-N239 PolarHBondContact ND2-O 3.35Å; N237-N239 PolarHBondContact ND2-OD1 2.95Å; N237-N239 PolarHBondContact O-N 3.23Å; N237-F242 HydrophobicContact CB-CB 4.06Å; N237-F242 HydrophobicContact CB-CD1 3.45Å; N237-F242 VanDerWaalsContact CB-CD1 3.45Å; N237-F242 HydrophobicContact CB-CD2 3.83Å; N237-F242 HydrophobicContact CB-CE1 3.67Å; N237-F242 HydrophobicContact CB-CE2 4.01Å; N237-F242 HydrophobicContact CB-CG 3.53Å; N237-F242 HydrophobicContact CB-CZ 3.93Å; N237-G268 CarbonylContact O-C 3.6Å; N237-G268 WeakPolarHBondContact O-CA 3.42Å; N237-Y269 PolarHBondContact N-O 3.37Å; N237-Y269 VanDerWaalsContact N-O 3.08Å; N237-Y269 PolarHBondContact O-N 2.94Å; N237-N294 PolarHBondContact OD1-ND2 2.65Å
238	I	83.5	Confident	90.3	Very high	70 Å²	70	39.6 Å²	39.6	36%	0.359	23%	0.227	S	C	.	.	S	Bend	trans	-71.3	-16.5	-178.8	-159.5	67	0	0	0	113.3	P205 P207 R267	P205-I238 HydrophobicContact CB-CG1 3.85Å; P205-I238 HydrophobicContact CB-CG2 4.22Å; P205-I238 HydrophobicContact CG-CG1 4.31Å; P207-I238 HydrophobicContact CB-CG2 4.1Å; P207-I238 HydrophobicContact CG-CG2 3.97Å; I238-R267 VanDerWaalsContact O-O 3.11Å
239	N	82.6	Confident	90.2	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.043	21%	0.209	C	C	.	.	S	Bend	trans	-139	174.6	174.9	72.6	31.7	0	0	0	111.3	P205 N237 E241 F242 Y269	P205-N239 PolarHBondContact O-ND2 3.42Å; N237-N239 PolarHBondContact ND2-N 2.84Å; N237-N239 PolarHBondContact ND2-O 3.35Å; N237-N239 PolarHBondContact ND2-OD1 2.95Å; N237-N239 PolarHBondContact O-N 3.23Å; N239-E241 VanDerWaalsContact C-N 3.29Å; N239-E241 PolarHBondContact O-N 2.85Å; N239-E241 WeakPolarHBondContact OD1-CB 3.41Å; N239-E241 PolarHBondContact OD1-N 3Å; N239-F242 WeakPolarHBondContact O-CD1 3.43Å; N239-Y269 VanDerWaalsContact CA-CD2 3.48Å
240	S	82.2	Confident	89.8	Confident	51 Å²	51	44 Å²	44	36%	0.357	25%	0.254	S	S	.	.	S	Bend	trans	-74.9	-11.4	-176.5	51.1	0	0	0	0	115	F242 R271	S240-F242 VanDerWaalsContact C-N 3.31Å; S240-F242 PolarHBondContact O-N 2.87Å; S240-R271 PolarHBondContact O-NH2 2.79Å
241	E	83.5	Confident	89.4	Confident	109 Å²	109	41.9 Å²	41.9	51%	0.509	25%	0.253	S	S	.	.			trans	-83.8	71.6	-178.6	-81.2	168.7	-162.2	0	0	111.6	R204 N239	R204-E241 VanDerWaalsContact CZ-CD 3.47Å; R204-E241 IonicContact CZ-OE1 2.67Å; R204-E241 IonicContact CZ-OE2 2.64Å; R204-E241 VanDerWaalsContact CZ-OE2 3.27Å; R204-E241 IonicContact NH1-OE1 2.71Å; R204-E241 PolarHBondContact NH1-OE1 3.35Å; R204-E241 IonicContact NH1-OE2 2.67Å; R204-E241 PolarHBondContact NH1-OE2 3.12Å; R204-E241 IonicContact NH2-OE1 3.78Å; R204-E241 PolarHBondContact NH2-OE1 3.37Å; R204-E241 IonicContact NH2-OE2 2.77Å; R204-E241 PolarHBondContact NH2-OE2 2.94Å; N239-E241 VanDerWaalsContact C-N 3.29Å; N239-E241 PolarHBondContact O-N 2.85Å; N239-E241 WeakPolarHBondContact OD1-CB 3.41Å; N239-E241 PolarHBondContact OD1-N 3Å
242	F	89.6	Confident	89.1	Confident	10 Å²	10	42.3 Å²	42.3	4%	0.044	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	153.4	166.8	74.2	-62.1	0	0	0	109.8	S235 N237 N239 S240 L244 Y269 R271 H293 N294	S235-F242 WeakPolarHBondContact O-CE2 3.47Å; N237-F242 HydrophobicContact CB-CB 4.06Å; N237-F242 HydrophobicContact CB-CD1 3.45Å; N237-F242 VanDerWaalsContact CB-CD1 3.45Å; N237-F242 HydrophobicContact CB-CD2 3.83Å; N237-F242 HydrophobicContact CB-CE1 3.67Å; N237-F242 HydrophobicContact CB-CE2 4.01Å; N237-F242 HydrophobicContact CB-CG 3.53Å; N237-F242 HydrophobicContact CB-CZ 3.93Å; N239-F242 WeakPolarHBondContact O-CD1 3.43Å; S240-F242 VanDerWaalsContact C-N 3.31Å; S240-F242 PolarHBondContact O-N 2.87Å; F242-L244 HydrophobicContact CD2-CD1 3.76Å; F242-L244 HydrophobicContact CE2-CD1 3.64Å; F242-Y269 WeakPolarHBondContact CZ-O 3.44Å; F242-R271 HydrophobicContact CE1-CB 4.47Å; F242-R271 HydrophobicContact CE1-CG 3.76Å; F242-R271 HydrophobicContact CE2-CB 3.94Å; F242-R271 HydrophobicContact CE2-CG 4.08Å; F242-R271 HydrophobicContact CZ-CB 3.7Å; F242-R271 HydrophobicContact CZ-CG 3.49Å; F242-R271 VanDerWaalsContact CZ-CG 3.49Å; F242-R271 WeakPolarHBondContact O-CD 3.39Å; F242-R271 PolarHBondContact O-NE 3Å; F242-R271 PolarHBondContact O-NH2 2.99Å; F242-H293 CarbonylContact C-O 3.51Å; F242-H293 WeakPolarHBondContact CA-O 3.48Å; F242-H293 VanDerWaalsContact CB-O 3.27Å; F242-H293 WeakPolarHBondContact CB-O 3.22Å; F242-N294 HydrophobicContact CB-CB 3.91Å
243	S	89.4	Confident	88.7	Confident	51 Å²	51	47.6 Å²	47.6	36%	0.357	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.5	-178.8	57.3	0	0	0	0	111.4	A292 H293	S243-A292 VanDerWaalsContact O-CA 3.3Å; S243-A292 WeakPolarHBondContact O-CA 3.24Å; S243-H293 PolarHBondContact N-O 3.28Å; S243-H293 PolarHBondContact O-N 3.1Å
244	L	92.8	Very high	88.5	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.037	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139.8	166.9	-75	62.5	0	0	0	108	F242 R271 T273 H291 A292	F242-L244 HydrophobicContact CD2-CD1 3.76Å; F242-L244 HydrophobicContact CE2-CD1 3.64Å; L244-R271 HydrophobicContact CD1-CB 3.53Å; L244-R271 HydrophobicContact CD1-CG 4.31Å; L244-R271 HydrophobicContact CD2-CB 3.99Å; L244-R271 WeakPolarHBondContact CD2-O 3.32Å; L244-R271 HydrophobicContact CG-CB 4.37Å; L244-T273 HydrophobicContact CB-CG2 3.98Å; L244-T273 HydrophobicContact CD2-CG2 4.06Å; L244-H291 CarbonylContact C-O 3.54Å; L244-H291 VanDerWaalsContact CA-O 3.29Å; L244-H291 WeakPolarHBondContact CA-O 3.49Å; L244-A292 HydrophobicContact CG-CB 4.43Å
245	T	92	Very high	88.4	Confident	76 Å²	76	50.9 Å²	50.9	47%	0.466	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	150.3	178.5	53.8	0	0	0	0	111.5	C290 H291	T245-C290 WeakPolarHBondContact O-CA 3.49Å; T245-H291 PolarHBondContact N-O 2.81Å; T245-H291 PolarHBondContact O-N 2.72Å
246	W	93.2	Very high	88.2	Confident	23 Å²	23	55.4 Å²	55.4	9%	0.087	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	109.2	-179.7	-78.8	114.2	0	0	0	111.8	L215 L231 C233 V248 K256 T273 L275 C290	L215-W246 HydrophobicContact CD2-CH2 3.77Å; L215-W246 HydrophobicContact CD2-CZ3 4.13Å; L231-W246 HydrophobicContact CB-CH2 4.35Å; L231-W246 HydrophobicContact CD2-CH2 3.46Å; L231-W246 VanDerWaalsContact CD2-CH2 3.46Å; L231-W246 HydrophobicContact CD2-CZ3 3.54Å; L231-W246 HydrophobicContact CG-CH2 3.68Å; L231-W246 HydrophobicContact CG-CZ2 4.49Å; L231-W246 HydrophobicContact CG-CZ3 4.29Å; C233-W246 HydrophobicContact CB-CH2 3.6Å; C233-W246 HydrophobicContact CB-CZ2 3.41Å; C233-W246 VanDerWaalsContact CB-CZ2 3.41Å; C233-W246 HydrophobicContact CB-CZ3 4.49Å; W246-V248 HydrophobicContact CB-CG1 4.12Å; W246-K256 HydrophobicContact CB-CD 3.98Å; W246-K256 HydrophobicContact CG-CD 4.41Å; W246-K256 PolarHBondContact O-NZ 3.26Å; W246-T273 HydrophobicContact CZ2-CG2 4.41Å; W246-T273 VanDerWaalsContact NE1-CG2 3.28Å; W246-T273 PolarHBondContact NE1-OG1 3.47Å; W246-L275 HydrophobicContact CB-CD1 4.29Å; W246-L275 HydrophobicContact CD2-CB 4.3Å; W246-L275 HydrophobicContact CD2-CD1 3.69Å; W246-L275 HydrophobicContact CE3-CD1 3.9Å; W246-L275 HydrophobicContact CG-CD1 3.9Å; W246-L275 HydrophobicContact CZ2-CB 4.03Å; W246-L275 HydrophobicContact CZ3-CD1 4.49Å; W246-C290 HydrophobicContact CD2-CB 4.48Å; W246-C290 HydrophobicContact CE3-CB 3.96Å; W246-C290 HydrophobicContact CH2-CB 4.02Å; W246-C290 HydrophobicContact CZ3-CB 3.7Å
247	D	93.6	Very high	88.1	Confident	64 Å²	64	55.3 Å²	55.3	34%	0.342	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	131.1	160.8	170	39	0	0	0	109	R289 H291	D247-R289 HydrophobicContact CB-CB 4.05Å; D247-R289 PolarHBondContact N-O 3.02Å; D247-R289 PolarHBondContact O-N 3.08Å; D247-R289 VanDerWaalsContact O-O 3.1Å; D247-R289 IonicContact OD2-CZ 3.75Å; D247-R289 IonicContact OD2-NH1 3.74Å; D247-R289 PolarHBondContact OD2-NH1 2.72Å; D247-H291 WeakPolarHBondContact CB-NE2 3.46Å; D247-H291 IonicContact OD2-NE2 3.9Å
248	V	93.1	Very high	87.9	Confident	30 Å²	30	59.3 Å²	59.3	18%	0.182	34%	0.344	C	S	.	.			trans	-147.6	156.3	-167.7	-57	0	0	0	0	110.6	W246 S250 P254 L275 Y288	W246-V248 HydrophobicContact CB-CG1 4.12Å; V248-S250 PolarHBondContact O-N 3.39Å; V248-P254 HydrophobicContact CG1-CG 4.4Å; V248-L275 HydrophobicContact CG1-CD1 3.72Å; V248-Y288 HydrophobicContact CB-CD1 4.21Å; V248-Y288 HydrophobicContact CB-CE1 4.18Å; V248-Y288 HydrophobicContact CG1-CD1 3.84Å; V248-Y288 HydrophobicContact CG1-CE1 4.1Å
249	P	91.3	Very high	87.6	Confident	25 Å²	25	60.5 Å²	60.5	16%	0.162	35%	0.351	C	S	.	.			trans	-57.7	136.8	176.8	-23.2	35.1	0	0	0	111.6	A251 A252 I287 Y288	P249-A251 PolarHBondContact O-N 3.11Å; P249-A252 HydrophobicContact CB-CB 4.24Å; P249-A252 WeakPolarHBondContact O-CB 3.4Å; P249-A252 PolarHBondContact O-N 2.88Å; P249-I287 WeakPolarHBondContact CD-O 3.47Å; P249-Y288 HydrophobicContact CG-CD2 4.37Å; P249-Y288 HydrophobicContact CG-CE2 3.89Å
250	S	85.7	Confident	87.2	Confident	137 Å²	137	63.9 Å²	63.9	96%	0.958	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.3	-171.1	-46.2	0	0	0	0	115.4	V248	V248-S250 PolarHBondContact O-N 3.39Å
251	A	85	Confident	86.8	Confident	52 Å²	52	66.6 Å²	66.6	43%	0.43	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-14.9	173.5	0	0	0	0	0	113.5	P249 N253 L283	P249-A251 PolarHBondContact O-N 3.11Å; A251-N253 PolarHBondContact O-ND2 3.05Å; A251-L283 HydrophobicContact CB-CB 4.18Å
252	A	85.6	Confident	86	Confident	9 Å²	9	67.1 Å²	67.1	7%	0.074	39%	0.387	C	S	.	.			trans	-84.4	134.9	-176.2	0	0	0	0	0	111.7	P249 P254 D284 Y288	P249-A252 HydrophobicContact CB-CB 4.24Å; P249-A252 WeakPolarHBondContact O-CB 3.4Å; P249-A252 PolarHBondContact O-N 2.88Å; A252-P254 VanDerWaalsContact O-CD 3.24Å; A252-P254 WeakPolarHBondContact O-CD 3.25Å; A252-D284 WeakPolarHBondContact CA-OD1 3.41Å; A252-D284 HydrophobicContact CB-CB 4.44Å; A252-D284 WeakPolarHBondContact CB-OD1 3.44Å; A252-Y288 VanDerWaalsContact CB-OH 3.28Å; A252-Y288 WeakPolarHBondContact CB-OH 3.31Å
253	N	85.9	Confident	84.9	Confident	144 Å²	144	69 Å²	69	77%	0.77	40%	0.397	S	S	*	.			trans	-120	65.2	-178.4	-74.8	-79.8	0	0	0	112.8	A251	A251-N253 PolarHBondContact O-ND2 3.05Å
254	P	88.4	Confident	83.1	Confident	20 Å²	20	73 Å²	73	13%	0.13	42%	0.422	C	S	.	.			trans	-79.5	146.2	-177.1	33.4	-36.7	0	0	0	113.3	V248 A252 K256 L275 I277	V248-P254 HydrophobicContact CG1-CG 4.4Å; A252-P254 VanDerWaalsContact O-CD 3.24Å; A252-P254 WeakPolarHBondContact O-CD 3.25Å; P254-K256 PolarHBondContact O-N 3.25Å; P254-L275 HydrophobicContact CB-CD1 4.32Å; P254-L275 HydrophobicContact CB-CD2 3.49Å; P254-L275 VanDerWaalsContact CB-CD2 3.49Å; P254-L275 HydrophobicContact CB-CG 3.67Å; P254-L275 HydrophobicContact CG-CD1 4.03Å; P254-L275 HydrophobicContact CG-CD2 4.05Å; P254-L275 HydrophobicContact CG-CG 3.92Å; P254-I277 HydrophobicContact CB-CD1 4.23Å; P254-I277 HydrophobicContact CB-CG1 3.68Å
255	V	90.4	Very high	81.1	Confident	103 Å²	103	78.2 Å²	78.2	62%	0.624	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.9	165.9	-179.2	0	0	0	0	108.5	L275 S276	V255-L275 CarbonylContact O-C 3.58Å; V255-L275 WeakPolarHBondContact O-CA 3.45Å; V255-S276 PolarHBondContact N-O 2.94Å; V255-S276 PolarHBondContact O-N 3.35Å
256	K	88.8	Confident	79.3	Confident	99 Å²	99	78 Å²	78	43%	0.43	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.2	179.1	-64.6	175.4	-176	-179.2	0	109.4	W246 P254 K274	W246-K256 HydrophobicContact CB-CD 3.98Å; W246-K256 HydrophobicContact CG-CD 4.41Å; W246-K256 PolarHBondContact O-NZ 3.26Å; P254-K256 PolarHBondContact O-N 3.25Å; K256-K274 WeakPolarHBondContact CA-O 3.31Å
257	S	86.9	Confident	77.8	Confident	59 Å²	59	84.3 Å²	84.3	41%	0.413	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	158	171.9	68.5	0	0	0	0	110.9	T273 K274	S257-T273 CarbonylContact O-C 3.56Å; S257-T273 WeakPolarHBondContact O-CA 3.28Å; S257-T273 WeakPolarHBondContact O-CB 3.36Å; S257-T273 PolarHBondContact O-OG1 3.2Å; S257-K274 PolarHBondContact N-O 3.06Å; S257-K274 PolarHBondContact O-N 2.82Å
258	Q	81.9	Confident	76.8	Confident	98 Å²	98	81.6 Å²	81.6	46%	0.458	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	137.5	-177.7	-171.3	-178.3	-84.8	0	0	110.6	S272	Q258-S272 CarbonylContact C-O 3.59Å; Q258-S272 WeakPolarHBondContact CA-O 3.43Å; Q258-S272 WeakPolarHBondContact CG-O 3.44Å
259	I	78.8	Confident	76.3	Confident	96 Å²	96	84.1 Å²	84.1	49%	0.492	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.3	179.3	-45.2	178.8	0	0	0	108.1	H261 S272	I259-H261 VanDerWaalsContact CG2-NE2 3.3Å; I259-H261 WeakPolarHBondContact CG2-NE2 3.15Å; I259-S272 PolarHBondContact N-O 3.08Å; I259-S272 PolarHBondContact O-N 3.07Å; I259-S272 VanDerWaalsContact O-O 3.07Å
260	S	73.3	Confident	76.1	Confident	79 Å²	79	84.9 Å²	84.9	55%	0.552	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.4	178.4	55.9	0	0	0	0	110.6	L270	S260-L270 WeakPolarHBondContact CA-O 3.35Å
261	H	73.7	Confident	76.3	Confident	107 Å²	107	81 Å²	81	50%	0.495	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	149.4	-179.5	-63	-64.9	0	0	0	111.1	I259 L270	I259-H261 VanDerWaalsContact CG2-NE2 3.3Å; I259-H261 WeakPolarHBondContact CG2-NE2 3.15Å; H261-L270 PolarHBondContact N-O 3.48Å; H261-L270 PolarHBondContact O-N 3.03Å
262	I	66.4	Low	76.6	Confident	120 Å²	120	79.6 Å²	79.6	62%	0.615	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	131.2	168	-56	174.8	0	0	0	107	Y269	I262-Y269 HydrophobicContact CD1-CE1 4.38Å; I262-Y269 HydrophobicContact CG1-CD1 4.19Å; I262-Y269 HydrophobicContact CG1-CE1 3.9Å
263	L	67.2	Low	76.9	Confident	49 Å²	49	79.5 Å²	79.5	26%	0.257	43%	0.43	S	S	.	.			trans	-77.1	126.8	177.5	-67.7	169.2	0	0	0	109.5	T236 S265 G268 L270	T236-L263 HydrophobicContact CG2-CD1 4.11Å; L263-S265 PolarHBondContact O-N 3.31Å; L263-G268 WeakPolarHBondContact CB-O 3.33Å; L263-G268 PolarHBondContact N-O 3.01Å; L263-L270 HydrophobicContact CD1-CB 4.41Å; L263-L270 HydrophobicContact CD2-CB 4Å; L263-L270 HydrophobicContact CD2-CD2 4.31Å; L263-L270 HydrophobicContact CG-CB 4.1Å
264	P	51.3	Low	77.2	Confident	135 Å²	135	76 Å²	76	88%	0.877	41%	0.408	S	S	*	.	S	Bend	trans	-72	-28.8	-175.2	-22.7	34.6	0	0	0	115
265	S	50.9	Low	77.4	Confident	117 Å²	117	75 Å²	75	82%	0.818	40%	0.402	S	S	*	.	S	Bend	trans	-98.2	-14	-168.1	51.6	0	0	0	0	114.9	L263	L263-S265 PolarHBondContact O-N 3.31Å
266	S	53.3	Low	77.5	Confident	71 Å²	71	71.5 Å²	71.5	50%	0.497	38%	0.382	S	S	.	.	S	Bend	trans	-146.9	145.7	172.5	57.7	0	0	0	0	107.9	G268	S266-G268 PolarHBondContact O-N 3.46Å
267	R	62.5	Low	77.7	Confident	157 Å²	157	67.5 Å²	67.5	59%	0.592	37%	0.365	S	S	*	.	S	Bend	trans	-76.1	58.6	-172.2	-60.3	-178.5	-173.8	175.2	2.8	112.5	E177 I238	E177-R267 IonicContact OE1-CZ 2.83Å; E177-R267 IonicContact OE1-NH1 2.62Å; E177-R267 PolarHBondContact OE1-NH1 2.98Å; E177-R267 IonicContact OE2-NH1 3.61Å; E177-R267 PolarHBondContact OE2-NH1 2.94Å; I238-R267 VanDerWaalsContact O-O 3.11Å
268	G	72.4	Confident	77.9	Confident	7 Å²	7	68.7 Å²	68.7	7%	0.072	38%	0.379	C	S	.	.			trans	-125.2	162.5	-179.9	0	0	0	0	0	112.1	N237 L263 S266	N237-G268 CarbonylContact O-C 3.6Å; N237-G268 WeakPolarHBondContact O-CA 3.42Å; L263-G268 WeakPolarHBondContact CB-O 3.33Å; L263-G268 PolarHBondContact N-O 3.01Å; S266-G268 PolarHBondContact O-N 3.46Å
269	Y	82.8	Confident	78.4	Confident	82 Å²	82	68.4 Å²	68.4	32%	0.322	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.8	179.7	-68.5	-100.9	0	0	0	108.8	T236 N237 N239 F242 I262	T236-Y269 WeakPolarHBondContact CA-O 3.29Å; N237-Y269 PolarHBondContact N-O 3.37Å; N237-Y269 VanDerWaalsContact N-O 3.08Å; N237-Y269 PolarHBondContact O-N 2.94Å; N239-Y269 VanDerWaalsContact CA-CD2 3.48Å; F242-Y269 WeakPolarHBondContact CZ-O 3.44Å; I262-Y269 HydrophobicContact CD1-CE1 4.38Å; I262-Y269 HydrophobicContact CG1-CD1 4.19Å; I262-Y269 HydrophobicContact CG1-CE1 3.9Å
270	L	87.4	Confident	79.1	Confident	41 Å²	41	63.9 Å²	63.9	22%	0.215	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125.7	170.6	173	64.1	0	0	0	108.3	N234 T236 S260 H261 L263	N234-L270 HydrophobicContact CB-CD1 4.29Å; T236-L270 HydrophobicContact CG2-CB 4.39Å; T236-L270 HydrophobicContact CG2-CD1 3.82Å; S260-L270 WeakPolarHBondContact CA-O 3.35Å; H261-L270 PolarHBondContact N-O 3.48Å; H261-L270 PolarHBondContact O-N 3.03Å; L263-L270 HydrophobicContact CD1-CB 4.41Å; L263-L270 HydrophobicContact CD2-CB 4Å; L263-L270 HydrophobicContact CD2-CD2 4.31Å; L263-L270 HydrophobicContact CG-CB 4.1Å
271	R	89.5	Confident	80	Confident	56 Å²	56	63.6 Å²	63.6	21%	0.211	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.2	164.8	-74.4	176.6	-174.4	-105.8	10.4	108.3	N234 S235 S240 F242 L244	N234-R271 WeakPolarHBondContact CA-O 3.46Å; S235-R271 PolarHBondContact N-O 2.92Å; S235-R271 PolarHBondContact O-N 3.17Å; S240-R271 PolarHBondContact O-NH2 2.79Å; F242-R271 HydrophobicContact CE1-CB 4.47Å; F242-R271 HydrophobicContact CE1-CG 3.76Å; F242-R271 HydrophobicContact CE2-CB 3.94Å; F242-R271 HydrophobicContact CE2-CG 4.08Å; F242-R271 HydrophobicContact CZ-CB 3.7Å; F242-R271 HydrophobicContact CZ-CG 3.49Å; F242-R271 VanDerWaalsContact CZ-CG 3.49Å; F242-R271 WeakPolarHBondContact O-CD 3.39Å; F242-R271 PolarHBondContact O-NE 3Å; F242-R271 PolarHBondContact O-NH2 2.99Å; L244-R271 HydrophobicContact CD1-CB 3.53Å; L244-R271 HydrophobicContact CD1-CG 4.31Å; L244-R271 HydrophobicContact CD2-CB 3.99Å; L244-R271 WeakPolarHBondContact CD2-O 3.32Å; L244-R271 HydrophobicContact CG-CB 4.37Å
272	S	91	Very high	80.8	Confident	23 Å²	23	63.6 Å²	63.6	16%	0.161	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.4	173.6	-173.5	0	0	0	0	108.3	T232 C233 N234 Q258 I259	T232-S272 WeakPolarHBondContact CG2-OG 3.46Å; C233-S272 CarbonylContact O-C 3.59Å; C233-S272 WeakPolarHBondContact O-CA 3.4Å; N234-S272 WeakPolarHBondContact OD1-CB 3.27Å; N234-S272 PolarHBondContact OD1-OG 3.29Å; Q258-S272 CarbonylContact C-O 3.59Å; Q258-S272 WeakPolarHBondContact CA-O 3.43Å; Q258-S272 WeakPolarHBondContact CG-O 3.44Å; I259-S272 PolarHBondContact N-O 3.08Å; I259-S272 PolarHBondContact O-N 3.07Å; I259-S272 VanDerWaalsContact O-O 3.07Å
273	T	91.6	Very high	82	Confident	6 Å²	6	63.9 Å²	63.9	4%	0.037	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	131	167	173.7	0	0	0	0	110.2	T232 C233 L244 W246 S257	T232-T273 WeakPolarHBondContact CA-O 3.25Å; C233-T273 HydrophobicContact CB-CG2 4.03Å; C233-T273 PolarHBondContact N-O 3.36Å; C233-T273 PolarHBondContact O-N 3.44Å; L244-T273 HydrophobicContact CB-CG2 3.98Å; L244-T273 HydrophobicContact CD2-CG2 4.06Å; W246-T273 HydrophobicContact CZ2-CG2 4.41Å; W246-T273 VanDerWaalsContact NE1-CG2 3.28Å; W246-T273 PolarHBondContact NE1-OG1 3.47Å; S257-T273 CarbonylContact O-C 3.56Å; S257-T273 WeakPolarHBondContact O-CA 3.28Å; S257-T273 WeakPolarHBondContact O-CB 3.36Å; S257-T273 PolarHBondContact O-OG1 3.2Å
274	K	91.8	Very high	83.2	Confident	70 Å²	70	62 Å²	62	30%	0.304	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137	177.3	-168.7	-176.7	-168.4	-167.8	0	109.1	E230 K256 S257	E230-K274 VanDerWaalsContact OE1-CE 3.23Å; E230-K274 WeakPolarHBondContact OE1-CE 3.25Å; E230-K274 IonicContact OE1-NZ 3.35Å; E230-K274 PolarHBondContact OE1-NZ 2.98Å; E230-K274 WeakPolarHBondContact OE2-CE 3.46Å; E230-K274 IonicContact OE2-NZ 2.74Å; E230-K274 PolarHBondContact OE2-NZ 2.79Å; K256-K274 WeakPolarHBondContact CA-O 3.31Å; S257-K274 PolarHBondContact N-O 3.06Å; S257-K274 PolarHBondContact O-N 2.82Å
275	L	93.2	Very high	85.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.8	174.8	-176.8	159.6	0	0	0	107	F229 E230 L231 W246 V248 P254 V255 Y288	F229-L275 HydrophobicContact CD1-CD2 4.11Å; F229-L275 HydrophobicContact CE1-CD2 3.91Å; E230-L275 CarbonylContact C-O 3.3Å; E230-L275 WeakPolarHBondContact CA-O 3.49Å; L231-L275 PolarHBondContact N-O 3.49Å; L231-L275 PolarHBondContact O-N 2.86Å; W246-L275 HydrophobicContact CB-CD1 4.29Å; W246-L275 HydrophobicContact CD2-CB 4.3Å; W246-L275 HydrophobicContact CD2-CD1 3.69Å; W246-L275 HydrophobicContact CE3-CD1 3.9Å; W246-L275 HydrophobicContact CG-CD1 3.9Å; W246-L275 HydrophobicContact CZ2-CB 4.03Å; W246-L275 HydrophobicContact CZ3-CD1 4.49Å; V248-L275 HydrophobicContact CG1-CD1 3.72Å; P254-L275 HydrophobicContact CB-CD1 4.32Å; P254-L275 HydrophobicContact CB-CD2 3.49Å; P254-L275 VanDerWaalsContact CB-CD2 3.49Å; P254-L275 HydrophobicContact CB-CG 3.67Å; P254-L275 HydrophobicContact CG-CD1 4.03Å; P254-L275 HydrophobicContact CG-CD2 4.05Å; P254-L275 HydrophobicContact CG-CG 3.92Å; V255-L275 CarbonylContact O-C 3.58Å; V255-L275 WeakPolarHBondContact O-CA 3.45Å; L275-Y288 HydrophobicContact CD1-CD1 3.72Å; L275-Y288 HydrophobicContact CD1-CE1 4.13Å; L275-Y288 HydrophobicContact CD2-CD1 4.08Å; L275-Y288 HydrophobicContact CD2-CE1 3.96Å
276	S	92.7	Very high	87.2	Confident	30 Å²	30	52.4 Å²	52.4	21%	0.21	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	141.6	178.5	56.5	0	0	0	0	113.1	F229 V255	F229-S276 CarbonylContact O-C 3.45Å; F229-S276 VanDerWaalsContact O-CA 3.24Å; F229-S276 WeakPolarHBondContact O-CA 3.42Å; V255-S276 PolarHBondContact N-O 2.94Å; V255-S276 PolarHBondContact O-N 3.35Å
277	I	93.9	Very high	89.1	Confident	15 Å²	15	53 Å²	53	8%	0.077	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.2	171	-52.2	177.3	0	0	0	106.7	A228 F229 P254 V280 D284 Y288	A228-I277 CarbonylContact C-O 3.5Å; A228-I277 WeakPolarHBondContact CA-O 3.32Å; F229-I277 HydrophobicContact CB-CB 4.28Å; F229-I277 HydrophobicContact CD1-CD1 4.04Å; F229-I277 HydrophobicContact CD1-CG1 4.29Å; F229-I277 PolarHBondContact N-O 3.08Å; F229-I277 PolarHBondContact O-N 2.75Å; P254-I277 HydrophobicContact CB-CD1 4.23Å; P254-I277 HydrophobicContact CB-CG1 3.68Å; I277-V280 HydrophobicContact CB-CG1 4.07Å; I277-V280 HydrophobicContact CD1-CG1 4.43Å; I277-V280 HydrophobicContact CG2-CG1 4Å; I277-D284 HydrophobicContact CD1-CB 4.01Å; I277-Y288 WeakPolarHBondContact CD1-OH 3.24Å
278	A	89.8	Confident	90.6	Very high	84 Å²	84	45.5 Å²	45.5	69%	0.694	26%	0.255	S	S	*	.	S	Bend	trans	-72.1	-34.2	-173.2	0	0	0	0	0	113.1
279	T	92.4	Very high	91.6	Very high	92 Å²	92	48.6 Å²	48.6	56%	0.564	26%	0.264	S	S	*	.	S	Bend	trans	-144.2	105.3	178	52.3	0	0	0	0	108.5	E227	E227-T279 CarbonylContact O-C 3.42Å; E227-T279 WeakPolarHBondContact O-CA 3.32Å
280	V	93.2	Very high	92.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.249	C	C	.	.			trans	-73.4	148	-178.5	-62.8	0	0	0	0	112.4	L223 K224 T225 G226 E227 F229 I277 D284 V307	L223-V280 HydrophobicContact CB-CG2 4.08Å; L223-V280 HydrophobicContact CD1-CG1 4.06Å; L223-V280 HydrophobicContact CD1-CG2 4.14Å; K224-V280 WeakPolarHBondContact O-CG2 3.17Å; T225-V280 CarbonylContact C-O 3.57Å; T225-V280 WeakPolarHBondContact CA-O 3.23Å; G226-V280 PolarHBondContact N-O 2.85Å; E227-V280 WeakPolarHBondContact O-CG2 3.21Å; E227-V280 PolarHBondContact O-N 2.93Å; F229-V280 HydrophobicContact CB-CG1 3.59Å; I277-V280 HydrophobicContact CB-CG1 4.07Å; I277-V280 HydrophobicContact CD1-CG1 4.43Å; I277-V280 HydrophobicContact CG2-CG1 4Å; V280-D284 WeakPolarHBondContact CA-OD2 3.18Å; V280-V307 HydrophobicContact CB-CG1 4.2Å; V280-V307 HydrophobicContact CB-CG2 4.07Å; V280-V307 HydrophobicContact CG2-CG1 3.64Å; V280-V307 HydrophobicContact CG2-CG2 4.05Å
281	V	92.8	Very high	92.5	Very high	74 Å²	74	45.8 Å²	45.8	45%	0.448	25%	0.253	S	S	.	.			trans	-121.5	165.3	169.3	-65.8	0	0	0	0	110.4	L283 D284	V281-L283 HydrophobicContact CG2-CB 4.14Å; V281-L283 PolarHBondContact O-N 3.02Å; V281-L283 VanDerWaalsContact O-N 3.08Å; V281-D284 WeakPolarHBondContact CG2-OD2 3.41Å; V281-D284 PolarHBondContact N-OD2 3.36Å; V281-D284 WeakPolarHBondContact O-CB 3.34Å; V281-D284 PolarHBondContact O-N 3.43Å
282	Q	90.6	Very high	92.7	Very high	106 Å²	106	43.1 Å²	43.1	50%	0.495	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-53.9	-33	-179.2	-172.1	170.7	90.6	0	0	113.2	D284 S285 D309	Q282-D284 VanDerWaalsContact C-N 3.28Å; Q282-D284 PolarHBondContact O-N 2.8Å; Q282-S285 VanDerWaalsContact O-CB 3.25Å; Q282-S285 WeakPolarHBondContact O-CB 3.29Å; Q282-S285 PolarHBondContact O-N 3.46Å; Q282-S285 PolarHBondContact O-OG 3.26Å; Q282-D309 VanDerWaalsContact NE2-CG 3.31Å; Q282-D309 PolarHBondContact NE2-OD1 3.5Å; Q282-D309 VanDerWaalsContact NE2-OD1 3.08Å; Q282-D309 PolarHBondContact NE2-OD2 3.37Å
283	L	90.7	Very high	92.8	Very high	126 Å²	126	46.7 Å²	46.7	66%	0.66	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-67.3	-17.4	177.1	-64.5	175	0	0	0	115	A251 V281 S285	A251-L283 HydrophobicContact CB-CB 4.18Å; V281-L283 HydrophobicContact CG2-CB 4.14Å; V281-L283 PolarHBondContact O-N 3.02Å; V281-L283 VanDerWaalsContact O-N 3.08Å; L283-S285 PolarHBondContact O-N 3.31Å
284	D	92.4	Very high	92.8	Very high	9 Å²	9	46.6 Å²	46.6	5%	0.048	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-76	-12.7	173.5	-64.4	-55.9	0	0	0	112.2	A252 I277 V280 V281 Q282 G286 Y288 L305	A252-D284 WeakPolarHBondContact CA-OD1 3.41Å; A252-D284 HydrophobicContact CB-CB 4.44Å; A252-D284 WeakPolarHBondContact CB-OD1 3.44Å; I277-D284 HydrophobicContact CD1-CB 4.01Å; V280-D284 WeakPolarHBondContact CA-OD2 3.18Å; V281-D284 WeakPolarHBondContact CG2-OD2 3.41Å; V281-D284 PolarHBondContact N-OD2 3.36Å; V281-D284 WeakPolarHBondContact O-CB 3.34Å; V281-D284 PolarHBondContact O-N 3.43Å; Q282-D284 VanDerWaalsContact C-N 3.28Å; Q282-D284 PolarHBondContact O-N 2.8Å; D284-G286 PolarHBondContact O-N 3.49Å; D284-Y288 WeakPolarHBondContact O-CE2 3.26Å; D284-Y288 PolarHBondContact O-OH 2.97Å; D284-L305 HydrophobicContact CB-CD2 4.21Å
285	S	93.2	Very high	92.7	Very high	38 Å²	38	47 Å²	47	27%	0.266	26%	0.259	S	S	.	.			trans	-61.8	134.1	-179.4	-54	0	0	0	0	112	Q282 L283 V307	Q282-S285 VanDerWaalsContact O-CB 3.25Å; Q282-S285 WeakPolarHBondContact O-CB 3.29Å; Q282-S285 PolarHBondContact O-N 3.46Å; Q282-S285 PolarHBondContact O-OG 3.26Å; L283-S285 PolarHBondContact O-N 3.31Å; S285-V307 WeakPolarHBondContact OG-CB 3.4Å; S285-V307 PolarHBondContact OG-N 3.34Å
286	G	93.3	Very high	92.5	Very high	14 Å²	14	51.9 Å²	51.9	14%	0.144	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.7	-168.6	179.7	0	0	0	0	0	113.5	D284 Q304 L305	D284-G286 PolarHBondContact O-N 3.49Å; G286-Q304 VanDerWaalsContact CA-NE2 3.33Å; G286-Q304 PolarHBondContact O-NE2 2.88Å; G286-L305 PolarHBondContact N-O 3.25Å; G286-L305 PolarHBondContact O-N 2.81Å
287	I	93.6	Very high	92.3	Very high	83 Å²	83	51.6 Å²	51.6	43%	0.426	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.8	179.7	-59.7	174.8	0	0	0	109.2	P249 A302 M303 Q304	P249-I287 WeakPolarHBondContact CD-O 3.47Å; I287-A302 HydrophobicContact CG2-CB 3.77Å; I287-M303 WeakPolarHBondContact CA-O 3.24Å; I287-Q304 VanDerWaalsContact CG1-OE1 3.27Å
288	Y	94.3	Very high	92.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.1	171.5	-72.6	-101.9	0	0	0	108.5	F229 V248 P249 A252 L275 I277 D284 A302 M303 L305	F229-Y288 HydrophobicContact CE1-CD1 4.09Å; F229-Y288 HydrophobicContact CE1-CD2 4.27Å; F229-Y288 HydrophobicContact CE1-CE1 4.03Å; F229-Y288 HydrophobicContact CE1-CE2 4.22Å; F229-Y288 HydrophobicContact CE1-CG 4.21Å; V248-Y288 HydrophobicContact CB-CD1 4.21Å; V248-Y288 HydrophobicContact CB-CE1 4.18Å; V248-Y288 HydrophobicContact CG1-CD1 3.84Å; V248-Y288 HydrophobicContact CG1-CE1 4.1Å; P249-Y288 HydrophobicContact CG-CD2 4.37Å; P249-Y288 HydrophobicContact CG-CE2 3.89Å; A252-Y288 VanDerWaalsContact CB-OH 3.28Å; A252-Y288 WeakPolarHBondContact CB-OH 3.31Å; L275-Y288 HydrophobicContact CD1-CD1 3.72Å; L275-Y288 HydrophobicContact CD1-CE1 4.13Å; L275-Y288 HydrophobicContact CD2-CD1 4.08Å; L275-Y288 HydrophobicContact CD2-CE1 3.96Å; I277-Y288 WeakPolarHBondContact CD1-OH 3.24Å; D284-Y288 WeakPolarHBondContact O-CE2 3.26Å; D284-Y288 PolarHBondContact O-OH 2.97Å; Y288-A302 CarbonylContact O-C 3.59Å; Y288-A302 VanDerWaalsContact O-CA 3.29Å; Y288-A302 WeakPolarHBondContact O-CA 3.5Å; Y288-M303 PolarHBondContact N-O 3.14Å; Y288-M303 PolarHBondContact O-N 2.89Å; Y288-L305 HydrophobicContact CD2-CB 3.9Å; Y288-L305 HydrophobicContact CE2-CB 3.66Å; Y288-L305 HydrophobicContact CE2-CD2 3.77Å; Y288-L305 HydrophobicContact CE2-CG 4.36Å
289	R	94.1	Very high	92.5	Very high	71 Å²	71	53.6 Å²	53.6	27%	0.268	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128.8	-174.6	176.3	-174.1	-72.8	106.1	-2.9	110.7	D247 H291 D300 A301 A302	D247-R289 HydrophobicContact CB-CB 4.05Å; D247-R289 PolarHBondContact N-O 3.02Å; D247-R289 PolarHBondContact O-N 3.08Å; D247-R289 VanDerWaalsContact O-O 3.1Å; D247-R289 IonicContact OD2-CZ 3.75Å; D247-R289 IonicContact OD2-NH1 3.74Å; D247-R289 PolarHBondContact OD2-NH1 2.72Å; R289-H291 WeakPolarHBondContact CD-CE1 3.43Å; R289-H291 WeakPolarHBondContact CD-NE2 3.48Å; R289-D300 VanDerWaalsContact CD-OD2 3.26Å; R289-D300 WeakPolarHBondContact CD-OD2 3.35Å; R289-D300 HydrophobicContact CG-CB 3.97Å; R289-D300 IonicContact NE-OD2 3.65Å; R289-D300 PolarHBondContact NE-OD2 3.21Å; R289-A301 WeakPolarHBondContact CA-O 3.17Å; R289-A302 HydrophobicContact CB-CB 3.91Å; R289-A302 HydrophobicContact CG-CB 4.16Å
290	C	94.4	Very high	92.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.3	168.1	-172.8	0	0	0	0	109.4	V213 L215 C233 T245 W246 D300 A301	V213-C290 HydrophobicContact CG1-CB 4.02Å; L215-C290 HydrophobicContact CD2-CB 3.81Å; C233-C290 HydrophobicContact CB-CB 3.53Å; C233-C290 WeakPolarHBondContact CB-SG 3.5Å; C233-C290 WeakPolarHBondContact SG-CB 3.37Å; C233-C290 CovalentContact SG-SG 2.02Å; C233-C290 PolarHBondContact SG-SG 2.75Å; T245-C290 WeakPolarHBondContact O-CA 3.49Å; W246-C290 HydrophobicContact CD2-CB 4.48Å; W246-C290 HydrophobicContact CE3-CB 3.96Å; W246-C290 HydrophobicContact CH2-CB 4.02Å; W246-C290 HydrophobicContact CZ3-CB 3.7Å; C290-D300 WeakPolarHBondContact O-CA 3.28Å; C290-D300 WeakPolarHBondContact O-CB 3.45Å; C290-A301 PolarHBondContact N-O 3.49Å; C290-A301 PolarHBondContact O-N 2.89Å
291	H	93.9	Very high	92.6	Very high	64 Å²	64	54.1 Å²	54.1	30%	0.296	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.6	170.5	-59	-93.9	0	0	0	110	L244 T245 D247 R289 S299	L244-H291 CarbonylContact C-O 3.54Å; L244-H291 VanDerWaalsContact CA-O 3.29Å; L244-H291 WeakPolarHBondContact CA-O 3.49Å; T245-H291 PolarHBondContact N-O 2.81Å; T245-H291 PolarHBondContact O-N 2.72Å; D247-H291 WeakPolarHBondContact CB-NE2 3.46Å; D247-H291 IonicContact OD2-NE2 3.9Å; R289-H291 WeakPolarHBondContact CD-CE1 3.43Å; R289-H291 WeakPolarHBondContact CD-NE2 3.48Å; H291-S299 CarbonylContact C-O 3.58Å; H291-S299 WeakPolarHBondContact CA-O 3.48Å
292	A	94.2	Very high	92.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	145.1	164.5	0	0	0	0	0	110.9	P211 V213 S243 L244 H298 S299	P211-A292 HydrophobicContact CB-CB 4.04Å; P211-A292 HydrophobicContact CG-CB 3.62Å; V213-A292 HydrophobicContact CG2-CB 3.59Å; S243-A292 VanDerWaalsContact O-CA 3.3Å; S243-A292 WeakPolarHBondContact O-CA 3.24Å; L244-A292 HydrophobicContact CG-CB 4.43Å; A292-H298 WeakPolarHBondContact O-CA 3.2Å; A292-S299 PolarHBondContact N-O 3Å; A292-S299 PolarHBondContact O-N 2.92Å
293	H	93.3	Very high	92.7	Very high	99 Å²	99	47.9 Å²	47.9	46%	0.458	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	134.4	-177.6	174.8	46.1	0	0	0	111.8	F242 S243 G297	F242-H293 CarbonylContact C-O 3.51Å; F242-H293 WeakPolarHBondContact CA-O 3.48Å; F242-H293 VanDerWaalsContact CB-O 3.27Å; F242-H293 WeakPolarHBondContact CB-O 3.22Å; S243-H293 PolarHBondContact N-O 3.28Å; S243-H293 PolarHBondContact O-N 3.1Å; H293-G297 WeakPolarHBondContact CA-O 3.38Å; H293-G297 PolarHBondContact ND1-O 3.45Å
294	N	91.4	Very high	92.8	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	-179.2	169.5	77.5	0.1	0	0	0	110.7	P207 L209 N237 F242 K296 G297	P207-N294 WeakPolarHBondContact CB-ND2 3.44Å; L209-N294 PolarHBondContact O-ND2 3.16Å; N237-N294 PolarHBondContact OD1-ND2 2.65Å; F242-N294 HydrophobicContact CB-CB 3.91Å; N294-K296 PolarHBondContact O-N 2.87Å; N294-K296 PolarHBondContact OD1-N 2.67Å; N294-G297 PolarHBondContact N-O 3.42Å; N294-G297 PolarHBondContact O-N 2.85Å; N294-G297 VanDerWaalsContact O-O 3.08Å; N294-G297 PolarHBondContact OD1-N 3.37Å
295	E	88.6	Confident	92.8	Very high	77 Å²	77	44.8 Å²	44.8	36%	0.36	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-10.1	-178.9	63.8	147.5	-90.3	0	0	116.1	R127 V206 P207	R127-E295 IonicContact CZ-OE2 3.53Å; R127-E295 IonicContact NE-OE2 3.67Å; R127-E295 IonicContact NH2-OE1 3.85Å; R127-E295 PolarHBondContact NH2-OE1 3.03Å; R127-E295 IonicContact NH2-OE2 3.67Å; R127-E295 PolarHBondContact NH2-OE2 2.6Å; V206-E295 WeakPolarHBondContact CG1-OE1 3.43Å; P207-E295 HydrophobicContact CG-CG 4.04Å
296	K	89.5	Confident	92.8	Very high	104 Å²	104	44.6 Å²	44.6	45%	0.452	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-9.5	176.1	-60	-49.7	-176	-155.5	0	114.3	P207 N294	P207-K296 HydrophobicContact CB-CG 4.32Å; P207-K296 WeakPolarHBondContact O-CE 3.29Å; P207-K296 WeakPolarHBondContact O-CG 3.31Å; N294-K296 PolarHBondContact O-N 2.87Å; N294-K296 PolarHBondContact OD1-N 2.67Å
297	G	89.3	Confident	92.7	Very high	23 Å²	23	44 Å²	44	24%	0.237	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.5	-161.3	172.7	0	0	0	0	0	114.3	H293 N294	H293-G297 WeakPolarHBondContact CA-O 3.38Å; H293-G297 PolarHBondContact ND1-O 3.45Å; N294-G297 PolarHBondContact N-O 3.42Å; N294-G297 PolarHBondContact O-N 2.85Å; N294-G297 VanDerWaalsContact O-O 3.08Å; N294-G297 PolarHBondContact OD1-N 3.37Å
298	H	92.4	Very high	92.6	Very high	127 Å²	127	45.6 Å²	45.6	59%	0.588	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	160.8	175.7	66.1	-93.6	0	0	0	110.9	R210 A292	R210-H298 WeakPolarHBondContact CD-O 3.46Å; A292-H298 WeakPolarHBondContact O-CA 3.2Å
299	S	94.3	Very high	92.2	Very high	14 Å²	14	50.2 Å²	50.2	10%	0.098	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	151.7	168.6	48.5	0	0	0	0	108.8	P211 V213 H291 A292	P211-S299 VanDerWaalsContact O-CB 3.29Å; P211-S299 WeakPolarHBondContact O-CB 3.41Å; P211-S299 PolarHBondContact O-OG 3.42Å; V213-S299 WeakPolarHBondContact CG2-OG 3.42Å; H291-S299 CarbonylContact C-O 3.58Å; H291-S299 WeakPolarHBondContact CA-O 3.48Å; A292-S299 PolarHBondContact N-O 3Å; A292-S299 PolarHBondContact O-N 2.92Å
300	D	93.8	Very high	92	Very high	78 Å²	78	53.7 Å²	53.7	42%	0.417	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	157.4	174.8	72.1	-64.4	0	0	0	111.6	R289 C290	R289-D300 VanDerWaalsContact CD-OD2 3.26Å; R289-D300 WeakPolarHBondContact CD-OD2 3.35Å; R289-D300 HydrophobicContact CG-CB 3.97Å; R289-D300 IonicContact NE-OD2 3.65Å; R289-D300 PolarHBondContact NE-OD2 3.21Å; C290-D300 WeakPolarHBondContact O-CA 3.28Å; C290-D300 WeakPolarHBondContact O-CB 3.45Å
301	A	93.6	Very high	91.7	Very high	25 Å²	25	54.1 Å²	54.1	21%	0.207	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	141.6	165.7	0	0	0	0	0	108.4	V213 L215 R289 C290	V213-A301 HydrophobicContact CB-CB 4Å; V213-A301 HydrophobicContact CG1-CB 3.64Å; L215-A301 HydrophobicContact CD1-CB 4.05Å; L215-A301 HydrophobicContact CG-CB 3.91Å; R289-A301 WeakPolarHBondContact CA-O 3.17Å; C290-A301 PolarHBondContact N-O 3.49Å; C290-A301 PolarHBondContact O-N 2.89Å
302	A	93.4	Very high	91.6	Very high	42 Å²	42	53.6 Å²	53.6	35%	0.347	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.3	-175.7	0	0	0	0	0	111.6	I287 Y288 R289	I287-A302 HydrophobicContact CG2-CB 3.77Å; Y288-A302 CarbonylContact O-C 3.59Å; Y288-A302 VanDerWaalsContact O-CA 3.29Å; Y288-A302 WeakPolarHBondContact O-CA 3.5Å; R289-A302 HydrophobicContact CB-CB 3.91Å; R289-A302 HydrophobicContact CG-CB 4.16Å
303	M	92.7	Very high	91.5	Very high	7 Å²	7	54.3 Å²	54.3	3%	0.034	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	160.2	170.7	67.5	73	62.5	0	0	110.3	L215 V221 F229 L231 I287 Y288	L215-M303 HydrophobicContact CD1-CB 4.2Å; L215-M303 HydrophobicContact CD1-CG 4.13Å; V221-M303 HydrophobicContact CB-CE 3.67Å; V221-M303 HydrophobicContact CG2-CE 3.46Å; V221-M303 VanDerWaalsContact CG2-CE 3.46Å; F229-M303 HydrophobicContact CE2-CE 4.32Å; F229-M303 HydrophobicContact CE2-SD 4.48Å; F229-M303 HydrophobicContact CZ-CE 4.37Å; F229-M303 HydrophobicContact CZ-SD 3.95Å; L231-M303 HydrophobicContact CD1-CG 3.85Å; L231-M303 HydrophobicContact CD1-SD 4.36Å; L231-M303 HydrophobicContact CD2-CG 3.7Å; L231-M303 HydrophobicContact CD2-SD 3.96Å; L231-M303 HydrophobicContact CG-CG 4.47Å; I287-M303 WeakPolarHBondContact CA-O 3.24Å; Y288-M303 PolarHBondContact N-O 3.14Å; Y288-M303 PolarHBondContact O-N 2.89Å
304	Q	92.6	Very high	91.4	Very high	70 Å²	70	52.7 Å²	52.7	33%	0.327	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.6	179.9	177.6	72	44.2	0	0	110.3	T220 V221 G286 I287	T220-Q304 CarbonylContact C-O 3.54Å; T220-Q304 VanDerWaalsContact CA-O 3.29Å; T220-Q304 WeakPolarHBondContact CA-O 3.41Å; T220-Q304 HydrophobicContact CG2-CB 4.05Å; T220-Q304 HydrophobicContact CG2-CG 3.95Å; V221-Q304 PolarHBondContact N-O 2.8Å; G286-Q304 VanDerWaalsContact CA-NE2 3.33Å; G286-Q304 PolarHBondContact O-NE2 2.88Å; I287-Q304 VanDerWaalsContact CG1-OE1 3.27Å
305	L	93.4	Very high	91.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136	163	-177.3	64.5	0	0	0	109.5	V221 L223 F229 D284 G286 Y288 V307	V221-L305 HydrophobicContact CB-CD1 4.44Å; V221-L305 HydrophobicContact CG1-CD1 4.36Å; V221-L305 WeakPolarHBondContact O-CA 3.38Å; L223-L305 HydrophobicContact CD1-CD1 4.03Å; L223-L305 HydrophobicContact CG-CD1 4.19Å; F229-L305 HydrophobicContact CD1-CD2 3.89Å; F229-L305 HydrophobicContact CD2-CD1 3.88Å; F229-L305 HydrophobicContact CE1-CD2 4.05Å; F229-L305 HydrophobicContact CE2-CD1 3.98Å; F229-L305 HydrophobicContact CG-CD1 4.25Å; F229-L305 HydrophobicContact CG-CD2 4.14Å; F229-L305 HydrophobicContact CZ-CD1 4.4Å; F229-L305 HydrophobicContact CZ-CD2 4.45Å; D284-L305 HydrophobicContact CB-CD2 4.21Å; G286-L305 PolarHBondContact N-O 3.25Å; G286-L305 PolarHBondContact O-N 2.81Å; Y288-L305 HydrophobicContact CD2-CB 3.9Å; Y288-L305 HydrophobicContact CE2-CB 3.66Å; Y288-L305 HydrophobicContact CE2-CD2 3.77Å; Y288-L305 HydrophobicContact CE2-CG 4.36Å; L305-V307 HydrophobicContact CD1-CG2 4.28Å; L305-V307 HydrophobicContact CD2-CG2 3.9Å; L305-V307 HydrophobicContact CG-CG2 3.83Å
306	D	91.7	Very high	91.2	Very high	35 Å²	35	53.7 Å²	53.7	19%	0.187	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	105.6	178.1	-178.2	9.6	0	0	0	108.8	T220 V221 I222 L223 R308	T220-D306 HydrophobicContact CG2-CB 4.28Å; V221-D306 PolarHBondContact O-N 2.91Å; I222-D306 VanDerWaalsContact CA-O 3.32Å; I222-D306 WeakPolarHBondContact CA-O 3.32Å; I222-D306 HydrophobicContact CG1-CB 4.34Å; L223-D306 PolarHBondContact N-O 3.34Å; D306-R308 IonicContact OD1-CZ 3.58Å; D306-R308 IonicContact OD1-NE 3.63Å; D306-R308 PolarHBondContact OD1-NE 2.95Å; D306-R308 IonicContact OD1-NH2 3.2Å; D306-R308 PolarHBondContact OD1-NH2 3.01Å; D306-R308 IonicContact OD2-CZ 2.84Å; D306-R308 IonicContact OD2-NE 3.97Å; D306-R308 PolarHBondContact OD2-NE 3.02Å; D306-R308 IonicContact OD2-NH2 2.7Å; D306-R308 PolarHBondContact OD2-NH2 2.71Å
307	V	92.4	Very high	90.5	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123	-175.6	-172.3	0	0	0	0	110.2	L223 T225 V280 S285 L305	L223-V307 WeakPolarHBondContact O-CA 3.39Å; T225-V307 HydrophobicContact CG2-CG1 3.97Å; V280-V307 HydrophobicContact CB-CG1 4.2Å; V280-V307 HydrophobicContact CB-CG2 4.07Å; V280-V307 HydrophobicContact CG2-CG1 3.64Å; V280-V307 HydrophobicContact CG2-CG2 4.05Å; S285-V307 WeakPolarHBondContact OG-CB 3.4Å; S285-V307 PolarHBondContact OG-N 3.34Å; L305-V307 HydrophobicContact CD1-CG2 4.28Å; L305-V307 HydrophobicContact CD2-CG2 3.9Å; L305-V307 HydrophobicContact CG-CG2 3.83Å
308	R	90.3	Very high	89.2	Confident	116 Å²	116	58.1 Å²	58.1	44%	0.438	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	149.6	-179.8	-56.4	-59.4	175.7	123.7	2.2	112.1	I222 L223 K224 T225 D306 Q310	I222-R308 HydrophobicContact CG2-CG 4.45Å; L223-R308 PolarHBondContact O-N 2.87Å; K224-R308 CarbonylContact C-O 3.57Å; K224-R308 WeakPolarHBondContact CA-O 3.36Å; K224-R308 WeakPolarHBondContact CB-O 3.47Å; T225-R308 PolarHBondContact N-O 2.93Å; D306-R308 IonicContact OD1-CZ 3.58Å; D306-R308 IonicContact OD1-NE 3.63Å; D306-R308 PolarHBondContact OD1-NE 2.95Å; D306-R308 IonicContact OD1-NH2 3.2Å; D306-R308 PolarHBondContact OD1-NH2 3.01Å; D306-R308 IonicContact OD2-CZ 2.84Å; D306-R308 IonicContact OD2-NE 3.97Å; D306-R308 PolarHBondContact OD2-NE 3.02Å; D306-R308 IonicContact OD2-NH2 2.7Å; D306-R308 PolarHBondContact OD2-NH2 2.71Å; R308-Q310 VanDerWaalsContact C-N 3.3Å; R308-Q310 PolarHBondContact O-N 2.86Å
309	D	87.6	Confident	87.9	Confident	96 Å²	96	56 Å²	56	51%	0.513	31%	0.308	S	S	.	.	S	Bend	trans	-73.2	-26.2	-178.8	-46.7	-57.2	0	0	0	112.3	Q282	Q282-D309 VanDerWaalsContact NE2-CG 3.31Å; Q282-D309 PolarHBondContact NE2-OD1 3.5Å; Q282-D309 VanDerWaalsContact NE2-OD1 3.08Å; Q282-D309 PolarHBondContact NE2-OD2 3.37Å
310	Q	88.9	Confident	87	Confident	145 Å²	145	58.2 Å²	58.2	68%	0.678	32%	0.324	S	S	*	.	S	Bend	trans	-144	158.6	177.1	-64.5	-175.3	-7.2	0	0	110.5	R308	R308-Q310 VanDerWaalsContact C-N 3.3Å; R308-Q310 PolarHBondContact O-N 2.86Å
311	G	88.9	Confident	86.6	Confident	8 Å²	8	58.1 Å²	58.1	8%	0.082	33%	0.327	C	S	.	.			trans	-66.2	154.7	168.8	0	0	0	0	0	113.2	Y340 D400	G311-Y340 CarbonylContact C-O 3.55Å; G311-Y340 VanDerWaalsContact C-O 3.3Å; G311-Y340 WeakPolarHBondContact CA-O 3.46Å; G311-D400 WeakPolarHBondContact CA-OD2 3.45Å; G311-D400 PolarHBondContact N-OD2 2.95Å; G311-D400 VanDerWaalsContact N-OD2 3.1Å
312	F	91.4	Very high	86.4	Confident	53 Å²	53	61.2 Å²	61.2	23%	0.232	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	158.8	-178.7	71.9	-90.5	0	0	0	112.1	I222 T314 D338 A339 Y340 N398	I222-F312 HydrophobicContact CD1-CE1 4.16Å; I222-F312 HydrophobicContact CD1-CZ 4.04Å; I222-F312 HydrophobicContact CG2-CE1 4.26Å; F312-T314 WeakPolarHBondContact CD2-OG1 3.26Å; F312-D338 HydrophobicContact CE2-CB 4.12Å; F312-A339 WeakPolarHBondContact O-CA 3.29Å; F312-Y340 PolarHBondContact N-O 3.4Å; F312-Y340 PolarHBondContact O-N 3.47Å; F312-N398 PolarHBondContact O-ND2 3.03Å; F312-N398 VanDerWaalsContact O-ND2 3.15Å
313	I	92.9	Very high	86.3	Confident	15 Å²	15	61.5 Å²	61.5	8%	0.077	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.4	163.6	-61.4	166.7	0	0	0	106.7	F337 D338 A339 V396 N398 A401 V403	I313-F337 HydrophobicContact CG2-CD2 4.08Å; I313-D338 WeakPolarHBondContact CA-O 3.36Å; I313-A339 HydrophobicContact CG1-CB 4.03Å; I313-V396 HydrophobicContact CD1-CG1 4.45Å; I313-V396 HydrophobicContact CD1-CG2 4.19Å; I313-V396 HydrophobicContact CG2-CG1 4.07Å; I313-N398 HydrophobicContact CD1-CB 4.47Å; I313-A401 HydrophobicContact CB-CB 4.44Å; I313-A401 HydrophobicContact CD1-CB 4.25Å; I313-A401 WeakPolarHBondContact CD1-O 3.36Å; I313-A401 HydrophobicContact CG1-CB 4.19Å; I313-V403 HydrophobicContact CB-CG2 3.92Å; I313-V403 HydrophobicContact CG2-CB 4.14Å; I313-V403 HydrophobicContact CG2-CG2 3.75Å
314	T	90.6	Very high	86.1	Confident	66 Å²	66	67 Å²	67	41%	0.405	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	108.6	-179.5	-55.5	0	0	0	0	109.7	F312 F337 D338	F312-T314 WeakPolarHBondContact CD2-OG1 3.26Å; T314-F337 CarbonylContact O-C 3.51Å; T314-F337 VanDerWaalsContact O-CA 3.26Å; T314-F337 WeakPolarHBondContact O-CA 3.43Å; T314-F337 WeakPolarHBondContact O-CB 3.46Å; T314-D338 PolarHBondContact N-O 2.78Å; T314-D338 PolarHBondContact O-N 2.82Å
315	P	89.1	Confident	85.9	Confident	61 Å²	61	64.1 Å²	64.1	40%	0.396	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	144.8	176.5	30	-34.5	0	0	0	111.1	V403	P315-V403 HydrophobicContact CB-CG1 4.37Å; P315-V403 HydrophobicContact CG-CG1 4.07Å
316	L	86.3	Confident	85.7	Confident	41 Å²	41	69.9 Å²	69.9	22%	0.215	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145	-177	-58.7	169.6	0	0	0	110.5	E336 R374	L316-E336 HydrophobicContact CB-CB 4.27Å; L316-E336 WeakPolarHBondContact CB-O 3.14Å; L316-E336 PolarHBondContact N-O 3.13Å; L316-R374 HydrophobicContact CD1-CG 4.5Å
317	G	74.6	Confident	85.3	Confident	49 Å²	49	72 Å²	72	51%	0.505	38%	0.38	S	S	.	.			trans	82.2	140	170	0	0	0	0	0	116.2	H319 R405	G317-H319 PolarHBondContact O-N 2.95Å; G317-R405 PolarHBondContact O-NH1 2.84Å; G317-R405 PolarHBondContact O-NH2 2.89Å
318	N	61.9	Low	84.7	Confident	171 Å²	171	73.9 Å²	73.9	91%	0.914	40%	0.4	S	S	*	.			trans	-91.3	75.3	172.4	-81.2	0.5	0	0	0	111
319	H	66	Low	84.5	Confident	81 Å²	81	73.4 Å²	73.4	38%	0.375	40%	0.402	S	S	.	.			trans	-75	137.2	159.2	-65.9	-55.2	0	0	0	110.1	G317 R334 R405 F407	G317-H319 PolarHBondContact O-N 2.95Å; H319-R334 PolarHBondContact CD2-O 3.46Å; H319-R334 VanDerWaalsContact CD2-O 3.26Å; H319-R405 PolarHBondContact O-NH2 2.99Å; H319-R405 VanDerWaalsContact O-NH2 3.15Å; H319-F407 HydrophobicContact CB-CE1 4.22Å
320	S	75.4	Confident	84.5	Confident	62 Å²	62	71.3 Å²	71.3	43%	0.434	40%	0.395	S	S	.	.			trans	-56	134.5	174.6	173.5	0	0	0	0	111	I322 Q323	S320-I322 WeakPolarHBondContact CB-O 3.15Å; S320-I322 PolarHBondContact O-N 2.9Å; S320-I322 PolarHBondContact OG-N 2.92Å; S320-I322 VanDerWaalsContact OG-N 3.09Å; S320-I322 PolarHBondContact OG-O 3.03Å; S320-Q323 PolarHBondContact O-NE2 2.85Å
321	P	84.3	Confident	84.6	Confident	75 Å²	75	65.3 Å²	65.3	49%	0.487	37%	0.368	S	S	.	.	S	Bend	trans	-70.3	-19.9	172	31.3	-35	0	0	0	112	F407 H408	P321-F407 CarbonylContact O-C 3.56Å; P321-F407 WeakPolarHBondContact O-CA 3.29Å; P321-H408 PolarHBondContact O-N 2.94Å
322	I	89.4	Confident	84.8	Confident	90 Å²	90	68.1 Å²	68.1	46%	0.462	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.4	175.5	-65.4	170.1	0	0	0	109.4	S320 Y410	S320-I322 WeakPolarHBondContact CB-O 3.15Å; S320-I322 PolarHBondContact O-N 2.9Å; S320-I322 PolarHBondContact OG-N 2.92Å; S320-I322 VanDerWaalsContact OG-N 3.09Å; S320-I322 PolarHBondContact OG-O 3.03Å; I322-Y410 HydrophobicContact CG2-CD2 4.06Å; I322-Y410 HydrophobicContact CG2-CE2 3.94Å
323	Q	91.1	Very high	84.8	Confident	48 Å²	48	65.7 Å²	65.7	22%	0.224	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	136.7	179.1	-59.2	-67.7	-42.5	0	0	109.9	S320 L331 L333 F407 H408 V409 Y410	S320-Q323 PolarHBondContact O-NE2 2.85Å; Q323-L331 HydrophobicContact CB-CD2 3.93Å; Q323-L333 HydrophobicContact CB-CD2 4.46Å; Q323-L333 HydrophobicContact CG-CD2 3.82Å; Q323-F407 HydrophobicContact CG-CD1 4.35Å; Q323-H408 PolarHBondContact N-O 3.29Å; Q323-V409 HydrophobicContact CB-CG2 4.33Å; Q323-V409 WeakPolarHBondContact O-CA 3.32Å; Q323-Y410 PolarHBondContact O-N 3.04Å
324	E	88.8	Confident	84.7	Confident	123 Å²	123	69.8 Å²	69.8	58%	0.575	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	144.6	175	-67.9	-175.7	-140.3	0	0	110.3	Y410 N412	E324-Y410 WeakPolarHBondContact CA-O 3.4Å; E324-N412 PolarHBondContact OE2-ND2 3.17Å
325	V	89.9	Confident	84.8	Confident	10 Å²	10	66.7 Å²	66.7	6%	0.061	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144.1	176.4	63	0	0	0	0	109.8	E329 L331 V384 V409 Y410 V411 N412	V325-E329 HydrophobicContact CG2-CB 3.92Å; V325-L331 HydrophobicContact CB-CB 4.23Å; V325-L331 HydrophobicContact CB-CD2 4.49Å; V325-L331 HydrophobicContact CG1-CD2 4.45Å; V325-L331 HydrophobicContact CG2-CB 4.15Å; V325-V384 HydrophobicContact CG1-CB 4.08Å; V325-V384 HydrophobicContact CG1-CG1 4.16Å; V325-V384 HydrophobicContact CG1-CG2 4.08Å; V325-V384 HydrophobicContact CG2-CG2 4.18Å; V325-V409 HydrophobicContact CG1-CG1 4.17Å; V325-Y410 PolarHBondContact N-O 3.4Å; V325-V411 HydrophobicContact CG1-CG2 4.11Å; V325-V411 CarbonylContact O-C 3.59Å; V325-V411 WeakPolarHBondContact O-CA 3.5Å; V325-N412 PolarHBondContact O-N 2.61Å
326	K	87.5	Confident	84.9	Confident	120 Å²	120	66.3 Å²	66.3	52%	0.522	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	145.7	172.7	-60.1	-175.2	175.6	-171.6	0	110.9	G328 E329 N412	K326-G328 PolarHBondContact O-N 2.87Å; K326-E329 HydrophobicContact CB-CG 4.04Å; K326-E329 WeakPolarHBondContact O-CB 3.37Å; K326-E329 PolarHBondContact O-N 3.17Å; K326-N412 CarbonylContact C-O 3.53Å; K326-N412 WeakPolarHBondContact CA-O 3.44Å
327	E	85	Confident	85.2	Confident	80 Å²	80	64.4 Å²	64.4	37%	0.374	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	124.5	177.7	-175.5	171.7	-134.6	0	0	111.5	V384 S386 V411 N412 S413	E327-V384 WeakPolarHBondContact CA-O 3.29Å; E327-S386 WeakPolarHBondContact OE1-CB 3.22Å; E327-S386 PolarHBondContact OE1-N 2.81Å; E327-S386 VanDerWaalsContact OE1-N 3.1Å; E327-S386 PolarHBondContact OE1-OG 3.03Å; E327-V411 HydrophobicContact CB-CG1 4.18Å; E327-N412 PolarHBondContact N-O 2.75Å; E327-S413 VanDerWaalsContact OE2-CB 3.32Å; E327-S413 WeakPolarHBondContact OE2-CB 3.38Å
328	G	79.6	Confident	86	Confident	41 Å²	41	63.7 Å²	63.7	42%	0.423	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-8.3	-175.3	0	0	0	0	0	115.9	K326 R383 V384	K326-G328 PolarHBondContact O-N 2.87Å; G328-R383 WeakPolarHBondContact O-CA 3.39Å; G328-R383 WeakPolarHBondContact O-CG 3.45Å; G328-V384 PolarHBondContact N-O 2.87Å
329	E	85.8	Confident	87.4	Confident	106 Å²	106	55.6 Å²	55.6	50%	0.495	29%	0.293	S	S	.	.	S	Bend	trans	-80.2	175	167.5	-66	-176.3	166.1	0	0	111.4	V325 K326 R383 V384	V325-E329 HydrophobicContact CG2-CB 3.92Å; K326-E329 HydrophobicContact CB-CG 4.04Å; K326-E329 WeakPolarHBondContact O-CB 3.37Å; K326-E329 PolarHBondContact O-N 3.17Å; E329-R383 CarbonylContact O-C 3.59Å; E329-R383 WeakPolarHBondContact O-CA 3.38Å; E329-R383 PolarHBondContact O-N 3.36Å; E329-V384 PolarHBondContact O-N 3.04Å
330	S	87.3	Confident	88.6	Confident	52 Å²	52	53.2 Å²	53.2	36%	0.364	28%	0.281	S	S	.	.			trans	-121.2	120.9	-177.7	-57.1	0	0	0	0	111.7	L381 R383	S330-L381 CarbonylContact C-O 3.56Å; S330-L381 WeakPolarHBondContact CA-O 3.32Å; S330-L381 WeakPolarHBondContact CB-O 3.24Å; S330-R383 PolarHBondContact OG-N 2.85Å
331	L	91.8	Very high	89.3	Confident	20 Å²	20	51.4 Å²	51.4	11%	0.105	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	154.8	176.4	-173.1	59.2	0	0	0	110.7	Q323 V325 L333 R380 L381 V384 V409	Q323-L331 HydrophobicContact CB-CD2 3.93Å; V325-L331 HydrophobicContact CB-CB 4.23Å; V325-L331 HydrophobicContact CB-CD2 4.49Å; V325-L331 HydrophobicContact CG1-CD2 4.45Å; V325-L331 HydrophobicContact CG2-CB 4.15Å; L331-L333 HydrophobicContact CD2-CD2 3.94Å; L331-L333 HydrophobicContact CG-CD2 4.18Å; L331-R380 CarbonylContact O-C 3.46Å; L331-R380 WeakPolarHBondContact O-CA 3.13Å; L331-L381 HydrophobicContact CB-CB 4.36Å; L331-L381 HydrophobicContact CB-CD1 4.42Å; L331-L381 HydrophobicContact CD2-CD1 4.32Å; L331-L381 PolarHBondContact N-O 3.45Å; L331-L381 PolarHBondContact O-N 2.94Å; L331-V384 HydrophobicContact CB-CG2 4.42Å; L331-V409 HydrophobicContact CD2-CB 4.38Å; L331-V409 HydrophobicContact CD2-CG1 3.69Å; L331-V409 HydrophobicContact CD2-CG2 3.76Å
332	T	92.1	Very high	89.4	Confident	66 Å²	66	50.9 Å²	50.9	41%	0.405	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	105.6	171.1	-60.5	0	0	0	0	110.5	Q378 L379 R380	T332-Q378 HydrophobicContact CG2-CB 4.4Å; T332-L379 CarbonylContact C-O 3.59Å; T332-L379 WeakPolarHBondContact CA-O 3.42Å; T332-R380 HydrophobicContact CG2-CB 4.3Å; T332-R380 WeakPolarHBondContact OG1-CG 3.39Å
333	L	92.4	Very high	89.5	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	137.1	172.1	-52.8	-178.6	0	0	0	108.7	Q323 L331 W348 Q378 L379 Y392 F407 V409	Q323-L333 HydrophobicContact CB-CD2 4.46Å; Q323-L333 HydrophobicContact CG-CD2 3.82Å; L331-L333 HydrophobicContact CD2-CD2 3.94Å; L331-L333 HydrophobicContact CG-CD2 4.18Å; L333-W348 HydrophobicContact CB-CH2 3.53Å; L333-W348 HydrophobicContact CB-CZ2 4.39Å; L333-W348 HydrophobicContact CB-CZ3 3.82Å; L333-W348 HydrophobicContact CD1-CE3 4.47Å; L333-W348 HydrophobicContact CD1-CH2 4.38Å; L333-W348 HydrophobicContact CD1-CZ3 3.77Å; L333-W348 HydrophobicContact CG-CZ3 4.47Å; L333-Q378 VanDerWaalsContact O-CA 3.31Å; L333-Q378 WeakPolarHBondContact O-CA 3.29Å; L333-L379 HydrophobicContact CB-CB 4.5Å; L333-L379 HydrophobicContact CD1-CD2 4.39Å; L333-L379 PolarHBondContact N-O 2.82Å; L333-L379 PolarHBondContact O-N 2.71Å; L333-Y392 HydrophobicContact CD1-CD2 4.42Å; L333-Y392 HydrophobicContact CD1-CG 4Å; L333-F407 HydrophobicContact CD1-CB 4.04Å; L333-F407 HydrophobicContact CD1-CD2 4.26Å; L333-F407 HydrophobicContact CD1-CG 4.2Å; L333-F407 HydrophobicContact CD2-CB 4.2Å; L333-F407 HydrophobicContact CD2-CD1 4.14Å; L333-F407 HydrophobicContact CD2-CG 4.16Å; L333-V409 HydrophobicContact CD1-CG2 4.31Å; L333-V409 HydrophobicContact CD2-CG2 4.27Å
334	R	90.6	Very high	89.3	Confident	101 Å²	101	54.8 Å²	54.8	38%	0.381	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.8	-180	-171.4	-170.5	-65.1	-158.5	5.5	110.8	H319 E336 T376 S377 Q378	H319-R334 PolarHBondContact CD2-O 3.46Å; H319-R334 VanDerWaalsContact CD2-O 3.26Å; R334-E336 WeakPolarHBondContact CD-OE1 3.48Å; R334-E336 HydrophobicContact CG-CG 4.32Å; R334-E336 IonicContact CZ-OE1 3.35Å; R334-E336 IonicContact NE-OE1 3.16Å; R334-E336 IonicContact NH1-OE1 2.71Å; R334-E336 PolarHBondContact NH1-OE1 3.48Å; R334-T376 HydrophobicContact CG-CG2 3.92Å; R334-S377 WeakPolarHBondContact CA-O 3.23Å; R334-Q378 HydrophobicContact CB-CG 4.33Å; R334-Q378 HydrophobicContact CG-CG 3.95Å
335	V	91.6	Very high	89.4	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.1	163.7	-174.1	0	0	0	0	108.6	F337 W348 S377 F394 R405 F407	V335-F337 HydrophobicContact CG1-CD1 4.38Å; V335-W348 HydrophobicContact CG2-CH2 4.12Å; V335-W348 HydrophobicContact CG2-CZ2 4.36Å; V335-S377 PolarHBondContact N-O 2.77Å; V335-S377 PolarHBondContact O-N 2.58Å; V335-F394 HydrophobicContact CB-CD1 3.8Å; V335-F394 HydrophobicContact CB-CE1 3.95Å; V335-F394 HydrophobicContact CB-CG 4.27Å; V335-F394 HydrophobicContact CG1-CD1 3.78Å; V335-F394 HydrophobicContact CG1-CE1 3.72Å; V335-F394 HydrophobicContact CG2-CB 4.01Å; V335-F394 HydrophobicContact CG2-CD1 3.68Å; V335-F394 HydrophobicContact CG2-CE1 4.35Å; V335-F394 HydrophobicContact CG2-CG 3.89Å; V335-R405 HydrophobicContact CG2-CG 4.42Å; V335-F407 HydrophobicContact CG2-CE2 3.8Å; V335-F407 HydrophobicContact CG2-CZ 3.86Å
336	E	92.1	Very high	89.4	Confident	53 Å²	53	53.5 Å²	53.5	25%	0.248	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	142.8	168.7	-68.2	-178.5	-160	0	0	108.4	L316 R334 F375 T376	L316-E336 HydrophobicContact CB-CB 4.27Å; L316-E336 WeakPolarHBondContact CB-O 3.14Å; L316-E336 PolarHBondContact N-O 3.13Å; R334-E336 WeakPolarHBondContact CD-OE1 3.48Å; R334-E336 HydrophobicContact CG-CG 4.32Å; R334-E336 IonicContact CZ-OE1 3.35Å; R334-E336 IonicContact NE-OE1 3.16Å; R334-E336 IonicContact NH1-OE1 2.71Å; R334-E336 PolarHBondContact NH1-OE1 3.48Å; E336-F375 WeakPolarHBondContact CA-O 3.38Å; E336-T376 HydrophobicContact CG-CG2 3.78Å
337	F	91.9	Very high	89.7	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	151	-178.3	61.8	-83.6	0	0	0	111.6	I313 T314 V335 A339 P343 F375 F394 V396	I313-F337 HydrophobicContact CG2-CD2 4.08Å; T314-F337 CarbonylContact O-C 3.51Å; T314-F337 VanDerWaalsContact O-CA 3.26Å; T314-F337 WeakPolarHBondContact O-CA 3.43Å; T314-F337 WeakPolarHBondContact O-CB 3.46Å; V335-F337 HydrophobicContact CG1-CD1 4.38Å; F337-A339 HydrophobicContact CD2-CB 3.95Å; F337-A339 HydrophobicContact CE2-CB 3.99Å; F337-P343 HydrophobicContact CE2-CG 3.81Å; F337-P343 HydrophobicContact CZ-CG 4.29Å; F337-F375 HydrophobicContact CD1-CB 4.26Å; F337-F375 HydrophobicContact CD2-CB 4.18Å; F337-F375 HydrophobicContact CD2-CD2 4.36Å; F337-F375 HydrophobicContact CE1-CB 3.77Å; F337-F375 HydrophobicContact CE2-CB 3.69Å; F337-F375 AromaticContact CE2-CD2 3.92Å; F337-F375 HydrophobicContact CE2-CD2 3.92Å; F337-F375 HydrophobicContact CE2-CG 4.02Å; F337-F375 HydrophobicContact CG-CB 4.45Å; F337-F375 HydrophobicContact CZ-CB 3.47Å; F337-F375 VanDerWaalsContact CZ-CB 3.47Å; F337-F375 HydrophobicContact CZ-CD2 4.47Å; F337-F375 HydrophobicContact CZ-CG 4.12Å; F337-F375 PolarHBondContact N-O 2.86Å; F337-F375 PolarHBondContact O-N 2.78Å; F337-F394 HydrophobicContact CD1-CE1 4.25Å; F337-F394 HydrophobicContact CD1-CZ 4.11Å; F337-F394 HydrophobicContact CE1-CE1 4.16Å; F337-F394 AromaticContact CE1-CZ 3.57Å; F337-F394 HydrophobicContact CE1-CZ 3.57Å; F337-F394 HydrophobicContact CZ-CZ 4.16Å; F337-V396 HydrophobicContact CE2-CG2 3.93Å; F337-V396 HydrophobicContact CZ-CG2 3.98Å
338	D	91.3	Very high	90.1	Very high	34 Å²	34	46.9 Å²	46.9	18%	0.182	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	140.3	165.7	-68.6	-40.8	0	0	0	109.1	F312 I313 T314 Y373 R374	F312-D338 HydrophobicContact CE2-CB 4.12Å; I313-D338 WeakPolarHBondContact CA-O 3.36Å; T314-D338 PolarHBondContact N-O 2.78Å; T314-D338 PolarHBondContact O-N 2.82Å; D338-Y373 WeakPolarHBondContact CA-O 3.27Å; D338-R374 WeakPolarHBondContact OD1-CA 3.43Å; D338-R374 WeakPolarHBondContact OD1-CB 3.36Å; D338-R374 VanDerWaalsContact OD1-CG 3.25Å; D338-R374 WeakPolarHBondContact OD1-CG 3.48Å; D338-R374 IonicContact OD1-CZ 3.58Å; D338-R374 IonicContact OD1-NE 3.41Å; D338-R374 PolarHBondContact OD1-NE 3.41Å; D338-R374 IonicContact OD1-NH2 3.18Å; D338-R374 PolarHBondContact OD1-NH2 2.93Å; D338-R374 IonicContact OD2-CZ 3.63Å; D338-R374 IonicContact OD2-NE 2.79Å; D338-R374 IonicContact OD2-NH2 2.84Å; D338-R374 PolarHBondContact OD2-NH2 2.83Å
339	A	91.7	Very high	90.8	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	138	179.5	0	0	0	0	0	113	F312 I313 F337 P343 Y373 F375	F312-A339 WeakPolarHBondContact O-CA 3.29Å; I313-A339 HydrophobicContact CG1-CB 4.03Å; F337-A339 HydrophobicContact CD2-CB 3.95Å; F337-A339 HydrophobicContact CE2-CB 3.99Å; A339-P343 HydrophobicContact CB-CG 4.04Å; A339-Y373 PolarHBondContact N-O 2.98Å; A339-F375 HydrophobicContact CB-CD2 4.15Å; A339-F375 HydrophobicContact CB-CE2 4.14Å
340	Y	90.5	Very high	91	Very high	31 Å²	31	42.7 Å²	42.7	12%	0.122	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	132.3	169.7	-173.1	-100.2	0	0	0	111.4	I222 K224 E227 G311 F312 Y373 N398	I222-Y340 HydrophobicContact CB-CD1 4.45Å; I222-Y340 HydrophobicContact CB-CG 4.35Å; I222-Y340 HydrophobicContact CG2-CD1 3.71Å; I222-Y340 HydrophobicContact CG2-CE1 4.3Å; I222-Y340 HydrophobicContact CG2-CG 3.95Å; K224-Y340 HydrophobicContact CG-CE1 4.46Å; E227-Y340 PolarHBondContact OE2-OH 3.37Å; G311-Y340 CarbonylContact C-O 3.55Å; G311-Y340 VanDerWaalsContact C-O 3.3Å; G311-Y340 WeakPolarHBondContact CA-O 3.46Å; F312-Y340 PolarHBondContact N-O 3.4Å; F312-Y340 PolarHBondContact O-N 3.47Å; Y340-Y373 AromaticContact CD2-CD1 3.57Å; Y340-Y373 HydrophobicContact CD2-CD1 3.57Å; Y340-Y373 AromaticContact CD2-CE1 3.3Å; Y340-Y373 HydrophobicContact CD2-CE1 3.3Å; Y340-Y373 HydrophobicContact CE2-CD1 4.38Å; Y340-Y373 AromaticContact CE2-CE1 3.68Å; Y340-Y373 HydrophobicContact CE2-CE1 3.68Å; Y340-Y373 HydrophobicContact CG-CD1 4.26Å; Y340-Y373 HydrophobicContact CG-CE1 4.18Å; Y340-N398 VanDerWaalsContact C-ND2 3.29Å; Y340-N398 PolarHBondContact O-ND2 3.18Å; Y340-N398 VanDerWaalsContact O-ND2 3.08Å
341	P	89.9	Confident	90.9	Very high	23 Å²	23	44.1 Å²	44.1	15%	0.149	22%	0.222	C	C	.	.	S	Bend	cis	-55.9	170.9	-9.7	-25.7	36.1	0	0	0	113.4	K224 N398	K224-P341 HydrophobicContact CD-CG 4.4Å; P341-N398 VanDerWaalsContact O-CB 3.31Å; P341-N398 WeakPolarHBondContact O-CB 3.46Å; P341-N398 PolarHBondContact O-ND2 3.37Å
342	A	88.1	Confident	90.6	Very high	64 Å²	64	52.6 Å²	52.6	53%	0.529	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-55.4	140.3	176.1	0	0	0	0	0	110.8	R344 F375	A342-R344 PolarHBondContact O-N 3.48Å; A342-F375 HydrophobicContact CB-CZ 4.49Å
343	P	90.2	Very high	90.4	Very high	26 Å²	26	56.8 Å²	56.8	17%	0.169	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-58.8	139.4	-176.7	-23.6	32.5	0	0	0	113.1	F337 A339 I346 F375 V396 S397	F337-P343 HydrophobicContact CE2-CG 3.81Å; F337-P343 HydrophobicContact CZ-CG 4.29Å; A339-P343 HydrophobicContact CB-CG 4.04Å; P343-I346 HydrophobicContact CB-CD1 3.8Å; P343-I346 HydrophobicContact CB-CG1 3.65Å; P343-I346 HydrophobicContact CG-CD1 4.13Å; P343-I346 HydrophobicContact CG-CG1 4.41Å; P343-F375 HydrophobicContact CG-CE2 4.45Å; P343-V396 HydrophobicContact CB-CG2 3.82Å; P343-V396 HydrophobicContact CG-CG2 4.04Å; P343-S397 CarbonylContact C-O 3.57Å
344	R	87.9	Confident	90.1	Very high	195 Å²	195	62.6 Å²	62.6	74%	0.736	30%	0.3	S	S	*	.	S	Bend	trans	-93	-34.7	177.4	-67.5	-178.7	176.6	-179.4	-0.8	111.8	A342 S397 N398	A342-R344 PolarHBondContact O-N 3.48Å; R344-S397 PolarHBondContact N-O 2.92Å; R344-N398 WeakPolarHBondContact CD-O 3.39Å; R344-N398 PolarHBondContact NE-O 3.22Å
345	S	89.6	Confident	90	Very high	50 Å²	50	59.2 Å²	59.2	35%	0.35	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.8	175.9	51.2	0	0	0	0	109.7	V396 S397	S345-V396 WeakPolarHBondContact O-CA 3.45Å; S345-S397 PolarHBondContact N-O 3.44Å; S345-S397 PolarHBondContact O-N 3.25Å
346	I	91.4	Very high	89.7	Confident	56 Å²	56	65.5 Å²	65.5	29%	0.287	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	121.8	173.6	-45.8	176.5	0	0	0	106.2	P343 V365 F394 V396	P343-I346 HydrophobicContact CB-CD1 3.8Å; P343-I346 HydrophobicContact CB-CG1 3.65Å; P343-I346 HydrophobicContact CG-CD1 4.13Å; P343-I346 HydrophobicContact CG-CG1 4.41Å; I346-V365 HydrophobicContact CB-CG2 4.39Å; I346-V365 HydrophobicContact CD1-CB 4.42Å; I346-V365 HydrophobicContact CD1-CG1 3.7Å; I346-V365 HydrophobicContact CD1-CG2 4.12Å; I346-V365 HydrophobicContact CG2-CG2 3.84Å; I346-F394 HydrophobicContact CG2-CE2 3.46Å; I346-F394 VanDerWaalsContact CG2-CE2 3.46Å; I346-F394 HydrophobicContact CG2-CZ 3.96Å; I346-V396 HydrophobicContact CG1-CG2 4.07Å
347	F	92.4	Very high	89.1	Confident	61 Å²	61	68 Å²	68	27%	0.268	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	166.5	176.5	58.4	-90.7	0	0	0	111.4	H354 S395	F347-H354 AromaticContact CD1-CE1 3.98Å; F347-H354 AromaticContact CD2-CE1 3.41Å; F347-H354 VanDerWaalsContact CD2-CE1 3.41Å; F347-H354 WeakPolarHBondContact CD2-CE1 3.48Å; F347-H354 AromaticContact CD2-ND1 3.32Å; F347-H354 VanDerWaalsContact CD2-ND1 3.32Å; F347-H354 WeakPolarHBondContact CD2-ND1 3.36Å; F347-H354 AromaticContact CE1-CE1 3.86Å; F347-H354 AromaticContact CE2-CE1 3.27Å; F347-H354 WeakPolarHBondContact CE2-CE1 3.33Å; F347-H354 AromaticContact CE2-ND1 3.68Å; F347-H354 AromaticContact CG-CE1 3.77Å; F347-H354 AromaticContact CG-ND1 3.63Å; F347-H354 AromaticContact CZ-CE1 3.51Å; F347-S395 VanDerWaalsContact CZ-CB 3.45Å; F347-S395 PolarHBondContact N-O 3.42Å; F347-S395 PolarHBondContact O-N 2.85Å
348	W	94.3	Very high	88.3	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	154.5	163	-70.3	81.5	0	0	0	108.4	L333 V335 L355 I363 S377 L379 T393 F394 F407	L333-W348 HydrophobicContact CB-CH2 3.53Å; L333-W348 HydrophobicContact CB-CZ2 4.39Å; L333-W348 HydrophobicContact CB-CZ3 3.82Å; L333-W348 HydrophobicContact CD1-CE3 4.47Å; L333-W348 HydrophobicContact CD1-CH2 4.38Å; L333-W348 HydrophobicContact CD1-CZ3 3.77Å; L333-W348 HydrophobicContact CG-CZ3 4.47Å; V335-W348 HydrophobicContact CG2-CH2 4.12Å; V335-W348 HydrophobicContact CG2-CZ2 4.36Å; W348-L355 HydrophobicContact CB-CB 4.36Å; W348-L355 HydrophobicContact CB-CD1 4.03Å; W348-L355 PolarHBondContact O-N 2.87Å; W348-I363 HydrophobicContact CB-CD1 4.2Å; W348-S377 PolarHBondContact NE1-OG 2.8Å; W348-L379 HydrophobicContact CB-CD2 4Å; W348-L379 HydrophobicContact CD2-CB 3.56Å; W348-L379 HydrophobicContact CD2-CD2 3.75Å; W348-L379 HydrophobicContact CD2-CG 4.3Å; W348-L379 VanDerWaalsContact CE2-CB 3.48Å; W348-L379 HydrophobicContact CE3-CB 3.97Å; W348-L379 HydrophobicContact CE3-CD2 3.64Å; W348-L379 HydrophobicContact CE3-CG 4.47Å; W348-L379 HydrophobicContact CG-CB 3.94Å; W348-L379 HydrophobicContact CG-CD2 3.93Å; W348-L379 HydrophobicContact CG-CG 4.49Å; W348-L379 HydrophobicContact CH2-CB 4.24Å; W348-L379 HydrophobicContact CZ2-CB 3.85Å; W348-L379 HydrophobicContact CZ3-CB 4.29Å; W348-L379 HydrophobicContact CZ3-CD2 4.34Å; W348-T393 CarbonylContact C-O 3.59Å; W348-T393 WeakPolarHBondContact CA-O 3.39Å; W348-F394 HydrophobicContact CD2-CB 3.91Å; W348-F394 HydrophobicContact CD2-CD2 4.17Å; W348-F394 AromaticContact CE2-CD2 3.68Å; W348-F394 HydrophobicContact CE3-CB 3.78Å; W348-F394 HydrophobicContact CG-CD2 4.47Å; W348-F394 HydrophobicContact CH2-CB 3.79Å; W348-F394 HydrophobicContact CH2-CG 4.5Å; W348-F394 HydrophobicContact CZ2-CB 3.91Å; W348-F394 AromaticContact CZ2-CD2 3.99Å; W348-F394 HydrophobicContact CZ2-CD2 3.99Å; W348-F394 HydrophobicContact CZ2-CG 4.19Å; W348-F394 HydrophobicContact CZ3-CB 3.73Å; W348-F394 AromaticContact NE1-CD2 3.69Å; W348-F407 HydrophobicContact CH2-CD2 4.16Å; W348-F407 AromaticContact CH2-CE2 3.72Å; W348-F407 HydrophobicContact CH2-CE2 3.72Å; W348-F407 AromaticContact CZ3-CD2 3.79Å; W348-F407 HydrophobicContact CZ3-CD2 3.79Å; W348-F407 AromaticContact CZ3-CE2 3.81Å; W348-F407 HydrophobicContact CZ3-CE2 3.81Å
349	S	93	Very high	87.1	Confident	11 Å²	11	70.3 Å²	70.3	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	153.7	171	54.9	0	0	0	0	110.5	E353 Y392 T393	S349-E353 CarbonylContact C-O 3.54Å; S349-E353 WeakPolarHBondContact CA-O 3.36Å; S349-E353 WeakPolarHBondContact CB-O 3.36Å; S349-Y392 CarbonylContact O-C 3.41Å; S349-Y392 VanDerWaalsContact O-CA 3.27Å; S349-Y392 WeakPolarHBondContact O-CA 3.22Å; S349-T393 PolarHBondContact N-O 2.84Å; S349-T393 PolarHBondContact O-N 3.34Å; S349-T393 PolarHBondContact OG-O 2.73Å
350	Y	91.7	Very high	86	Confident	47 Å²	47	72.5 Å²	72.5	18%	0.184	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.3	174.1	172.4	-115.9	0	0	0	108	K352 E353 S387 E388 G389 Y392	Y350-K352 PolarHBondContact O-N 2.91Å; Y350-E353 PolarHBondContact N-O 3.25Å; Y350-E353 PolarHBondContact O-N 3.1Å; Y350-S387 PolarHBondContact OH-O 2.9Å; Y350-E388 WeakPolarHBondContact CE2-O 3.49Å; Y350-E388 WeakPolarHBondContact OH-CA 3.37Å; Y350-G389 PolarHBondContact OH-O 2.86Å; Y350-Y392 AromaticContact CD2-CD1 3.92Å; Y350-Y392 HydrophobicContact CD2-CD1 3.92Å; Y350-Y392 HydrophobicContact CD2-CD2 4.02Å; Y350-Y392 AromaticContact CD2-CE1 3.48Å; Y350-Y392 HydrophobicContact CD2-CE1 3.48Å; Y350-Y392 VanDerWaalsContact CD2-CE1 3.48Å; Y350-Y392 AromaticContact CD2-CE2 3.63Å; Y350-Y392 HydrophobicContact CD2-CE2 3.63Å; Y350-Y392 HydrophobicContact CD2-CG 4.18Å; Y350-Y392 AromaticContact CD2-CZ 3.33Å; Y350-Y392 HydrophobicContact CE2-CD2 4.43Å; Y350-Y392 HydrophobicContact CE2-CE1 4.28Å; Y350-Y392 AromaticContact CE2-CE2 3.75Å; Y350-Y392 HydrophobicContact CE2-CE2 3.75Å; Y350-Y392 AromaticContact CE2-CZ 3.66Å; Y350-Y392 HydrophobicContact CG-CD1 4.44Å; Y350-Y392 AromaticContact CG-CE1 3.95Å; Y350-Y392 HydrophobicContact CG-CE1 3.95Å
351	N	85.2	Confident	85.6	Confident	82 Å²	82	72.3 Å²	72.3	44%	0.439	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	34.2	-177.3	-61.5	-25	0	0	0	113.9	V391	N351-V391 PolarHBondContact N-O 2.99Å; N351-V391 PolarHBondContact OD1-N 2.9Å
352	K	84.1	Confident	85.1	Confident	198 Å²	198	73.4 Å²	73.4	86%	0.861	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-2.1	-175.4	-49.4	176	-176.1	176.7	0	117.1	Y350	Y350-K352 PolarHBondContact O-N 2.91Å
353	E	87.7	Confident	85.1	Confident	154 Å²	154	71.7 Å²	71.7	72%	0.72	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	141.2	169.9	-61.8	-166.5	155.9	0	0	111.1	S349 Y350 L355	S349-E353 CarbonylContact C-O 3.54Å; S349-E353 WeakPolarHBondContact CA-O 3.36Å; S349-E353 WeakPolarHBondContact CB-O 3.36Å; Y350-E353 PolarHBondContact N-O 3.25Å; Y350-E353 PolarHBondContact O-N 3.1Å; E353-L355 PolarHBondContact O-N 3.23Å
354	H	87.9	Confident	84.9	Confident	125 Å²	125	72 Å²	72	58%	0.579	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	125.7	-179.5	-80.2	-98.7	0	0	0	111.5	F347	F347-H354 AromaticContact CD1-CE1 3.98Å; F347-H354 AromaticContact CD2-CE1 3.41Å; F347-H354 VanDerWaalsContact CD2-CE1 3.41Å; F347-H354 WeakPolarHBondContact CD2-CE1 3.48Å; F347-H354 AromaticContact CD2-ND1 3.32Å; F347-H354 VanDerWaalsContact CD2-ND1 3.32Å; F347-H354 WeakPolarHBondContact CD2-ND1 3.36Å; F347-H354 AromaticContact CE1-CE1 3.86Å; F347-H354 AromaticContact CE2-CE1 3.27Å; F347-H354 WeakPolarHBondContact CE2-CE1 3.33Å; F347-H354 AromaticContact CE2-ND1 3.68Å; F347-H354 AromaticContact CG-CE1 3.77Å; F347-H354 AromaticContact CG-ND1 3.63Å; F347-H354 AromaticContact CZ-CE1 3.51Å
355	L	87.8	Confident	84.7	Confident	30 Å²	30	65.5 Å²	65.5	16%	0.157	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	126.6	174.6	-71.7	173	0	0	0	111.1	W348 E353 I363 L379 Y392	W348-L355 HydrophobicContact CB-CB 4.36Å; W348-L355 HydrophobicContact CB-CD1 4.03Å; W348-L355 PolarHBondContact O-N 2.87Å; E353-L355 PolarHBondContact O-N 3.23Å; L355-I363 HydrophobicContact CB-CD1 4.1Å; L355-L379 HydrophobicContact CD1-CD2 3.63Å; L355-Y392 HydrophobicContact CD1-CD1 3.76Å; L355-Y392 HydrophobicContact CD1-CE1 3.83Å
356	L	84.8	Confident	84.5	Confident	133 Å²	133	69.3 Å²	69.3	70%	0.696	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-84.8	155.4	166.1	-59.4	-179.9	0	0	0	110.2	T358	L356-T358 PolarHBondContact O-N 3.23Å
357	N	79.7	Confident	84.1	Confident	107 Å²	107	70.9 Å²	70.9	57%	0.572	36%	0.355	S	S	*	.			trans	-76.6	107.9	178.9	-169	13.9	0	0	0	110.1	H361 I363	N357-H361 PolarHBondContact OD1-O 2.84Å; N357-I363 HydrophobicContact CB-CB 4.39Å; N357-I363 PolarHBondContact ND2-O 2.83Å; N357-I363 PolarHBondContact OD1-N 2.76Å; N357-I363 PolarHBondContact OD1-O 3.18Å
358	T	75.3	Confident	83.5	Confident	45 Å²	45	70.1 Å²	70.1	28%	0.276	36%	0.355	S	S	.	.			trans	-122.9	-177.1	179.3	73.9	0	0	0	0	110.2	L356 E360 H361 V362	L356-T358 PolarHBondContact O-N 3.23Å; T358-E360 VanDerWaalsContact C-N 3.34Å; T358-E360 PolarHBondContact OG1-N 3.24Å; T358-H361 PolarHBondContact N-O 2.97Å; T358-H361 CarbonylContact O-C 3.58Å; T358-H361 VanDerWaalsContact O-C 3.29Å; T358-H361 PolarHBondContact OG1-N 3.21Å; T358-V362 WeakPolarHBondContact O-CA 3.42Å; T358-V362 VanDerWaalsContact O-CG2 3.27Å; T358-V362 WeakPolarHBondContact O-CG2 3.44Å; T358-V362 PolarHBondContact O-N 3.23Å
359	T	66.4	Low	82.2	Confident	38 Å²	38	78.9 Å²	78.9	23%	0.233	39%	0.393	C	S	.	.	S	Bend	trans	-80.2	-15.5	171.3	51.2	0	0	0	0	113.9	V382 T607 V617	T359-V382 VanDerWaalsContact O-CB 3.25Å; T359-V382 WeakPolarHBondContact O-CB 3.37Å; T359-V382 VanDerWaalsContact O-CG2 3.25Å; T359-V382 WeakPolarHBondContact O-CG2 3.36Å; T359-T607 HydrophobicContact CG2-CG2 4.21Å; T359-V617 HydrophobicContact CG2-CB 3.67Å; T359-V617 HydrophobicContact CG2-CG1 3.78Å; T359-V617 WeakPolarHBondContact OG1-CB 3.17Å; T359-V617 WeakPolarHBondContact OG1-CG1 3.31Å
360	E	68.1	Low	81	Confident	46 Å²	46	86.8 Å²	86.8	22%	0.215	43%	0.429	C	S	.	.	S	Bend	trans	-83.9	-41.8	170.2	-80.2	154.9	176.8	0	0	109.8	T358 L381 V382 Y609	T358-E360 VanDerWaalsContact C-N 3.34Å; T358-E360 PolarHBondContact OG1-N 3.24Å; E360-L381 CarbonylContact O-C 3.55Å; E360-L381 VanDerWaalsContact O-CA 3.29Å; E360-L381 WeakPolarHBondContact O-CA 3.42Å; E360-V382 PolarHBondContact O-N 3Å; E360-Y609 HydrophobicContact CG-CE1 3.99Å; E360-Y609 WeakPolarHBondContact CG-OH 3.27Å; E360-Y609 WeakPolarHBondContact OE1-CE1 3.39Å; E360-Y609 VanDerWaalsContact OE1-CZ 3.24Å; E360-Y609 PolarHBondContact OE1-OH 2.83Å; E360-Y609 WeakPolarHBondContact OE2-CE1 3.47Å
361	H	81.8	Confident	80.2	Confident	27 Å²	27	91.3 Å²	91.3	13%	0.125	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	74.8	178.5	-60.7	80.6	0	0	0	110.6	N357 T358 I363 L379 L381 E388 Y392	N357-H361 PolarHBondContact OD1-O 2.84Å; T358-H361 PolarHBondContact N-O 2.97Å; T358-H361 CarbonylContact O-C 3.58Å; T358-H361 VanDerWaalsContact O-C 3.29Å; T358-H361 PolarHBondContact OG1-N 3.21Å; H361-I363 PolarHBondContact O-N 3.15Å; H361-I363 VanDerWaalsContact O-N 3.11Å; H361-L379 HydrophobicContact CB-CD1 3.92Å; H361-L381 WeakPolarHBondContact CD2-CD2 3.35Å; H361-E388 IonicContact CE1-OE1 2.69Å; H361-E388 PolarHBondContact CE1-OE1 2.87Å; H361-E388 IonicContact NE2-OE1 3.04Å; H361-E388 PolarHBondContact NE2-OE1 2.91Å; H361-Y392 AromaticContact NE2-CE1 3.51Å; H361-Y392 AromaticContact NE2-CZ 3.47Å; H361-Y392 PolarHBondContact NE2-OH 3.38Å
362	V	80.3	Confident	79.9	Confident	47 Å²	47	93.6 Å²	93.6	29%	0.285	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	99.8	-179.1	-179.4	0	0	0	0	109.5	T358 T364 R380 V382	T358-V362 WeakPolarHBondContact O-CA 3.42Å; T358-V362 VanDerWaalsContact O-CG2 3.27Å; T358-V362 WeakPolarHBondContact O-CG2 3.44Å; T358-V362 PolarHBondContact O-N 3.23Å; V362-T364 HydrophobicContact CG1-CG2 4.17Å; V362-R380 HydrophobicContact CB-CB 4.27Å; V362-R380 PolarHBondContact N-O 3.01Å; V362-R380 PolarHBondContact O-N 2.63Å; V362-V382 HydrophobicContact CG2-CG2 4.07Å
363	I	87.1	Confident	80	Confident	28 Å²	28	85.6 Å²	85.6	14%	0.144	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.5	176.7	-61.6	170.1	0	0	0	109	W348 L355 N357 H361 Q378 L379	W348-I363 HydrophobicContact CB-CD1 4.2Å; L355-I363 HydrophobicContact CB-CD1 4.1Å; N357-I363 HydrophobicContact CB-CB 4.39Å; N357-I363 PolarHBondContact ND2-O 2.83Å; N357-I363 PolarHBondContact OD1-N 2.76Å; N357-I363 PolarHBondContact OD1-O 3.18Å; H361-I363 PolarHBondContact O-N 3.15Å; H361-I363 VanDerWaalsContact O-N 3.11Å; I363-Q378 WeakPolarHBondContact CA-O 3.25Å; I363-L379 HydrophobicContact CG1-CD1 3.8Å
364	T	86.2	Confident	80.1	Confident	33 Å²	33	80.9 Å²	80.9	20%	0.202	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	125.2	171.6	64.5	0	0	0	0	111.2	V362 R366 Q378	V362-T364 HydrophobicContact CG1-CG2 4.17Å; T364-R366 PolarHBondContact OG1-NH1 3.43Å; T364-Q378 PolarHBondContact N-O 2.76Å; T364-Q378 PolarHBondContact O-N 3.13Å
365	V	84.9	Confident	80.2	Confident	58 Å²	58	76.2 Å²	76.2	35%	0.352	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	133.4	167	-176.7	0	0	0	0	107.8	I346 T376	I346-V365 HydrophobicContact CB-CG2 4.39Å; I346-V365 HydrophobicContact CD1-CB 4.42Å; I346-V365 HydrophobicContact CD1-CG1 3.7Å; I346-V365 HydrophobicContact CD1-CG2 4.12Å; I346-V365 HydrophobicContact CG2-CG2 3.84Å; V365-T376 WeakPolarHBondContact CA-O 3.48Å
366	R	84.4	Confident	80.4	Confident	130 Å²	130	75.7 Å²	75.7	49%	0.491	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.4	175.6	-59.1	-174.5	-175.8	85.5	2.2	110.3	T364 T376	T364-R366 PolarHBondContact OG1-NH1 3.43Å; R366-T376 PolarHBondContact N-O 2.88Å; R366-T376 PolarHBondContact O-N 2.82Å
367	P	82.4	Confident	80.7	Confident	88 Å²	88	69.3 Å²	69.3	57%	0.571	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	145.3	161.4	30.8	-33.3	0	0	0	109.2	R374 F375	P367-R374 CarbonylContact C-O 3.57Å; P367-R374 WeakPolarHBondContact CA-O 3.22Å; P367-F375 HydrophobicContact CB-CD1 4.36Å; P367-F375 HydrophobicContact CB-CE1 4.31Å
368	V	80	Confident	81.3	Confident	46 Å²	46	66.1 Å²	66.1	28%	0.279	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-78	128.3	178.9	177.5	0	0	0	0	109.4	H370 R371 R374 T376	V368-H370 PolarHBondContact O-N 3.32Å; V368-R371 HydrophobicContact CB-CB 4.41Å; V368-R371 PolarHBondContact O-N 2.79Å; V368-R374 HydrophobicContact CB-CB 4.18Å; V368-R374 HydrophobicContact CB-CG 4.23Å; V368-R374 HydrophobicContact CG2-CB 4.22Å; V368-R374 HydrophobicContact CG2-CG 3.78Å; V368-R374 PolarHBondContact N-O 3.5Å; V368-T376 WeakPolarHBondContact CG2-OG1 3.26Å
369	K	68.3	Low	82.2	Confident	184 Å²	184	64 Å²	64	80%	0.8	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	134	177	-70.1	-171.3	176.1	-175.2	0	109.9	R371	K369-R371 VanDerWaalsContact C-N 3.27Å; K369-R371 PolarHBondContact O-N 3.08Å
370	H	66.3	Low	83.3	Confident	177 Å²	177	68.3 Å²	68.3	82%	0.819	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	17.7	-177.6	-41.3	-81.4	0	0	0	115.8	V368	V368-H370 PolarHBondContact O-N 3.32Å
371	R	75	Confident	84.4	Confident	141 Å²	141	66.2 Å²	66.2	53%	0.532	31%	0.305	S	S	.	.			trans	-137.9	93.2	170.1	-68.2	-170.6	-179.6	-133	-1.3	111.8	V368 K369 Y373 R374	V368-R371 HydrophobicContact CB-CB 4.41Å; V368-R371 PolarHBondContact O-N 2.79Å; K369-R371 VanDerWaalsContact C-N 3.27Å; K369-R371 PolarHBondContact O-N 3.08Å; R371-Y373 PolarHBondContact O-N 2.87Å; R371-R374 HydrophobicContact CB-CB 3.83Å; R371-R374 PolarHBondContact O-N 3.04Å; R371-R374 VanDerWaalsContact O-N 3.12Å
372	K	78.5	Confident	84.5	Confident	130 Å²	130	66.9 Å²	66.9	57%	0.565	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-32.8	-173.5	-173.9	-179.7	174.9	-164.9	0	115.5
373	Y	86.9	Confident	84.5	Confident	30 Å²	30	70.2 Å²	70.2	12%	0.118	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	2.3	-173	-55.9	-69.4	0	0	0	114.3	I222 D338 A339 Y340 R371 F375	I222-Y373 HydrophobicContact CB-CE1 4.2Å; I222-Y373 HydrophobicContact CB-CE2 4.08Å; I222-Y373 HydrophobicContact CD1-CD2 3.87Å; I222-Y373 HydrophobicContact CD1-CE2 4.16Å; I222-Y373 HydrophobicContact CD1-CG 4.14Å; I222-Y373 HydrophobicContact CG1-CD2 4.12Å; I222-Y373 HydrophobicContact CG1-CE2 3.88Å; I222-Y373 PolarHBondContact N-OH 3.5Å; I222-Y373 PolarHBondContact O-OH 2.98Å; D338-Y373 WeakPolarHBondContact CA-O 3.27Å; A339-Y373 PolarHBondContact N-O 2.98Å; Y340-Y373 AromaticContact CD2-CD1 3.57Å; Y340-Y373 HydrophobicContact CD2-CD1 3.57Å; Y340-Y373 AromaticContact CD2-CE1 3.3Å; Y340-Y373 HydrophobicContact CD2-CE1 3.3Å; Y340-Y373 HydrophobicContact CE2-CD1 4.38Å; Y340-Y373 AromaticContact CE2-CE1 3.68Å; Y340-Y373 HydrophobicContact CE2-CE1 3.68Å; Y340-Y373 HydrophobicContact CG-CD1 4.26Å; Y340-Y373 HydrophobicContact CG-CE1 4.18Å; R371-Y373 PolarHBondContact O-N 2.87Å; Y373-F375 WeakPolarHBondContact O-CE2 3.48Å
374	R	89.4	Confident	84.4	Confident	55 Å²	55	68.9 Å²	68.9	21%	0.208	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.3	-175	-170.3	164.1	-69.3	-159.3	-6.8	112.2	L316 D338 P367 V368 R371	L316-R374 HydrophobicContact CD1-CG 4.5Å; D338-R374 WeakPolarHBondContact OD1-CA 3.43Å; D338-R374 WeakPolarHBondContact OD1-CB 3.36Å; D338-R374 VanDerWaalsContact OD1-CG 3.25Å; D338-R374 WeakPolarHBondContact OD1-CG 3.48Å; D338-R374 IonicContact OD1-CZ 3.58Å; D338-R374 IonicContact OD1-NE 3.41Å; D338-R374 PolarHBondContact OD1-NE 3.41Å; D338-R374 IonicContact OD1-NH2 3.18Å; D338-R374 PolarHBondContact OD1-NH2 2.93Å; D338-R374 IonicContact OD2-CZ 3.63Å; D338-R374 IonicContact OD2-NE 2.79Å; D338-R374 IonicContact OD2-NH2 2.84Å; D338-R374 PolarHBondContact OD2-NH2 2.83Å; P367-R374 CarbonylContact C-O 3.57Å; P367-R374 WeakPolarHBondContact CA-O 3.22Å; V368-R374 HydrophobicContact CB-CB 4.18Å; V368-R374 HydrophobicContact CB-CG 4.23Å; V368-R374 HydrophobicContact CG2-CB 4.22Å; V368-R374 HydrophobicContact CG2-CG 3.78Å; V368-R374 PolarHBondContact N-O 3.5Å; R371-R374 HydrophobicContact CB-CB 3.83Å; R371-R374 PolarHBondContact O-N 3.04Å; R371-R374 VanDerWaalsContact O-N 3.12Å
375	F	90.8	Very high	84.4	Confident	27 Å²	27	70.1 Å²	70.1	12%	0.118	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	149.6	-177.8	-59.2	-88.1	0	0	0	111.6	E336 F337 A339 A342 P343 P367 Y373	E336-F375 WeakPolarHBondContact CA-O 3.38Å; F337-F375 HydrophobicContact CD1-CB 4.26Å; F337-F375 HydrophobicContact CD2-CB 4.18Å; F337-F375 HydrophobicContact CD2-CD2 4.36Å; F337-F375 HydrophobicContact CE1-CB 3.77Å; F337-F375 HydrophobicContact CE2-CB 3.69Å; F337-F375 AromaticContact CE2-CD2 3.92Å; F337-F375 HydrophobicContact CE2-CD2 3.92Å; F337-F375 HydrophobicContact CE2-CG 4.02Å; F337-F375 HydrophobicContact CG-CB 4.45Å; F337-F375 HydrophobicContact CZ-CB 3.47Å; F337-F375 VanDerWaalsContact CZ-CB 3.47Å; F337-F375 HydrophobicContact CZ-CD2 4.47Å; F337-F375 HydrophobicContact CZ-CG 4.12Å; F337-F375 PolarHBondContact N-O 2.86Å; F337-F375 PolarHBondContact O-N 2.78Å; A339-F375 HydrophobicContact CB-CD2 4.15Å; A339-F375 HydrophobicContact CB-CE2 4.14Å; A342-F375 HydrophobicContact CB-CZ 4.49Å; P343-F375 HydrophobicContact CG-CE2 4.45Å; P367-F375 HydrophobicContact CB-CD1 4.36Å; P367-F375 HydrophobicContact CB-CE1 4.31Å; Y373-F375 WeakPolarHBondContact O-CE2 3.48Å
376	T	91.2	Very high	84.2	Confident	19 Å²	19	68.4 Å²	68.4	12%	0.117	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118.2	170.8	-53.5	0	0	0	0	108.6	R334 E336 V365 R366 V368 Q378	R334-T376 HydrophobicContact CG-CG2 3.92Å; E336-T376 HydrophobicContact CG-CG2 3.78Å; V365-T376 WeakPolarHBondContact CA-O 3.48Å; R366-T376 PolarHBondContact N-O 2.88Å; R366-T376 PolarHBondContact O-N 2.82Å; V368-T376 WeakPolarHBondContact CG2-OG1 3.26Å; T376-Q378 HydrophobicContact CG2-CG 4.12Å
377	S	92.3	Very high	84	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134	168.3	-178.1	0	0	0	0	109.4	R334 V335 W348 F394	R334-S377 WeakPolarHBondContact CA-O 3.23Å; V335-S377 PolarHBondContact N-O 2.77Å; V335-S377 PolarHBondContact O-N 2.58Å; W348-S377 PolarHBondContact NE1-OG 2.8Å; S377-F394 WeakPolarHBondContact OG-CD2 3.2Å; S377-F394 WeakPolarHBondContact OG-CE2 3.42Å
378	Q	92.4	Very high	84.2	Confident	40 Å²	40	63.2 Å²	63.2	19%	0.187	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	126.6	175.4	-72.9	169	0.1	0	0	109.5	T332 L333 R334 I363 T364 T376	T332-Q378 HydrophobicContact CG2-CB 4.4Å; L333-Q378 VanDerWaalsContact O-CA 3.31Å; L333-Q378 WeakPolarHBondContact O-CA 3.29Å; R334-Q378 HydrophobicContact CB-CG 4.33Å; R334-Q378 HydrophobicContact CG-CG 3.95Å; I363-Q378 WeakPolarHBondContact CA-O 3.25Å; T364-Q378 PolarHBondContact N-O 2.76Å; T364-Q378 PolarHBondContact O-N 3.13Å; T376-Q378 HydrophobicContact CG2-CG 4.12Å
379	L	93.1	Very high	84.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112.3	164.2	166.8	59.3	0	0	0	107.5	T332 L333 W348 L355 H361 I363 L381 Y392	T332-L379 CarbonylContact C-O 3.59Å; T332-L379 WeakPolarHBondContact CA-O 3.42Å; L333-L379 HydrophobicContact CB-CB 4.5Å; L333-L379 HydrophobicContact CD1-CD2 4.39Å; L333-L379 PolarHBondContact N-O 2.82Å; L333-L379 PolarHBondContact O-N 2.71Å; W348-L379 HydrophobicContact CB-CD2 4Å; W348-L379 HydrophobicContact CD2-CB 3.56Å; W348-L379 HydrophobicContact CD2-CD2 3.75Å; W348-L379 HydrophobicContact CD2-CG 4.3Å; W348-L379 VanDerWaalsContact CE2-CB 3.48Å; W348-L379 HydrophobicContact CE3-CB 3.97Å; W348-L379 HydrophobicContact CE3-CD2 3.64Å; W348-L379 HydrophobicContact CE3-CG 4.47Å; W348-L379 HydrophobicContact CG-CB 3.94Å; W348-L379 HydrophobicContact CG-CD2 3.93Å; W348-L379 HydrophobicContact CG-CG 4.49Å; W348-L379 HydrophobicContact CH2-CB 4.24Å; W348-L379 HydrophobicContact CZ2-CB 3.85Å; W348-L379 HydrophobicContact CZ3-CB 4.29Å; W348-L379 HydrophobicContact CZ3-CD2 4.34Å; L355-L379 HydrophobicContact CD1-CD2 3.63Å; H361-L379 HydrophobicContact CB-CD1 3.92Å; I363-L379 HydrophobicContact CG1-CD1 3.8Å; L379-L381 HydrophobicContact CD1-CD2 3.91Å; L379-L381 HydrophobicContact CD2-CD2 4.02Å; L379-L381 HydrophobicContact CG-CD2 3.83Å; L379-Y392 HydrophobicContact CD2-CD1 3.68Å; L379-Y392 HydrophobicContact CD2-CE1 4.19Å; L379-Y392 HydrophobicContact CD2-CG 4.5Å
380	R	90.3	Very high	85.6	Confident	129 Å²	129	52.9 Å²	52.9	49%	0.487	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	115.8	173.9	174.9	176.9	-178.4	165.9	3.7	109.4	L331 T332 V362 V382	L331-R380 CarbonylContact O-C 3.46Å; L331-R380 WeakPolarHBondContact O-CA 3.13Å; T332-R380 HydrophobicContact CG2-CB 4.3Å; T332-R380 WeakPolarHBondContact OG1-CG 3.39Å; V362-R380 HydrophobicContact CB-CB 4.27Å; V362-R380 PolarHBondContact N-O 3.01Å; V362-R380 PolarHBondContact O-N 2.63Å; R380-V382 HydrophobicContact CG-CG2 3.91Å
381	L	90.6	Very high	86.8	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.9	172.2	-50.5	179.8	0	0	0	107.9	S330 L331 E360 H361 L379 V384 Y392 V409	S330-L381 CarbonylContact C-O 3.56Å; S330-L381 WeakPolarHBondContact CA-O 3.32Å; S330-L381 WeakPolarHBondContact CB-O 3.24Å; L331-L381 HydrophobicContact CB-CB 4.36Å; L331-L381 HydrophobicContact CB-CD1 4.42Å; L331-L381 HydrophobicContact CD2-CD1 4.32Å; L331-L381 PolarHBondContact N-O 3.45Å; L331-L381 PolarHBondContact O-N 2.94Å; E360-L381 CarbonylContact O-C 3.55Å; E360-L381 VanDerWaalsContact O-CA 3.29Å; E360-L381 WeakPolarHBondContact O-CA 3.42Å; H361-L381 WeakPolarHBondContact CD2-CD2 3.35Å; L379-L381 HydrophobicContact CD1-CD2 3.91Å; L379-L381 HydrophobicContact CD2-CD2 4.02Å; L379-L381 HydrophobicContact CG-CD2 3.83Å; L381-V384 HydrophobicContact CB-CG2 3.61Å; L381-V384 HydrophobicContact CD1-CG2 4.47Å; L381-Y392 HydrophobicContact CD1-CD2 4.38Å; L381-Y392 HydrophobicContact CD1-CE1 4.23Å; L381-Y392 HydrophobicContact CD1-CE2 3.74Å; L381-Y392 HydrophobicContact CD2-CD1 4.45Å; L381-Y392 HydrophobicContact CD2-CE1 3.74Å; L381-V409 HydrophobicContact CD1-CG1 4.4Å
382	V	83.3	Confident	87.7	Confident	42 Å²	42	39.4 Å²	39.4	26%	0.255	19%	0.192	S	C	.	.			trans	-108	109.8	-170.2	-178	0	0	0	0	111.3	T359 E360 V362 R380	T359-V382 VanDerWaalsContact O-CB 3.25Å; T359-V382 WeakPolarHBondContact O-CB 3.37Å; T359-V382 VanDerWaalsContact O-CG2 3.25Å; T359-V382 WeakPolarHBondContact O-CG2 3.36Å; E360-V382 PolarHBondContact O-N 3Å; V362-V382 HydrophobicContact CG2-CG2 4.07Å; R380-V382 HydrophobicContact CG-CG2 3.91Å
383	R	81.4	Confident	88.5	Confident	117 Å²	117	34.2 Å²	34.2	44%	0.442	17%	0.17	S	C	.	.	S	Bend	trans	61.9	57.5	-178.4	-60.3	176.4	164.5	179.6	-8.1	112.9	G328 E329 S330 L385 F591	G328-R383 WeakPolarHBondContact O-CA 3.39Å; G328-R383 WeakPolarHBondContact O-CG 3.45Å; E329-R383 CarbonylContact O-C 3.59Å; E329-R383 WeakPolarHBondContact O-CA 3.38Å; E329-R383 PolarHBondContact O-N 3.36Å; S330-R383 PolarHBondContact OG-N 2.85Å; R383-L385 PolarHBondContact O-N 3.2Å; R383-F591 PolarHBondContact NH1-O 2.76Å; R383-F591 PolarHBondContact NH2-O 3.03Å
384	V	85.9	Confident	88.8	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.166	C	C	.	.			trans	-54.1	126.3	-171.2	-165.6	0	0	0	0	111.3	V325 E327 G328 E329 L331 L381 E388 V411	V325-V384 HydrophobicContact CG1-CB 4.08Å; V325-V384 HydrophobicContact CG1-CG1 4.16Å; V325-V384 HydrophobicContact CG1-CG2 4.08Å; V325-V384 HydrophobicContact CG2-CG2 4.18Å; E327-V384 WeakPolarHBondContact CA-O 3.29Å; G328-V384 PolarHBondContact N-O 2.87Å; E329-V384 PolarHBondContact O-N 3.04Å; L331-V384 HydrophobicContact CB-CG2 4.42Å; L381-V384 HydrophobicContact CB-CG2 3.61Å; L381-V384 HydrophobicContact CD1-CG2 4.47Å; V384-E388 WeakPolarHBondContact CA-OE2 3.42Å; V384-E388 HydrophobicContact CG1-CB 3.83Å; V384-V411 HydrophobicContact CG1-CG1 4.36Å; V384-V411 HydrophobicContact CG1-CG2 3.64Å
385	L	85.2	Confident	88.9	Confident	58 Å²	58	30.4 Å²	30.4	30%	0.304	16%	0.157	S	C	.	.			trans	-85.5	153.1	175.8	-57.8	175.6	0	0	0	110.5	R383 S387 E388	R383-L385 PolarHBondContact O-N 3.2Å; L385-S387 PolarHBondContact O-N 3.08Å; L385-E388 HydrophobicContact CB-CG 4.23Å; L385-E388 PolarHBondContact N-OE2 2.96Å; L385-E388 WeakPolarHBondContact O-CB 3.01Å; L385-E388 PolarHBondContact O-N 3.3Å
386	S	79.9	Confident	89.1	Confident	22 Å²	22	29.2 Å²	29.2	15%	0.154	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-9.4	177.4	47.1	0	0	0	0	115.8	E327	E327-S386 WeakPolarHBondContact OE1-CB 3.22Å; E327-S386 PolarHBondContact OE1-N 2.81Å; E327-S386 VanDerWaalsContact OE1-N 3.1Å; E327-S386 PolarHBondContact OE1-OG 3.03Å
387	S	81.7	Confident	89.2	Confident	90 Å²	90	29.5 Å²	29.5	63%	0.629	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-4.3	172.3	58.2	0	0	0	0	114.7	Y350 L385	Y350-S387 PolarHBondContact OH-O 2.9Å; L385-S387 PolarHBondContact O-N 3.08Å
388	E	85.4	Confident	89.2	Confident	20 Å²	20	29.5 Å²	29.5	9%	0.093	15%	0.154	C	C	.	.			trans	-99.2	6.8	-179.7	-63.4	179.6	111.6	0	0	112.7	Y350 H361 V384 L385 Y392	Y350-E388 WeakPolarHBondContact CE2-O 3.49Å; Y350-E388 WeakPolarHBondContact OH-CA 3.37Å; H361-E388 IonicContact CE1-OE1 2.69Å; H361-E388 PolarHBondContact CE1-OE1 2.87Å; H361-E388 IonicContact NE2-OE1 3.04Å; H361-E388 PolarHBondContact NE2-OE1 2.91Å; V384-E388 WeakPolarHBondContact CA-OE2 3.42Å; V384-E388 HydrophobicContact CG1-CB 3.83Å; L385-E388 HydrophobicContact CB-CG 4.23Å; L385-E388 PolarHBondContact N-OE2 2.96Å; L385-E388 WeakPolarHBondContact O-CB 3.01Å; L385-E388 PolarHBondContact O-N 3.3Å; E388-Y392 PolarHBondContact O-OH 3.12Å; E388-Y392 VanDerWaalsContact O-OH 3.11Å
389	G	87.9	Confident	88.9	Confident	12 Å²	12	29.9 Å²	29.9	12%	0.124	17%	0.169	C	C	.	.			trans	-70.1	130.4	169.6	0	0	0	0	0	111.3	Y350 V409	Y350-G389 PolarHBondContact OH-O 2.86Å; G389-V409 CarbonylContact C-O 3.38Å; G389-V409 VanDerWaalsContact CA-O 3.31Å; G389-V409 WeakPolarHBondContact CA-O 3.23Å
390	G	90.3	Very high	88.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.5	-160.5	-175.9	0	0	0	0	0	113.3	V409	G390-V409 PolarHBondContact N-O 3.35Å; G390-V409 PolarHBondContact O-N 3.12Å
391	V	92.4	Very high	88.7	Confident	36 Å²	36	28 Å²	28	22%	0.218	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	116.9	-176.9	-175.4	0	0	0	0	110.7	N351 F407 F474	N351-V391 PolarHBondContact N-O 2.99Å; N351-V391 PolarHBondContact OD1-N 2.9Å; V391-F407 CarbonylContact C-O 3.59Å; V391-F407 WeakPolarHBondContact CA-O 3.49Å; V391-F474 HydrophobicContact CG2-CZ 4.18Å
392	Y	93.9	Very high	88.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	117.7	177.2	-72.4	-88.4	0	0	0	110.3	L333 S349 Y350 L355 H361 L379 L381 E388 S406 F407 V409	L333-Y392 HydrophobicContact CD1-CD2 4.42Å; L333-Y392 HydrophobicContact CD1-CG 4Å; S349-Y392 CarbonylContact O-C 3.41Å; S349-Y392 VanDerWaalsContact O-CA 3.27Å; S349-Y392 WeakPolarHBondContact O-CA 3.22Å; Y350-Y392 AromaticContact CD2-CD1 3.92Å; Y350-Y392 HydrophobicContact CD2-CD1 3.92Å; Y350-Y392 HydrophobicContact CD2-CD2 4.02Å; Y350-Y392 AromaticContact CD2-CE1 3.48Å; Y350-Y392 HydrophobicContact CD2-CE1 3.48Å; Y350-Y392 VanDerWaalsContact CD2-CE1 3.48Å; Y350-Y392 AromaticContact CD2-CE2 3.63Å; Y350-Y392 HydrophobicContact CD2-CE2 3.63Å; Y350-Y392 HydrophobicContact CD2-CG 4.18Å; Y350-Y392 AromaticContact CD2-CZ 3.33Å; Y350-Y392 HydrophobicContact CE2-CD2 4.43Å; Y350-Y392 HydrophobicContact CE2-CE1 4.28Å; Y350-Y392 AromaticContact CE2-CE2 3.75Å; Y350-Y392 HydrophobicContact CE2-CE2 3.75Å; Y350-Y392 AromaticContact CE2-CZ 3.66Å; Y350-Y392 HydrophobicContact CG-CD1 4.44Å; Y350-Y392 AromaticContact CG-CE1 3.95Å; Y350-Y392 HydrophobicContact CG-CE1 3.95Å; L355-Y392 HydrophobicContact CD1-CD1 3.76Å; L355-Y392 HydrophobicContact CD1-CE1 3.83Å; H361-Y392 AromaticContact NE2-CE1 3.51Å; H361-Y392 AromaticContact NE2-CZ 3.47Å; H361-Y392 PolarHBondContact NE2-OH 3.38Å; L379-Y392 HydrophobicContact CD2-CD1 3.68Å; L379-Y392 HydrophobicContact CD2-CE1 4.19Å; L379-Y392 HydrophobicContact CD2-CG 4.5Å; L381-Y392 HydrophobicContact CD1-CD2 4.38Å; L381-Y392 HydrophobicContact CD1-CE1 4.23Å; L381-Y392 HydrophobicContact CD1-CE2 3.74Å; L381-Y392 HydrophobicContact CD2-CD1 4.45Å; L381-Y392 HydrophobicContact CD2-CE1 3.74Å; E388-Y392 PolarHBondContact O-OH 3.12Å; E388-Y392 VanDerWaalsContact O-OH 3.11Å; Y392-S406 CarbonylContact O-C 3.59Å; Y392-S406 WeakPolarHBondContact O-CA 3.35Å; Y392-F407 PolarHBondContact N-O 3.03Å; Y392-F407 PolarHBondContact O-N 3.1Å; Y392-V409 HydrophobicContact CD2-CB 3.89Å; Y392-V409 HydrophobicContact CD2-CG2 3.49Å; Y392-V409 VanDerWaalsContact CD2-CG2 3.49Å; Y392-V409 HydrophobicContact CE2-CB 3.92Å; Y392-V409 HydrophobicContact CE2-CG1 4.37Å; Y392-V409 HydrophobicContact CE2-CG2 3.9Å; Y392-V409 HydrophobicContact CG-CG2 4.48Å
393	T	93.4	Very high	89.2	Confident	20 Å²	20	31.5 Å²	31.5	12%	0.123	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.4	179.9	-59.8	0	0	0	0	111.1	W348 S349 E404 S406	W348-T393 CarbonylContact C-O 3.59Å; W348-T393 WeakPolarHBondContact CA-O 3.39Å; S349-T393 PolarHBondContact N-O 2.84Å; S349-T393 PolarHBondContact O-N 3.34Å; S349-T393 PolarHBondContact OG-O 2.73Å; T393-E404 HydrophobicContact CG2-CB 4.18Å; T393-S406 PolarHBondContact OG1-OG 2.81Å
394	F	93.8	Very high	89.7	Confident	3 Å²	3	32 Å²	32	1%	0.013	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	132	165.4	170.9	-107.3	0	0	0	110.1	V335 F337 I346 W348 S377 V396 E404 R405	V335-F394 HydrophobicContact CB-CD1 3.8Å; V335-F394 HydrophobicContact CB-CE1 3.95Å; V335-F394 HydrophobicContact CB-CG 4.27Å; V335-F394 HydrophobicContact CG1-CD1 3.78Å; V335-F394 HydrophobicContact CG1-CE1 3.72Å; V335-F394 HydrophobicContact CG2-CB 4.01Å; V335-F394 HydrophobicContact CG2-CD1 3.68Å; V335-F394 HydrophobicContact CG2-CE1 4.35Å; V335-F394 HydrophobicContact CG2-CG 3.89Å; F337-F394 HydrophobicContact CD1-CE1 4.25Å; F337-F394 HydrophobicContact CD1-CZ 4.11Å; F337-F394 HydrophobicContact CE1-CE1 4.16Å; F337-F394 AromaticContact CE1-CZ 3.57Å; F337-F394 HydrophobicContact CE1-CZ 3.57Å; F337-F394 HydrophobicContact CZ-CZ 4.16Å; I346-F394 HydrophobicContact CG2-CE2 3.46Å; I346-F394 VanDerWaalsContact CG2-CE2 3.46Å; I346-F394 HydrophobicContact CG2-CZ 3.96Å; W348-F394 HydrophobicContact CD2-CB 3.91Å; W348-F394 HydrophobicContact CD2-CD2 4.17Å; W348-F394 AromaticContact CE2-CD2 3.68Å; W348-F394 HydrophobicContact CE3-CB 3.78Å; W348-F394 HydrophobicContact CG-CD2 4.47Å; W348-F394 HydrophobicContact CH2-CB 3.79Å; W348-F394 HydrophobicContact CH2-CG 4.5Å; W348-F394 HydrophobicContact CZ2-CB 3.91Å; W348-F394 AromaticContact CZ2-CD2 3.99Å; W348-F394 HydrophobicContact CZ2-CD2 3.99Å; W348-F394 HydrophobicContact CZ2-CG 4.19Å; W348-F394 HydrophobicContact CZ3-CB 3.73Å; W348-F394 AromaticContact NE1-CD2 3.69Å; S377-F394 WeakPolarHBondContact OG-CD2 3.2Å; S377-F394 WeakPolarHBondContact OG-CE2 3.42Å; F394-V396 HydrophobicContact CD1-CG1 4.49Å; F394-V396 HydrophobicContact CE1-CB 4.01Å; F394-V396 HydrophobicContact CE1-CG1 3.55Å; F394-V396 HydrophobicContact CZ-CB 3.76Å; F394-V396 HydrophobicContact CZ-CG1 3.81Å; F394-E404 CarbonylContact O-C 3.55Å; F394-E404 VanDerWaalsContact O-CA 3.29Å; F394-E404 WeakPolarHBondContact O-CA 3.42Å; F394-R405 PolarHBondContact N-O 2.79Å; F394-R405 WeakPolarHBondContact O-CA 3.31Å; F394-R405 PolarHBondContact O-N 3.32Å
395	S	92.9	Very high	90	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	138.3	177.7	-52.5	0	0	0	0	110.8	F347 E404	F347-S395 VanDerWaalsContact CZ-CB 3.45Å; F347-S395 PolarHBondContact N-O 3.42Å; F347-S395 PolarHBondContact O-N 2.85Å; S395-E404 VanDerWaalsContact CB-OE1 3.3Å; S395-E404 WeakPolarHBondContact CB-OE1 3.42Å; S395-E404 PolarHBondContact OG-OE1 2.91Å
396	V	94.3	Very high	90.3	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.2	-176.8	56.4	0	0	0	0	111.9	I313 F337 P343 S345 I346 F394 S402 V403	I313-V396 HydrophobicContact CD1-CG1 4.45Å; I313-V396 HydrophobicContact CD1-CG2 4.19Å; I313-V396 HydrophobicContact CG2-CG1 4.07Å; F337-V396 HydrophobicContact CE2-CG2 3.93Å; F337-V396 HydrophobicContact CZ-CG2 3.98Å; P343-V396 HydrophobicContact CB-CG2 3.82Å; P343-V396 HydrophobicContact CG-CG2 4.04Å; S345-V396 WeakPolarHBondContact O-CA 3.45Å; I346-V396 HydrophobicContact CG1-CG2 4.07Å; F394-V396 HydrophobicContact CD1-CG1 4.49Å; F394-V396 HydrophobicContact CE1-CB 4.01Å; F394-V396 HydrophobicContact CE1-CG1 3.55Å; F394-V396 HydrophobicContact CZ-CB 3.76Å; F394-V396 HydrophobicContact CZ-CG1 3.81Å; V396-S402 CarbonylContact O-C 3.6Å; V396-S402 VanDerWaalsContact O-CA 3.25Å; V396-S402 WeakPolarHBondContact O-CA 3.35Å; V396-S402 PolarHBondContact O-OG 3.33Å; V396-S402 VanDerWaalsContact O-OG 3.09Å; V396-V403 HydrophobicContact CG1-CB 4.17Å; V396-V403 PolarHBondContact N-O 2.8Å; V396-V403 PolarHBondContact O-N 2.93Å
397	S	93.5	Very high	90.9	Very high	24 Å²	24	33.2 Å²	33.2	17%	0.168	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	148	171	-178	0	0	0	0	112.4	P343 R344 S345 G399 A401	P343-S397 CarbonylContact C-O 3.57Å; R344-S397 PolarHBondContact N-O 2.92Å; S345-S397 PolarHBondContact N-O 3.44Å; S345-S397 PolarHBondContact O-N 3.25Å; S397-G399 PolarHBondContact OG-N 3.03Å; S397-G399 VanDerWaalsContact OG-N 3.16Å; S397-A401 VanDerWaalsContact CA-O 3.31Å; S397-A401 WeakPolarHBondContact CA-O 3.43Å; S397-A401 WeakPolarHBondContact CB-O 3.32Å; S397-A401 PolarHBondContact OG-O 3Å
398	N	91.1	Very high	91.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.195	C	C	.	.			trans	-110.1	2.9	171.8	63.6	3.1	0	0	0	113.3	F312 I313 Y340 P341 R344 D400 A401	F312-N398 PolarHBondContact O-ND2 3.03Å; F312-N398 VanDerWaalsContact O-ND2 3.15Å; I313-N398 HydrophobicContact CD1-CB 4.47Å; Y340-N398 VanDerWaalsContact C-ND2 3.29Å; Y340-N398 PolarHBondContact O-ND2 3.18Å; Y340-N398 VanDerWaalsContact O-ND2 3.08Å; P341-N398 VanDerWaalsContact O-CB 3.31Å; P341-N398 WeakPolarHBondContact O-CB 3.46Å; P341-N398 PolarHBondContact O-ND2 3.37Å; R344-N398 WeakPolarHBondContact CD-O 3.39Å; R344-N398 PolarHBondContact NE-O 3.22Å; N398-D400 PolarHBondContact OD1-N 3.5Å; N398-D400 VanDerWaalsContact OD1-N 3.14Å; N398-A401 PolarHBondContact N-O 3.28Å; N398-A401 PolarHBondContact OD1-N 3.25Å; N398-A401 PolarHBondContact OD1-O 2.82Å
399	G	86.6	Confident	91.7	Very high	49 Å²	49	31.1 Å²	31.1	51%	0.505	19%	0.191	S	C	.	.	S	Bend	trans	96.6	-29.2	-176	0	0	0	0	0	114.3	S397	S397-G399 PolarHBondContact OG-N 3.03Å; S397-G399 VanDerWaalsContact OG-N 3.16Å
400	D	88.2	Confident	91.8	Very high	60 Å²	60	33.3 Å²	33.3	32%	0.321	20%	0.195	S	C	.	.	S	Bend	trans	-95.8	-32.6	177.9	-58.3	-13.2	0	0	0	110.6	K224 G311 N398	K224-D400 IonicContact NZ-OD1 3.66Å; K224-D400 PolarHBondContact NZ-OD1 3.29Å; K224-D400 IonicContact NZ-OD2 2.76Å; K224-D400 PolarHBondContact NZ-OD2 2.8Å; G311-D400 WeakPolarHBondContact CA-OD2 3.45Å; G311-D400 PolarHBondContact N-OD2 2.95Å; G311-D400 VanDerWaalsContact N-OD2 3.1Å; N398-D400 PolarHBondContact OD1-N 3.5Å; N398-D400 VanDerWaalsContact OD1-N 3.14Å
401	A	90.2	Very high	91.8	Very high	29 Å²	29	33.3 Å²	33.3	24%	0.24	20%	0.195	C	C	.	.			trans	-134	163.6	176.4	0	0	0	0	0	112.5	I313 S397 N398	I313-A401 HydrophobicContact CB-CB 4.44Å; I313-A401 HydrophobicContact CD1-CB 4.25Å; I313-A401 WeakPolarHBondContact CD1-O 3.36Å; I313-A401 HydrophobicContact CG1-CB 4.19Å; S397-A401 VanDerWaalsContact CA-O 3.31Å; S397-A401 WeakPolarHBondContact CA-O 3.43Å; S397-A401 WeakPolarHBondContact CB-O 3.32Å; S397-A401 PolarHBondContact OG-O 3Å; N398-A401 PolarHBondContact N-O 3.28Å; N398-A401 PolarHBondContact OD1-N 3.25Å; N398-A401 PolarHBondContact OD1-O 2.82Å
402	S	92.7	Very high	91.5	Very high	81 Å²	81	32.7 Å²	32.7	57%	0.566	19%	0.191	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	145.1	170.1	-169.5	0	0	0	0	111.5	V396	V396-S402 CarbonylContact O-C 3.6Å; V396-S402 VanDerWaalsContact O-CA 3.25Å; V396-S402 WeakPolarHBondContact O-CA 3.35Å; V396-S402 PolarHBondContact O-OG 3.33Å; V396-S402 VanDerWaalsContact O-OG 3.09Å
403	V	92.8	Very high	91.2	Very high	36 Å²	36	32.9 Å²	32.9	22%	0.218	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	138	-178.3	176.4	0	0	0	0	109.9	I313 P315 V396	I313-V403 HydrophobicContact CB-CG2 3.92Å; I313-V403 HydrophobicContact CG2-CB 4.14Å; I313-V403 HydrophobicContact CG2-CG2 3.75Å; P315-V403 HydrophobicContact CB-CG1 4.37Å; P315-V403 HydrophobicContact CG-CG1 4.07Å; V396-V403 HydrophobicContact CG1-CB 4.17Å; V396-V403 PolarHBondContact N-O 2.8Å; V396-V403 PolarHBondContact O-N 2.93Å
404	E	92.4	Very high	90.9	Very high	128 Å²	128	38.4 Å²	38.4	60%	0.598	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	159.4	175.7	-55.7	-153.4	123.5	0	0	112.2	T393 F394 S395	T393-E404 HydrophobicContact CG2-CB 4.18Å; F394-E404 CarbonylContact O-C 3.55Å; F394-E404 VanDerWaalsContact O-CA 3.29Å; F394-E404 WeakPolarHBondContact O-CA 3.42Å; S395-E404 VanDerWaalsContact CB-OE1 3.3Å; S395-E404 WeakPolarHBondContact CB-OE1 3.42Å; S395-E404 PolarHBondContact OG-OE1 2.91Å
405	R	90.9	Very high	90.7	Very high	50 Å²	50	38.4 Å²	38.4	19%	0.189	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	66.2	-147	-179.9	-147.4	-151.8	-176	16.1	112.3	G317 H319 V335 F394 F407	G317-R405 PolarHBondContact O-NH1 2.84Å; G317-R405 PolarHBondContact O-NH2 2.89Å; H319-R405 PolarHBondContact O-NH2 2.99Å; H319-R405 VanDerWaalsContact O-NH2 3.15Å; V335-R405 HydrophobicContact CG2-CG 4.42Å; F394-R405 PolarHBondContact N-O 2.79Å; F394-R405 WeakPolarHBondContact O-CA 3.31Å; F394-R405 PolarHBondContact O-N 3.32Å; R405-F407 HydrophobicContact CG-CE2 3.93Å; R405-F407 HydrophobicContact CG-CZ 4.14Å; R405-F407 VanDerWaalsContact O-CD2 3.31Å; R405-F407 WeakPolarHBondContact O-CD2 3.35Å; R405-F407 WeakPolarHBondContact O-CE2 3.45Å
406	S	92.1	Very high	90.4	Very high	53 Å²	53	41 Å²	41	37%	0.371	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.5	-177	-56.5	0	0	0	0	114.9	Y392 T393	Y392-S406 CarbonylContact O-C 3.59Å; Y392-S406 WeakPolarHBondContact O-CA 3.35Å; T393-S406 PolarHBondContact OG1-OG 2.81Å
407	F	92.8	Very high	90.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.3	174.5	-60.7	-96	0	0	0	110	H319 P321 Q323 L333 V335 W348 V391 Y392 R405	H319-F407 HydrophobicContact CB-CE1 4.22Å; P321-F407 CarbonylContact O-C 3.56Å; P321-F407 WeakPolarHBondContact O-CA 3.29Å; Q323-F407 HydrophobicContact CG-CD1 4.35Å; L333-F407 HydrophobicContact CD1-CB 4.04Å; L333-F407 HydrophobicContact CD1-CD2 4.26Å; L333-F407 HydrophobicContact CD1-CG 4.2Å; L333-F407 HydrophobicContact CD2-CB 4.2Å; L333-F407 HydrophobicContact CD2-CD1 4.14Å; L333-F407 HydrophobicContact CD2-CG 4.16Å; V335-F407 HydrophobicContact CG2-CE2 3.8Å; V335-F407 HydrophobicContact CG2-CZ 3.86Å; W348-F407 HydrophobicContact CH2-CD2 4.16Å; W348-F407 AromaticContact CH2-CE2 3.72Å; W348-F407 HydrophobicContact CH2-CE2 3.72Å; W348-F407 AromaticContact CZ3-CD2 3.79Å; W348-F407 HydrophobicContact CZ3-CD2 3.79Å; W348-F407 AromaticContact CZ3-CE2 3.81Å; W348-F407 HydrophobicContact CZ3-CE2 3.81Å; V391-F407 CarbonylContact C-O 3.59Å; V391-F407 WeakPolarHBondContact CA-O 3.49Å; Y392-F407 PolarHBondContact N-O 3.03Å; Y392-F407 PolarHBondContact O-N 3.1Å; R405-F407 HydrophobicContact CG-CE2 3.93Å; R405-F407 HydrophobicContact CG-CZ 4.14Å; R405-F407 VanDerWaalsContact O-CD2 3.31Å; R405-F407 WeakPolarHBondContact O-CD2 3.35Å; R405-F407 WeakPolarHBondContact O-CE2 3.45Å
408	H	91.7	Very high	89.8	Confident	66 Å²	66	44.6 Å²	44.6	31%	0.306	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	116.8	175	-61.1	-103.8	0	0	0	108.4	P321 Q323 Y410 F474	P321-H408 PolarHBondContact O-N 2.94Å; Q323-H408 PolarHBondContact N-O 3.29Å; H408-Y410 HydrophobicContact CB-CE2 3.88Å; H408-F474 HydrophobicContact CB-CE1 4.26Å
409	V	91.8	Very high	89.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.2	-176.8	176.4	0	0	0	0	109.6	Q323 V325 L331 L333 L381 G389 G390 Y392 V411	Q323-V409 HydrophobicContact CB-CG2 4.33Å; Q323-V409 WeakPolarHBondContact O-CA 3.32Å; V325-V409 HydrophobicContact CG1-CG1 4.17Å; L331-V409 HydrophobicContact CD2-CB 4.38Å; L331-V409 HydrophobicContact CD2-CG1 3.69Å; L331-V409 HydrophobicContact CD2-CG2 3.76Å; L333-V409 HydrophobicContact CD1-CG2 4.31Å; L333-V409 HydrophobicContact CD2-CG2 4.27Å; L381-V409 HydrophobicContact CD1-CG1 4.4Å; G389-V409 CarbonylContact C-O 3.38Å; G389-V409 VanDerWaalsContact CA-O 3.31Å; G389-V409 WeakPolarHBondContact CA-O 3.23Å; G390-V409 PolarHBondContact N-O 3.35Å; G390-V409 PolarHBondContact O-N 3.12Å; Y392-V409 HydrophobicContact CD2-CB 3.89Å; Y392-V409 HydrophobicContact CD2-CG2 3.49Å; Y392-V409 VanDerWaalsContact CD2-CG2 3.49Å; Y392-V409 HydrophobicContact CE2-CB 3.92Å; Y392-V409 HydrophobicContact CE2-CG1 4.37Å; Y392-V409 HydrophobicContact CE2-CG2 3.9Å; Y392-V409 HydrophobicContact CG-CG2 4.48Å; V409-V411 HydrophobicContact CG1-CG2 4.47Å
410	Y	89.5	Confident	89.3	Confident	58 Å²	58	48.1 Å²	48.1	23%	0.227	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.5	178.1	-64.2	-92.1	0	0	0	110.1	I322 Q323 E324 V325 H408 Y435 A473 F474	I322-Y410 HydrophobicContact CG2-CD2 4.06Å; I322-Y410 HydrophobicContact CG2-CE2 3.94Å; Q323-Y410 PolarHBondContact O-N 3.04Å; E324-Y410 WeakPolarHBondContact CA-O 3.4Å; V325-Y410 PolarHBondContact N-O 3.4Å; H408-Y410 HydrophobicContact CB-CE2 3.88Å; Y410-Y435 HydrophobicContact CD1-CE1 4.2Å; Y410-Y435 WeakPolarHBondContact CD1-OH 3.41Å; Y410-A473 WeakPolarHBondContact CE1-O 3.45Å; Y410-F474 HydrophobicContact CD1-CB 4.5Å; Y410-F474 AromaticContact CD1-CD1 3.73Å; Y410-F474 HydrophobicContact CD1-CD1 3.73Å; Y410-F474 HydrophobicContact CD1-CE1 4.45Å; Y410-F474 HydrophobicContact CD1-CG 4.49Å; Y410-F474 HydrophobicContact CD2-CD1 4.46Å; Y410-F474 AromaticContact CE1-CD1 3.44Å; Y410-F474 HydrophobicContact CE1-CD1 3.44Å; Y410-F474 VanDerWaalsContact CE1-CD1 3.44Å; Y410-F474 AromaticContact CE1-CE1 3.74Å; Y410-F474 HydrophobicContact CE1-CE1 3.74Å; Y410-F474 HydrophobicContact CE1-CG 4.37Å; Y410-F474 HydrophobicContact CE2-CD1 4.2Å; Y410-F474 HydrophobicContact CE2-CE1 4.18Å; Y410-F474 HydrophobicContact CG-CD1 4.24Å; Y410-F474 AromaticContact CZ-CD1 3.7Å; Y410-F474 AromaticContact CZ-CE1 3.58Å
411	V	90.4	Very high	89	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	98.4	-174.6	-171.2	0	0	0	0	111.1	V325 E327 V384 V409 S413 Y435 F474	V325-V411 HydrophobicContact CG1-CG2 4.11Å; V325-V411 CarbonylContact O-C 3.59Å; V325-V411 WeakPolarHBondContact O-CA 3.5Å; E327-V411 HydrophobicContact CB-CG1 4.18Å; V384-V411 HydrophobicContact CG1-CG1 4.36Å; V384-V411 HydrophobicContact CG1-CG2 3.64Å; V409-V411 HydrophobicContact CG1-CG2 4.47Å; V411-S413 PolarHBondContact O-N 2.96Å; V411-Y435 WeakPolarHBondContact O-CB 3.35Å; V411-F474 PolarHBondContact N-O 3Å
412	N	87.5	Confident	88	Confident	23 Å²	23	49.4 Å²	49.4	12%	0.123	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	114.2	-179.7	-66.3	-23.6	0	0	0	110	E324 V325 K326 E327 Y435	E324-N412 PolarHBondContact OE2-ND2 3.17Å; V325-N412 PolarHBondContact O-N 2.61Å; K326-N412 CarbonylContact C-O 3.53Å; K326-N412 WeakPolarHBondContact CA-O 3.44Å; E327-N412 PolarHBondContact N-O 2.75Å; N412-Y435 CarbonylContact C-O 3.52Å; N412-Y435 WeakPolarHBondContact CA-O 3.26Å; N412-Y435 WeakPolarHBondContact OD1-CD1 3Å
413	S	87	Confident	86.9	Confident	3 Å²	3	49 Å²	49	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.4	-177.7	47.9	0	0	0	0	110.8	E327 V411 G434 Y435	E327-S413 VanDerWaalsContact OE2-CB 3.32Å; E327-S413 WeakPolarHBondContact OE2-CB 3.38Å; V411-S413 PolarHBondContact O-N 2.96Å; S413-G434 CarbonylContact O-C 3.58Å; S413-G434 WeakPolarHBondContact O-CA 3.41Å; S413-Y435 PolarHBondContact N-O 3.07Å; S413-Y435 PolarHBondContact O-N 2.92Å; S413-Y435 VanDerWaalsContact O-O 3.07Å; S413-Y435 PolarHBondContact OG-N 2.88Å
414	K	87.7	Confident	85.6	Confident	136 Å²	136	51.9 Å²	51.9	59%	0.591	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.8	154.4	-178.3	68.5	177.2	-175.2	172	0	111.8	V416 E504	K414-V416 HydrophobicContact CG-CG2 4.35Å; K414-V416 PolarHBondContact O-N 3.41Å; K414-E504 HydrophobicContact CB-CB 4.3Å; K414-E504 HydrophobicContact CB-CG 4.44Å
415	P	88.5	Confident	84.3	Confident	4 Å²	4	54 Å²	54	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	137.9	175.8	27.3	-31.9	0	0	0	110.2	P438 A499 T501 E504 A506	P415-P438 HydrophobicContact CB-CB 4.16Å; P415-A499 HydrophobicContact CB-CB 4.12Å; P415-A499 WeakPolarHBondContact CG-O 3.19Å; P415-T501 VanDerWaalsContact CD-OG1 3.32Å; P415-T501 WeakPolarHBondContact CD-OG1 3.42Å; P415-E504 HydrophobicContact CG-CB 4.38Å; P415-E504 WeakPolarHBondContact CG-O 3.27Å; P415-A506 WeakPolarHBondContact O-CB 3.31Å
416	V	87.8	Confident	83.3	Confident	58 Å²	58	53.1 Å²	53.1	35%	0.352	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	128.4	170.9	176.9	0	0	0	0	108	K414 I418 A432 A433	K414-V416 HydrophobicContact CG-CG2 4.35Å; K414-V416 PolarHBondContact O-N 3.41Å; V416-I418 PolarHBondContact O-N 3.44Å; V416-A432 WeakPolarHBondContact O-CA 3.35Å; V416-A433 PolarHBondContact N-O 2.95Å; V416-A433 VanDerWaalsContact N-O 3.16Å; V416-A433 PolarHBondContact O-N 2.71Å
417	I	87.3	Confident	82.7	Confident	30 Å²	30	53.8 Å²	53.8	15%	0.154	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	121.2	172.2	-62	174.4	0	0	0	107.8	I431 A432 A499 A506 I508	I417-I431 CarbonylContact C-O 3.54Å; I417-I431 WeakPolarHBondContact CA-O 3.2Å; I417-A432 HydrophobicContact CG1-CB 4.4Å; I417-A499 HydrophobicContact CG1-CB 4.28Å; I417-A506 HydrophobicContact CG1-CB 4.45Å; I417-I508 HydrophobicContact CD1-CB 3.9Å; I417-I508 HydrophobicContact CD1-CG2 3.76Å; I417-I508 HydrophobicContact CG2-CG2 4.3Å
418	I	86.8	Confident	82.2	Confident	70 Å²	70	53.9 Å²	53.9	36%	0.359	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-27.5	-173.5	55.7	172.3	0	0	0	113.1	V416 I431 A433 E478	V416-I418 PolarHBondContact O-N 3.44Å; I418-I431 HydrophobicContact CD1-CG2 3.79Å; I418-I431 HydrophobicContact CG1-CB 4Å; I418-I431 HydrophobicContact CG1-CG2 3.77Å; I418-I431 WeakPolarHBondContact CG1-O 3.29Å; I418-I431 PolarHBondContact N-O 2.87Å; I418-A433 HydrophobicContact CD1-CB 4.08Å; I418-A433 HydrophobicContact CG2-CB 4.19Å; I418-E478 HydrophobicContact CD1-CB 4.43Å; I418-E478 VanDerWaalsContact CD1-CD 3.49Å; I418-E478 HydrophobicContact CD1-CG 4.28Å; I418-E478 VanDerWaalsContact CD1-OE1 3.31Å; I418-E478 WeakPolarHBondContact CD1-OE1 3.34Å
419	A	83.1	Confident	82	Confident	39 Å²	39	53.8 Å²	53.8	32%	0.322	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	154.5	175.5	0	0	0	0	0	111.1	I431	A419-I431 HydrophobicContact CB-CB 4.24Å; A419-I431 HydrophobicContact CB-CD1 4.02Å; A419-I431 HydrophobicContact CB-CG1 4.21Å; A419-I431 PolarHBondContact N-O 2.95Å; A419-I431 PolarHBondContact O-N 3.19Å
420	Q	84.8	Confident	81.9	Confident	85 Å²	85	53.8 Å²	53.8	40%	0.397	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.3	169	61.4	172.7	12.5	0	0	109.1	R429 I508 F510	Q420-R429 VanDerWaalsContact CA-O 3.3Å; Q420-R429 WeakPolarHBondContact CA-O 3.28Å; Q420-I508 HydrophobicContact CG-CD1 4.34Å; Q420-I508 VanDerWaalsContact OE1-CG1 3.31Å; Q420-F510 HydrophobicContact CB-CE1 3.93Å; Q420-F510 HydrophobicContact CB-CZ 3.77Å
421	D	80.9	Confident	81.9	Confident	81 Å²	81	51.6 Å²	51.6	43%	0.433	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.4	170.1	-59.5	-55	0	0	0	109.1	V428 R429	D421-V428 CarbonylContact O-C 3.41Å; D421-V428 WeakPolarHBondContact O-CA 3.48Å; D421-R429 HydrophobicContact CB-CB 3.98Å; D421-R429 PolarHBondContact N-O 2.85Å; D421-R429 VanDerWaalsContact N-O 3.09Å; D421-R429 PolarHBondContact O-N 3.12Å; D421-R429 WeakPolarHBondContact OD2-CD 3.3Å; D421-R429 IonicContact OD2-CZ 2.71Å; D421-R429 IonicContact OD2-NE 2.8Å; D421-R429 IonicContact OD2-NH1 3.17Å; D421-R429 PolarHBondContact OD2-NH1 2.87Å
422	G	69.8	Low	81.8	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	103.4	177.6	172.6	0	0	0	0	0	116.2
423	P	69	Low	81.9	Confident	74 Å²	74	50.5 Å²	50.5	48%	0.481	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-71.9	122.7	2	28.7	-34.1	0	0	0	112.6	Q427 V428	P423-Q427 WeakPolarHBondContact CA-O 3.46Å; P423-V428 HydrophobicContact CB-CG1 4.07Å
424	V	66.6	Low	81.9	Confident	96 Å²	96	50.4 Å²	50.4	58%	0.582	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.2	171.3	173.3	0	0	0	0	106.8	G426 Q427	V424-G426 PolarHBondContact O-N 3.4Å; V424-Q427 PolarHBondContact N-O 3.12Å; V424-Q427 VanDerWaalsContact N-O 3.09Å; V424-Q427 PolarHBondContact O-N 3.34Å
425	D	64.5	Low	81.7	Confident	171 Å²	171	45.9 Å²	45.9	91%	0.914	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	31.3	-176.1	-57.8	-29.6	0	0	0	114.8	Q427	D425-Q427 VanDerWaalsContact C-N 3.33Å; D425-Q427 PolarHBondContact O-N 3.13Å
426	G	69.8	Low	81.5	Confident	33 Å²	33	47.6 Å²	47.6	34%	0.34	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	4.5	-178.3	0	0	0	0	0	115.2	V424 N484 V485	V424-G426 PolarHBondContact O-N 3.4Å; G426-N484 CarbonylContact O-C 3.59Å; G426-V485 PolarHBondContact O-N 2.74Å
427	Q	78.6	Confident	81.4	Confident	66 Å²	66	47.8 Å²	47.8	31%	0.308	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	143.1	173.4	-175.6	164.2	102	0	0	111.6	P423 V424 D425 N484	P423-Q427 WeakPolarHBondContact CA-O 3.46Å; V424-Q427 PolarHBondContact N-O 3.12Å; V424-Q427 VanDerWaalsContact N-O 3.09Å; V424-Q427 PolarHBondContact O-N 3.34Å; D425-Q427 VanDerWaalsContact C-N 3.33Å; D425-Q427 PolarHBondContact O-N 3.13Å; Q427-N484 PolarHBondContact NE2-OD1 2.67Å
428	V	83.8	Confident	81.4	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	154.4	164.8	-65.4	0	0	0	0	110.7	D421 P423 W442 R482 L483 V485 L495 F510	D421-V428 CarbonylContact O-C 3.41Å; D421-V428 WeakPolarHBondContact O-CA 3.48Å; P423-V428 HydrophobicContact CB-CG1 4.07Å; V428-W442 HydrophobicContact CB-CH2 4.17Å; V428-W442 HydrophobicContact CB-CZ3 4.45Å; V428-W442 HydrophobicContact CG2-CE3 4.47Å; V428-W442 HydrophobicContact CG2-CH2 3.51Å; V428-W442 HydrophobicContact CG2-CZ2 4.33Å; V428-W442 HydrophobicContact CG2-CZ3 3.61Å; V428-R482 WeakPolarHBondContact O-CA 3.43Å; V428-L483 HydrophobicContact CG2-CB 3.93Å; V428-L483 WeakPolarHBondContact CG2-O 3.48Å; V428-L483 PolarHBondContact N-O 2.73Å; V428-L483 PolarHBondContact O-N 3.47Å; V428-V485 HydrophobicContact CG2-CG2 4.43Å; V428-L495 HydrophobicContact CG1-CD2 4.47Å; V428-L495 HydrophobicContact CG2-CD2 3.61Å; V428-F510 HydrophobicContact CB-CD1 4.24Å; V428-F510 HydrophobicContact CB-CE1 4.04Å; V428-F510 HydrophobicContact CB-CZ 4.36Å; V428-F510 HydrophobicContact CG1-CD1 3.84Å; V428-F510 HydrophobicContact CG1-CE1 4.13Å; V428-F510 HydrophobicContact CG1-CG 4.28Å
429	R	87.4	Confident	81.4	Confident	65 Å²	65	50.5 Å²	50.5	25%	0.245	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	135.7	-177.9	-170	-164.4	-166.7	-163.5	-4.7	109.3	Q420 D421 I431 E480 R482	Q420-R429 VanDerWaalsContact CA-O 3.3Å; Q420-R429 WeakPolarHBondContact CA-O 3.28Å; D421-R429 HydrophobicContact CB-CB 3.98Å; D421-R429 PolarHBondContact N-O 2.85Å; D421-R429 VanDerWaalsContact N-O 3.09Å; D421-R429 PolarHBondContact O-N 3.12Å; D421-R429 WeakPolarHBondContact OD2-CD 3.3Å; D421-R429 IonicContact OD2-CZ 2.71Å; D421-R429 IonicContact OD2-NE 2.8Å; D421-R429 IonicContact OD2-NH1 3.17Å; D421-R429 PolarHBondContact OD2-NH1 2.87Å; R429-I431 HydrophobicContact CG-CG1 4.37Å; R429-E480 HydrophobicContact CG-CG 4.16Å; R429-E480 IonicContact CZ-OE1 2.76Å; R429-E480 IonicContact CZ-OE2 2.71Å; R429-E480 IonicContact NE-OE1 3.42Å; R429-E480 PolarHBondContact NE-OE1 3.21Å; R429-E480 IonicContact NE-OE2 2.76Å; R429-E480 PolarHBondContact NE-OE2 3.47Å; R429-E480 VanDerWaalsContact NE-OE2 3.16Å; R429-E480 IonicContact NH2-OE1 2.78Å; R429-E480 IonicContact NH2-OE2 3.68Å; R429-E480 PolarHBondContact NH2-OE2 2.88Å; R429-R482 HydrophobicContact CB-CG 4.42Å; R429-R482 HydrophobicContact CG-CG 4.1Å
430	C	88.6	Confident	81.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.4	175.7	-169.9	0	0	0	0	108.5	W442 S481 C497	C430-W442 HydrophobicContact CB-CH2 3.6Å; C430-W442 HydrophobicContact CB-CZ2 3.51Å; C430-S481 PolarHBondContact N-O 3.49Å; C430-S481 PolarHBondContact O-N 3.34Å; C430-C497 HydrophobicContact CB-CB 3.77Å; C430-C497 WeakPolarHBondContact CB-SG 3.4Å; C430-C497 WeakPolarHBondContact SG-CB 3.24Å; C430-C497 CovalentContact SG-SG 2.04Å; C430-C497 PolarHBondContact SG-SG 2.79Å
431	I	90.1	Very high	81.6	Confident	12 Å²	12	45.5 Å²	45.5	6%	0.062	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126	177.6	-43.6	-173.8	0	0	0	108.7	I417 I418 A419 R429 L469 V479 E480	I417-I431 CarbonylContact C-O 3.54Å; I417-I431 WeakPolarHBondContact CA-O 3.2Å; I418-I431 HydrophobicContact CD1-CG2 3.79Å; I418-I431 HydrophobicContact CG1-CB 4Å; I418-I431 HydrophobicContact CG1-CG2 3.77Å; I418-I431 WeakPolarHBondContact CG1-O 3.29Å; I418-I431 PolarHBondContact N-O 2.87Å; A419-I431 HydrophobicContact CB-CB 4.24Å; A419-I431 HydrophobicContact CB-CD1 4.02Å; A419-I431 HydrophobicContact CB-CG1 4.21Å; A419-I431 PolarHBondContact N-O 2.95Å; A419-I431 PolarHBondContact O-N 3.19Å; R429-I431 HydrophobicContact CG-CG1 4.37Å; I431-L469 HydrophobicContact CD1-CD1 4.21Å; I431-L469 HydrophobicContact CG2-CD1 3.78Å; I431-V479 CarbonylContact C-O 3.56Å; I431-V479 WeakPolarHBondContact CA-O 3.27Å; I431-V479 VanDerWaalsContact CG2-O 3.25Å; I431-V479 WeakPolarHBondContact CG2-O 3.42Å; I431-E480 HydrophobicContact CG1-CB 4.5Å; I431-E480 HydrophobicContact CG1-CG 4.33Å
432	A	89.3	Confident	81.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153.5	-178.6	0	0	0	0	0	111.5	V416 I417 P438 I440 V479 A499	V416-A432 WeakPolarHBondContact O-CA 3.35Å; I417-A432 HydrophobicContact CG1-CB 4.4Å; A432-P438 HydrophobicContact CB-CG 4.49Å; A432-I440 HydrophobicContact CB-CD1 4.07Å; A432-I440 HydrophobicContact CB-CG1 4.26Å; A432-V479 HydrophobicContact CB-CG2 4.47Å; A432-V479 PolarHBondContact N-O 3.35Å; A432-V479 PolarHBondContact O-N 3.05Å; A432-A499 HydrophobicContact CB-CB 3.41Å; A432-A499 VanDerWaalsContact CB-CB 3.41Å
433	A	88.3	Confident	82.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	134.5	-180	0	0	0	0	0	113	V416 I418 R476 S477 E478	V416-A433 PolarHBondContact N-O 2.95Å; V416-A433 VanDerWaalsContact N-O 3.16Å; V416-A433 PolarHBondContact O-N 2.71Å; I418-A433 HydrophobicContact CD1-CB 4.08Å; I418-A433 HydrophobicContact CG2-CB 4.19Å; A433-R476 HydrophobicContact CB-CG 4.1Å; A433-R476 PolarHBondContact O-NE 2.77Å; A433-R476 PolarHBondContact O-NH2 2.92Å; A433-S477 CarbonylContact C-O 3.59Å; A433-S477 WeakPolarHBondContact CA-O 3.32Å; A433-S477 WeakPolarHBondContact CB-O 3.41Å; A433-E478 HydrophobicContact CB-CB 4.07Å; A433-E478 HydrophobicContact CB-CG 3.71Å
434	G	86.6	Confident	82.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.8	-177.1	-176.4	0	0	0	0	0	112.2	S413 P436 S477	S413-G434 CarbonylContact O-C 3.58Å; S413-G434 WeakPolarHBondContact O-CA 3.41Å; G434-P436 CarbonylContact C-O 3.59Å; G434-S477 PolarHBondContact N-O 3.07Å; G434-S477 PolarHBondContact O-N 2.83Å
435	Y	85.1	Confident	83.3	Confident	42 Å²	42	34.2 Å²	34.2	17%	0.165	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.8	170.2	-167.5	-100.2	0	0	0	111.1	Y410 V411 N412 S413 A473 G475	Y410-Y435 HydrophobicContact CD1-CE1 4.2Å; Y410-Y435 WeakPolarHBondContact CD1-OH 3.41Å; V411-Y435 WeakPolarHBondContact O-CB 3.35Å; N412-Y435 CarbonylContact C-O 3.52Å; N412-Y435 WeakPolarHBondContact CA-O 3.26Å; N412-Y435 WeakPolarHBondContact OD1-CD1 3Å; S413-Y435 PolarHBondContact N-O 3.07Å; S413-Y435 PolarHBondContact O-N 2.92Å; S413-Y435 VanDerWaalsContact O-O 3.07Å; S413-Y435 PolarHBondContact OG-N 2.88Å; Y435-A473 PolarHBondContact OH-O 2.98Å; Y435-G475 WeakPolarHBondContact CD2-O 2.98Å
436	P	84.6	Confident	83.4	Confident	40 Å²	40	32.7 Å²	32.7	26%	0.26	16%	0.164	S	C	.	.	S	Bend	cis	-56.5	178.5	-3.6	-26.8	36.5	0	0	0	114.4	G434 P438 T501 Q502	G434-P436 CarbonylContact C-O 3.59Å; P436-P438 WeakPolarHBondContact O-CD 3.37Å; P436-T501 HydrophobicContact CB-CG2 4.36Å; P436-T501 WeakPolarHBondContact O-CG2 3.5Å; P436-Q502 HydrophobicContact CG-CG 4.32Å
437	V	85.1	Confident	83.1	Confident	62 Å²	62	36.6 Å²	36.6	38%	0.376	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-61	122.7	-175.9	-175.6	0	0	0	0	110.6	V479 T501	V437-V479 HydrophobicContact CG1-CG1 3.49Å; V437-V479 VanDerWaalsContact CG1-CG1 3.49Å; V437-T501 WeakPolarHBondContact O-CG2 3.37Å
438	P	86.8	Confident	82.2	Confident	2 Å²	2	37 Å²	37	1%	0.013	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-74.7	147	-175.5	29.1	-34	0	0	0	112.8	P415 A432 P436 V479 S500 T501	P415-P438 HydrophobicContact CB-CB 4.16Å; A432-P438 HydrophobicContact CB-CG 4.49Å; P436-P438 WeakPolarHBondContact O-CD 3.37Å; P438-V479 HydrophobicContact CG-CG2 3.9Å; P438-S500 WeakPolarHBondContact CA-O 3.3Å; P438-T501 HydrophobicContact CB-CG2 4.3Å
439	K	86.6	Confident	80.9	Confident	154 Å²	154	48 Å²	48	67%	0.67	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.4	174.2	-63	-175.6	177.7	-172.7	0	110.3	A499 S500	K439-A499 CarbonylContact O-C 3.6Å; K439-A499 WeakPolarHBondContact O-CA 3.49Å; K439-S500 PolarHBondContact N-O 3.22Å; K439-S500 PolarHBondContact O-N 3.06Å; K439-S500 PolarHBondContact O-OG 2.9Å
440	I	86.9	Confident	79.6	Confident	2 Å²	2	48 Å²	48	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	144	173.9	-61.1	175	0	0	0	110.3	A432 V466 V479 V498 A499	A432-I440 HydrophobicContact CB-CD1 4.07Å; A432-I440 HydrophobicContact CB-CG1 4.26Å; I440-V466 HydrophobicContact CB-CG2 4.32Å; I440-V479 HydrophobicContact CD1-CG2 3.92Å; I440-V479 HydrophobicContact CG1-CG2 4.25Å; I440-V498 CarbonylContact C-O 3.54Å; I440-V498 WeakPolarHBondContact CA-O 3.29Å; I440-A499 HydrophobicContact CG1-CB 4.29Å
441	S	85.6	Confident	78.8	Confident	18 Å²	18	50.9 Å²	50.9	13%	0.126	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	152.8	173.2	-67.9	0	0	0	0	110.3	V498	S441-V498 PolarHBondContact N-O 3.42Å; S441-V498 PolarHBondContact O-N 3.18Å
442	W	85	Confident	77.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.3	-173.3	-65.8	91.9	0	0	0	111.4	V428 C430 W461 S481 L483 L495 E496 C497 F510	V428-W442 HydrophobicContact CB-CH2 4.17Å; V428-W442 HydrophobicContact CB-CZ3 4.45Å; V428-W442 HydrophobicContact CG2-CE3 4.47Å; V428-W442 HydrophobicContact CG2-CH2 3.51Å; V428-W442 HydrophobicContact CG2-CZ2 4.33Å; V428-W442 HydrophobicContact CG2-CZ3 3.61Å; C430-W442 HydrophobicContact CB-CH2 3.6Å; C430-W442 HydrophobicContact CB-CZ2 3.51Å; W442-W461 HydrophobicContact CB-CB 4.39Å; W442-W461 PolarHBondContact O-N 3.5Å; W442-S481 PolarHBondContact NE1-OG 2.97Å; W442-L483 HydrophobicContact CB-CD2 3.91Å; W442-L483 HydrophobicContact CD2-CB 4.11Å; W442-L483 HydrophobicContact CD2-CD2 4.02Å; W442-L483 HydrophobicContact CE3-CD2 4.17Å; W442-L483 HydrophobicContact CG-CB 4.44Å; W442-L483 HydrophobicContact CG-CD2 3.94Å; W442-L483 HydrophobicContact CZ2-CB 4.25Å; W442-L495 HydrophobicContact CE3-CD1 4.03Å; W442-L495 HydrophobicContact CE3-CD2 3.82Å; W442-L495 HydrophobicContact CE3-CG 3.84Å; W442-L495 HydrophobicContact CZ3-CD2 3.74Å; W442-L495 HydrophobicContact CZ3-CG 4.08Å; W442-E496 WeakPolarHBondContact CA-O 3.47Å; W442-C497 HydrophobicContact CD2-CB 4.29Å; W442-C497 HydrophobicContact CE3-CB 3.84Å; W442-C497 HydrophobicContact CH2-CB 4.02Å; W442-C497 HydrophobicContact CZ2-CB 4.42Å; W442-C497 HydrophobicContact CZ3-CB 3.71Å; W442-F510 AromaticContact CH2-CE2 3.86Å; W442-F510 HydrophobicContact CH2-CE2 3.86Å; W442-F510 HydrophobicContact CH2-CZ 4.08Å; W442-F510 HydrophobicContact CZ3-CD2 4Å; W442-F510 AromaticContact CZ3-CE2 3.53Å; W442-F510 HydrophobicContact CZ3-CE2 3.53Å; W442-F510 HydrophobicContact CZ3-CZ 4.19Å
443	Y	82.4	Confident	76.8	Confident	36 Å²	36	51.8 Å²	51.8	14%	0.141	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	132.1	-178.8	-56.7	-96.8	0	0	0	111.1	A458 Q460 E496 V498	Y443-A458 HydrophobicContact CD1-CB 4.21Å; Y443-Q460 HydrophobicContact CD1-CB 3.91Å; Y443-Q460 HydrophobicContact CD1-CG 4.26Å; Y443-Q460 HydrophobicContact CE1-CB 3.65Å; Y443-Q460 HydrophobicContact CE1-CG 3.76Å; Y443-E496 PolarHBondContact N-O 2.92Å; Y443-E496 PolarHBondContact O-N 3.39Å; Y443-V498 HydrophobicContact CD2-CG2 3.78Å; Y443-V498 HydrophobicContact CE2-CB 4.08Å; Y443-V498 HydrophobicContact CE2-CG2 3.66Å
444	F	79.4	Confident	75.9	Confident	10 Å²	10	57 Å²	57	4%	0.044	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	143.1	175.2	-70.1	-86.7	0	0	0	111.8	W461 L483 H489 Y492 L495	F444-W461 HydrophobicContact CE2-CB 4.25Å; F444-W461 HydrophobicContact CE2-CD2 4.21Å; F444-W461 AromaticContact CE2-CE3 3.8Å; F444-W461 HydrophobicContact CE2-CE3 3.8Å; F444-W461 HydrophobicContact CE2-CG 4.42Å; F444-L483 HydrophobicContact CE2-CD2 4.32Å; F444-L483 HydrophobicContact CZ-CD2 3.96Å; F444-H489 HydrophobicContact CD1-CB 4.41Å; F444-H489 HydrophobicContact CE1-CB 3.87Å; F444-H489 AromaticContact CE1-CD2 3.53Å; F444-H489 AromaticContact CE1-CG 3.85Å; F444-H489 AromaticContact CE2-CD2 3.65Å; F444-H489 AromaticContact CE2-NE2 3.97Å; F444-H489 HydrophobicContact CZ-CB 4.39Å; F444-H489 AromaticContact CZ-CD2 3.3Å; F444-H489 WeakPolarHBondContact CZ-CD2 3.36Å; F444-H489 AromaticContact CZ-CG 3.88Å; F444-H489 AromaticContact CZ-NE2 3.86Å; F444-Y492 HydrophobicContact CB-CD1 3.92Å; F444-Y492 HydrophobicContact CB-CD2 3.65Å; F444-Y492 HydrophobicContact CB-CE1 4.07Å; F444-Y492 HydrophobicContact CB-CE2 3.8Å; F444-Y492 HydrophobicContact CB-CG 3.7Å; F444-Y492 AromaticContact CD1-CD2 3.65Å; F444-Y492 HydrophobicContact CD1-CD2 3.65Å; F444-Y492 HydrophobicContact CD1-CE2 4.24Å; F444-Y492 HydrophobicContact CD1-CG 4.15Å; F444-Y492 AromaticContact CG-CD2 3.83Å; F444-Y492 HydrophobicContact CG-CD2 3.83Å; F444-Y492 HydrophobicContact CG-CE2 4.03Å; F444-Y492 HydrophobicContact CG-CG 4.31Å; F444-L495 HydrophobicContact CD1-CD1 3.86Å; F444-L495 HydrophobicContact CD2-CD1 4.43Å; F444-L495 HydrophobicContact CE1-CD1 3.82Å; F444-L495 HydrophobicContact CE2-CD1 4.39Å; F444-L495 HydrophobicContact CG-CD1 4.18Å; F444-L495 HydrophobicContact CZ-CD1 4.1Å
445	C	74	Confident	75	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	121.9	-174.7	-67.4	0	0	0	0	113	C452 Y492 H493 T494	C445-C452 HydrophobicContact CB-CB 4.27Å; C445-C452 WeakPolarHBondContact CB-SG 3.44Å; C445-C452 WeakPolarHBondContact SG-CB 3.37Å; C445-C452 CovalentContact SG-SG 2.03Å; C445-C452 PolarHBondContact SG-SG 2.84Å; C445-Y492 WeakPolarHBondContact O-CB 3.23Å; C445-H493 PolarHBondContact O-N 2.89Å; C445-T494 VanDerWaalsContact CB-O 3.29Å; C445-T494 WeakPolarHBondContact CB-O 3.42Å; C445-T494 WeakPolarHBondContact CB-OG1 3.36Å; C445-T494 PolarHBondContact N-O 2.9Å; C445-T494 PolarHBondContact O-N 2.02Å
446	E	67	Low	73.6	Confident	140 Å²	140	65.6 Å²	65.6	65%	0.654	34%	0.335	S	S	*	.	S	Bend	trans	-73	-35.4	173.3	-62.3	-176.2	166.4	0	0	112.9	Y492 H493	E446-Y492 HydrophobicContact CG-CD1 3.91Å; E446-Y492 HydrophobicContact CG-CE1 3.84Å; E446-H493 PolarHBondContact O-ND1 2.85Å
447	L	64.1	Low	72.3	Confident	114 Å²	114	70.9 Å²	70.9	60%	0.597	36%	0.36	S	S	*	.	S	Bend	trans	-108.9	131.6	-174	-71.9	171.9	0	0	0	112.7
448	P	59.4	Low	71.1	Confident	75 Å²	75	69.4 Å²	69.4	49%	0.487	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	137.5	175.7	-23	32.8	0	0	0	113.5	T450 H493	P448-T450 PolarHBondContact O-N 2.85Å; P448-H493 HydrophobicContact CG-CB 4.03Å
449	R	56.8	Low	70	Confident	236 Å²	236	72.8 Å²	72.8	89%	0.891	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	23.8	167.5	-52.8	179.4	176	172	-1.2	116.8
450	T	60.9	Low	68.9	Low	64 Å²	64	70.9 Å²	70.9	39%	0.393	37%	0.369	S	S	.	.	S	Bend	trans	-113.7	147.5	167.8	52.2	0	0	0	0	110.8	P448 C452	P448-T450 PolarHBondContact O-N 2.85Å; T450-C452 PolarHBondContact O-N 3.38Å; T450-C452 PolarHBondContact O-SG 2.99Å; T450-C452 VanDerWaalsContact O-SG 3.36Å
451	R	69.8	Low	67.9	Low	61 Å²	61	76 Å²	76	23%	0.23	39%	0.388	C	S	.	.			trans	-75.3	117	175.5	-176.5	179.6	173.6	-166.1	-13.1	108.5	S453 N454 E496 E505 Y507	R451-S453 PolarHBondContact NE-OG 3.03Å; R451-S453 PolarHBondContact NH2-OG 2.88Å; R451-N454 PolarHBondContact NE-OD1 2.65Å; R451-N454 PolarHBondContact NH1-OD1 2.68Å; R451-E496 WeakPolarHBondContact CG-OE1 3.14Å; R451-E496 IonicContact NE-OE1 3.23Å; R451-E505 IonicContact CZ-OE2 3.84Å; R451-E505 IonicContact NH1-OE2 3.27Å; R451-E505 PolarHBondContact NH1-OE2 3.48Å; R451-E505 IonicContact NH2-OE1 3.03Å; R451-E505 IonicContact NH2-OE2 2.88Å; R451-E505 PolarHBondContact NH2-OE2 3.41Å; R451-Y507 HydrophobicContact CG-CE2 4.38Å
452	C	71.9	Confident	66.6	Low	5 Å²	5	83.4 Å²	83.4	3%	0.034	42%	0.421	C	S	.	.	S	Bend	trans	-88.9	-32.2	-170.5	-56.5	0	0	0	0	111.7	C445 T450 N454 L455 A458 E496	C445-C452 HydrophobicContact CB-CB 4.27Å; C445-C452 WeakPolarHBondContact CB-SG 3.44Å; C445-C452 WeakPolarHBondContact SG-CB 3.37Å; C445-C452 CovalentContact SG-SG 2.03Å; C445-C452 PolarHBondContact SG-SG 2.84Å; T450-C452 PolarHBondContact O-N 3.38Å; T450-C452 PolarHBondContact O-SG 2.99Å; T450-C452 VanDerWaalsContact O-SG 3.36Å; C452-N454 PolarHBondContact O-N 2.87Å; C452-L455 WeakPolarHBondContact O-CB 3.31Å; C452-L455 PolarHBondContact O-N 3.31Å; C452-A458 VanDerWaalsContact O-CB 3.27Å; C452-A458 WeakPolarHBondContact O-CB 3.42Å; C452-E496 WeakPolarHBondContact CA-OE2 3.13Å; C452-E496 WeakPolarHBondContact CB-OE2 3.47Å; C452-E496 PolarHBondContact N-OE2 2.96Å
453	S	67.4	Low	65.4	Low	26 Å²	26	87.3 Å²	87.3	18%	0.182	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-11.2	172.8	56.4	0	0	0	0	114.9	R451 E496	R451-S453 PolarHBondContact NE-OG 3.03Å; R451-S453 PolarHBondContact NH2-OG 2.88Å; S453-E496 WeakPolarHBondContact CB-OE1 3.32Å; S453-E496 PolarHBondContact N-OE2 2.81Å; S453-E496 PolarHBondContact OG-OE1 2.85Å
454	N	67.6	Low	64.5	Low	110 Å²	110	87.2 Å²	87.2	59%	0.588	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-0.6	172.6	-76.9	18.5	0	0	0	114.2	R451 C452	R451-N454 PolarHBondContact NE-OD1 2.65Å; R451-N454 PolarHBondContact NH1-OD1 2.68Å; C452-N454 PolarHBondContact O-N 2.87Å
455	L	67.5	Low	63.7	Low	94 Å²	94	95.5 Å²	95.5	49%	0.492	49%	0.491	S	S	.	.	S	Bend	trans	-98	132.4	-177.6	-64.3	173.8	0	0	0	111	C452 N457 A458	C452-L455 WeakPolarHBondContact O-CB 3.31Å; C452-L455 PolarHBondContact O-N 3.31Å; L455-N457 PolarHBondContact O-N 3Å; L455-N457 VanDerWaalsContact O-N 3.1Å; L455-A458 HydrophobicContact CB-CB 4.47Å; L455-A458 WeakPolarHBondContact O-CB 3.49Å; L455-A458 PolarHBondContact O-N 3.29Å; L455-A458 VanDerWaalsContact O-N 3.16Å
456	P	57.1	Low	63.5	Low	128 Å²	128	98 Å²	98	83%	0.831	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-12	-175.7	28.3	-36.2	0	0	0	114.6
457	N	57	Low	63.9	Low	150 Å²	150	95.5 Å²	95.5	80%	0.802	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	13.6	178.8	-65.5	14.1	0	0	0	112.6	L455 T459	L455-N457 PolarHBondContact O-N 3Å; L455-N457 VanDerWaalsContact O-N 3.1Å; N457-T459 PolarHBondContact O-N 2.86Å
458	A	60.7	Low	64.4	Low	31 Å²	31	93.5 Å²	93.5	26%	0.256	49%	0.492	S	S	.	.			trans	-68.2	125.4	-178.8	0	0	0	0	0	111.7	Y443 C452 L455 Q460	Y443-A458 HydrophobicContact CD1-CB 4.21Å; C452-A458 VanDerWaalsContact O-CB 3.27Å; C452-A458 WeakPolarHBondContact O-CB 3.42Å; L455-A458 HydrophobicContact CB-CB 4.47Å; L455-A458 WeakPolarHBondContact O-CB 3.49Å; L455-A458 PolarHBondContact O-N 3.29Å; L455-A458 VanDerWaalsContact O-N 3.16Å; A458-Q460 VanDerWaalsContact C-N 3.35Å; A458-Q460 PolarHBondContact O-N 3.48Å
459	T	61.9	Low	65.2	Low	73 Å²	73	93.9 Å²	93.9	45%	0.448	49%	0.49	S	S	.	.			trans	-71.8	90.4	170.5	47	0	0	0	0	109.8	N457	N457-T459 PolarHBondContact O-N 2.86Å
460	Q	64	Low	65.9	Low	114 Å²	114	85.5 Å²	85.5	53%	0.533	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	128.3	165.1	-175	177.7	4.9	0	0	108.9	Y443 A458	Y443-Q460 HydrophobicContact CD1-CB 3.91Å; Y443-Q460 HydrophobicContact CD1-CG 4.26Å; Y443-Q460 HydrophobicContact CE1-CB 3.65Å; Y443-Q460 HydrophobicContact CE1-CG 3.76Å; A458-Q460 VanDerWaalsContact C-N 3.35Å; A458-Q460 PolarHBondContact O-N 3.48Å
461	W	65.4	Low	66.4	Low	110 Å²	110	90.1 Å²	90.1	42%	0.417	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	139.8	167.6	-166.3	-94.5	0	0	0	109.1	W442 F444 S463 L483 H489	W442-W461 HydrophobicContact CB-CB 4.39Å; W442-W461 PolarHBondContact O-N 3.5Å; F444-W461 HydrophobicContact CE2-CB 4.25Å; F444-W461 HydrophobicContact CE2-CD2 4.21Å; F444-W461 AromaticContact CE2-CE3 3.8Å; F444-W461 HydrophobicContact CE2-CE3 3.8Å; F444-W461 HydrophobicContact CE2-CG 4.42Å; W461-S463 PolarHBondContact O-N 3.28Å; W461-L483 HydrophobicContact CG-CD1 4.18Å; W461-H489 AromaticContact CE3-NE2 3.97Å; W461-H489 AromaticContact CH2-NE2 3.88Å; W461-H489 AromaticContact CZ3-CE1 3.89Å; W461-H489 AromaticContact CZ3-NE2 3.3Å; W461-H489 VanDerWaalsContact CZ3-NE2 3.3Å; W461-H489 WeakPolarHBondContact CZ3-NE2 3.3Å
462	E	59.9	Low	66.5	Low	174 Å²	174	89.3 Å²	89.3	81%	0.813	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-54.3	134.2	176.9	-69.5	-167.8	138.4	0	0	110	P464	E462-P464 WeakPolarHBondContact O-CD 3.31Å
463	S	59.8	Low	66.5	Low	82 Å²	82	92.2 Å²	92.2	57%	0.573	51%	0.513	S	S	*	.			trans	-61.9	109.6	-170.1	54	0	0	0	0	110.8	W461	W461-S463 PolarHBondContact O-N 3.28Å
464	P	62.6	Low	66.8	Low	33 Å²	33	93.3 Å²	93.3	21%	0.214	51%	0.514	C	S	.	.			trans	-66.7	153	175.9	30.9	-35.1	0	0	0	109.2	E462 V466 S481	E462-P464 WeakPolarHBondContact O-CD 3.31Å; P464-V466 PolarHBondContact O-N 2.8Å; P464-S481 WeakPolarHBondContact CG-OG 3.36Å
465	E	62.7	Low	66.9	Low	184 Å²	184	88 Å²	88	86%	0.86	49%	0.486	S	S	*	.			trans	-52.3	133.3	-175.6	-66.8	-170.6	138.8	0	0	112
466	V	70.1	Confident	67.4	Low	53 Å²	53	87 Å²	87	32%	0.321	48%	0.476	S	S	.	.			trans	-100.3	106.1	-174.8	174.2	0	0	0	0	108.2	I440 P464 V479	I440-V466 HydrophobicContact CB-CG2 4.32Å; P464-V466 PolarHBondContact O-N 2.8Å; V466-V479 HydrophobicContact CG1-CB 3.55Å; V466-V479 HydrophobicContact CG1-CG1 4.09Å; V466-V479 HydrophobicContact CG1-CG2 3.68Å
467	T	75.5	Confident	68.6	Low	88 Å²	88	81 Å²	81	54%	0.54	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	120.3	-178.8	-54.7	0	0	0	0	109.7	L469 V479 E480	T467-L469 PolarHBondContact O-N 2.97Å; T467-V479 CarbonylContact O-C 3.53Å; T467-V479 WeakPolarHBondContact O-CA 3.47Å; T467-E480 PolarHBondContact N-O 3.1Å; T467-E480 PolarHBondContact O-N 3.13Å
468	V	75.4	Confident	70.1	Confident	72 Å²	72	77 Å²	77	44%	0.436	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	120.9	171.3	-175.5	0	0	0	0	108.9	E471 V479	V468-E471 HydrophobicContact CG1-CB 4.1Å; V468-V479 HydrophobicContact CG2-CG1 4.22Å
469	L	74.7	Confident	71.4	Confident	83 Å²	83	75.5 Å²	75.5	44%	0.435	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-32.9	177	-67.1	-174.9	0	0	0	112.3	I431 T467 E478 E480	I431-L469 HydrophobicContact CD1-CD1 4.21Å; I431-L469 HydrophobicContact CG2-CD1 3.78Å; T467-L469 PolarHBondContact O-N 2.97Å; L469-E478 HydrophobicContact CB-CB 4.34Å; L469-E478 PolarHBondContact N-O 2.64Å; L469-E480 HydrophobicContact CD1-CB 3.93Å; L469-E480 HydrophobicContact CD2-CB 4.11Å; L469-E480 HydrophobicContact CG-CB 3.89Å
470	S	72.5	Confident	72.7	Confident	60 Å²	60	72.8 Å²	72.8	42%	0.42	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	121.5	-178.7	-175.6	0	0	0	0	109.3	S477 E478	S470-S477 CarbonylContact O-C 3.59Å; S470-S477 VanDerWaalsContact O-CA 3.28Å; S470-S477 WeakPolarHBondContact O-CA 3.45Å; S470-S477 WeakPolarHBondContact O-CB 3.47Å; S470-E478 PolarHBondContact N-O 3.01Å; S470-E478 PolarHBondContact O-N 3.15Å
471	E	70.7	Confident	73.8	Confident	161 Å²	161	67.4 Å²	67.4	75%	0.752	36%	0.358	S	S	*	.			trans	-105.6	129.2	-179.7	-172.4	173.6	-155.9	0	0	110.4	V468	V468-E471 HydrophobicContact CG1-CB 4.1Å
472	S	73.2	Confident	74.7	Confident	44 Å²	44	67.8 Å²	67.8	31%	0.308	36%	0.36	S	S	.	.			trans	-124.2	116.8	174.8	176.1	0	0	0	0	109.9	F474 G475 R476 S477	S472-F474 PolarHBondContact O-N 2.92Å; S472-F474 VanDerWaalsContact O-N 3.12Å; S472-G475 WeakPolarHBondContact CB-O 3.42Å; S472-G475 PolarHBondContact OG-N 2.94Å; S472-R476 WeakPolarHBondContact CB-O 3.38Å; S472-S477 PolarHBondContact N-OG 3.27Å; S472-S477 PolarHBondContact O-OG 3.05Å
473	A	69.9	Low	75.8	Confident	67 Å²	67	60 Å²	60	55%	0.554	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.5	-173.6	0	0	0	0	0	114.3	Y410 Y435	Y410-A473 WeakPolarHBondContact CE1-O 3.45Å; Y435-A473 PolarHBondContact OH-O 2.98Å
474	F	74.2	Confident	76.7	Confident	48 Å²	48	61.2 Å²	61.2	21%	0.211	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	2.8	-174.4	-61.3	-79.5	0	0	0	114.1	V391 H408 Y410 V411 S472	V391-F474 HydrophobicContact CG2-CZ 4.18Å; H408-F474 HydrophobicContact CB-CE1 4.26Å; Y410-F474 HydrophobicContact CD1-CB 4.5Å; Y410-F474 AromaticContact CD1-CD1 3.73Å; Y410-F474 HydrophobicContact CD1-CD1 3.73Å; Y410-F474 HydrophobicContact CD1-CE1 4.45Å; Y410-F474 HydrophobicContact CD1-CG 4.49Å; Y410-F474 HydrophobicContact CD2-CD1 4.46Å; Y410-F474 AromaticContact CE1-CD1 3.44Å; Y410-F474 HydrophobicContact CE1-CD1 3.44Å; Y410-F474 VanDerWaalsContact CE1-CD1 3.44Å; Y410-F474 AromaticContact CE1-CE1 3.74Å; Y410-F474 HydrophobicContact CE1-CE1 3.74Å; Y410-F474 HydrophobicContact CE1-CG 4.37Å; Y410-F474 HydrophobicContact CE2-CD1 4.2Å; Y410-F474 HydrophobicContact CE2-CE1 4.18Å; Y410-F474 HydrophobicContact CG-CD1 4.24Å; Y410-F474 AromaticContact CZ-CD1 3.7Å; Y410-F474 AromaticContact CZ-CE1 3.58Å; V411-F474 PolarHBondContact N-O 3Å; S472-F474 PolarHBondContact O-N 2.92Å; S472-F474 VanDerWaalsContact O-N 3.12Å
475	G	70.4	Confident	77.2	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-168.4	-163.3	-170.2	0	0	0	0	0	114	Y435 S472 S477	Y435-G475 WeakPolarHBondContact CD2-O 2.98Å; S472-G475 WeakPolarHBondContact CB-O 3.42Å; S472-G475 PolarHBondContact OG-N 2.94Å; G475-S477 PolarHBondContact O-N 3.33Å; G475-S477 PolarHBondContact O-OG 2.93Å
476	R	77.3	Confident	77.5	Confident	73 Å²	73	54.4 Å²	54.4	28%	0.275	30%	0.296	S	S	.	.			trans	-57	121.7	-165.5	-172.9	168.4	-170.4	-124.9	-0.6	112.8	A433 S472	A433-R476 HydrophobicContact CB-CG 4.1Å; A433-R476 PolarHBondContact O-NE 2.77Å; A433-R476 PolarHBondContact O-NH2 2.92Å; S472-R476 WeakPolarHBondContact CB-O 3.38Å
477	S	82.8	Confident	77.2	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	149.8	176.1	-60.7	0	0	0	0	109.9	A433 G434 S470 S472 G475	A433-S477 CarbonylContact C-O 3.59Å; A433-S477 WeakPolarHBondContact CA-O 3.32Å; A433-S477 WeakPolarHBondContact CB-O 3.41Å; G434-S477 PolarHBondContact N-O 3.07Å; G434-S477 PolarHBondContact O-N 2.83Å; S470-S477 CarbonylContact O-C 3.59Å; S470-S477 VanDerWaalsContact O-CA 3.28Å; S470-S477 WeakPolarHBondContact O-CA 3.45Å; S470-S477 WeakPolarHBondContact O-CB 3.47Å; S472-S477 PolarHBondContact N-OG 3.27Å; S472-S477 PolarHBondContact O-OG 3.05Å; G475-S477 PolarHBondContact O-N 3.33Å; G475-S477 PolarHBondContact O-OG 2.93Å
478	E	87.9	Confident	76.4	Confident	66 Å²	66	63 Å²	63	31%	0.308	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138	-175.3	-48.2	-157.5	141.1	0	0	111.4	I418 A433 L469 S470	I418-E478 HydrophobicContact CD1-CB 4.43Å; I418-E478 VanDerWaalsContact CD1-CD 3.49Å; I418-E478 HydrophobicContact CD1-CG 4.28Å; I418-E478 VanDerWaalsContact CD1-OE1 3.31Å; I418-E478 WeakPolarHBondContact CD1-OE1 3.34Å; A433-E478 HydrophobicContact CB-CB 4.07Å; A433-E478 HydrophobicContact CB-CG 3.71Å; L469-E478 HydrophobicContact CB-CB 4.34Å; L469-E478 PolarHBondContact N-O 2.64Å; S470-E478 PolarHBondContact N-O 3.01Å; S470-E478 PolarHBondContact O-N 3.15Å
479	V	88.3	Confident	75.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.1	-178	-51.7	0	0	0	0	112.3	I431 A432 V437 P438 I440 V466 T467 V468	I431-V479 CarbonylContact C-O 3.56Å; I431-V479 WeakPolarHBondContact CA-O 3.27Å; I431-V479 VanDerWaalsContact CG2-O 3.25Å; I431-V479 WeakPolarHBondContact CG2-O 3.42Å; A432-V479 HydrophobicContact CB-CG2 4.47Å; A432-V479 PolarHBondContact N-O 3.35Å; A432-V479 PolarHBondContact O-N 3.05Å; V437-V479 HydrophobicContact CG1-CG1 3.49Å; V437-V479 VanDerWaalsContact CG1-CG1 3.49Å; P438-V479 HydrophobicContact CG-CG2 3.9Å; I440-V479 HydrophobicContact CD1-CG2 3.92Å; I440-V479 HydrophobicContact CG1-CG2 4.25Å; V466-V479 HydrophobicContact CG1-CB 3.55Å; V466-V479 HydrophobicContact CG1-CG1 4.09Å; V466-V479 HydrophobicContact CG1-CG2 3.68Å; T467-V479 CarbonylContact O-C 3.53Å; T467-V479 WeakPolarHBondContact O-CA 3.47Å; V468-V479 HydrophobicContact CG2-CG1 4.22Å
480	E	88.7	Confident	75.1	Confident	15 Å²	15	59.2 Å²	59.2	7%	0.07	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143.9	179.5	178.2	169.7	158.7	0	0	111.5	R429 I431 T467 L469 R482	R429-E480 HydrophobicContact CG-CG 4.16Å; R429-E480 IonicContact CZ-OE1 2.76Å; R429-E480 IonicContact CZ-OE2 2.71Å; R429-E480 IonicContact NE-OE1 3.42Å; R429-E480 PolarHBondContact NE-OE1 3.21Å; R429-E480 IonicContact NE-OE2 2.76Å; R429-E480 PolarHBondContact NE-OE2 3.47Å; R429-E480 VanDerWaalsContact NE-OE2 3.16Å; R429-E480 IonicContact NH2-OE1 2.78Å; R429-E480 IonicContact NH2-OE2 3.68Å; R429-E480 PolarHBondContact NH2-OE2 2.88Å; I431-E480 HydrophobicContact CG1-CB 4.5Å; I431-E480 HydrophobicContact CG1-CG 4.33Å; T467-E480 PolarHBondContact N-O 3.1Å; T467-E480 PolarHBondContact O-N 3.13Å; L469-E480 HydrophobicContact CD1-CB 3.93Å; L469-E480 HydrophobicContact CD2-CB 4.11Å; L469-E480 HydrophobicContact CG-CB 3.89Å; E480-R482 IonicContact OE1-CZ 3.74Å; E480-R482 IonicContact OE1-NE 2.71Å; E480-R482 PolarHBondContact OE1-NE 2.6Å; E480-R482 IonicContact OE1-NH2 3.83Å; E480-R482 PolarHBondContact OE1-NH2 3.41Å
481	S	87.8	Confident	74.6	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.014	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.6	169.1	-176.5	0	0	0	0	109.9	C430 W442 P464	C430-S481 PolarHBondContact N-O 3.49Å; C430-S481 PolarHBondContact O-N 3.34Å; W442-S481 PolarHBondContact NE1-OG 2.97Å; P464-S481 WeakPolarHBondContact CG-OG 3.36Å
482	R	85	Confident	74.6	Confident	118 Å²	118	56.3 Å²	56.3	45%	0.445	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	147.9	177.3	-62.9	-174.3	-175.3	-152	4.9	110.6	V428 R429 E480	V428-R482 WeakPolarHBondContact O-CA 3.43Å; R429-R482 HydrophobicContact CB-CG 4.42Å; R429-R482 HydrophobicContact CG-CG 4.1Å; E480-R482 IonicContact OE1-CZ 3.74Å; E480-R482 IonicContact OE1-NE 2.71Å; E480-R482 PolarHBondContact OE1-NE 2.6Å; E480-R482 IonicContact OE1-NH2 3.83Å; E480-R482 PolarHBondContact OE1-NH2 3.41Å
483	L	82.8	Confident	74.4	Confident	9 Å²	9	58.7 Å²	58.7	5%	0.047	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	137.9	174.3	-173	68.3	0	0	0	110.1	V428 W442 F444 W461 L495	V428-L483 HydrophobicContact CG2-CB 3.93Å; V428-L483 WeakPolarHBondContact CG2-O 3.48Å; V428-L483 PolarHBondContact N-O 2.73Å; V428-L483 PolarHBondContact O-N 3.47Å; W442-L483 HydrophobicContact CB-CD2 3.91Å; W442-L483 HydrophobicContact CD2-CB 4.11Å; W442-L483 HydrophobicContact CD2-CD2 4.02Å; W442-L483 HydrophobicContact CE3-CD2 4.17Å; W442-L483 HydrophobicContact CG-CB 4.44Å; W442-L483 HydrophobicContact CG-CD2 3.94Å; W442-L483 HydrophobicContact CZ2-CB 4.25Å; F444-L483 HydrophobicContact CE2-CD2 4.32Å; F444-L483 HydrophobicContact CZ-CD2 3.96Å; W461-L483 HydrophobicContact CG-CD1 4.18Å; L483-L495 HydrophobicContact CD2-CD1 3.93Å; L483-L495 HydrophobicContact CD2-CD2 4.11Å
484	N	78.6	Confident	74.7	Confident	109 Å²	109	56 Å²	56	58%	0.583	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.7	174.3	-65.2	-16.1	0	0	0	109.2	G426 Q427 S486	G426-N484 CarbonylContact O-C 3.59Å; Q427-N484 PolarHBondContact NE2-OD1 2.67Å; N484-S486 PolarHBondContact O-N 3.41Å
485	V	73.7	Confident	75.1	Confident	29 Å²	29	53.8 Å²	53.8	18%	0.176	27%	0.267	C	S	.	.			trans	-93.9	95.4	179.9	-174.8	0	0	0	0	108.8	G426 V428 H489 L495	G426-V485 PolarHBondContact O-N 2.74Å; V428-V485 HydrophobicContact CG2-CG2 4.43Å; V485-H489 HydrophobicContact CG1-CB 4.19Å; V485-L495 HydrophobicContact CG2-CD2 4.11Å
486	S	68.6	Low	75.8	Confident	44 Å²	44	53.8 Å²	53.8	31%	0.308	27%	0.267	S	S	.	.			trans	-72.4	160.9	177	78.5	0	0	0	0	112.1	N484 E488 H489	N484-S486 PolarHBondContact O-N 3.41Å; S486-E488 PolarHBondContact O-N 2.94Å; S486-E488 VanDerWaalsContact O-N 3.08Å; S486-E488 PolarHBondContact OG-OE2 2.82Å; S486-E488 VanDerWaalsContact OG-OE2 3.14Å; S486-H489 WeakPolarHBondContact O-CB 3.41Å; S486-H489 PolarHBondContact O-N 3.43Å; S486-H489 PolarHBondContact OG-CE1 3.17Å; S486-H489 PolarHBondContact OG-ND1 2.87Å
487	N	62.5	Low	76.3	Confident	158 Å²	158	50.3 Å²	50.3	85%	0.845	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-58.5	-21	177.1	-77.5	-34.7	0	0	0	114.1	H489 A490	N487-H489 PolarHBondContact O-N 3.11Å; N487-A490 WeakPolarHBondContact O-CB 3.45Å; N487-A490 PolarHBondContact O-N 2.67Å
488	E	59.7	Low	76.6	Confident	163 Å²	163	50.4 Å²	50.4	76%	0.762	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-68.4	-25.8	176.3	-62.5	158.7	142.5	0	0	111.7	S486 A490	S486-E488 PolarHBondContact O-N 2.94Å; S486-E488 VanDerWaalsContact O-N 3.08Å; S486-E488 PolarHBondContact OG-OE2 2.82Å; S486-E488 VanDerWaalsContact OG-OE2 3.14Å; E488-A490 VanDerWaalsContact C-N 3.25Å; E488-A490 PolarHBondContact O-N 2.82Å
489	H	65.7	Low	76.6	Confident	25 Å²	25	47.2 Å²	47.2	12%	0.116	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-83.1	2.6	177.8	-61.3	83.4	0	0	0	113	F444 W461 V485 S486 N487 Q491 Y492	F444-H489 HydrophobicContact CD1-CB 4.41Å; F444-H489 HydrophobicContact CE1-CB 3.87Å; F444-H489 AromaticContact CE1-CD2 3.53Å; F444-H489 AromaticContact CE1-CG 3.85Å; F444-H489 AromaticContact CE2-CD2 3.65Å; F444-H489 AromaticContact CE2-NE2 3.97Å; F444-H489 HydrophobicContact CZ-CB 4.39Å; F444-H489 AromaticContact CZ-CD2 3.3Å; F444-H489 WeakPolarHBondContact CZ-CD2 3.36Å; F444-H489 AromaticContact CZ-CG 3.88Å; F444-H489 AromaticContact CZ-NE2 3.86Å; W461-H489 AromaticContact CE3-NE2 3.97Å; W461-H489 AromaticContact CH2-NE2 3.88Å; W461-H489 AromaticContact CZ3-CE1 3.89Å; W461-H489 AromaticContact CZ3-NE2 3.3Å; W461-H489 VanDerWaalsContact CZ3-NE2 3.3Å; W461-H489 WeakPolarHBondContact CZ3-NE2 3.3Å; V485-H489 HydrophobicContact CG1-CB 4.19Å; S486-H489 WeakPolarHBondContact O-CB 3.41Å; S486-H489 PolarHBondContact O-N 3.43Å; S486-H489 PolarHBondContact OG-CE1 3.17Å; S486-H489 PolarHBondContact OG-ND1 2.87Å; N487-H489 PolarHBondContact O-N 3.11Å; H489-Q491 PolarHBondContact O-N 3.5Å; H489-Y492 HydrophobicContact CB-CD2 4.28Å; H489-Y492 WeakPolarHBondContact O-CD2 3.41Å; H489-Y492 PolarHBondContact O-N 2.77Å; H489-Y492 VanDerWaalsContact O-N 3.1Å
490	A	57.7	Low	76.5	Confident	51 Å²	51	48.9 Å²	48.9	42%	0.421	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	2	-176.3	0	0	0	0	0	115.4	N487 E488	N487-A490 WeakPolarHBondContact O-CB 3.45Å; N487-A490 PolarHBondContact O-N 2.67Å; E488-A490 VanDerWaalsContact C-N 3.25Å; E488-A490 PolarHBondContact O-N 2.82Å
491	Q	62.2	Low	76.4	Confident	130 Å²	130	49 Å²	49	61%	0.607	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-20.9	169.9	68.3	-176.6	18.1	0	0	113.6	H489	H489-Q491 PolarHBondContact O-N 3.5Å
492	Y	70.1	Confident	76.1	Confident	30 Å²	30	56 Å²	56	12%	0.118	29%	0.286	C	S	.	.			trans	-89.1	142.5	-178.5	-57.9	-67.2	0	0	0	111.6	F444 C445 E446 H489	F444-Y492 HydrophobicContact CB-CD1 3.92Å; F444-Y492 HydrophobicContact CB-CD2 3.65Å; F444-Y492 HydrophobicContact CB-CE1 4.07Å; F444-Y492 HydrophobicContact CB-CE2 3.8Å; F444-Y492 HydrophobicContact CB-CG 3.7Å; F444-Y492 AromaticContact CD1-CD2 3.65Å; F444-Y492 HydrophobicContact CD1-CD2 3.65Å; F444-Y492 HydrophobicContact CD1-CE2 4.24Å; F444-Y492 HydrophobicContact CD1-CG 4.15Å; F444-Y492 AromaticContact CG-CD2 3.83Å; F444-Y492 HydrophobicContact CG-CD2 3.83Å; F444-Y492 HydrophobicContact CG-CE2 4.03Å; F444-Y492 HydrophobicContact CG-CG 4.31Å; C445-Y492 WeakPolarHBondContact O-CB 3.23Å; E446-Y492 HydrophobicContact CG-CD1 3.91Å; E446-Y492 HydrophobicContact CG-CE1 3.84Å; H489-Y492 HydrophobicContact CB-CD2 4.28Å; H489-Y492 WeakPolarHBondContact O-CD2 3.41Å; H489-Y492 PolarHBondContact O-N 2.77Å; H489-Y492 VanDerWaalsContact O-N 3.1Å
493	H	68.8	Low	75.7	Confident	95 Å²	95	54 Å²	54	44%	0.44	30%	0.302	S	S	.	.	S	Bend	trans	-89.5	-35.4	-177.2	-71.1	97.2	0	0	0	112.5	C445 E446 P448 I512	C445-H493 PolarHBondContact O-N 2.89Å; E446-H493 PolarHBondContact O-ND1 2.85Å; P448-H493 HydrophobicContact CG-CB 4.03Å; H493-I512 PolarHBondContact O-N 2.86Å
494	T	76.2	Confident	75.6	Confident	10 Å²	10	58.8 Å²	58.8	6%	0.061	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	163.8	177.7	51.2	0	0	0	0	111.3	C445 F510	C445-T494 VanDerWaalsContact CB-O 3.29Å; C445-T494 WeakPolarHBondContact CB-O 3.42Å; C445-T494 WeakPolarHBondContact CB-OG1 3.36Å; C445-T494 PolarHBondContact N-O 2.9Å; C445-T494 PolarHBondContact O-N 2.02Å; T494-F510 CarbonylContact C-O 3.58Å; T494-F510 WeakPolarHBondContact CA-O 3.3Å; T494-F510 WeakPolarHBondContact CB-O 3.43Å; T494-F510 WeakPolarHBondContact CG2-O 3.2Å
495	L	81.8	Confident	76	Confident	1 Å²	1	58 Å²	58	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	135.4	175.2	169.4	72.8	0	0	0	108.2	V428 W442 F444 L483 V485 L509 F510 I512	V428-L495 HydrophobicContact CG1-CD2 4.47Å; V428-L495 HydrophobicContact CG2-CD2 3.61Å; W442-L495 HydrophobicContact CE3-CD1 4.03Å; W442-L495 HydrophobicContact CE3-CD2 3.82Å; W442-L495 HydrophobicContact CE3-CG 3.84Å; W442-L495 HydrophobicContact CZ3-CD2 3.74Å; W442-L495 HydrophobicContact CZ3-CG 4.08Å; F444-L495 HydrophobicContact CD1-CD1 3.86Å; F444-L495 HydrophobicContact CD2-CD1 4.43Å; F444-L495 HydrophobicContact CE1-CD1 3.82Å; F444-L495 HydrophobicContact CE2-CD1 4.39Å; F444-L495 HydrophobicContact CG-CD1 4.18Å; F444-L495 HydrophobicContact CZ-CD1 4.1Å; L483-L495 HydrophobicContact CD2-CD1 3.93Å; L483-L495 HydrophobicContact CD2-CD2 4.11Å; V485-L495 HydrophobicContact CG2-CD2 4.11Å; L495-L509 CarbonylContact O-C 3.51Å; L495-L509 WeakPolarHBondContact O-CA 3.37Å; L495-F510 HydrophobicContact CB-CB 4.35Å; L495-F510 PolarHBondContact N-O 3.02Å; L495-F510 PolarHBondContact O-N 3.08Å; L495-I512 HydrophobicContact CB-CD1 4.21Å
496	E	85.9	Confident	76.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.6	-178.8	-168.7	-176.7	157.4	0	0	110.2	W442 Y443 R451 C452 S453 V498 Y507 I508 L509	W442-E496 WeakPolarHBondContact CA-O 3.47Å; Y443-E496 PolarHBondContact N-O 2.92Å; Y443-E496 PolarHBondContact O-N 3.39Å; R451-E496 WeakPolarHBondContact CG-OE1 3.14Å; R451-E496 IonicContact NE-OE1 3.23Å; C452-E496 WeakPolarHBondContact CA-OE2 3.13Å; C452-E496 WeakPolarHBondContact CB-OE2 3.47Å; C452-E496 PolarHBondContact N-OE2 2.96Å; S453-E496 WeakPolarHBondContact CB-OE1 3.32Å; S453-E496 PolarHBondContact N-OE2 2.81Å; S453-E496 PolarHBondContact OG-OE1 2.85Å; E496-V498 HydrophobicContact CG-CG2 3.97Å; E496-V498 WeakPolarHBondContact OE1-CG2 3.2Å; E496-Y507 HydrophobicContact CG-CD2 4.35Å; E496-I508 WeakPolarHBondContact CA-O 3.19Å; E496-L509 HydrophobicContact CB-CD2 3.85Å; E496-L509 HydrophobicContact CG-CD2 4.11Å
497	C	87.4	Confident	77.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.7	162.2	170.5	0	0	0	0	108.4	C430 W442 Y507 I508 F510	C430-C497 HydrophobicContact CB-CB 3.77Å; C430-C497 WeakPolarHBondContact CB-SG 3.4Å; C430-C497 WeakPolarHBondContact SG-CB 3.24Å; C430-C497 CovalentContact SG-SG 2.04Å; C430-C497 PolarHBondContact SG-SG 2.79Å; W442-C497 HydrophobicContact CD2-CB 4.29Å; W442-C497 HydrophobicContact CE3-CB 3.84Å; W442-C497 HydrophobicContact CH2-CB 4.02Å; W442-C497 HydrophobicContact CZ2-CB 4.42Å; W442-C497 HydrophobicContact CZ3-CB 3.71Å; C497-Y507 CarbonylContact O-C 3.53Å; C497-Y507 WeakPolarHBondContact O-CA 3.15Å; C497-Y507 WeakPolarHBondContact O-CB 3.19Å; C497-I508 HydrophobicContact CB-CG2 4.16Å; C497-I508 PolarHBondContact N-O 2.81Å; C497-I508 PolarHBondContact O-N 3.19Å; C497-F510 HydrophobicContact CB-CE2 4.14Å
498	V	88.5	Confident	78.6	Confident	3 Å²	3	56 Å²	56	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.6	173.6	-174.4	0	0	0	0	109.4	I440 S441 Y443 E496 E505 A506	I440-V498 CarbonylContact C-O 3.54Å; I440-V498 WeakPolarHBondContact CA-O 3.29Å; S441-V498 PolarHBondContact N-O 3.42Å; S441-V498 PolarHBondContact O-N 3.18Å; Y443-V498 HydrophobicContact CD2-CG2 3.78Å; Y443-V498 HydrophobicContact CE2-CB 4.08Å; Y443-V498 HydrophobicContact CE2-CG2 3.66Å; E496-V498 HydrophobicContact CG-CG2 3.97Å; E496-V498 WeakPolarHBondContact OE1-CG2 3.2Å; V498-E505 HydrophobicContact CG1-CB 4.41Å; V498-A506 CarbonylContact C-O 3.43Å; V498-A506 WeakPolarHBondContact CA-O 3.29Å
499	A	89	Confident	79.7	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.4	170.7	0	0	0	0	0	109.7	P415 I417 A432 K439 I440 E505 A506	P415-A499 HydrophobicContact CB-CB 4.12Å; P415-A499 WeakPolarHBondContact CG-O 3.19Å; I417-A499 HydrophobicContact CG1-CB 4.28Å; A432-A499 HydrophobicContact CB-CB 3.41Å; A432-A499 VanDerWaalsContact CB-CB 3.41Å; K439-A499 CarbonylContact O-C 3.6Å; K439-A499 WeakPolarHBondContact O-CA 3.49Å; I440-A499 HydrophobicContact CG1-CB 4.29Å; A499-E505 CarbonylContact O-C 3.59Å; A499-E505 WeakPolarHBondContact O-CA 3.12Å; A499-A506 PolarHBondContact N-O 3.4Å; A499-A506 PolarHBondContact O-N 3.1Å
500	S	86.8	Confident	80.3	Confident	35 Å²	35	50.2 Å²	50.2	25%	0.245	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.9	-170.8	61.4	0	0	0	0	113.1	P438 K439 E504	P438-S500 WeakPolarHBondContact CA-O 3.3Å; K439-S500 PolarHBondContact N-O 3.22Å; K439-S500 PolarHBondContact O-N 3.06Å; K439-S500 PolarHBondContact O-OG 2.9Å; S500-E504 WeakPolarHBondContact CA-O 3.15Å
501	T	86.1	Confident	81	Confident	16 Å²	16	51.8 Å²	51.8	10%	0.098	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	127.9	173.5	-1.8	0	0	0	0	112.8	P415 P436 V437 P438 G503 E504	P415-T501 VanDerWaalsContact CD-OG1 3.32Å; P415-T501 WeakPolarHBondContact CD-OG1 3.42Å; P436-T501 HydrophobicContact CB-CG2 4.36Å; P436-T501 WeakPolarHBondContact O-CG2 3.5Å; V437-T501 WeakPolarHBondContact O-CG2 3.37Å; P438-T501 HydrophobicContact CB-CG2 4.3Å; T501-G503 PolarHBondContact O-N 2.85Å; T501-E504 PolarHBondContact N-O 2.81Å; T501-E504 PolarHBondContact O-N 3.31Å
502	Q	81.9	Confident	81.4	Confident	150 Å²	150	47.9 Å²	47.9	70%	0.701	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	24.8	-179.6	-67.1	-171.6	-19.8	0	0	115.3	P436	P436-Q502 HydrophobicContact CG-CG 4.32Å
503	G	75.1	Confident	81	Confident	77 Å²	77	54.6 Å²	54.6	79%	0.794	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	-5.5	-178.4	0	0	0	0	0	115.4	T501	T501-G503 PolarHBondContact O-N 2.85Å
504	E	81.9	Confident	79.9	Confident	108 Å²	108	58.8 Å²	58.8	51%	0.505	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	149.6	166.1	-66.5	-75.5	162.9	0	0	110.3	K414 P415 S500 T501	K414-E504 HydrophobicContact CB-CB 4.3Å; K414-E504 HydrophobicContact CB-CG 4.44Å; P415-E504 HydrophobicContact CG-CB 4.38Å; P415-E504 WeakPolarHBondContact CG-O 3.27Å; S500-E504 WeakPolarHBondContact CA-O 3.15Å; T501-E504 PolarHBondContact N-O 2.81Å; T501-E504 PolarHBondContact O-N 3.31Å
505	E	86.4	Confident	77.9	Confident	92 Å²	92	68.8 Å²	68.8	43%	0.43	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.1	-175.7	-60.6	-176.9	126	0	0	112.9	R451 V498 A499	R451-E505 IonicContact CZ-OE2 3.84Å; R451-E505 IonicContact NH1-OE2 3.27Å; R451-E505 PolarHBondContact NH1-OE2 3.48Å; R451-E505 IonicContact NH2-OE1 3.03Å; R451-E505 IonicContact NH2-OE2 2.88Å; R451-E505 PolarHBondContact NH2-OE2 3.41Å; V498-E505 HydrophobicContact CG1-CB 4.41Å; A499-E505 CarbonylContact O-C 3.59Å; A499-E505 WeakPolarHBondContact O-CA 3.12Å
506	A	85.9	Confident	76	Confident	22 Å²	22	76.8 Å²	76.8	18%	0.182	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.4	164.7	0	0	0	0	0	109.7	P415 I417 V498 A499	P415-A506 WeakPolarHBondContact O-CB 3.31Å; I417-A506 HydrophobicContact CG1-CB 4.45Å; V498-A506 CarbonylContact C-O 3.43Å; V498-A506 WeakPolarHBondContact CA-O 3.29Å; A499-A506 PolarHBondContact N-O 3.4Å; A499-A506 PolarHBondContact O-N 3.1Å
507	Y	87.6	Confident	73.9	Confident	117 Å²	117	81.3 Å²	81.3	46%	0.459	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	157.1	-176.5	71.6	-84.4	0	0	0	112.5	R451 E496 C497	R451-Y507 HydrophobicContact CG-CE2 4.38Å; E496-Y507 HydrophobicContact CG-CD2 4.35Å; C497-Y507 CarbonylContact O-C 3.53Å; C497-Y507 WeakPolarHBondContact O-CA 3.15Å; C497-Y507 WeakPolarHBondContact O-CB 3.19Å
508	I	85.4	Confident	71.7	Confident	52 Å²	52	86.9 Å²	86.9	27%	0.267	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.9	173.6	-155.7	157.2	0	0	0	111.3	I417 Q420 E496 C497 F510	I417-I508 HydrophobicContact CD1-CB 3.9Å; I417-I508 HydrophobicContact CD1-CG2 3.76Å; I417-I508 HydrophobicContact CG2-CG2 4.3Å; Q420-I508 HydrophobicContact CG-CD1 4.34Å; Q420-I508 VanDerWaalsContact OE1-CG1 3.31Å; E496-I508 WeakPolarHBondContact CA-O 3.19Å; C497-I508 HydrophobicContact CB-CG2 4.16Å; C497-I508 PolarHBondContact N-O 2.81Å; C497-I508 PolarHBondContact O-N 3.19Å; I508-F510 HydrophobicContact CG2-CE2 3.98Å; I508-F510 HydrophobicContact CG2-CZ 4.45Å
509	L	83.6	Confident	69.5	Low	57 Å²	57	95.1 Å²	95.1	30%	0.298	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125	-172.1	-75.4	162.1	0	0	0	111.8	L495 E496	L495-L509 CarbonylContact O-C 3.51Å; L495-L509 WeakPolarHBondContact O-CA 3.37Å; E496-L509 HydrophobicContact CB-CD2 3.85Å; E496-L509 HydrophobicContact CG-CD2 4.11Å
510	F	78.4	Confident	67.5	Low	9 Å²	9	104.8 Å²	104.8	4%	0.039	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	145.4	171.2	-58.3	-101.1	0	0	0	109.8	Q420 V428 W442 T494 L495 C497 I508	Q420-F510 HydrophobicContact CB-CE1 3.93Å; Q420-F510 HydrophobicContact CB-CZ 3.77Å; V428-F510 HydrophobicContact CB-CD1 4.24Å; V428-F510 HydrophobicContact CB-CE1 4.04Å; V428-F510 HydrophobicContact CB-CZ 4.36Å; V428-F510 HydrophobicContact CG1-CD1 3.84Å; V428-F510 HydrophobicContact CG1-CE1 4.13Å; V428-F510 HydrophobicContact CG1-CG 4.28Å; W442-F510 AromaticContact CH2-CE2 3.86Å; W442-F510 HydrophobicContact CH2-CE2 3.86Å; W442-F510 HydrophobicContact CH2-CZ 4.08Å; W442-F510 HydrophobicContact CZ3-CD2 4Å; W442-F510 AromaticContact CZ3-CE2 3.53Å; W442-F510 HydrophobicContact CZ3-CE2 3.53Å; W442-F510 HydrophobicContact CZ3-CZ 4.19Å; T494-F510 CarbonylContact C-O 3.58Å; T494-F510 WeakPolarHBondContact CA-O 3.3Å; T494-F510 WeakPolarHBondContact CB-O 3.43Å; T494-F510 WeakPolarHBondContact CG2-O 3.2Å; L495-F510 HydrophobicContact CB-CB 4.35Å; L495-F510 PolarHBondContact N-O 3.02Å; L495-F510 PolarHBondContact O-N 3.08Å; C497-F510 HydrophobicContact CB-CE2 4.14Å; I508-F510 HydrophobicContact CG2-CE2 3.98Å; I508-F510 HydrophobicContact CG2-CZ 4.45Å
511	T	73.1	Confident	65.9	Low	84 Å²	84	110.4 Å²	110.4	52%	0.515	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.9	131.9	177	-57.9	0	0	0	0	110.6
512	I	69.9	Low	64	Low	48 Å²	48	118.1 Å²	118.1	25%	0.246	58%	0.583	C	S	.	*			trans	-96.8	-20.7	-171.8	-59.1	172.7	0	0	0	112.1	H493 L495	H493-I512 PolarHBondContact O-N 2.86Å; L495-I512 HydrophobicContact CB-CD1 4.21Å
513	R	60.5	Low	62.5	Low	171 Å²	171	117.4 Å²	117.4	65%	0.645	59%	0.589	S	S	*	*			trans	-158.2	143.6	-179.8	-126.5	172.9	-176.2	162.5	3.6	114.4
514	E	46.2	Very low	61.4	Low	182 Å²	182	118 Å²	118	85%	0.85	58%	0.579	S	S	*	*			trans	-106.5	153.4	158.5	-66.7	-164.3	142.6	0	0	110.8
515	R	35.1	Very low	59.9	Low	221 Å²	221	118.7 Å²	118.7	83%	0.834	59%	0.585	S	S	*	*			trans	-132.9	122.9	167.6	-93.2	-169	174.4	-170.8	1.2	110
516	I	40.5	Very low	58.3	Low	168 Å²	168	120.2 Å²	120.2	86%	0.862	60%	0.596	S	S	*	*			trans	-80.5	133.7	168.7	-59.5	172	0	0	0	108.5
517	V	42.6	Very low	56.9	Low	96 Å²	96	124.6 Å²	124.6	58%	0.582	62%	0.621	S	S	*	*			trans	-125.1	118.8	175.9	-178.4	0	0	0	0	109.6
518	P	41.3	Very low	55.5	Low	116 Å²	116	121 Å²	121	75%	0.753	62%	0.619	S	S	*	*			trans	-86.9	123.2	179	32.3	-32.1	0	0	0	111.7
519	H	41.5	Very low	54.4	Low	177 Å²	177	124.1 Å²	124.1	82%	0.819	63%	0.634	S	S	*	*			trans	-98.1	121.1	174.6	-73.3	-72.2	0	0	0	112.2
520	K	47.8	Very low	53.4	Low	202 Å²	202	127.5 Å²	127.5	88%	0.878	65%	0.652	S	S	*	*			trans	-102.6	91.9	168	-73	-173.7	177.9	-177.5	0	110.4
521	L	53.6	Low	52.7	Low	153 Å²	153	130.5 Å²	130.5	80%	0.801	68%	0.679	S	S	*	*			trans	-170.3	78.1	166.7	-110.2	159.1	0	0	0	110.5
522	F	45.9	Very low	52.4	Low	178 Å²	178	130 Å²	130	78%	0.781	68%	0.675	S	S	*	*			trans	-139.9	55.4	-174.6	-149.3	-86.4	0	0	0	112.9
523	T	50.9	Low	52.4	Low	136 Å²	136	129.3 Å²	129.3	83%	0.834	68%	0.68	S	S	*	*	S	Bend	trans	-143.1	-9.8	-177.9	8.6	0	0	0	0	117.8
524	P	51.4	Low	53.1	Low	88 Å²	88	125.7 Å²	125.7	57%	0.571	68%	0.677	S	S	*	*	S	Bend	trans	-108	-15.8	170	36.4	-31.4	0	0	0	114.8	L526 T527	P524-L526 PolarHBondContact O-N 3.44Å; P524-T527 PolarHBondContact O-OG1 3.19Å
525	L	49.3	Very low	54.5	Low	123 Å²	123	124 Å²	124	64%	0.644	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-23.1	-170.4	-134.4	88.5	0	0	0	114.4	T527 G528 M529	L525-T527 VanDerWaalsContact C-N 3.33Å; L525-T527 PolarHBondContact O-N 2.98Å; L525-G528 PolarHBondContact O-N 3.29Å; L525-M529 WeakPolarHBondContact O-CG 3.34Å; L525-M529 PolarHBondContact O-N 3.49Å
526	L	53.6	Low	56.3	Low	124 Å²	124	118.5 Å²	118.5	65%	0.649	65%	0.653	S	S	*	*	H	α-helix	trans	-68.3	-28.9	-166.4	-165.1	68.6	0	0	0	113.7	P524	P524-L526 PolarHBondContact O-N 3.44Å
527	T	56.3	Low	57.8	Low	115 Å²	115	113.1 Å²	113.1	71%	0.706	63%	0.631	S	S	*	*	H	α-helix	trans	-75.7	-36.6	-178.3	49.1	0	0	0	0	112.7	P524 L525	P524-T527 PolarHBondContact O-OG1 3.19Å; L525-T527 VanDerWaalsContact C-N 3.33Å; L525-T527 PolarHBondContact O-N 2.98Å
528	G	58.3	Low	59.5	Low	42 Å²	42	112.7 Å²	112.7	43%	0.433	63%	0.628	S	S	.	*	H	α-helix	trans	-67.4	-39.1	173.9	0	0	0	0	0	112.6	L525 L530 A531 T532	L525-G528 PolarHBondContact O-N 3.29Å; G528-L530 PolarHBondContact O-N 2.94Å; G528-A531 PolarHBondContact O-N 3.47Å; G528-T532 PolarHBondContact O-N 3.48Å; G528-T532 PolarHBondContact O-OG1 3.32Å
529	M	61.7	Low	61.2	Low	116 Å²	116	110.3 Å²	110.3	57%	0.571	61%	0.608	S	S	*	*	H	α-helix	trans	-56.8	-32.2	-179.1	-72	-76.7	-74.3	0	0	113.6	L525 T532 G533	L525-M529 WeakPolarHBondContact O-CG 3.34Å; L525-M529 PolarHBondContact O-N 3.49Å; M529-T532 WeakPolarHBondContact CA-OG1 3.34Å; M529-T532 PolarHBondContact O-OG1 3.33Å; M529-G533 WeakPolarHBondContact O-CA 3.49Å; M529-G533 PolarHBondContact O-N 2.72Å
530	L	63	Low	62.8	Low	128 Å²	128	107 Å²	107	67%	0.67	60%	0.596	S	S	*	*	H	α-helix	trans	-68.1	-45.7	178.7	-78.2	161.6	0	0	0	112.4	G528 G533 V534	G528-L530 PolarHBondContact O-N 2.94Å; L530-G533 PolarHBondContact O-N 2.98Å; L530-V534 PolarHBondContact O-N 2.87Å
531	A	63.6	Low	64.3	Low	73 Å²	73	102.1 Å²	102.1	60%	0.603	58%	0.583	S	S	*	*	H	α-helix	trans	-67.8	-44.9	179.4	0	0	0	0	0	111.6	G528 G533 V534 F535	G528-A531 PolarHBondContact O-N 3.47Å; A531-G533 VanDerWaalsContact C-N 3.27Å; A531-G533 PolarHBondContact O-N 2.72Å; A531-V534 PolarHBondContact O-N 2.98Å; A531-F535 PolarHBondContact O-N 2.89Å
532	T	68.2	Low	65.3	Low	73 Å²	73	98.9 Å²	98.9	45%	0.448	57%	0.569	S	S	.	*	H	α-helix	trans	-65.1	-32.8	173.4	52	0	0	0	0	111.9	G528 M529 V534 F535 L536	G528-T532 PolarHBondContact O-N 3.48Å; G528-T532 PolarHBondContact O-OG1 3.32Å; M529-T532 WeakPolarHBondContact CA-OG1 3.34Å; M529-T532 PolarHBondContact O-OG1 3.33Å; T532-V534 PolarHBondContact O-N 3.07Å; T532-F535 PolarHBondContact O-N 2.59Å; T532-L536 VanDerWaalsContact O-CB 3.23Å; T532-L536 WeakPolarHBondContact O-CB 3.39Å; T532-L536 VanDerWaalsContact O-CG 3.26Å; T532-L536 WeakPolarHBondContact O-CG 3.38Å; T532-L536 PolarHBondContact O-N 3.33Å
533	G	70	Confident	66.5	Low	33 Å²	33	95.4 Å²	95.4	34%	0.34	56%	0.558	S	S	.	*	H	α-helix	trans	-63.5	-37.9	178.3	0	0	0	0	0	113.4	M529 L530 A531 S537	M529-G533 WeakPolarHBondContact O-CA 3.49Å; M529-G533 PolarHBondContact O-N 2.72Å; L530-G533 PolarHBondContact O-N 2.98Å; A531-G533 VanDerWaalsContact C-N 3.27Å; A531-G533 PolarHBondContact O-N 2.72Å; G533-S537 VanDerWaalsContact O-CB 3.24Å; G533-S537 WeakPolarHBondContact O-CB 3.21Å; G533-S537 PolarHBondContact O-N 3.33Å; G533-S537 PolarHBondContact O-OG 2.92Å
534	V	74.9	Confident	67.5	Low	96 Å²	96	92.3 Å²	92.3	58%	0.582	54%	0.539	S	S	*	.	H	α-helix	trans	-71.2	-41.2	174.9	176.1	0	0	0	0	111.7	L530 A531 T532 S537 V538	L530-V534 PolarHBondContact O-N 2.87Å; A531-V534 PolarHBondContact O-N 2.98Å; T532-V534 PolarHBondContact O-N 3.07Å; V534-S537 PolarHBondContact O-N 2.81Å; V534-S537 PolarHBondContact O-OG 2.84Å; V534-V538 WeakPolarHBondContact O-CG2 3.47Å; V534-V538 PolarHBondContact O-N 2.89Å; V534-V538 VanDerWaalsContact O-N 3.08Å
535	F	75.9	Confident	68.4	Low	147 Å²	147	95.4 Å²	95.4	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-43.1	176.2	-171.5	-112.3	0	0	0	111.8	A531 T532 V538 I539	A531-F535 PolarHBondContact O-N 2.89Å; T532-F535 PolarHBondContact O-N 2.59Å; F535-V538 PolarHBondContact O-N 2.69Å; F535-I539 HydrophobicContact CD1-CD1 3.78Å; F535-I539 HydrophobicContact CE1-CD1 3.45Å; F535-I539 VanDerWaalsContact CE1-CD1 3.45Å; F535-I539 HydrophobicContact CG-CD1 4.47Å; F535-I539 HydrophobicContact CZ-CD1 3.89Å; F535-I539 WeakPolarHBondContact O-CG1 3.45Å; F535-I539 PolarHBondContact O-N 2.91Å
536	L	72.3	Confident	68.9	Low	105 Å²	105	96.4 Å²	96.4	55%	0.55	54%	0.539	S	S	.	.	H	α-helix	trans	-67.9	-30.4	174.7	-72.6	170.5	0	0	0	112.7	T532 L540	T532-L536 VanDerWaalsContact O-CB 3.23Å; T532-L536 WeakPolarHBondContact O-CB 3.39Å; T532-L536 VanDerWaalsContact O-CG 3.26Å; T532-L536 WeakPolarHBondContact O-CG 3.38Å; T532-L536 PolarHBondContact O-N 3.33Å; L536-L540 WeakPolarHBondContact O-CB 3.46Å; L536-L540 PolarHBondContact O-N 2.83Å
537	S	72.6	Confident	69.1	Low	55 Å²	55	96.5 Å²	96.5	39%	0.385	53%	0.532	S	S	.	.	H	α-helix	trans	-73.8	-35.2	175.6	73.1	0	0	0	0	112.2	G533 V534 L540 V541	G533-S537 VanDerWaalsContact O-CB 3.24Å; G533-S537 WeakPolarHBondContact O-CB 3.21Å; G533-S537 PolarHBondContact O-N 3.33Å; G533-S537 PolarHBondContact O-OG 2.92Å; V534-S537 PolarHBondContact O-N 2.81Å; V534-S537 PolarHBondContact O-OG 2.84Å; S537-L540 PolarHBondContact O-N 3.46Å; S537-V541 WeakPolarHBondContact O-CB 3.4Å; S537-V541 VanDerWaalsContact O-CG2 3.32Å; S537-V541 WeakPolarHBondContact O-CG2 3.49Å; S537-V541 PolarHBondContact O-N 2.98Å
538	V	77.5	Confident	69.2	Low	86 Å²	86	97.5 Å²	97.5	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-65.2	-44.3	170.2	173.8	0	0	0	0	110.9	V534 F535 L540 V541 V542	V534-V538 WeakPolarHBondContact O-CG2 3.47Å; V534-V538 PolarHBondContact O-N 2.89Å; V534-V538 VanDerWaalsContact O-N 3.08Å; F535-V538 PolarHBondContact O-N 2.69Å; V538-L540 VanDerWaalsContact C-N 3.32Å; V538-L540 PolarHBondContact O-N 2.84Å; V538-V541 PolarHBondContact O-N 3Å; V538-V542 WeakPolarHBondContact O-CG2 3.43Å; V538-V542 PolarHBondContact O-N 3.33Å
539	I	76.8	Confident	68.8	Low	67 Å²	67	101.2 Å²	101.2	34%	0.344	54%	0.536	S	S	.	.	H	α-helix	trans	-61.7	-41.1	172.8	-70.7	171.2	0	0	0	110.8	F535 V541 V542 L543	F535-I539 HydrophobicContact CD1-CD1 3.78Å; F535-I539 HydrophobicContact CE1-CD1 3.45Å; F535-I539 VanDerWaalsContact CE1-CD1 3.45Å; F535-I539 HydrophobicContact CG-CD1 4.47Å; F535-I539 HydrophobicContact CZ-CD1 3.89Å; F535-I539 WeakPolarHBondContact O-CG1 3.45Å; F535-I539 PolarHBondContact O-N 2.91Å; I539-V541 PolarHBondContact O-N 2.97Å; I539-V542 PolarHBondContact O-N 3.29Å; I539-L543 HydrophobicContact CG2-CD1 3.78Å; I539-L543 HydrophobicContact CG2-CG 4.19Å; I539-L543 WeakPolarHBondContact O-CB 3.49Å; I539-L543 VanDerWaalsContact O-CG 3.28Å; I539-L543 WeakPolarHBondContact O-CG 3.49Å; I539-L543 PolarHBondContact O-N 2.85Å
540	L	74.5	Confident	68.1	Low	106 Å²	106	101.2 Å²	101.2	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-63.3	-40.1	175.9	-174.3	68.3	0	0	0	111.3	L536 S537 V538 L543 V544	L536-L540 WeakPolarHBondContact O-CB 3.46Å; L536-L540 PolarHBondContact O-N 2.83Å; S537-L540 PolarHBondContact O-N 3.46Å; V538-L540 VanDerWaalsContact C-N 3.32Å; V538-L540 PolarHBondContact O-N 2.84Å; L540-L543 PolarHBondContact O-N 3.09Å; L540-V544 HydrophobicContact CD1-CG2 4.36Å; L540-V544 HydrophobicContact CG-CG2 4.28Å; L540-V544 WeakPolarHBondContact O-CB 3.48Å; L540-V544 WeakPolarHBondContact O-CG2 3.38Å; L540-V544 PolarHBondContact O-N 2.93Å
541	V	79.2	Confident	67.5	Low	101 Å²	101	98.7 Å²	98.7	61%	0.612	53%	0.525	S	S	*	.	H	α-helix	trans	-64.7	-39.9	174.7	166.7	0	0	0	0	111.3	S537 V538 I539 V544 Y545	S537-V541 WeakPolarHBondContact O-CB 3.4Å; S537-V541 VanDerWaalsContact O-CG2 3.32Å; S537-V541 WeakPolarHBondContact O-CG2 3.49Å; S537-V541 PolarHBondContact O-N 2.98Å; V538-V541 PolarHBondContact O-N 3Å; I539-V541 PolarHBondContact O-N 2.97Å; V541-V544 PolarHBondContact O-N 2.62Å; V541-Y545 VanDerWaalsContact O-CB 3.26Å; V541-Y545 WeakPolarHBondContact O-CB 3.33Å; V541-Y545 PolarHBondContact O-N 2.67Å
542	V	76.6	Confident	67	Low	84 Å²	84	102.1 Å²	102.1	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-69	-38.8	174.7	173.5	0	0	0	0	111.9	V538 I539 Y545 K546	V538-V542 WeakPolarHBondContact O-CG2 3.43Å; V538-V542 PolarHBondContact O-N 3.33Å; I539-V542 PolarHBondContact O-N 3.29Å; V542-Y545 PolarHBondContact O-N 2.95Å; V542-K546 WeakPolarHBondContact O-CB 3.21Å; V542-K546 WeakPolarHBondContact O-CG 3.43Å; V542-K546 PolarHBondContact O-N 2.66Å
543	L	71.1	Confident	66.1	Low	106 Å²	106	99.3 Å²	99.3	56%	0.555	51%	0.507	S	S	*	.	H	α-helix	trans	-68.3	-39.4	174.2	-73.1	173.7	0	0	0	111.8	I539 L540 K546 Y547	I539-L543 HydrophobicContact CG2-CD1 3.78Å; I539-L543 HydrophobicContact CG2-CG 4.19Å; I539-L543 WeakPolarHBondContact O-CB 3.49Å; I539-L543 VanDerWaalsContact O-CG 3.28Å; I539-L543 WeakPolarHBondContact O-CG 3.49Å; I539-L543 PolarHBondContact O-N 2.85Å; L540-L543 PolarHBondContact O-N 3.09Å; L543-K546 CarbonylContact O-C 3.43Å; L543-K546 PolarHBondContact O-N 3.04Å; L543-Y547 WeakPolarHBondContact O-CB 3.27Å; L543-Y547 PolarHBondContact O-N 3.22Å
544	V	69.9	Low	65.2	Low	70 Å²	70	105 Å²	105	42%	0.424	53%	0.526	S	S	.	.	H	α-helix	trans	-66	-41.8	173.5	165.8	0	0	0	0	110.1	L540 V541 K546 Y547 M548	L540-V544 HydrophobicContact CD1-CG2 4.36Å; L540-V544 HydrophobicContact CG-CG2 4.28Å; L540-V544 WeakPolarHBondContact O-CB 3.48Å; L540-V544 WeakPolarHBondContact O-CG2 3.38Å; L540-V544 PolarHBondContact O-N 2.93Å; V541-V544 PolarHBondContact O-N 2.62Å; V544-K546 PolarHBondContact O-N 2.86Å; V544-Y547 PolarHBondContact O-N 2.74Å; V544-M548 HydrophobicContact CG1-CG 4.04Å; V544-M548 VanDerWaalsContact O-CB 3.29Å; V544-M548 WeakPolarHBondContact O-CB 3.45Å; V544-M548 WeakPolarHBondContact O-CG 3.48Å; V544-M548 PolarHBondContact O-N 2.87Å
545	Y	70.4	Confident	64.1	Low	154 Å²	154	101.6 Å²	101.6	60%	0.604	50%	0.504	S	S	*	.	H	α-helix	trans	-59.1	-46.7	172.8	-179.4	-93.3	0	0	0	111.5	V541 V542 Y547 Q549	V541-Y545 VanDerWaalsContact O-CB 3.26Å; V541-Y545 WeakPolarHBondContact O-CB 3.33Å; V541-Y545 PolarHBondContact O-N 2.67Å; V542-Y545 PolarHBondContact O-N 2.95Å; Y545-Y547 VanDerWaalsContact C-N 3.35Å; Y545-Y547 PolarHBondContact O-N 2.93Å; Y545-Q549 PolarHBondContact O-N 2.85Å; Y545-Q549 PolarHBondContact OH-NE2 3.45Å
546	K	61.3	Low	63.1	Low	143 Å²	143	96 Å²	96	62%	0.622	48%	0.48	S	S	*	.	H	α-helix	trans	-63.6	-34.7	173.1	-78.4	-79.4	-175.5	176.1	0	113.5	V542 L543 V544	V542-K546 WeakPolarHBondContact O-CB 3.21Å; V542-K546 WeakPolarHBondContact O-CG 3.43Å; V542-K546 PolarHBondContact O-N 2.66Å; L543-K546 CarbonylContact O-C 3.43Å; L543-K546 PolarHBondContact O-N 3.04Å; V544-K546 PolarHBondContact O-N 2.86Å
547	Y	58.2	Low	61.9	Low	127 Å²	127	91.4 Å²	91.4	50%	0.498	46%	0.455	S	S	.	.	H	α-helix	trans	-74.9	-39.4	179.8	179.1	-92.2	0	0	0	112	L543 V544 Y545 Q549 K550 H630	L543-Y547 WeakPolarHBondContact O-CB 3.27Å; L543-Y547 PolarHBondContact O-N 3.22Å; V544-Y547 PolarHBondContact O-N 2.74Å; Y545-Y547 VanDerWaalsContact C-N 3.35Å; Y545-Y547 PolarHBondContact O-N 2.93Å; Y547-Q549 PolarHBondContact O-N 3.29Å; Y547-K550 WeakPolarHBondContact O-CB 3.14Å; Y547-K550 WeakPolarHBondContact O-CG 3.24Å; Y547-K550 PolarHBondContact O-N 2.91Å; Y547-K550 VanDerWaalsContact O-N 3.1Å; Y547-H630 PolarHBondContact OH-CE1 3.47Å
548	M	57.7	Low	61.5	Low	135 Å²	135	92 Å²	92	67%	0.665	45%	0.45	S	S	*	.	H	α-helix	trans	-70.8	-15.9	175	-67.5	-69.8	-85.3	0	0	112.7	V544 K550	V544-M548 HydrophobicContact CG1-CG 4.04Å; V544-M548 VanDerWaalsContact O-CB 3.29Å; V544-M548 WeakPolarHBondContact O-CB 3.45Å; V544-M548 WeakPolarHBondContact O-CG 3.48Å; V544-M548 PolarHBondContact O-N 2.87Å; M548-K550 VanDerWaalsContact C-N 3.3Å
549	Q	49.3	Very low	60.6	Low	120 Å²	120	87.9 Å²	87.9	56%	0.561	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	4.7	167.8	-76.1	-166.2	-0.1	0	0	114.5	Y545 Y547	Y545-Q549 PolarHBondContact O-N 2.85Å; Y545-Q549 PolarHBondContact OH-NE2 3.45Å; Y547-Q549 PolarHBondContact O-N 3.29Å
550	K	47.7	Very low	59.8	Low	116 Å²	116	85 Å²	85	50%	0.504	41%	0.411	S	S	.	.	S	Bend	trans	-62.7	131.9	168.3	-77.1	-177.1	175.8	-176.5	0	110.1	Y547 M548 K552	Y547-K550 WeakPolarHBondContact O-CB 3.14Å; Y547-K550 WeakPolarHBondContact O-CG 3.24Å; Y547-K550 PolarHBondContact O-N 2.91Å; Y547-K550 VanDerWaalsContact O-N 3.1Å; M548-K550 VanDerWaalsContact C-N 3.3Å; K550-K552 PolarHBondContact O-N 2.91Å
551	P	50.2	Low	58.6	Low	76 Å²	76	85.9 Å²	85.9	49%	0.494	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-67.2	125.8	-179.4	27.5	-33.9	0	0	0	110.6
552	K	53.3	Low	56.9	Low	145 Å²	145	83.2 Å²	83.2	63%	0.63	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-79.6	135.3	175.6	-62.8	178.8	-178.8	-178.7	0	109.8	K550	K550-K552 PolarHBondContact O-N 2.91Å
553	F	49.5	Very low	55.8	Low	13 Å²	13	83.6 Å²	83.6	6%	0.057	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-69.2	134.1	168.7	-178.2	-108.1	0	0	0	110.1	F600 E633 A636 L788	F553-F600 HydrophobicContact CB-CD1 3.96Å; F553-F600 HydrophobicContact CB-CD2 4.09Å; F553-F600 HydrophobicContact CB-CE1 4.13Å; F553-F600 HydrophobicContact CB-CE2 4.27Å; F553-F600 HydrophobicContact CB-CG 3.93Å; F553-F600 HydrophobicContact CB-CZ 4.28Å; F553-F600 AromaticContact CD2-CD2 3.57Å; F553-F600 HydrophobicContact CD2-CD2 3.57Å; F553-F600 AromaticContact CD2-CE2 3.8Å; F553-F600 HydrophobicContact CD2-CE2 3.8Å; F553-F600 HydrophobicContact CD2-CG 4.18Å; F553-F600 HydrophobicContact CE2-CD2 4.39Å; F553-F600 HydrophobicContact CG-CD2 4.06Å; F553-F600 HydrophobicContact CG-CE2 4.44Å; F553-F600 HydrophobicContact CG-CG 4.21Å; F553-E633 HydrophobicContact CB-CG 4.42Å; F553-A636 HydrophobicContact CD1-CB 3.54Å; F553-A636 HydrophobicContact CE1-CB 3.87Å; F553-L788 HydrophobicContact CD1-CD2 3.63Å; F553-L788 HydrophobicContact CD1-CG 4.44Å; F553-L788 HydrophobicContact CD2-CD2 4.24Å; F553-L788 HydrophobicContact CE1-CD1 4.35Å; F553-L788 HydrophobicContact CE1-CD2 3.4Å; F553-L788 HydrophobicContact CE1-CG 3.72Å; F553-L788 HydrophobicContact CE2-CD2 4.04Å; F553-L788 HydrophobicContact CE2-CG 4.25Å; F553-L788 HydrophobicContact CG-CD2 4.07Å; F553-L788 HydrophobicContact CZ-CD2 3.63Å; F553-L788 HydrophobicContact CZ-CG 3.62Å
554	Q	50	Low	54.3	Low	154 Å²	154	84 Å²	84	72%	0.72	40%	0.399	S	S	*	.			trans	-134.4	147.6	174	-74.1	-172.4	-32	0	0	109
555	I	51.5	Low	53.6	Low	24 Å²	24	83.4 Å²	83.4	12%	0.123	41%	0.407	C	S	.	.			trans	-71.3	141.5	-178.1	-55.9	160.4	0	0	0	109.9	W557 A636 S639	I555-W557 HydrophobicContact CG2-CB 4.01Å; I555-A636 WeakPolarHBondContact CD1-O 3.29Å; I555-A636 HydrophobicContact CG1-CB 4.19Å; I555-A636 WeakPolarHBondContact CG1-O 3.45Å; I555-S639 VanDerWaalsContact CD1-CB 3.42Å; I555-S639 VanDerWaalsContact CD1-OG 3.27Å; I555-S639 WeakPolarHBondContact CD1-OG 3.18Å
556	Q	55.1	Low	52.3	Low	30 Å²	30	82.8 Å²	82.8	14%	0.14	41%	0.414	C	S	.	.	S	Bend	trans	-74.6	-48	173.9	-59.6	-62.4	-4.2	0	0	111.6	H765 R766 D767 D785	Q556-H765 WeakPolarHBondContact CB-O 3.34Å; Q556-R766 VanDerWaalsContact O-CD 3.27Å; Q556-R766 WeakPolarHBondContact O-CD 3.35Å; Q556-R766 PolarHBondContact O-NH1 3.22Å; Q556-D767 HydrophobicContact CB-CB 4.36Å; Q556-D767 HydrophobicContact CG-CB 3.94Å; Q556-D785 WeakPolarHBondContact CG-OD2 3.45Å
557	W	48.4	Very low	51.7	Low	8 Å²	8	81.7 Å²	81.7	3%	0.03	42%	0.415	C	S	.	.			trans	-57.5	137.3	177.8	-56.2	78.2	0	0	0	113.1	I555 V643 L647 I758 I764 H765 I783	I555-W557 HydrophobicContact CG2-CB 4.01Å; W557-V643 HydrophobicContact CB-CG1 3.96Å; W557-V643 HydrophobicContact CG-CG1 4.38Å; W557-L647 HydrophobicContact CE3-CD1 3.94Å; W557-L647 HydrophobicContact CH2-CD1 4.26Å; W557-L647 HydrophobicContact CZ3-CD1 3.66Å; W557-I758 HydrophobicContact CE3-CG2 4.41Å; W557-I758 HydrophobicContact CH2-CD1 3.58Å; W557-I758 HydrophobicContact CH2-CG1 4.16Å; W557-I758 HydrophobicContact CZ3-CB 4.47Å; W557-I758 HydrophobicContact CZ3-CD1 3.69Å; W557-I758 HydrophobicContact CZ3-CG1 3.83Å; W557-I758 HydrophobicContact CZ3-CG2 3.78Å; W557-I764 WeakPolarHBondContact CA-O 3.4Å; W557-H765 AromaticContact CE2-CD2 3.81Å; W557-H765 AromaticContact CH2-CD2 3.49Å; W557-H765 VanDerWaalsContact CH2-CD2 3.49Å; W557-H765 WeakPolarHBondContact CH2-CD2 3.41Å; W557-H765 AromaticContact CZ2-CD2 3.31Å; W557-H765 WeakPolarHBondContact CZ2-CD2 3.36Å; W557-H765 AromaticContact CZ2-NE2 3.57Å; W557-I783 HydrophobicContact CH2-CG2 4.4Å
558	K	64.3	Low	51.7	Low	66 Å²	66	78 Å²	78	29%	0.287	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	144.2	168.6	-71.7	-170.5	170.2	-167.6	0	110.7	Y570 C763 I764	K558-Y570 HydrophobicContact CB-CD1 3.91Å; K558-Y570 HydrophobicContact CB-CE1 4.41Å; K558-Y570 HydrophobicContact CD-CD1 3.62Å; K558-Y570 HydrophobicContact CD-CD2 3.98Å; K558-Y570 HydrophobicContact CD-CE1 3.9Å; K558-Y570 HydrophobicContact CD-CE2 4.21Å; K558-Y570 HydrophobicContact CD-CG 3.66Å; K558-Y570 HydrophobicContact CG-CD1 4.43Å; K558-C763 VanDerWaalsContact O-CA 3.31Å; K558-C763 WeakPolarHBondContact O-CA 3.31Å; K558-C763 PolarHBondContact O-SG 2.78Å; K558-I764 PolarHBondContact N-O 3.36Å; K558-I764 VanDerWaalsContact N-O 3.15Å; K558-I764 PolarHBondContact O-N 3.13Å
559	V	57.8	Low	51.9	Low	1 Å²	1	74.9 Å²	74.9	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.6	172	-172.9	0	0	0	0	108.6	Y570 I571 L576 V643 Y646	V559-Y570 CarbonylContact O-C 3.49Å; V559-Y570 WeakPolarHBondContact O-CA 2.81Å; V559-I571 HydrophobicContact CB-CB 4.44Å; V559-I571 HydrophobicContact CB-CD1 4.29Å; V559-I571 HydrophobicContact CG1-CD1 3.8Å; V559-I571 HydrophobicContact CG1-CG1 4.49Å; V559-I571 PolarHBondContact O-N 3.25Å; V559-L576 HydrophobicContact CG2-CD1 4.48Å; V559-V643 HydrophobicContact CG2-CG2 4.48Å; V559-Y646 HydrophobicContact CG1-CD1 4.29Å; V559-Y646 HydrophobicContact CG1-CE1 3.59Å; V559-Y646 HydrophobicContact CG2-CD1 4Å; V559-Y646 HydrophobicContact CG2-CE1 4.1Å
560	I	60.3	Low	52.7	Low	6 Å²	6	72.3 Å²	72.3	3%	0.031	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.9	177.8	-62.5	150.7	0	0	0	109.4	S562 I563 Y568 I569 Y570 N762 I764 F823	I560-S562 WeakPolarHBondContact CG2-O 3.49Å; I560-I563 HydrophobicContact CG2-CG1 4.05Å; I560-Y568 HydrophobicContact CD1-CD1 3.67Å; I560-Y568 HydrophobicContact CD1-CE1 4.1Å; I560-Y568 HydrophobicContact CG1-CD1 4.05Å; I560-Y568 HydrophobicContact CG2-CD1 4.35Å; I560-I569 CarbonylContact C-O 3.58Å; I560-I569 WeakPolarHBondContact CA-O 3.2Å; I560-Y570 HydrophobicContact CG1-CD1 4.39Å; I560-N762 HydrophobicContact CB-CB 4.37Å; I560-N762 PolarHBondContact N-O 3.3Å; I560-I764 HydrophobicContact CD1-CD1 3.9Å; I560-I764 HydrophobicContact CD1-CG1 4.08Å; I560-I764 HydrophobicContact CG1-CD1 4.28Å; I560-F823 HydrophobicContact CD1-CE1 3.64Å; I560-F823 HydrophobicContact CD1-CE2 3.9Å; I560-F823 HydrophobicContact CD1-CZ 3.27Å
561	E	47.8	Very low	53.3	Low	125 Å²	125	68.3 Å²	68.3	58%	0.584	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	-48.8	177.3	-163.3	173.7	-175.6	0	0	111.3	I569 I571	E561-I569 HydrophobicContact CB-CG2 4.13Å; E561-I569 PolarHBondContact N-O 3.43Å; E561-I571 HydrophobicContact CB-CD1 4.35Å; E561-I571 HydrophobicContact CB-CG1 3.52Å; E561-I571 HydrophobicContact CG-CD1 4.5Å; E561-I571 HydrophobicContact CG-CG1 3.91Å
562	S	45.1	Very low	54	Low	45 Å²	45	68.1 Å²	68.1	32%	0.315	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	160.4	-179.7	58.2	0	0	0	0	111.5	I560 I569	I560-S562 WeakPolarHBondContact CG2-O 3.49Å; S562-I569 PolarHBondContact O-N 2.88Å; S562-I569 VanDerWaalsContact O-N 3.13Å
563	I	51.8	Low	54.6	Low	92 Å²	92	62.2 Å²	62.2	47%	0.472	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	93.3	-178.1	-58.4	174.6	0	0	0	107.6	I560 G565	I560-I563 HydrophobicContact CG2-CG1 4.05Å; I563-G565 WeakPolarHBondContact CG2-O 3.33Å; I563-G565 PolarHBondContact O-N 3.36Å
564	N	40.9	Very low	55.3	Low	114 Å²	114	65.8 Å²	65.8	61%	0.61	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	81.1	176.9	-85.9	-1.1	0	0	0	109.1	N566 N567	N564-N566 PolarHBondContact O-N 3.28Å; N564-N567 PolarHBondContact N-O 2.77Å; N564-N567 VanDerWaalsContact N-O 3.1Å; N564-N567 PolarHBondContact O-N 3.43Å
565	G	54.9	Low	56.3	Low	57 Å²	57	65.3 Å²	65.3	59%	0.588	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	-124.7	-172.8	0	0	0	0	0	110.8	I563 N567	I563-G565 WeakPolarHBondContact CG2-O 3.33Å; I563-G565 PolarHBondContact O-N 3.36Å; G565-N567 VanDerWaalsContact C-N 3.27Å; G565-N567 PolarHBondContact O-N 3.2Å
566	N	43.9	Very low	57.5	Low	141 Å²	141	64.8 Å²	64.8	75%	0.754	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-2.5	179.6	-65.4	5.1	0	0	0	113.6	N564	N564-N566 PolarHBondContact O-N 3.28Å
567	N	48.4	Very low	58.6	Low	121 Å²	121	68.5 Å²	68.5	65%	0.647	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.8	-177.1	-72.9	-17.6	0	0	0	111.7	N564 G565	N564-N567 PolarHBondContact N-O 2.77Å; N564-N567 VanDerWaalsContact N-O 3.1Å; N564-N567 PolarHBondContact O-N 3.43Å; G565-N567 VanDerWaalsContact C-N 3.27Å; G565-N567 PolarHBondContact O-N 3.2Å
568	Y	58.5	Low	60.2	Low	49 Å²	49	70.3 Å²	70.3	19%	0.192	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.4	177.7	-64.3	-95.9	0	0	0	110.4	I560 T822 F823 E824	I560-Y568 HydrophobicContact CD1-CD1 3.67Å; I560-Y568 HydrophobicContact CD1-CE1 4.1Å; I560-Y568 HydrophobicContact CG1-CD1 4.05Å; I560-Y568 HydrophobicContact CG2-CD1 4.35Å; Y568-T822 HydrophobicContact CD2-CG2 3.85Å; Y568-T822 HydrophobicContact CE2-CG2 3.3Å; Y568-F823 HydrophobicContact CE1-CD2 4.47Å; Y568-F823 HydrophobicContact CE1-CE2 4.35Å; Y568-E824 PolarHBondContact OH-OE2 3.14Å
569	I	61.2	Low	61.1	Low	69 Å²	69	70.3 Å²	70.3	35%	0.354	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.3	171.3	-64.6	174.7	0	0	0	107.9	I560 E561 S562	I560-I569 CarbonylContact C-O 3.58Å; I560-I569 WeakPolarHBondContact CA-O 3.2Å; E561-I569 HydrophobicContact CB-CG2 4.13Å; E561-I569 PolarHBondContact N-O 3.43Å; S562-I569 PolarHBondContact O-N 2.88Å; S562-I569 VanDerWaalsContact O-N 3.13Å
570	Y	65.1	Low	62.4	Low	66 Å²	66	76.5 Å²	76.5	26%	0.259	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.7	-177.6	-53.5	-69.8	0	0	0	110.8	K558 V559 I560 D572 I764 Y821	K558-Y570 HydrophobicContact CB-CD1 3.91Å; K558-Y570 HydrophobicContact CB-CE1 4.41Å; K558-Y570 HydrophobicContact CD-CD1 3.62Å; K558-Y570 HydrophobicContact CD-CD2 3.98Å; K558-Y570 HydrophobicContact CD-CE1 3.9Å; K558-Y570 HydrophobicContact CD-CE2 4.21Å; K558-Y570 HydrophobicContact CD-CG 3.66Å; K558-Y570 HydrophobicContact CG-CD1 4.43Å; V559-Y570 CarbonylContact O-C 3.49Å; V559-Y570 WeakPolarHBondContact O-CA 2.81Å; I560-Y570 HydrophobicContact CG1-CD1 4.39Å; Y570-D572 PolarHBondContact O-N 3.19Å; Y570-I764 HydrophobicContact CE1-CD1 4.09Å; Y570-Y821 PolarHBondContact OH-O 3.09Å
571	I	61.8	Low	63.7	Low	33 Å²	33	81.2 Å²	81.2	17%	0.169	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	130.6	169.2	-56	178.7	0	0	0	108	V559 E561 P573 L576	V559-I571 HydrophobicContact CB-CB 4.44Å; V559-I571 HydrophobicContact CB-CD1 4.29Å; V559-I571 HydrophobicContact CG1-CD1 3.8Å; V559-I571 HydrophobicContact CG1-CG1 4.49Å; V559-I571 PolarHBondContact O-N 3.25Å; E561-I571 HydrophobicContact CB-CD1 4.35Å; E561-I571 HydrophobicContact CB-CG1 3.52Å; E561-I571 HydrophobicContact CG-CD1 4.5Å; E561-I571 HydrophobicContact CG-CG1 3.91Å; I571-P573 WeakPolarHBondContact O-CD 3.19Å; I571-L576 HydrophobicContact CG2-CD2 4.19Å; I571-L576 HydrophobicContact CG2-CG 4.34Å
572	D	65.1	Low	65.8	Low	71 Å²	71	76.9 Å²	76.9	38%	0.38	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-66.6	116.5	166.4	177.9	-2.7	0	0	0	109.2	Y570 L574 Q575	Y570-D572 PolarHBondContact O-N 3.19Å; D572-L574 PolarHBondContact O-N 3.05Å; D572-L574 WeakPolarHBondContact OD1-CB 3.42Å; D572-L574 WeakPolarHBondContact OD1-CG 3.29Å; D572-L574 PolarHBondContact OD1-N 3.44Å; D572-Q575 HydrophobicContact CB-CG 4.14Å; D572-Q575 WeakPolarHBondContact O-CB 3.44Å; D572-Q575 PolarHBondContact O-N 3.21Å
573	P	64.4	Low	68.1	Low	21 Å²	21	77.3 Å²	77.3	14%	0.136	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-16	179.7	-28.4	40.2	0	0	0	114.9	I571 Q575 L576 K642 V643	I571-P573 WeakPolarHBondContact O-CD 3.19Å; P573-Q575 VanDerWaalsContact C-N 3.27Å; P573-Q575 PolarHBondContact O-N 3.38Å; P573-L576 HydrophobicContact CB-CD1 4.48Å; P573-K642 WeakPolarHBondContact O-CD 3.15Å; P573-V643 HydrophobicContact CB-CG2 4.28Å; P573-V643 HydrophobicContact CG-CG2 4.47Å
574	L	65.1	Low	70	Confident	89 Å²	89	73.9 Å²	73.9	47%	0.466	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-30.5	170.1	-65.6	175.1	0	0	0	112.5	D572 E635 K642	D572-L574 PolarHBondContact O-N 3.05Å; D572-L574 WeakPolarHBondContact OD1-CB 3.42Å; D572-L574 WeakPolarHBondContact OD1-CG 3.29Å; D572-L574 PolarHBondContact OD1-N 3.44Å; L574-E635 HydrophobicContact CD2-CB 4.43Å; L574-K642 PolarHBondContact O-NZ 3.37Å
575	Q	71.7	Confident	72.4	Confident	144 Å²	144	71.5 Å²	71.5	67%	0.673	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-20.5	-178	-57.8	-177.2	28.1	0	0	113.5	D572 P573	D572-Q575 HydrophobicContact CB-CG 4.14Å; D572-Q575 WeakPolarHBondContact O-CB 3.44Å; D572-Q575 PolarHBondContact O-N 3.21Å; P573-Q575 VanDerWaalsContact C-N 3.27Å; P573-Q575 PolarHBondContact O-N 3.38Å
576	L	76.1	Confident	74.1	Confident	13 Å²	13	71.3 Å²	71.3	7%	0.068	36%	0.36	C	S	.	.	S	Bend	trans	-59.8	138.7	175.9	-68.2	174.1	0	0	0	111	V559 I571 P573 K642 V643 Y646	V559-L576 HydrophobicContact CG2-CD1 4.48Å; I571-L576 HydrophobicContact CG2-CD2 4.19Å; I571-L576 HydrophobicContact CG2-CG 4.34Å; P573-L576 HydrophobicContact CB-CD1 4.48Å; L576-K642 HydrophobicContact CB-CB 3.98Å; L576-K642 HydrophobicContact CB-CD 4.23Å; L576-K642 HydrophobicContact CB-CG 4.5Å; L576-K642 HydrophobicContact CD1-CB 4.35Å; L576-K642 VanDerWaalsContact O-CD 3.24Å; L576-K642 WeakPolarHBondContact O-CD 3.23Å; L576-K642 WeakPolarHBondContact O-CE 3.4Å; L576-K642 PolarHBondContact O-NZ 2.85Å; L576-V643 HydrophobicContact CD1-CG2 4.01Å; L576-Y646 HydrophobicContact CD2-CD2 4.19Å; L576-Y646 HydrophobicContact CD2-CG 4.47Å
577	P	77.5	Confident	76.1	Confident	107 Å²	107	71.7 Å²	71.7	70%	0.695	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-69.7	145.5	177.8	28.2	-34.3	0	0	0	111.7
578	Y	82.5	Confident	78	Confident	47 Å²	47	70.8 Å²	70.8	18%	0.184	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-98.9	125.7	165.3	175.8	-120.4	0	0	0	109.3	L580 W582 E583 M638 L641 T661	Y578-L580 HydrophobicContact CE1-CD2 4.37Å; Y578-W582 HydrophobicContact CE2-CB 4.15Å; Y578-E583 PolarHBondContact OH-OE2 2.94Å; Y578-M638 HydrophobicContact CD1-CE 3.81Å; Y578-M638 HydrophobicContact CD2-CE 4Å; Y578-M638 HydrophobicContact CE1-CE 4.36Å; Y578-M638 HydrophobicContact CG-CE 3.6Å; Y578-L641 HydrophobicContact CD2-CD2 4.11Å; Y578-L641 HydrophobicContact CD2-CG 4.23Å; Y578-L641 HydrophobicContact CE2-CD1 4.32Å; Y578-L641 HydrophobicContact CE2-CD2 3.62Å; Y578-L641 HydrophobicContact CE2-CG 3.97Å; Y578-T661 HydrophobicContact CE1-CG2 3.88Å; Y578-T661 HydrophobicContact CE2-CG2 4.38Å
579	D	83.6	Confident	79.6	Confident	65 Å²	65	69 Å²	69	35%	0.348	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-94	121.1	-179.6	-170.3	-30	0	0	0	110.6	K581 W582	D579-K581 HydrophobicContact CB-CD 4.41Å; D579-K581 HydrophobicContact CB-CG 4.21Å; D579-K581 PolarHBondContact O-N 3.19Å; D579-K581 VanDerWaalsContact OD1-CB 3.3Å; D579-K581 WeakPolarHBondContact OD1-CB 3.45Å; D579-K581 VanDerWaalsContact OD1-CG 3.28Å; D579-K581 WeakPolarHBondContact OD1-CG 3.42Å; D579-K581 PolarHBondContact OD1-N 2.82Å; D579-K581 WeakPolarHBondContact OD2-CD 3.38Å; D579-K581 WeakPolarHBondContact OD2-CE 3.42Å; D579-K581 IonicContact OD2-NZ 3.48Å; D579-K581 PolarHBondContact OD2-NZ 2.78Å; D579-W582 PolarHBondContact O-N 2.82Å
580	L	85.3	Confident	80.8	Confident	131 Å²	131	70.7 Å²	70.7	69%	0.686	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-61.1	-15.1	-179.6	-67.3	173.3	0	0	0	113.5	Y578 W582 E583	Y578-L580 HydrophobicContact CE1-CD2 4.37Å; L580-W582 PolarHBondContact O-N 3.13Å; L580-W582 VanDerWaalsContact O-N 3.07Å; L580-E583 WeakPolarHBondContact O-CB 3.36Å; L580-E583 PolarHBondContact O-N 2.71Å
581	K	86.3	Confident	82	Confident	106 Å²	106	71.9 Å²	71.9	46%	0.461	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-59.4	-16.5	173.7	80.4	-171	169.7	-141.9	0	114.3	D579	D579-K581 HydrophobicContact CB-CD 4.41Å; D579-K581 HydrophobicContact CB-CG 4.21Å; D579-K581 PolarHBondContact O-N 3.19Å; D579-K581 VanDerWaalsContact OD1-CB 3.3Å; D579-K581 WeakPolarHBondContact OD1-CB 3.45Å; D579-K581 VanDerWaalsContact OD1-CG 3.28Å; D579-K581 WeakPolarHBondContact OD1-CG 3.42Å; D579-K581 PolarHBondContact OD1-N 2.82Å; D579-K581 WeakPolarHBondContact OD2-CD 3.38Å; D579-K581 WeakPolarHBondContact OD2-CE 3.42Å; D579-K581 IonicContact OD2-NZ 3.48Å; D579-K581 PolarHBondContact OD2-NZ 2.78Å
582	W	91.7	Very high	83.1	Confident	34 Å²	34	71.8 Å²	71.8	13%	0.129	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-90.4	-14.6	177.6	-62.4	118.9	0	0	0	113.4	Y578 D579 L580 F584 S645 L656 G658 A659	Y578-W582 HydrophobicContact CE2-CB 4.15Å; D579-W582 PolarHBondContact O-N 2.82Å; L580-W582 PolarHBondContact O-N 3.13Å; L580-W582 VanDerWaalsContact O-N 3.07Å; W582-F584 PolarHBondContact O-N 2.96Å; W582-S645 PolarHBondContact NE1-OG 3.14Å; W582-L656 HydrophobicContact CD2-CD2 3.65Å; W582-L656 HydrophobicContact CD2-CG 4.13Å; W582-L656 HydrophobicContact CE3-CD2 4Å; W582-L656 HydrophobicContact CE3-CG 3.95Å; W582-L656 HydrophobicContact CG-CD2 4.02Å; W582-L656 HydrophobicContact CH2-CB 4.35Å; W582-L656 HydrophobicContact CH2-CD2 4.25Å; W582-L656 HydrophobicContact CH2-CG 4.3Å; W582-L656 HydrophobicContact CZ2-CD2 3.94Å; W582-L656 HydrophobicContact CZ2-CG 4.49Å; W582-L656 HydrophobicContact CZ3-CB 4.38Å; W582-L656 HydrophobicContact CZ3-CD2 4.29Å; W582-L656 HydrophobicContact CZ3-CG 4.04Å; W582-L656 VanDerWaalsContact CZ3-O 3.3Å; W582-L656 WeakPolarHBondContact CZ3-O 3.36Å; W582-G658 CarbonylContact O-C 3.55Å; W582-G658 WeakPolarHBondContact O-CA 3.35Å; W582-A659 PolarHBondContact O-N 2.8Å
583	E	93.8	Very high	84	Confident	54 Å²	54	73 Å²	73	25%	0.252	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-70.8	115.4	-174.7	-166	67.8	-160	0	0	110.7	Y578 L580 A659 C660 T661 V662	Y578-E583 PolarHBondContact OH-OE2 2.94Å; L580-E583 WeakPolarHBondContact O-CB 3.36Å; L580-E583 PolarHBondContact O-N 2.71Å; E583-A659 CarbonylContact C-O 3.6Å; E583-A659 WeakPolarHBondContact CA-O 3.45Å; E583-C660 WeakPolarHBondContact OE1-CA 3.3Å; E583-T661 VanDerWaalsContact CD-N 3.34Å; E583-T661 PolarHBondContact OE1-N 3.38Å; E583-T661 WeakPolarHBondContact OE2-CB 3.48Å; E583-T661 PolarHBondContact OE2-N 2.83Å; E583-T661 VanDerWaalsContact OE2-N 3.13Å; E583-T661 PolarHBondContact OE2-OG1 3.15Å; E583-V662 HydrophobicContact CG-CG2 4.48Å; E583-V662 PolarHBondContact OE1-N 3.38Å
584	F	92.8	Very high	85	Confident	19 Å²	19	74.7 Å²	74.7	8%	0.083	37%	0.369	C	S	.	.			trans	-108.7	135.3	-172.9	-178.6	-103.4	0	0	0	110.9	W582 R586 K588 L589 A608 Y609 L611 A659 C660 I669	W582-F584 PolarHBondContact O-N 2.96Å; F584-R586 PolarHBondContact O-N 2.9Å; F584-K588 HydrophobicContact CE1-CB 3.93Å; F584-K588 HydrophobicContact CZ-CB 3.67Å; F584-L589 HydrophobicContact CE1-CB 4.09Å; F584-L589 HydrophobicContact CE1-CD1 4.33Å; F584-A608 HydrophobicContact CE1-CB 4.2Å; F584-A608 HydrophobicContact CZ-CB 4.09Å; F584-Y609 WeakPolarHBondContact CE2-O 3.43Å; F584-Y609 VanDerWaalsContact CZ-O 3.24Å; F584-Y609 WeakPolarHBondContact CZ-O 3.37Å; F584-L611 HydrophobicContact CD2-CD1 3.5Å; F584-L611 HydrophobicContact CE2-CB 4Å; F584-L611 HydrophobicContact CE2-CD1 3.66Å; F584-L611 HydrophobicContact CE2-CG 4.45Å; F584-L611 HydrophobicContact CG-CD1 4.1Å; F584-L611 HydrophobicContact CZ-CB 4.45Å; F584-L611 HydrophobicContact CZ-CD1 4.35Å; F584-A659 PolarHBondContact N-O 3.36Å; F584-C660 PolarHBondContact O-SG 3.4Å; F584-I669 HydrophobicContact CB-CD1 3.96Å; F584-I669 HydrophobicContact CD1-CD1 3.63Å; F584-I669 HydrophobicContact CE1-CD1 4.45Å; F584-I669 HydrophobicContact CG-CD1 4.02Å
585	P	89.9	Confident	85.8	Confident	65 Å²	65	72.4 Å²	72.4	42%	0.422	36%	0.357	S	S	.	.			trans	-60.5	109.4	179.9	-25.1	35.2	0	0	0	112.4	Q587 K588	P585-Q587 PolarHBondContact O-N 3.4Å; P585-K588 HydrophobicContact CB-CG 4.28Å; P585-K588 WeakPolarHBondContact O-CB 3.35Å; P585-K588 PolarHBondContact O-N 2.75Å
586	R	91.3	Very high	85.9	Confident	53 Å²	53	65.7 Å²	65.7	20%	0.2	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-57.6	-21.1	-176.3	56.8	173	61.2	-104	4.2	114.9	F584 K588 L589 C660 V662 G663 P665	F584-R586 PolarHBondContact O-N 2.9Å; R586-K588 VanDerWaalsContact C-N 3.31Å; R586-L589 PolarHBondContact O-N 3.32Å; R586-C660 HydrophobicContact CB-CB 4.1Å; R586-C660 PolarHBondContact NH2-O 3.27Å; R586-V662 VanDerWaalsContact CZ-O 3.25Å; R586-V662 PolarHBondContact NE-O 3.13Å; R586-V662 PolarHBondContact NH2-O 3.26Å; R586-G663 WeakPolarHBondContact CD-O 3.27Å; R586-G663 PolarHBondContact NE-O 2.85Å; R586-P665 PolarHBondContact NH1-O 2.91Å; R586-P665 PolarHBondContact NH2-O 3.24Å
587	Q	86.8	Confident	85.9	Confident	148 Å²	148	68.5 Å²	68.5	69%	0.692	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-68.8	-29.3	173.6	-59.3	80.8	-3.9	0	0	112.3	P585 L589	P585-Q587 PolarHBondContact O-N 3.4Å; Q587-L589 PolarHBondContact O-N 3.44Å
588	K	88.5	Confident	85.4	Confident	103 Å²	103	63.6 Å²	63.6	45%	0.448	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-85.3	16.4	177.1	-64.6	-162.3	179.4	-166.9	0	113.3	F584 P585 R586 A608 Y609	F584-K588 HydrophobicContact CE1-CB 3.93Å; F584-K588 HydrophobicContact CZ-CB 3.67Å; P585-K588 HydrophobicContact CB-CG 4.28Å; P585-K588 WeakPolarHBondContact O-CB 3.35Å; P585-K588 PolarHBondContact O-N 2.75Å; R586-K588 VanDerWaalsContact C-N 3.31Å; K588-A608 WeakPolarHBondContact O-CA 3.37Å; K588-Y609 WeakPolarHBondContact CB-O 3.27Å; K588-Y609 WeakPolarHBondContact CD-O 3.42Å; K588-Y609 WeakPolarHBondContact O-CD2 3.15Å; K588-Y609 PolarHBondContact O-N 3.31Å
589	L	91	Very high	84.5	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.052	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	108.6	-178.3	-167.4	64.6	0	0	0	110.5	F584 R586 Q587 F591 A606 A608 V620 V622 L667 I669	F584-L589 HydrophobicContact CE1-CB 4.09Å; F584-L589 HydrophobicContact CE1-CD1 4.33Å; R586-L589 PolarHBondContact O-N 3.32Å; Q587-L589 PolarHBondContact O-N 3.44Å; L589-F591 HydrophobicContact CD2-CE1 3.9Å; L589-F591 HydrophobicContact CD2-CZ 4.23Å; L589-F591 HydrophobicContact CG-CE1 4.15Å; L589-A606 HydrophobicContact CD1-CB 3.94Å; L589-A606 HydrophobicContact CG-CB 4.36Å; L589-A608 HydrophobicContact CD1-CB 3.75Å; L589-V620 HydrophobicContact CD1-CG2 4.11Å; L589-V622 HydrophobicContact CD1-CG2 4.1Å; L589-V622 HydrophobicContact CD2-CG1 4.39Å; L589-V622 HydrophobicContact CD2-CG2 4.12Å; L589-V622 HydrophobicContact CG-CG2 4.47Å; L589-L667 HydrophobicContact CD2-CD1 3.74Å; L589-I669 HydrophobicContact CD1-CD1 4.22Å; L589-I669 HydrophobicContact CD2-CD1 3.97Å; L589-I669 HydrophobicContact CD2-CG1 4.29Å
590	R	86.5	Confident	83.7	Confident	106 Å²	106	60.7 Å²	60.7	40%	0.4	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	114.9	-179	-59.5	-65.3	-158.7	169.9	8.2	110.6	A606 T607 Y609	R590-A606 CarbonylContact O-C 3.48Å; R590-A606 VanDerWaalsContact O-CA 3.28Å; R590-A606 WeakPolarHBondContact O-CA 3.32Å; R590-A606 WeakPolarHBondContact O-CB 3.23Å; R590-T607 PolarHBondContact N-O 3.28Å; R590-T607 PolarHBondContact O-N 2.85Å; R590-Y609 HydrophobicContact CB-CE2 4.15Å; R590-Y609 HydrophobicContact CG-CD2 4.43Å; R590-Y609 HydrophobicContact CG-CE2 3.54Å
591	F	89.7	Confident	83.4	Confident	90 Å²	90	54.5 Å²	54.5	40%	0.395	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	146.3	-179	-57.1	-58	0	0	0	113.5	R383 L589 V604 A606 V622 M624 L667	R383-F591 PolarHBondContact NH1-O 2.76Å; R383-F591 PolarHBondContact NH2-O 3.03Å; L589-F591 HydrophobicContact CD2-CE1 3.9Å; L589-F591 HydrophobicContact CD2-CZ 4.23Å; L589-F591 HydrophobicContact CG-CE1 4.15Å; F591-V604 HydrophobicContact CD1-CG2 3.61Å; F591-V604 HydrophobicContact CE1-CG2 4.25Å; F591-V604 HydrophobicContact CG-CG2 4.35Å; F591-A606 HydrophobicContact CD1-CB 3.99Å; F591-V622 HydrophobicContact CE1-CB 4.38Å; F591-V622 HydrophobicContact CE1-CG1 4.16Å; F591-V622 HydrophobicContact CE1-CG2 4.44Å; F591-M624 HydrophobicContact CD1-CE 3.93Å; F591-M624 HydrophobicContact CE1-CE 3.47Å; F591-M624 VanDerWaalsContact CE1-CE 3.47Å; F591-M624 HydrophobicContact CE2-CE 4.43Å; F591-M624 HydrophobicContact CZ-CE 3.76Å; F591-L667 HydrophobicContact CE1-CD1 4.36Å; F591-L667 HydrophobicContact CZ-CD1 3.8Å; F591-L667 HydrophobicContact CZ-CD2 4.35Å
592	G	86	Confident	83.3	Confident	32 Å²	32	53.1 Å²	53.1	33%	0.33	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	-146.4	175.5	0	0	0	0	0	111.8	R605	G592-R605 CarbonylContact C-O 3.52Å; G592-R605 WeakPolarHBondContact CA-O 3.5Å; G592-R605 PolarHBondContact N-O 2.76Å
593	K	84.4	Confident	83.2	Confident	97 Å²	97	51.7 Å²	51.7	42%	0.422	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	144.5	-176.7	72.9	-168.7	-167.3	-172.9	0	112.6	L595 R605 D732	K593-L595 HydrophobicContact CG-CD2 4.35Å; K593-R605 HydrophobicContact CG-CB 4.38Å; K593-R605 PolarHBondContact O-N 3.47Å; K593-D732 IonicContact NZ-OD2 2.99Å; K593-D732 PolarHBondContact NZ-OD2 3.07Å
594	T	84.9	Confident	83	Confident	56 Å²	56	49.3 Å²	49.3	34%	0.344	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	132.4	170.4	-58.8	0	0	0	0	108.9	G596 K602 V604	T594-G596 WeakPolarHBondContact CG2-O 3.49Å; T594-K602 HydrophobicContact CG2-CB 4.38Å; T594-V604 HydrophobicContact CG2-CG1 4.46Å
595	L	82	Confident	82.9	Confident	40 Å²	40	51.2 Å²	51.2	21%	0.209	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-41.4	-179.6	-60.7	172.7	0	0	0	110.7	K593 V603 R605 A621 Y672 M720	K593-L595 HydrophobicContact CG-CD2 4.35Å; L595-V603 HydrophobicContact CD1-CG1 4.5Å; L595-V603 PolarHBondContact N-O 2.76Å; L595-R605 HydrophobicContact CD1-CB 4.15Å; L595-R605 HydrophobicContact CD2-CB 4.18Å; L595-R605 HydrophobicContact CG-CB 4.21Å; L595-A621 HydrophobicContact CD1-CB 4.36Å; L595-Y672 HydrophobicContact CD1-CD2 3.96Å; L595-Y672 HydrophobicContact CD1-CE2 3.71Å; L595-Y672 HydrophobicContact CD2-CE2 3.92Å; L595-Y672 HydrophobicContact CG-CE2 4.48Å; L595-M720 WeakPolarHBondContact O-CB 3.24Å
596	G	74.3	Confident	83	Confident	4 Å²	4	48.2 Å²	48.2	4%	0.041	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	153.1	172.7	0	0	0	0	0	110.8	T594 K602 V603	T594-G596 WeakPolarHBondContact CG2-O 3.49Å; G596-K602 CarbonylContact O-C 3.56Å; G596-K602 WeakPolarHBondContact O-CA 3.36Å; G596-K602 WeakPolarHBondContact O-CB 3.48Å; G596-V603 PolarHBondContact N-O 2.88Å; G596-V603 PolarHBondContact O-N 3.4Å
597	S	74.6	Confident	82.9	Confident	72 Å²	72	47.2 Å²	47.2	50%	0.503	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	120.3	177.2	-178.9	0	0	0	0	108.8	A789	S597-A789 CarbonylContact C-O 3.58Å; S597-A789 PolarHBondContact N-O 3.32Å
598	G	68.8	Low	83.1	Confident	3 Å²	3	40.2 Å²	40.2	3%	0.031	21%	0.206	C	C	.	.			trans	-102.5	-164.5	-176.6	0	0	0	0	0	113.7	G601 K626 A789 R790	G598-G601 PolarHBondContact N-O 2.93Å; G598-K626 WeakPolarHBondContact O-CE 3.48Å; G598-K626 PolarHBondContact O-NZ 2.79Å; G598-A789 VanDerWaalsContact CA-C 3.45Å; G598-A789 PolarHBondContact N-O 3.15Å; G598-R790 WeakPolarHBondContact CA-O 3.49Å
599	A	62.7	Low	83	Confident	27 Å²	27	37.1 Å²	37.1	22%	0.223	19%	0.192	C	C	.	.	S	Bend	trans	-64.8	-44	172.4	0	0	0	0	0	111.3	K626 R790	A599-K626 WeakPolarHBondContact O-CE 3.38Å; A599-K626 PolarHBondContact O-NZ 3.4Å; A599-R790 PolarHBondContact N-O 2.98Å
600	F	66.4	Low	82.5	Confident	25 Å²	25	37.8 Å²	37.8	11%	0.11	20%	0.201	C	C	.	.	S	Bend	trans	-98.1	-33.1	-168.2	-47.2	-71.1	0	0	0	114.2	F553 K626 E633 L788 I792	F553-F600 HydrophobicContact CB-CD1 3.96Å; F553-F600 HydrophobicContact CB-CD2 4.09Å; F553-F600 HydrophobicContact CB-CE1 4.13Å; F553-F600 HydrophobicContact CB-CE2 4.27Å; F553-F600 HydrophobicContact CB-CG 3.93Å; F553-F600 HydrophobicContact CB-CZ 4.28Å; F553-F600 AromaticContact CD2-CD2 3.57Å; F553-F600 HydrophobicContact CD2-CD2 3.57Å; F553-F600 AromaticContact CD2-CE2 3.8Å; F553-F600 HydrophobicContact CD2-CE2 3.8Å; F553-F600 HydrophobicContact CD2-CG 4.18Å; F553-F600 HydrophobicContact CE2-CD2 4.39Å; F553-F600 HydrophobicContact CG-CD2 4.06Å; F553-F600 HydrophobicContact CG-CE2 4.44Å; F553-F600 HydrophobicContact CG-CG 4.21Å; F600-K626 PolarHBondContact O-N 3.14Å; F600-E633 WeakPolarHBondContact CD1-OE1 3.24Å; F600-L788 HydrophobicContact CB-CD2 3.86Å; F600-I792 HydrophobicContact CE2-CD1 4.39Å
601	G	78.9	Confident	82.1	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	-164.6	-175.5	0	0	0	0	0	113.8	G598 M624 L788	G598-G601 PolarHBondContact N-O 2.93Å; G601-M624 CarbonylContact C-O 3.58Å; G601-M624 VanDerWaalsContact CA-O 3.27Å; G601-M624 WeakPolarHBondContact CA-O 3.34Å; G601-L788 CarbonylContact C-O 3.54Å; G601-L788 VanDerWaalsContact C-O 3.27Å; G601-L788 WeakPolarHBondContact CA-O 3.22Å; G601-L788 PolarHBondContact N-O 3.3Å
602	K	85.4	Confident	81.1	Confident	78 Å²	78	32.1 Å²	32.1	34%	0.339	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	158.2	171.2	67.4	177.8	-176.2	178.9	0	111.1	T594 G596 V604 M624	T594-K602 HydrophobicContact CG2-CB 4.38Å; G596-K602 CarbonylContact O-C 3.56Å; G596-K602 WeakPolarHBondContact O-CA 3.36Å; G596-K602 WeakPolarHBondContact O-CB 3.48Å; K602-V604 HydrophobicContact CD-CG1 4.1Å; K602-V604 HydrophobicContact CG-CG1 4.28Å; K602-M624 HydrophobicContact CD-SD 4.34Å; K602-M624 WeakPolarHBondContact CE-SD 3.45Å; K602-M624 HydrophobicContact CG-CG 3.69Å; K602-M624 HydrophobicContact CG-SD 4.11Å; K602-M624 PolarHBondContact N-O 3.15Å; K602-M624 PolarHBondContact O-N 2.92Å; K602-M624 VanDerWaalsContact O-O 3.05Å
603	V	88.8	Confident	80.4	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.1	173.8	-173.6	0	0	0	0	107.9	L595 G596 A621 V622 K623 F786 A789	L595-V603 HydrophobicContact CD1-CG1 4.5Å; L595-V603 PolarHBondContact N-O 2.76Å; G596-V603 PolarHBondContact N-O 2.88Å; G596-V603 PolarHBondContact O-N 3.4Å; V603-A621 HydrophobicContact CG1-CB 4.14Å; V603-V622 WeakPolarHBondContact CA-O 3.39Å; V603-K623 HydrophobicContact CG1-CG 4.45Å; V603-K623 HydrophobicContact CG2-CB 4.42Å; V603-K623 HydrophobicContact CG2-CG 3.93Å; V603-F786 HydrophobicContact CG2-CD1 4.4Å; V603-F786 HydrophobicContact CG2-CE1 4.3Å; V603-A789 HydrophobicContact CB-CB 4.44Å; V603-A789 HydrophobicContact CG2-CB 3.62Å
604	V	89.4	Confident	79.1	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.024	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	148.4	-179.1	-54.4	0	0	0	0	110.1	F591 T594 K602 A621 V622 M624	F591-V604 HydrophobicContact CD1-CG2 3.61Å; F591-V604 HydrophobicContact CE1-CG2 4.25Å; F591-V604 HydrophobicContact CG-CG2 4.35Å; T594-V604 HydrophobicContact CG2-CG1 4.46Å; K602-V604 HydrophobicContact CD-CG1 4.1Å; K602-V604 HydrophobicContact CG-CG1 4.28Å; V604-A621 CarbonylContact O-C 3.47Å; V604-A621 WeakPolarHBondContact O-CA 3.32Å; V604-V622 HydrophobicContact CG2-CB 4.04Å; V604-V622 PolarHBondContact N-O 3.11Å; V604-V622 PolarHBondContact O-N 3.23Å; V604-M624 HydrophobicContact CG1-CE 4.4Å; V604-M624 HydrophobicContact CG2-CE 3.62Å
605	R	90.3	Very high	77.8	Confident	60 Å²	60	35.3 Å²	35.3	23%	0.226	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	140	160.9	-178.4	178.5	171.4	-164.1	1.3	107.5	G592 K593 L595 T619 V620 Y672 D732	G592-R605 CarbonylContact C-O 3.52Å; G592-R605 WeakPolarHBondContact CA-O 3.5Å; G592-R605 PolarHBondContact N-O 2.76Å; K593-R605 HydrophobicContact CG-CB 4.38Å; K593-R605 PolarHBondContact O-N 3.47Å; L595-R605 HydrophobicContact CD1-CB 4.15Å; L595-R605 HydrophobicContact CD2-CB 4.18Å; L595-R605 HydrophobicContact CG-CB 4.21Å; R605-T619 HydrophobicContact CG-CG2 3.81Å; R605-T619 VanDerWaalsContact NE-CG2 3.31Å; R605-V620 WeakPolarHBondContact CA-O 3.38Å; R605-Y672 HydrophobicContact CB-CE2 4.37Å; R605-Y672 HydrophobicContact CG-CD2 4.4Å; R605-Y672 HydrophobicContact CG-CE2 4.21Å; R605-D732 IonicContact CZ-OD1 2.7Å; R605-D732 IonicContact NH1-OD1 3.51Å; R605-D732 PolarHBondContact NH1-OD1 3.21Å; R605-D732 IonicContact NH1-OD2 3.66Å; R605-D732 PolarHBondContact NH1-OD2 3.48Å; R605-D732 VanDerWaalsContact NH1-OD2 3.16Å; R605-D732 IonicContact NH2-OD1 3.76Å
606	A	91.4	Very high	77.3	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.008	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	167.8	170.3	0	0	0	0	0	111	L589 R590 F591 T619 V620 V622	L589-A606 HydrophobicContact CD1-CB 3.94Å; L589-A606 HydrophobicContact CG-CB 4.36Å; R590-A606 CarbonylContact O-C 3.48Å; R590-A606 VanDerWaalsContact O-CA 3.28Å; R590-A606 WeakPolarHBondContact O-CA 3.32Å; R590-A606 WeakPolarHBondContact O-CB 3.23Å; F591-A606 HydrophobicContact CD1-CB 3.99Å; A606-T619 WeakPolarHBondContact O-CA 3.43Å; A606-V620 HydrophobicContact CB-CG2 3.94Å; A606-V620 PolarHBondContact N-O 3.4Å; A606-V620 PolarHBondContact O-N 2.98Å; A606-V622 HydrophobicContact CB-CG2 3.57Å
607	T	90.9	Very high	77.7	Confident	33 Å²	33	37.3 Å²	37.3	20%	0.202	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.2	174	-55.9	0	0	0	0	107.4	T359 R590 Y609 V617	T359-T607 HydrophobicContact CG2-CG2 4.21Å; R590-T607 PolarHBondContact N-O 3.28Å; R590-T607 PolarHBondContact O-N 2.85Å; T607-Y609 HydrophobicContact CG2-CD2 4.15Å; T607-Y609 HydrophobicContact CG2-CE2 3.57Å; T607-V617 HydrophobicContact CG2-CG1 3.33Å
608	A	89.7	Confident	78.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.2	-173.6	0	0	0	0	0	111.1	F584 K588 L589 L611 V617 T618 V620	F584-A608 HydrophobicContact CE1-CB 4.2Å; F584-A608 HydrophobicContact CZ-CB 4.09Å; K588-A608 WeakPolarHBondContact O-CA 3.37Å; L589-A608 HydrophobicContact CD1-CB 3.75Å; A608-L611 HydrophobicContact CB-CB 4.18Å; A608-L611 HydrophobicContact CB-CD2 3.74Å; A608-L611 HydrophobicContact CB-CG 4.45Å; A608-V617 WeakPolarHBondContact O-CA 3.19Å; A608-V617 WeakPolarHBondContact O-CG1 3.1Å; A608-T618 PolarHBondContact N-O 2.87Å; A608-T618 PolarHBondContact O-N 3.16Å; A608-V620 HydrophobicContact CB-CG1 4.06Å; A608-V620 HydrophobicContact CB-CG2 3.85Å
609	Y	86.5	Confident	79.3	Confident	39 Å²	39	37.8 Å²	37.8	15%	0.153	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.9	-168.5	-62.6	-119.9	0	0	0	110.8	E360 F584 K588 R590 T607 L611 V617	E360-Y609 HydrophobicContact CG-CE1 3.99Å; E360-Y609 WeakPolarHBondContact CG-OH 3.27Å; E360-Y609 WeakPolarHBondContact OE1-CE1 3.39Å; E360-Y609 VanDerWaalsContact OE1-CZ 3.24Å; E360-Y609 PolarHBondContact OE1-OH 2.83Å; E360-Y609 WeakPolarHBondContact OE2-CE1 3.47Å; F584-Y609 WeakPolarHBondContact CE2-O 3.43Å; F584-Y609 VanDerWaalsContact CZ-O 3.24Å; F584-Y609 WeakPolarHBondContact CZ-O 3.37Å; K588-Y609 WeakPolarHBondContact CB-O 3.27Å; K588-Y609 WeakPolarHBondContact CD-O 3.42Å; K588-Y609 WeakPolarHBondContact O-CD2 3.15Å; K588-Y609 PolarHBondContact O-N 3.31Å; R590-Y609 HydrophobicContact CB-CE2 4.15Å; R590-Y609 HydrophobicContact CG-CD2 4.43Å; R590-Y609 HydrophobicContact CG-CE2 3.54Å; T607-Y609 HydrophobicContact CG2-CD2 4.15Å; T607-Y609 HydrophobicContact CG2-CE2 3.57Å; Y609-L611 VanDerWaalsContact C-N 3.32Å; Y609-V617 HydrophobicContact CD1-CB 4.35Å; Y609-V617 HydrophobicContact CD1-CG1 3.8Å; Y609-V617 HydrophobicContact CD1-CG2 3.56Å; Y609-V617 HydrophobicContact CD2-CG1 3.74Å; Y609-V617 HydrophobicContact CE1-CG1 4.16Å; Y609-V617 HydrophobicContact CE1-CG2 4.22Å; Y609-V617 HydrophobicContact CE2-CG1 4.07Å; Y609-V617 HydrophobicContact CG-CB 4.44Å; Y609-V617 HydrophobicContact CG-CG1 3.6Å; Y609-V617 HydrophobicContact CG-CG2 3.97Å
610	G	81.7	Confident	80.8	Confident	24 Å²	24	36.5 Å²	36.5	25%	0.247	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	21.8	-177.1	0	0	0	0	0	114.3	S613 A614 T616	G610-S613 CarbonylContact C-O 3.52Å; G610-S613 WeakPolarHBondContact CA-O 3.35Å; G610-A614 WeakPolarHBondContact CA-O 3.49Å; G610-T616 PolarHBondContact N-O 3.1Å
611	L	77.7	Confident	82.1	Confident	24 Å²	24	35.8 Å²	35.8	13%	0.126	21%	0.213	C	C	.	.	S	Bend	trans	-79.1	-32.7	-170.8	-175.1	65.2	0	0	0	113.7	F584 A608 Y609 V620 L657 I669	F584-L611 HydrophobicContact CD2-CD1 3.5Å; F584-L611 HydrophobicContact CE2-CB 4Å; F584-L611 HydrophobicContact CE2-CD1 3.66Å; F584-L611 HydrophobicContact CE2-CG 4.45Å; F584-L611 HydrophobicContact CG-CD1 4.1Å; F584-L611 HydrophobicContact CZ-CB 4.45Å; F584-L611 HydrophobicContact CZ-CD1 4.35Å; A608-L611 HydrophobicContact CB-CB 4.18Å; A608-L611 HydrophobicContact CB-CD2 3.74Å; A608-L611 HydrophobicContact CB-CG 4.45Å; Y609-L611 VanDerWaalsContact C-N 3.32Å; L611-V620 HydrophobicContact CD2-CG1 3.63Å; L611-L657 HydrophobicContact CD2-CB 3.91Å; L611-L657 HydrophobicContact CD2-CD1 4.11Å; L611-L657 HydrophobicContact CG-CB 4.49Å; L611-I669 HydrophobicContact CD2-CG2 4.49Å
612	C	68.6	Low	82.8	Confident	53 Å²	53	35.8 Å²	35.8	36%	0.358	21%	0.213	S	C	.	.	S	Bend	trans	-107.1	-49.8	-179.7	-53.5	0	0	0	0	110.6	T616	C612-T616 WeakPolarHBondContact CB-OG1 3.41Å; C612-T616 PolarHBondContact N-OG1 2.86Å
613	S	71.2	Confident	83.1	Confident	37 Å²	37	32.9 Å²	32.9	26%	0.259	20%	0.2	S	C	.	.	S	Bend	trans	-138.7	170.4	162.1	70.4	0	0	0	0	109.1	G610 D615 T616	G610-S613 CarbonylContact C-O 3.52Å; G610-S613 WeakPolarHBondContact CA-O 3.35Å; S613-D615 VanDerWaalsContact C-N 3.25Å; S613-D615 PolarHBondContact O-N 2.91Å; S613-D615 VanDerWaalsContact O-N 3.12Å; S613-T616 PolarHBondContact N-OG1 2.78Å; S613-T616 VanDerWaalsContact N-OG1 3.08Å; S613-T616 PolarHBondContact O-N 3.41Å; S613-T616 VanDerWaalsContact O-N 3.13Å; S613-T616 PolarHBondContact O-OG1 3.42Å; S613-T616 VanDerWaalsContact OG-CG2 3.32Å; S613-T616 WeakPolarHBondContact OG-CG2 3.33Å
614	A	56.6	Low	83.1	Confident	77 Å²	77	33.8 Å²	33.8	64%	0.636	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-38.5	-167.4	0	0	0	0	0	114.5	G610	G610-A614 WeakPolarHBondContact CA-O 3.49Å
615	D	58.8	Low	83	Confident	137 Å²	137	34.8 Å²	34.8	73%	0.733	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-9.1	-174.2	-42.9	-67.2	0	0	0	113.1	S613	S613-D615 VanDerWaalsContact C-N 3.25Å; S613-D615 PolarHBondContact O-N 2.91Å; S613-D615 VanDerWaalsContact O-N 3.12Å
616	T	70.6	Confident	82.6	Confident	48 Å²	48	35.5 Å²	35.5	29%	0.294	21%	0.214	S	C	.	.			trans	-74.8	143.7	176.4	65.1	0	0	0	0	110.8	G610 C612 S613	G610-T616 PolarHBondContact N-O 3.1Å; C612-T616 WeakPolarHBondContact CB-OG1 3.41Å; C612-T616 PolarHBondContact N-OG1 2.86Å; S613-T616 PolarHBondContact N-OG1 2.78Å; S613-T616 VanDerWaalsContact N-OG1 3.08Å; S613-T616 PolarHBondContact O-N 3.41Å; S613-T616 VanDerWaalsContact O-N 3.13Å; S613-T616 PolarHBondContact O-OG1 3.42Å; S613-T616 VanDerWaalsContact OG-CG2 3.32Å; S613-T616 WeakPolarHBondContact OG-CG2 3.33Å
617	V	83.3	Confident	81.9	Confident	39 Å²	39	42 Å²	42	24%	0.236	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.8	168.9	-166	0	0	0	0	110.5	T359 T607 A608 Y609	T359-V617 HydrophobicContact CG2-CB 3.67Å; T359-V617 HydrophobicContact CG2-CG1 3.78Å; T359-V617 WeakPolarHBondContact OG1-CB 3.17Å; T359-V617 WeakPolarHBondContact OG1-CG1 3.31Å; T607-V617 HydrophobicContact CG2-CG1 3.33Å; A608-V617 WeakPolarHBondContact O-CA 3.19Å; A608-V617 WeakPolarHBondContact O-CG1 3.1Å; Y609-V617 HydrophobicContact CD1-CB 4.35Å; Y609-V617 HydrophobicContact CD1-CG1 3.8Å; Y609-V617 HydrophobicContact CD1-CG2 3.56Å; Y609-V617 HydrophobicContact CD2-CG1 3.74Å; Y609-V617 HydrophobicContact CE1-CG1 4.16Å; Y609-V617 HydrophobicContact CE1-CG2 4.22Å; Y609-V617 HydrophobicContact CE2-CG1 4.07Å; Y609-V617 HydrophobicContact CG-CB 4.44Å; Y609-V617 HydrophobicContact CG-CG1 3.6Å; Y609-V617 HydrophobicContact CG-CG2 3.97Å
618	T	86.4	Confident	81.1	Confident	37 Å²	37	46.8 Å²	46.8	23%	0.227	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.1	-166.8	-54	0	0	0	0	110	A608 V620	A608-T618 PolarHBondContact N-O 2.87Å; A608-T618 PolarHBondContact O-N 3.16Å; T618-V620 HydrophobicContact CG2-CG1 3.89Å
619	T	90.2	Very high	80.3	Confident	48 Å²	48	47.3 Å²	47.3	29%	0.294	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.6	166.4	-64.7	0	0	0	0	108.6	R605 A606 Y672	R605-T619 HydrophobicContact CG-CG2 3.81Å; R605-T619 VanDerWaalsContact NE-CG2 3.31Å; A606-T619 WeakPolarHBondContact O-CA 3.43Å; T619-Y672 HydrophobicContact CG2-CD1 3.54Å; T619-Y672 HydrophobicContact CG2-CD2 4.44Å; T619-Y672 HydrophobicContact CG2-CE1 4.11Å; T619-Y672 HydrophobicContact CG2-CG 3.73Å; T619-Y672 WeakPolarHBondContact O-CB 3.24Å
620	V	94.3	Very high	79.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	159.5	-174	-63.4	0	0	0	0	111.2	L589 R605 A606 A608 L611 T618 V622 L657 I669 T670	L589-V620 HydrophobicContact CD1-CG2 4.11Å; R605-V620 WeakPolarHBondContact CA-O 3.38Å; A606-V620 HydrophobicContact CB-CG2 3.94Å; A606-V620 PolarHBondContact N-O 3.4Å; A606-V620 PolarHBondContact O-N 2.98Å; A608-V620 HydrophobicContact CB-CG1 4.06Å; A608-V620 HydrophobicContact CB-CG2 3.85Å; L611-V620 HydrophobicContact CD2-CG1 3.63Å; T618-V620 HydrophobicContact CG2-CG1 3.89Å; V620-V622 HydrophobicContact CG2-CG2 4.02Å; V620-L657 HydrophobicContact CG1-CD1 3.78Å; V620-I669 HydrophobicContact CB-CG2 3.69Å; V620-I669 HydrophobicContact CG1-CG2 3.91Å; V620-I669 HydrophobicContact CG2-CG2 3.65Å; V620-T670 WeakPolarHBondContact CA-O 3.49Å; V620-T670 WeakPolarHBondContact CB-O 3.4Å
621	A	94.1	Very high	79.4	Confident	10 Å²	10	51.6 Å²	51.6	8%	0.083	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	140.1	162.2	0	0	0	0	0	108.9	L595 V603 V604 T670	L595-A621 HydrophobicContact CD1-CB 4.36Å; V603-A621 HydrophobicContact CG1-CB 4.14Å; V604-A621 CarbonylContact O-C 3.47Å; V604-A621 WeakPolarHBondContact O-CA 3.32Å; A621-T670 PolarHBondContact N-O 3.35Å; A621-T670 PolarHBondContact O-N 3.29Å
622	V	93.4	Very high	79	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	116	177.7	-174.1	0	0	0	0	109.4	L589 F591 V603 V604 A606 V620 M624 L667 V668 I669	L589-V622 HydrophobicContact CD1-CG2 4.1Å; L589-V622 HydrophobicContact CD2-CG1 4.39Å; L589-V622 HydrophobicContact CD2-CG2 4.12Å; L589-V622 HydrophobicContact CG-CG2 4.47Å; F591-V622 HydrophobicContact CE1-CB 4.38Å; F591-V622 HydrophobicContact CE1-CG1 4.16Å; F591-V622 HydrophobicContact CE1-CG2 4.44Å; V603-V622 WeakPolarHBondContact CA-O 3.39Å; V604-V622 HydrophobicContact CG2-CB 4.04Å; V604-V622 PolarHBondContact N-O 3.11Å; V604-V622 PolarHBondContact O-N 3.23Å; A606-V622 HydrophobicContact CB-CG2 3.57Å; V620-V622 HydrophobicContact CG2-CG2 4.02Å; V622-M624 HydrophobicContact CG1-CE 4.16Å; V622-L667 HydrophobicContact CG1-CB 3.89Å; V622-L667 HydrophobicContact CG1-CD2 4.2Å; V622-L667 HydrophobicContact CG1-CG 4.46Å; V622-V668 CarbonylContact C-O 3.57Å; V622-V668 WeakPolarHBondContact CA-O 3.48Å; V622-I669 HydrophobicContact CG2-CG1 4.39Å; V622-I669 HydrophobicContact CG2-CG2 4.4Å
623	K	91	Very high	79.3	Confident	17 Å²	17	51.1 Å²	51.1	7%	0.074	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.9	170	-54.4	-171.9	165.4	-176.2	0	109.5	V603 L637 E640 V668 D785	V603-K623 HydrophobicContact CG1-CG 4.45Å; V603-K623 HydrophobicContact CG2-CB 4.42Å; V603-K623 HydrophobicContact CG2-CG 3.93Å; K623-L637 HydrophobicContact CB-CD1 4.32Å; K623-E640 VanDerWaalsContact CD-OE1 3.31Å; K623-E640 WeakPolarHBondContact CD-OE1 3.45Å; K623-E640 WeakPolarHBondContact CE-OE1 3.41Å; K623-E640 IonicContact NZ-OE1 3.67Å; K623-E640 PolarHBondContact NZ-OE1 2.68Å; K623-E640 IonicContact NZ-OE2 2.76Å; K623-E640 PolarHBondContact NZ-OE2 3.29Å; K623-V668 HydrophobicContact CB-CB 4.32Å; K623-V668 PolarHBondContact N-O 2.89Å; K623-V668 PolarHBondContact O-N 3.42Å; K623-D785 PolarHBondContact NZ-O 2.8Å
624	M	89	Confident	79.8	Confident	21 Å²	21	54.2 Å²	54.2	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	152.9	176.7	63.4	-179	66.5	0	0	110.8	F591 G601 K602 V604 V622 L667	F591-M624 HydrophobicContact CD1-CE 3.93Å; F591-M624 HydrophobicContact CE1-CE 3.47Å; F591-M624 VanDerWaalsContact CE1-CE 3.47Å; F591-M624 HydrophobicContact CE2-CE 4.43Å; F591-M624 HydrophobicContact CZ-CE 3.76Å; G601-M624 CarbonylContact C-O 3.58Å; G601-M624 VanDerWaalsContact CA-O 3.27Å; G601-M624 WeakPolarHBondContact CA-O 3.34Å; K602-M624 HydrophobicContact CD-SD 4.34Å; K602-M624 WeakPolarHBondContact CE-SD 3.45Å; K602-M624 HydrophobicContact CG-CG 3.69Å; K602-M624 HydrophobicContact CG-SD 4.11Å; K602-M624 PolarHBondContact N-O 3.15Å; K602-M624 PolarHBondContact O-N 2.92Å; K602-M624 VanDerWaalsContact O-O 3.05Å; V604-M624 HydrophobicContact CG1-CE 4.4Å; V604-M624 HydrophobicContact CG2-CE 3.62Å; V622-M624 HydrophobicContact CG1-CE 4.16Å; M624-L667 HydrophobicContact CB-CD2 3.74Å; M624-L667 HydrophobicContact CE-CD2 3.96Å
625	L	86.4	Confident	80.8	Confident	26 Å²	26	54.5 Å²	54.5	14%	0.136	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	167.9	174.5	-63.8	170.1	0	0	0	111.9	A629 E633 K634 L637 L788	L625-A629 HydrophobicContact CB-CB 3.71Å; L625-A629 HydrophobicContact CD1-CB 4.08Å; L625-A629 HydrophobicContact CG-CB 4.36Å; L625-E633 VanDerWaalsContact CD1-C 3.5Å; L625-E633 HydrophobicContact CD1-CB 4.22Å; L625-E633 WeakPolarHBondContact CD1-O 3.36Å; L625-E633 HydrophobicContact CD2-CB 4.28Å; L625-K634 HydrophobicContact CD1-CB 4.19Å; L625-K634 HydrophobicContact CD1-CG 3.67Å; L625-L637 HydrophobicContact CD1-CB 4.23Å; L625-L637 HydrophobicContact CD1-CD2 4.23Å; L625-L637 HydrophobicContact CG-CB 4.39Å; L625-L637 HydrophobicContact CG-CD2 3.87Å; L625-L788 HydrophobicContact CD2-CD2 3.77Å
626	K	82.4	Confident	81.7	Confident	74 Å²	74	48.4 Å²	48.4	32%	0.322	27%	0.268	S	S	.	.			trans	-70.6	154.2	169.5	-67.7	176.9	-177.5	172.3	0	110.6	G598 A599 F600 N628 A629	G598-K626 WeakPolarHBondContact O-CE 3.48Å; G598-K626 PolarHBondContact O-NZ 2.79Å; A599-K626 WeakPolarHBondContact O-CE 3.38Å; A599-K626 PolarHBondContact O-NZ 3.4Å; F600-K626 PolarHBondContact O-N 3.14Å; K626-N628 PolarHBondContact O-N 3.08Å; K626-N628 VanDerWaalsContact O-N 3.09Å; K626-A629 VanDerWaalsContact O-CB 3.26Å; K626-A629 WeakPolarHBondContact O-CB 3.37Å; K626-A629 PolarHBondContact O-N 3.04Å; K626-A629 VanDerWaalsContact O-N 3.1Å
627	P	77	Confident	82.3	Confident	139 Å²	139	46.1 Å²	46.1	90%	0.903	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.7	-174.8	-25.6	35.3	0	0	0	114.4
628	N	75.1	Confident	82.3	Confident	133 Å²	133	46.1 Å²	46.1	71%	0.711	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	21.9	-178	55.6	-29	0	0	0	113.8	K626	K626-N628 PolarHBondContact O-N 3.08Å; K626-N628 VanDerWaalsContact O-N 3.09Å
629	A	72.5	Confident	82	Confident	11 Å²	11	44.8 Å²	44.8	9%	0.091	25%	0.245	C	C	.	.			trans	-69.9	141.9	-179.7	0	0	0	0	0	114	L625 K626 E633 K634	L625-A629 HydrophobicContact CB-CB 3.71Å; L625-A629 HydrophobicContact CD1-CB 4.08Å; L625-A629 HydrophobicContact CG-CB 4.36Å; K626-A629 VanDerWaalsContact O-CB 3.26Å; K626-A629 WeakPolarHBondContact O-CB 3.37Å; K626-A629 PolarHBondContact O-N 3.04Å; K626-A629 VanDerWaalsContact O-N 3.1Å; A629-E633 WeakPolarHBondContact CA-OE2 3.48Å; A629-E633 HydrophobicContact CB-CB 4.34Å; A629-E633 VanDerWaalsContact CB-OE2 3.31Å; A629-E633 WeakPolarHBondContact CB-OE2 3.48Å; A629-K634 VanDerWaalsContact O-CE 3.24Å; A629-K634 WeakPolarHBondContact O-CE 3.31Å; A629-K634 PolarHBondContact O-NZ 3.05Å
630	H	73.6	Confident	81.7	Confident	79 Å²	79	42.9 Å²	42.9	37%	0.366	23%	0.232	S	C	.	.			trans	-72.6	163.9	-179.7	-66	-73.2	0	0	0	112.5	Y547 T632 E633 K634	Y547-H630 PolarHBondContact OH-CE1 3.47Å; H630-T632 PolarHBondContact O-N 2.84Å; H630-E633 HydrophobicContact CB-CG 4.34Å; H630-E633 IonicContact CD2-OE2 2.78Å; H630-E633 PolarHBondContact N-OE2 2.86Å; H630-E633 PolarHBondContact O-N 3.34Å; H630-K634 PolarHBondContact O-N 2.83Å
631	S	74.4	Confident	81.4	Confident	73 Å²	73	42.9 Å²	42.9	51%	0.51	23%	0.232	S	C	.	.	H	α-helix	trans	-59	-45.1	179.3	63.5	0	0	0	0	111.9	E633 K634 E635	S631-E633 PolarHBondContact O-N 2.96Å; S631-E633 VanDerWaalsContact O-N 3.15Å; S631-K634 CarbonylContact O-C 3.59Å; S631-K634 WeakPolarHBondContact O-CA 3.44Å; S631-K634 WeakPolarHBondContact O-CB 3.44Å; S631-K634 PolarHBondContact O-N 2.87Å; S631-E635 VanDerWaalsContact CB-OE1 3.29Å; S631-E635 WeakPolarHBondContact CB-OE1 3.23Å; S631-E635 WeakPolarHBondContact O-CG 3.21Å; S631-E635 PolarHBondContact O-N 3.29Å; S631-E635 PolarHBondContact OG-OE1 2.83Å
632	T	69.9	Low	81	Confident	46 Å²	46	43.9 Å²	43.9	28%	0.282	24%	0.235	S	C	.	.	H	α-helix	trans	-59.3	-28.5	177.8	56.2	0	0	0	0	113.8	H630 E635 A636	H630-T632 PolarHBondContact O-N 2.84Å; T632-E635 WeakPolarHBondContact CA-OE2 3.38Å; T632-E635 PolarHBondContact N-OE1 2.89Å; T632-A636 WeakPolarHBondContact O-CB 3.47Å; T632-A636 PolarHBondContact O-N 3.03Å; T632-A636 VanDerWaalsContact O-N 3.12Å
633	E	74.6	Confident	80.6	Confident	22 Å²	22	44 Å²	44	10%	0.103	24%	0.236	C	C	.	.	H	α-helix	trans	-78.1	-35.9	176.6	-62.2	169	157	0	0	110.7	F553 F600 L625 A629 H630 S631 L637	F553-E633 HydrophobicContact CB-CG 4.42Å; F600-E633 WeakPolarHBondContact CD1-OE1 3.24Å; L625-E633 VanDerWaalsContact CD1-C 3.5Å; L625-E633 HydrophobicContact CD1-CB 4.22Å; L625-E633 WeakPolarHBondContact CD1-O 3.36Å; L625-E633 HydrophobicContact CD2-CB 4.28Å; A629-E633 WeakPolarHBondContact CA-OE2 3.48Å; A629-E633 HydrophobicContact CB-CB 4.34Å; A629-E633 VanDerWaalsContact CB-OE2 3.31Å; A629-E633 WeakPolarHBondContact CB-OE2 3.48Å; H630-E633 HydrophobicContact CB-CG 4.34Å; H630-E633 IonicContact CD2-OE2 2.78Å; H630-E633 PolarHBondContact N-OE2 2.86Å; H630-E633 PolarHBondContact O-N 3.34Å; S631-E633 PolarHBondContact O-N 2.96Å; S631-E633 VanDerWaalsContact O-N 3.15Å; E633-L637 PolarHBondContact O-N 2.94Å
634	K	81.5	Confident	80.4	Confident	101 Å²	101	44.2 Å²	44.2	44%	0.439	24%	0.237	S	C	.	.	H	α-helix	trans	-67.7	-43.4	172.8	-63.7	169.3	-173.7	172.3	0	111.5	L625 A629 H630 S631 L637 M638 I666	L625-K634 HydrophobicContact CD1-CB 4.19Å; L625-K634 HydrophobicContact CD1-CG 3.67Å; A629-K634 VanDerWaalsContact O-CE 3.24Å; A629-K634 WeakPolarHBondContact O-CE 3.31Å; A629-K634 PolarHBondContact O-NZ 3.05Å; H630-K634 PolarHBondContact O-N 2.83Å; S631-K634 CarbonylContact O-C 3.59Å; S631-K634 WeakPolarHBondContact O-CA 3.44Å; S631-K634 WeakPolarHBondContact O-CB 3.44Å; S631-K634 PolarHBondContact O-N 2.87Å; K634-L637 PolarHBondContact O-N 3.05Å; K634-M638 WeakPolarHBondContact O-CB 3.2Å; K634-M638 PolarHBondContact O-N 3.35Å; K634-I666 HydrophobicContact CB-CD1 4.2Å
635	E	79	Confident	80.3	Confident	84 Å²	84	44.2 Å²	44.2	39%	0.393	24%	0.24	S	C	.	.	H	α-helix	trans	-55.8	-49.8	172.5	-71.5	150.7	-141.2	0	0	110.5	L574 S631 T632 M638 S639	L574-E635 HydrophobicContact CD2-CB 4.43Å; S631-E635 VanDerWaalsContact CB-OE1 3.29Å; S631-E635 WeakPolarHBondContact CB-OE1 3.23Å; S631-E635 WeakPolarHBondContact O-CG 3.21Å; S631-E635 PolarHBondContact O-N 3.29Å; S631-E635 PolarHBondContact OG-OE1 2.83Å; T632-E635 WeakPolarHBondContact CA-OE2 3.38Å; T632-E635 PolarHBondContact N-OE1 2.89Å; E635-M638 WeakPolarHBondContact O-CB 3.27Å; E635-M638 PolarHBondContact O-N 2.97Å; E635-S639 PolarHBondContact O-N 3Å; E635-S639 PolarHBondContact O-OG 3.04Å
636	A	76.6	Confident	80.3	Confident	8 Å²	8	47.8 Å²	47.8	7%	0.066	25%	0.252	C	S	.	.	H	α-helix	trans	-65.1	-39.1	179.1	0	0	0	0	0	113.9	F553 I555 T632 M638 S639 E640	F553-A636 HydrophobicContact CD1-CB 3.54Å; F553-A636 HydrophobicContact CE1-CB 3.87Å; I555-A636 WeakPolarHBondContact CD1-O 3.29Å; I555-A636 HydrophobicContact CG1-CB 4.19Å; I555-A636 WeakPolarHBondContact CG1-O 3.45Å; T632-A636 WeakPolarHBondContact O-CB 3.47Å; T632-A636 PolarHBondContact O-N 3.03Å; T632-A636 VanDerWaalsContact O-N 3.12Å; A636-M638 VanDerWaalsContact C-N 3.34Å; A636-S639 PolarHBondContact O-N 3.18Å; A636-E640 PolarHBondContact O-N 2.79Å
637	L	83.8	Confident	80.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66	-37.7	171.3	177.8	60	0	0	0	111.7	K623 L625 E633 K634 S639 E640 L641 I666 V668 L788	K623-L637 HydrophobicContact CB-CD1 4.32Å; L625-L637 HydrophobicContact CD1-CB 4.23Å; L625-L637 HydrophobicContact CD1-CD2 4.23Å; L625-L637 HydrophobicContact CG-CB 4.39Å; L625-L637 HydrophobicContact CG-CD2 3.87Å; E633-L637 PolarHBondContact O-N 2.94Å; K634-L637 PolarHBondContact O-N 3.05Å; L637-S639 VanDerWaalsContact C-N 3.34Å; L637-E640 PolarHBondContact O-N 2.79Å; L637-L641 PolarHBondContact O-N 2.95Å; L637-L641 VanDerWaalsContact O-N 3.12Å; L637-I666 HydrophobicContact CD2-CB 4.14Å; L637-I666 HydrophobicContact CD2-CG2 3.83Å; L637-I666 HydrophobicContact CG-CG2 4Å; L637-V668 HydrophobicContact CD1-CB 4.23Å; L637-V668 HydrophobicContact CD1-CG2 3.58Å; L637-V668 HydrophobicContact CG-CG2 4.02Å; L637-L788 HydrophobicContact CB-CD1 4.38Å; L637-L788 HydrophobicContact CD1-CD1 3.71Å
638	M	83.8	Confident	81	Confident	40 Å²	40	38.7 Å²	38.7	20%	0.197	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-34.3	177.6	-170.6	64.7	-165.3	0	0	112.1	Y578 K634 E635 A636 L641 K642 T661 I666	Y578-M638 HydrophobicContact CD1-CE 3.81Å; Y578-M638 HydrophobicContact CD2-CE 4Å; Y578-M638 HydrophobicContact CE1-CE 4.36Å; Y578-M638 HydrophobicContact CG-CE 3.6Å; K634-M638 WeakPolarHBondContact O-CB 3.2Å; K634-M638 PolarHBondContact O-N 3.35Å; E635-M638 WeakPolarHBondContact O-CB 3.27Å; E635-M638 PolarHBondContact O-N 2.97Å; A636-M638 VanDerWaalsContact C-N 3.34Å; M638-L641 HydrophobicContact CE-CD2 4.32Å; M638-L641 WeakPolarHBondContact O-CB 3.31Å; M638-L641 HydrophobicContact SD-CD2 4.01Å; M638-K642 WeakPolarHBondContact O-CG 3.36Å; M638-K642 PolarHBondContact O-N 3.12Å; M638-K642 VanDerWaalsContact O-N 3.13Å; M638-T661 HydrophobicContact CE-CG2 4.09Å; M638-T661 HydrophobicContact SD-CG2 3.91Å; M638-I666 HydrophobicContact CB-CD1 4.38Å
639	S	80.5	Confident	81.7	Confident	9 Å²	9	34.5 Å²	34.5	6%	0.063	18%	0.182	C	C	.	.	H	α-helix	trans	-82.3	-25.4	175.5	21	0	0	0	0	113.5	I555 E635 A636 L637 L641 K642 V643	I555-S639 VanDerWaalsContact CD1-CB 3.42Å; I555-S639 VanDerWaalsContact CD1-OG 3.27Å; I555-S639 WeakPolarHBondContact CD1-OG 3.18Å; E635-S639 PolarHBondContact O-N 3Å; E635-S639 PolarHBondContact O-OG 3.04Å; A636-S639 PolarHBondContact O-N 3.18Å; L637-S639 VanDerWaalsContact C-N 3.34Å; S639-L641 VanDerWaalsContact C-N 3.32Å; S639-K642 PolarHBondContact O-N 2.65Å; S639-V643 WeakPolarHBondContact O-CG2 3.42Å; S639-V643 PolarHBondContact O-N 2.94Å
640	E	83.2	Confident	82.7	Confident	7 Å²	7	35.6 Å²	35.6	3%	0.033	19%	0.185	C	C	.	.	H	α-helix	trans	-58.6	-46.3	164.8	-158.8	-152.5	112.1	0	0	110.5	K623 A636 L637 K642 V643 L644	K623-E640 VanDerWaalsContact CD-OE1 3.31Å; K623-E640 WeakPolarHBondContact CD-OE1 3.45Å; K623-E640 WeakPolarHBondContact CE-OE1 3.41Å; K623-E640 IonicContact NZ-OE1 3.67Å; K623-E640 PolarHBondContact NZ-OE1 2.68Å; K623-E640 IonicContact NZ-OE2 2.76Å; K623-E640 PolarHBondContact NZ-OE2 3.29Å; A636-E640 PolarHBondContact O-N 2.79Å; L637-E640 PolarHBondContact O-N 2.79Å; E640-K642 PolarHBondContact O-N 3.47Å; E640-V643 PolarHBondContact O-N 3.25Å; E640-L644 WeakPolarHBondContact O-CG 3.25Å; E640-L644 PolarHBondContact O-N 3.43Å
641	L	87.7	Confident	83.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-44.7	174.3	173.4	58.9	0	0	0	112.6	Y578 L637 M638 S639 L644 S645 L656 A659 T661 V668	Y578-L641 HydrophobicContact CD2-CD2 4.11Å; Y578-L641 HydrophobicContact CD2-CG 4.23Å; Y578-L641 HydrophobicContact CE2-CD1 4.32Å; Y578-L641 HydrophobicContact CE2-CD2 3.62Å; Y578-L641 HydrophobicContact CE2-CG 3.97Å; L637-L641 PolarHBondContact O-N 2.95Å; L637-L641 VanDerWaalsContact O-N 3.12Å; M638-L641 HydrophobicContact CE-CD2 4.32Å; M638-L641 WeakPolarHBondContact O-CB 3.31Å; M638-L641 HydrophobicContact SD-CD2 4.01Å; S639-L641 VanDerWaalsContact C-N 3.32Å; L641-L644 PolarHBondContact O-N 3.23Å; L641-S645 WeakPolarHBondContact O-CB 3.49Å; L641-S645 PolarHBondContact O-N 3.25Å; L641-L656 HydrophobicContact CD1-CD1 3.57Å; L641-L656 HydrophobicContact CD1-CD2 3.71Å; L641-L656 HydrophobicContact CD1-CG 4.3Å; L641-A659 HydrophobicContact CD1-CB 3.71Å; L641-A659 HydrophobicContact CD2-CB 3.54Å; L641-A659 HydrophobicContact CG-CB 4.29Å; L641-T661 HydrophobicContact CD2-CG2 3.69Å; L641-V668 HydrophobicContact CB-CG2 3.84Å; L641-V668 HydrophobicContact CD1-CG1 4.21Å; L641-V668 HydrophobicContact CD1-CG2 4.29Å; L641-V668 HydrophobicContact CD2-CG2 4.29Å; L641-V668 HydrophobicContact CG-CG2 4.37Å
642	K	85.8	Confident	84.7	Confident	32 Å²	32	30 Å²	30	14%	0.139	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-42.8	176.2	-71.7	172.2	171.7	-148.6	0	112.4	P573 L574 L576 M638 S639 E640 S645 Y646	P573-K642 WeakPolarHBondContact O-CD 3.15Å; L574-K642 PolarHBondContact O-NZ 3.37Å; L576-K642 HydrophobicContact CB-CB 3.98Å; L576-K642 HydrophobicContact CB-CD 4.23Å; L576-K642 HydrophobicContact CB-CG 4.5Å; L576-K642 HydrophobicContact CD1-CB 4.35Å; L576-K642 VanDerWaalsContact O-CD 3.24Å; L576-K642 WeakPolarHBondContact O-CD 3.23Å; L576-K642 WeakPolarHBondContact O-CE 3.4Å; L576-K642 PolarHBondContact O-NZ 2.85Å; M638-K642 WeakPolarHBondContact O-CG 3.36Å; M638-K642 PolarHBondContact O-N 3.12Å; M638-K642 VanDerWaalsContact O-N 3.13Å; S639-K642 PolarHBondContact O-N 2.65Å; E640-K642 PolarHBondContact O-N 3.47Å; K642-S645 WeakPolarHBondContact O-CB 3.39Å; K642-S645 PolarHBondContact O-N 2.96Å; K642-Y646 WeakPolarHBondContact O-CB 3.37Å; K642-Y646 PolarHBondContact O-N 3.49Å
643	V	84.3	Confident	85.8	Confident	3 Å²	3	28 Å²	28	2%	0.018	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-45.4	177.5	169.9	0	0	0	0	111.2	W557 V559 P573 L576 S639 E640 S645 Y646 L647	W557-V643 HydrophobicContact CB-CG1 3.96Å; W557-V643 HydrophobicContact CG-CG1 4.38Å; V559-V643 HydrophobicContact CG2-CG2 4.48Å; P573-V643 HydrophobicContact CB-CG2 4.28Å; P573-V643 HydrophobicContact CG-CG2 4.47Å; L576-V643 HydrophobicContact CD1-CG2 4.01Å; S639-V643 WeakPolarHBondContact O-CG2 3.42Å; S639-V643 PolarHBondContact O-N 2.94Å; E640-V643 PolarHBondContact O-N 3.25Å; V643-S645 VanDerWaalsContact C-N 3.32Å; V643-S645 PolarHBondContact O-N 3.23Å; V643-Y646 PolarHBondContact O-N 3.41Å; V643-Y646 VanDerWaalsContact O-N 3.1Å; V643-L647 HydrophobicContact CG1-CD1 4.04Å; V643-L647 HydrophobicContact CG1-CG 4.32Å; V643-L647 WeakPolarHBondContact O-CG 3.43Å; V643-L647 PolarHBondContact O-N 2.98Å
644	L	87.9	Confident	86.8	Confident	20 Å²	20	27.4 Å²	27.4	11%	0.105	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-38.5	175.6	-67.3	170.8	0	0	0	112.1	E640 L641 Y646 G648 L656 V668	E640-L644 WeakPolarHBondContact O-CG 3.25Å; E640-L644 PolarHBondContact O-N 3.43Å; L641-L644 PolarHBondContact O-N 3.23Å; L644-Y646 VanDerWaalsContact C-N 3.31Å; L644-Y646 PolarHBondContact O-N 3.1Å; L644-G648 PolarHBondContact O-N 3.01Å; L644-L656 HydrophobicContact CB-CB 4.08Å; L644-L656 HydrophobicContact CB-CD2 4.35Å; L644-V668 HydrophobicContact CD1-CG1 4.39Å
645	S	86.8	Confident	87.3	Confident	22 Å²	22	22.9 Å²	22.9	15%	0.154	12%	0.119	C	C	.	.	H	α-helix	trans	-64.8	-31.3	173	176.7	0	0	0	0	113.3	W582 L641 K642 V643	W582-S645 PolarHBondContact NE1-OG 3.14Å; L641-S645 WeakPolarHBondContact O-CB 3.49Å; L641-S645 PolarHBondContact O-N 3.25Å; K642-S645 WeakPolarHBondContact O-CB 3.39Å; K642-S645 PolarHBondContact O-N 2.96Å; V643-S645 VanDerWaalsContact C-N 3.32Å; V643-S645 PolarHBondContact O-N 3.23Å
646	Y	85.4	Confident	88	Confident	100 Å²	100	19.1 Å²	19.1	39%	0.392	10%	0.102	S	C	.	.	H	α-helix	trans	-79.5	-43	179.3	171.5	-93.6	0	0	0	112.4	V559 L576 K642 V643 L644 G648 K761	V559-Y646 HydrophobicContact CG1-CD1 4.29Å; V559-Y646 HydrophobicContact CG1-CE1 3.59Å; V559-Y646 HydrophobicContact CG2-CD1 4Å; V559-Y646 HydrophobicContact CG2-CE1 4.1Å; L576-Y646 HydrophobicContact CD2-CD2 4.19Å; L576-Y646 HydrophobicContact CD2-CG 4.47Å; K642-Y646 WeakPolarHBondContact O-CB 3.37Å; K642-Y646 PolarHBondContact O-N 3.49Å; V643-Y646 PolarHBondContact O-N 3.41Å; V643-Y646 VanDerWaalsContact O-N 3.1Å; L644-Y646 VanDerWaalsContact C-N 3.31Å; L644-Y646 PolarHBondContact O-N 3.1Å; Y646-G648 VanDerWaalsContact C-N 3.32Å; Y646-G648 PolarHBondContact O-N 3.13Å; Y646-K761 WeakPolarHBondContact CE1-O 3.46Å
647	L	86.8	Confident	88.8	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-56.7	-47.5	176.2	-72.4	170.7	0	0	0	110.8	W557 V643 Y757 K761 C763	W557-L647 HydrophobicContact CE3-CD1 3.94Å; W557-L647 HydrophobicContact CH2-CD1 4.26Å; W557-L647 HydrophobicContact CZ3-CD1 3.66Å; V643-L647 HydrophobicContact CG1-CD1 4.04Å; V643-L647 HydrophobicContact CG1-CG 4.32Å; V643-L647 WeakPolarHBondContact O-CG 3.43Å; V643-L647 PolarHBondContact O-N 2.98Å; L647-Y757 WeakPolarHBondContact O-CE1 3.5Å; L647-Y757 PolarHBondContact O-OH 2.98Å; L647-K761 HydrophobicContact CD2-CB 3.69Å; L647-K761 HydrophobicContact CD2-CG 4.15Å; L647-K761 WeakPolarHBondContact O-CD 3.36Å; L647-K761 VanDerWaalsContact O-CE 3.23Å; L647-K761 WeakPolarHBondContact O-CE 3.41Å; L647-K761 PolarHBondContact O-NZ 3.42Å; L647-C763 HydrophobicContact CD2-CB 3.78Å
648	G	86.9	Confident	89.3	Confident	21 Å²	21	21.2 Å²	21.2	22%	0.216	11%	0.112	C	C	.	.			trans	81.5	-168.9	-171.9	0	0	0	0	0	112.5	L644 Y646	L644-G648 PolarHBondContact O-N 3.01Å; Y646-G648 VanDerWaalsContact C-N 3.32Å; Y646-G648 PolarHBondContact O-N 3.13Å
649	N	90.3	Very high	89.8	Confident	46 Å²	46	19.3 Å²	19.3	25%	0.246	10%	0.102	C	C	.	.			trans	-88.2	138.4	-171	-63.3	-28.2	0	0	0	112.7	N655 Y757	N649-N655 VanDerWaalsContact CA-OD1 3.32Å; N649-N655 WeakPolarHBondContact CA-OD1 3.44Å; N649-Y757 VanDerWaalsContact O-CZ 3.31Å; N649-Y757 PolarHBondContact O-OH 2.69Å
650	H	93.8	Very high	90.5	Very high	34 Å²	34	18.9 Å²	18.9	16%	0.157	10%	0.099	C	C	.	.			trans	-144.7	149.9	168.6	-172.4	-116.7	0	0	0	111.4	N652 I653 N655 K753 Y757	H650-N652 VanDerWaalsContact C-N 3.31Å; H650-N652 PolarHBondContact ND1-N 3.2Å; H650-N652 PolarHBondContact O-N 3.15Å; H650-I653 HydrophobicContact CB-CB 4.23Å; H650-I653 HydrophobicContact CB-CD1 3.77Å; H650-I653 HydrophobicContact CB-CG1 3.92Å; H650-I653 PolarHBondContact O-N 2.83Å; H650-N655 PolarHBondContact N-OD1 2.93Å; H650-N655 PolarHBondContact O-ND2 2.94Å; H650-N655 PolarHBondContact O-OD1 2.93Å; H650-N655 VanDerWaalsContact O-OD1 3.11Å; H650-K753 PolarHBondContact CE1-O 3.38Å; H650-Y757 HydrophobicContact CB-CD1 3.91Å; H650-Y757 HydrophobicContact CB-CD2 3.81Å; H650-Y757 HydrophobicContact CB-CE1 4Å; H650-Y757 HydrophobicContact CB-CE2 3.87Å; H650-Y757 HydrophobicContact CB-CG 3.8Å; H650-Y757 AromaticContact CD2-CD2 3.38Å; H650-Y757 WeakPolarHBondContact CD2-CD2 3.28Å; H650-Y757 AromaticContact CD2-CE2 3.93Å; H650-Y757 AromaticContact CD2-CG 3.87Å; H650-Y757 AromaticContact CG-CD2 3.62Å; H650-Y757 AromaticContact CG-CG 3.67Å
651	V	93.2	Very high	90.9	Very high	35 Å²	35	20 Å²	20	21%	0.212	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-37.8	-178.1	63.2	0	0	0	0	112	V780 K782 Y911	V651-V780 HydrophobicContact CG2-CG1 4.19Å; V651-K782 VanDerWaalsContact O-CE 3.29Å; V651-K782 WeakPolarHBondContact O-CE 3.38Å; V651-K782 WeakPolarHBondContact O-CG 3.13Å; V651-K782 PolarHBondContact O-NZ 3.01Å; V651-Y911 HydrophobicContact CG1-CE2 4.37Å; V651-Y911 VanDerWaalsContact CG1-OH 3.28Å; V651-Y911 WeakPolarHBondContact CG1-OH 3.27Å
652	N	96.6	Very high	90.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	23.4	179.4	-56.3	116.6	0	0	0	115.3	H650 Q750 A781 K782 I783 Y911	H650-N652 VanDerWaalsContact C-N 3.31Å; H650-N652 PolarHBondContact ND1-N 3.2Å; H650-N652 PolarHBondContact O-N 3.15Å; N652-Q750 VanDerWaalsContact CB-O 3.23Å; N652-Q750 WeakPolarHBondContact CB-O 3.49Å; N652-Q750 WeakPolarHBondContact ND2-CB 3.38Å; N652-Q750 PolarHBondContact ND2-OE1 2.57Å; N652-Q750 VanDerWaalsContact ND2-OE1 3.16Å; N652-Q750 PolarHBondContact OD1-O 2.66Å; N652-A781 VanDerWaalsContact CA-O 3.29Å; N652-A781 WeakPolarHBondContact CA-O 3.33Å; N652-A781 WeakPolarHBondContact CB-O 3.08Å; N652-A781 PolarHBondContact ND2-O 3.23Å; N652-K782 WeakPolarHBondContact O-CA 3.33Å; N652-I783 PolarHBondContact O-N 2.77Å; N652-Y911 PolarHBondContact OD1-OH 3.16Å; N652-Y911 VanDerWaalsContact OD1-OH 3.08Å
653	I	94.4	Very high	90.3	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.015	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-121.7	150.4	169.9	-58.5	175.9	0	0	0	108.2	H650 N655 E671 Y757 I758 K782	H650-I653 HydrophobicContact CB-CB 4.23Å; H650-I653 HydrophobicContact CB-CD1 3.77Å; H650-I653 HydrophobicContact CB-CG1 3.92Å; H650-I653 PolarHBondContact O-N 2.83Å; I653-N655 PolarHBondContact O-N 2.92Å; I653-N655 PolarHBondContact O-ND2 2.85Å; I653-E671 VanDerWaalsContact O-OE2 3.13Å; I653-Y757 HydrophobicContact CD1-CD1 3.58Å; I653-Y757 HydrophobicContact CD1-CE1 4.11Å; I653-Y757 HydrophobicContact CD1-CG 4.34Å; I653-I758 HydrophobicContact CD1-CD1 4.06Å; I653-I758 HydrophobicContact CD1-CG1 3.61Å; I653-I758 HydrophobicContact CG1-CD1 4.29Å; I653-I758 HydrophobicContact CG1-CG1 4.37Å; I653-K782 PolarHBondContact O-NZ 2.86Å
654	V	93.8	Very high	90.3	Very high	10 Å²	10	28.6 Å²	28.6	6%	0.061	19%	0.185	C	C	.	.			trans	-75.2	99.6	168.8	177.1	0	0	0	0	108.4	T670 E671 L774 K782 I783 C784	V654-T670 HydrophobicContact CG1-CG2 4.49Å; V654-E671 WeakPolarHBondContact CA-OE2 3.44Å; V654-L774 HydrophobicContact CG2-CB 4.45Å; V654-L774 HydrophobicContact CG2-CD1 3.7Å; V654-L774 HydrophobicContact CG2-CG 4.4Å; V654-K782 HydrophobicContact CG2-CB 3.68Å; V654-I783 PolarHBondContact N-O 2.84Å; V654-C784 HydrophobicContact CB-CB 3.9Å; V654-C784 HydrophobicContact CG2-CB 3.6Å
655	N	93.4	Very high	90.3	Very high	6 Å²	6	32 Å²	32	3%	0.032	21%	0.209	C	C	.	.			trans	-74.3	147.9	-169.9	-60.4	-54.9	0	0	0	112.6	N649 H650 I653 T670 E671 K782	N649-N655 VanDerWaalsContact CA-OD1 3.32Å; N649-N655 WeakPolarHBondContact CA-OD1 3.44Å; H650-N655 PolarHBondContact N-OD1 2.93Å; H650-N655 PolarHBondContact O-ND2 2.94Å; H650-N655 PolarHBondContact O-OD1 2.93Å; H650-N655 VanDerWaalsContact O-OD1 3.11Å; I653-N655 PolarHBondContact O-N 2.92Å; I653-N655 PolarHBondContact O-ND2 2.85Å; N655-T670 VanDerWaalsContact O-CA 3.26Å; N655-T670 WeakPolarHBondContact O-CA 3.48Å; N655-T670 WeakPolarHBondContact O-CB 3.47Å; N655-E671 HydrophobicContact CB-CG 4.06Å; N655-E671 PolarHBondContact N-OE2 3.11Å; N655-E671 VanDerWaalsContact ND2-CD 3.31Å; N655-E671 PolarHBondContact ND2-OE1 2.98Å; N655-E671 PolarHBondContact ND2-OE2 2.89Å; N655-E671 PolarHBondContact O-N 2.73Å; N655-E671 VanDerWaalsContact O-N 3.12Å; N655-K782 PolarHBondContact ND2-NZ 2.75Å
656	L	93.6	Very high	90.4	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	130.7	168.2	-179	66.1	0	0	0	109.4	W582 L641 L644 G658 V668	W582-L656 HydrophobicContact CD2-CD2 3.65Å; W582-L656 HydrophobicContact CD2-CG 4.13Å; W582-L656 HydrophobicContact CE3-CD2 4Å; W582-L656 HydrophobicContact CE3-CG 3.95Å; W582-L656 HydrophobicContact CG-CD2 4.02Å; W582-L656 HydrophobicContact CH2-CB 4.35Å; W582-L656 HydrophobicContact CH2-CD2 4.25Å; W582-L656 HydrophobicContact CH2-CG 4.3Å; W582-L656 HydrophobicContact CZ2-CD2 3.94Å; W582-L656 HydrophobicContact CZ2-CG 4.49Å; W582-L656 HydrophobicContact CZ3-CB 4.38Å; W582-L656 HydrophobicContact CZ3-CD2 4.29Å; W582-L656 HydrophobicContact CZ3-CG 4.04Å; W582-L656 VanDerWaalsContact CZ3-O 3.3Å; W582-L656 WeakPolarHBondContact CZ3-O 3.36Å; L641-L656 HydrophobicContact CD1-CD1 3.57Å; L641-L656 HydrophobicContact CD1-CD2 3.71Å; L641-L656 HydrophobicContact CD1-CG 4.3Å; L644-L656 HydrophobicContact CB-CB 4.08Å; L644-L656 HydrophobicContact CB-CD2 4.35Å; L656-G658 WeakPolarHBondContact CD1-O 3.12Å; L656-V668 HydrophobicContact CD1-CG1 3.83Å
657	L	93.2	Very high	90.8	Very high	51 Å²	51	28.1 Å²	28.1	27%	0.267	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-23.8	175.6	-55.8	178.7	0	0	0	112	L611 V620 I669 E671	L611-L657 HydrophobicContact CD2-CB 3.91Å; L611-L657 HydrophobicContact CD2-CD1 4.11Å; L611-L657 HydrophobicContact CG-CB 4.49Å; V620-L657 HydrophobicContact CG1-CD1 3.78Å; L657-I669 PolarHBondContact N-O 2.94Å; L657-E671 HydrophobicContact CD1-CG 4.24Å; L657-E671 HydrophobicContact CD2-CG 4.18Å; L657-E671 HydrophobicContact CG-CG 4.32Å
658	G	93.4	Very high	91.1	Very high	1 Å²	1	28 Å²	28	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.5	-174.7	175.2	0	0	0	0	0	112.5	W582 L656 I669	W582-G658 CarbonylContact O-C 3.55Å; W582-G658 WeakPolarHBondContact O-CA 3.35Å; L656-G658 WeakPolarHBondContact CD1-O 3.12Å; G658-I669 PolarHBondContact N-O 3.31Å; G658-I669 WeakPolarHBondContact O-CA 3.41Å; G658-I669 VanDerWaalsContact O-CB 3.27Å; G658-I669 WeakPolarHBondContact O-CB 3.27Å; G658-I669 PolarHBondContact O-N 3.48Å
659	A	95.3	Very high	91.5	Very high	0 Å²	0	27 Å²	27	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	162.5	176.2	0	0	0	0	0	111.1	W582 E583 F584 L641 T661 L667	W582-A659 PolarHBondContact O-N 2.8Å; E583-A659 CarbonylContact C-O 3.6Å; E583-A659 WeakPolarHBondContact CA-O 3.45Å; F584-A659 PolarHBondContact N-O 3.36Å; L641-A659 HydrophobicContact CD1-CB 3.71Å; L641-A659 HydrophobicContact CD2-CB 3.54Å; L641-A659 HydrophobicContact CG-CB 4.29Å; A659-T661 HydrophobicContact CB-CG2 4.24Å; A659-L667 CarbonylContact C-O 3.43Å; A659-L667 WeakPolarHBondContact CA-O 3.43Å; A659-L667 VanDerWaalsContact CB-O 3.31Å; A659-L667 WeakPolarHBondContact CB-O 3.44Å
660	C	94.2	Very high	91.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	95	165.4	-49.6	0	0	0	0	107.7	E583 F584 R586 I666 L667	E583-C660 WeakPolarHBondContact OE1-CA 3.3Å; F584-C660 PolarHBondContact O-SG 3.4Å; R586-C660 HydrophobicContact CB-CB 4.1Å; R586-C660 PolarHBondContact NH2-O 3.27Å; C660-I666 WeakPolarHBondContact O-CA 3.46Å; C660-L667 HydrophobicContact CB-CB 3.97Å; C660-L667 HydrophobicContact CB-CD1 3.97Å; C660-L667 HydrophobicContact CB-CG 4.14Å; C660-L667 PolarHBondContact N-O 3.32Å; C660-L667 PolarHBondContact O-N 3.5Å
661	T	91.8	Very high	91.7	Very high	32 Å²	32	25.4 Å²	25.4	20%	0.196	17%	0.173	C	C	.	.			trans	-94	-27	178.7	67.5	0	0	0	0	112	Y578 E583 M638 L641 A659	Y578-T661 HydrophobicContact CE1-CG2 3.88Å; Y578-T661 HydrophobicContact CE2-CG2 4.38Å; E583-T661 VanDerWaalsContact CD-N 3.34Å; E583-T661 PolarHBondContact OE1-N 3.38Å; E583-T661 WeakPolarHBondContact OE2-CB 3.48Å; E583-T661 PolarHBondContact OE2-N 2.83Å; E583-T661 VanDerWaalsContact OE2-N 3.13Å; E583-T661 PolarHBondContact OE2-OG1 3.15Å; M638-T661 HydrophobicContact CE-CG2 4.09Å; M638-T661 HydrophobicContact SD-CG2 3.91Å; L641-T661 HydrophobicContact CD2-CG2 3.69Å; A659-T661 HydrophobicContact CB-CG2 4.24Å
662	V	84.1	Confident	91.7	Very high	97 Å²	97	25.4 Å²	25.4	59%	0.588	17%	0.17	S	C	*	.	S	Bend	trans	-94.6	148.2	-176.2	-175.5	0	0	0	0	111.7	E583 R586 G664	E583-V662 HydrophobicContact CG-CG2 4.48Å; E583-V662 PolarHBondContact OE1-N 3.38Å; R586-V662 VanDerWaalsContact CZ-O 3.25Å; R586-V662 PolarHBondContact NE-O 3.13Å; R586-V662 PolarHBondContact NH2-O 3.26Å; V662-G664 PolarHBondContact O-N 3.44Å
663	G	76.4	Confident	91.5	Very high	72 Å²	72	25.9 Å²	25.9	74%	0.742	17%	0.173	S	C	*	.	S	Bend	trans	67	29.6	165.7	0	0	0	0	0	116	R586	R586-G663 WeakPolarHBondContact CD-O 3.27Å; R586-G663 PolarHBondContact NE-O 2.85Å
664	G	85.6	Confident	91.1	Very high	46 Å²	46	26.4 Å²	26.4	47%	0.474	18%	0.177	S	C	.	.	S	Bend	trans	162.8	-163.3	179.2	0	0	0	0	0	112.5	V662	V662-G664 PolarHBondContact O-N 3.44Å
665	P	88.2	Confident	90.9	Very high	92 Å²	92	27.8 Å²	27.8	60%	0.597	18%	0.181	S	C	*	.	S	Bend	trans	-64.5	149.2	172.5	28.6	-34.9	0	0	0	111	R586 L667	R586-P665 PolarHBondContact NH1-O 2.91Å; R586-P665 PolarHBondContact NH2-O 3.24Å; P665-L667 PolarHBondContact O-N 3.03Å
666	I	89.1	Confident	90.8	Very high	35 Å²	35	28.5 Å²	28.5	18%	0.179	19%	0.19	C	C	.	.			trans	-65.2	125.3	173.5	-58.6	173	0	0	0	108.9	K634 L637 M638 C660	K634-I666 HydrophobicContact CB-CD1 4.2Å; L637-I666 HydrophobicContact CD2-CB 4.14Å; L637-I666 HydrophobicContact CD2-CG2 3.83Å; L637-I666 HydrophobicContact CG-CG2 4Å; M638-I666 HydrophobicContact CB-CD1 4.38Å; C660-I666 WeakPolarHBondContact O-CA 3.46Å
667	L	93.5	Very high	90.7	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.7	174.9	-54.2	-179.9	0	0	0	108.9	L589 F591 V622 M624 A659 C660 P665	L589-L667 HydrophobicContact CD2-CD1 3.74Å; F591-L667 HydrophobicContact CE1-CD1 4.36Å; F591-L667 HydrophobicContact CZ-CD1 3.8Å; F591-L667 HydrophobicContact CZ-CD2 4.35Å; V622-L667 HydrophobicContact CG1-CB 3.89Å; V622-L667 HydrophobicContact CG1-CD2 4.2Å; V622-L667 HydrophobicContact CG1-CG 4.46Å; M624-L667 HydrophobicContact CB-CD2 3.74Å; M624-L667 HydrophobicContact CE-CD2 3.96Å; A659-L667 CarbonylContact C-O 3.43Å; A659-L667 WeakPolarHBondContact CA-O 3.43Å; A659-L667 VanDerWaalsContact CB-O 3.31Å; A659-L667 WeakPolarHBondContact CB-O 3.44Å; C660-L667 HydrophobicContact CB-CB 3.97Å; C660-L667 HydrophobicContact CB-CD1 3.97Å; C660-L667 HydrophobicContact CB-CG 4.14Å; C660-L667 PolarHBondContact N-O 3.32Å; C660-L667 PolarHBondContact O-N 3.5Å; P665-L667 PolarHBondContact O-N 3.03Å
668	V	93.1	Very high	90.7	Very high	0 Å²	0	26 Å²	26	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.7	172.3	178.8	0	0	0	0	108.5	V622 K623 L637 L641 L644 L656 T670	V622-V668 CarbonylContact C-O 3.57Å; V622-V668 WeakPolarHBondContact CA-O 3.48Å; K623-V668 HydrophobicContact CB-CB 4.32Å; K623-V668 PolarHBondContact N-O 2.89Å; K623-V668 PolarHBondContact O-N 3.42Å; L637-V668 HydrophobicContact CD1-CB 4.23Å; L637-V668 HydrophobicContact CD1-CG2 3.58Å; L637-V668 HydrophobicContact CG-CG2 4.02Å; L641-V668 HydrophobicContact CB-CG2 3.84Å; L641-V668 HydrophobicContact CD1-CG1 4.21Å; L641-V668 HydrophobicContact CD1-CG2 4.29Å; L641-V668 HydrophobicContact CD2-CG2 4.29Å; L641-V668 HydrophobicContact CG-CG2 4.37Å; L644-V668 HydrophobicContact CD1-CG1 4.39Å; L656-V668 HydrophobicContact CD1-CG1 3.83Å; V668-T670 HydrophobicContact CG1-CG2 4.19Å
669	I	94.9	Very high	90.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.9	-170.7	-48.7	173.1	0	0	0	108.7	F584 L589 L611 V620 V622 L657 G658	F584-I669 HydrophobicContact CB-CD1 3.96Å; F584-I669 HydrophobicContact CD1-CD1 3.63Å; F584-I669 HydrophobicContact CE1-CD1 4.45Å; F584-I669 HydrophobicContact CG-CD1 4.02Å; L589-I669 HydrophobicContact CD1-CD1 4.22Å; L589-I669 HydrophobicContact CD2-CD1 3.97Å; L589-I669 HydrophobicContact CD2-CG1 4.29Å; L611-I669 HydrophobicContact CD2-CG2 4.49Å; V620-I669 HydrophobicContact CB-CG2 3.69Å; V620-I669 HydrophobicContact CG1-CG2 3.91Å; V620-I669 HydrophobicContact CG2-CG2 3.65Å; V622-I669 HydrophobicContact CG2-CG1 4.39Å; V622-I669 HydrophobicContact CG2-CG2 4.4Å; L657-I669 PolarHBondContact N-O 2.94Å; G658-I669 PolarHBondContact N-O 3.31Å; G658-I669 WeakPolarHBondContact O-CA 3.41Å; G658-I669 VanDerWaalsContact O-CB 3.27Å; G658-I669 WeakPolarHBondContact O-CB 3.27Å; G658-I669 PolarHBondContact O-N 3.48Å
670	T	94.3	Very high	90.4	Very high	6 Å²	6	27.1 Å²	27.1	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	169.4	-177.5	69.8	0	0	0	0	111.6	V620 A621 V654 N655 V668	V620-T670 WeakPolarHBondContact CA-O 3.49Å; V620-T670 WeakPolarHBondContact CB-O 3.4Å; A621-T670 PolarHBondContact N-O 3.35Å; A621-T670 PolarHBondContact O-N 3.29Å; V654-T670 HydrophobicContact CG1-CG2 4.49Å; N655-T670 VanDerWaalsContact O-CA 3.26Å; N655-T670 WeakPolarHBondContact O-CA 3.48Å; N655-T670 WeakPolarHBondContact O-CB 3.47Å; V668-T670 HydrophobicContact CG1-CG2 4.19Å
671	E	93.6	Very high	90.4	Very high	39 Å²	39	27.3 Å²	27.3	18%	0.182	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.7	142.3	169.6	-65.2	170	142	0	0	112.3	I653 V654 N655 L657 K782	I653-E671 VanDerWaalsContact O-OE2 3.13Å; V654-E671 WeakPolarHBondContact CA-OE2 3.44Å; N655-E671 HydrophobicContact CB-CG 4.06Å; N655-E671 PolarHBondContact N-OE2 3.11Å; N655-E671 VanDerWaalsContact ND2-CD 3.31Å; N655-E671 PolarHBondContact ND2-OE1 2.98Å; N655-E671 PolarHBondContact ND2-OE2 2.89Å; N655-E671 PolarHBondContact O-N 2.73Å; N655-E671 VanDerWaalsContact O-N 3.12Å; L657-E671 HydrophobicContact CD1-CG 4.24Å; L657-E671 HydrophobicContact CD2-CG 4.18Å; L657-E671 HydrophobicContact CG-CG 4.32Å; E671-K782 IonicContact OE1-NZ 2.73Å; E671-K782 PolarHBondContact OE1-NZ 2.86Å; E671-K782 WeakPolarHBondContact OE2-CD 3.43Å; E671-K782 WeakPolarHBondContact OE2-CE 3.47Å; E671-K782 IonicContact OE2-NZ 3.36Å; E671-K782 PolarHBondContact OE2-NZ 2.55Å
672	Y	92.8	Very high	90.5	Very high	35 Å²	35	25.8 Å²	25.8	14%	0.137	17%	0.174	C	C	.	.			trans	-89.4	124.5	170.3	178.4	-114.2	0	0	0	110.6	L595 R605 T619 C674 T776	L595-Y672 HydrophobicContact CD1-CD2 3.96Å; L595-Y672 HydrophobicContact CD1-CE2 3.71Å; L595-Y672 HydrophobicContact CD2-CE2 3.92Å; L595-Y672 HydrophobicContact CG-CE2 4.48Å; R605-Y672 HydrophobicContact CB-CE2 4.37Å; R605-Y672 HydrophobicContact CG-CD2 4.4Å; R605-Y672 HydrophobicContact CG-CE2 4.21Å; T619-Y672 HydrophobicContact CG2-CD1 3.54Å; T619-Y672 HydrophobicContact CG2-CD2 4.44Å; T619-Y672 HydrophobicContact CG2-CE1 4.11Å; T619-Y672 HydrophobicContact CG2-CG 3.73Å; T619-Y672 WeakPolarHBondContact O-CB 3.24Å; Y672-C674 HydrophobicContact CD1-CB 4.2Å; Y672-C674 HydrophobicContact CE1-CB 3.68Å; Y672-T776 PolarHBondContact O-OG1 2.9Å
673	C	92.3	Very high	90.9	Very high	10 Å²	10	24.8 Å²	24.8	7%	0.068	16%	0.16	C	C	.	.			trans	-105.4	109.3	174.6	-63.4	0	0	0	0	110.1	Y675 L774 L775	C673-Y675 PolarHBondContact O-N 2.59Å; C673-L774 HydrophobicContact CB-CB 3.53Å; C673-L774 HydrophobicContact CB-CD1 3.64Å; C673-L774 HydrophobicContact CB-CD2 4.47Å; C673-L774 HydrophobicContact CB-CG 4.07Å; C673-L775 CarbonylContact C-O 3.55Å; C673-L775 WeakPolarHBondContact CB-O 3.46Å
674	C	87.4	Confident	91.6	Very high	14 Å²	14	28.2 Å²	28.2	10%	0.095	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-18.1	-161.5	57.2	0	0	0	0	115.9	Y672 C733 L775 H777	Y672-C674 HydrophobicContact CD1-CB 4.2Å; Y672-C674 HydrophobicContact CE1-CB 3.68Å; C674-C733 HydrophobicContact CB-CB 4.26Å; C674-C733 VanDerWaalsContact CB-SG 3.52Å; C674-L775 PolarHBondContact N-O 2.91Å; C674-H777 VanDerWaalsContact SG-CD2 3.51Å; C674-H777 PolarHBondContact SG-NE2 3.09Å; C674-H777 VanDerWaalsContact SG-NE2 3.4Å
675	Y	88.9	Confident	91.7	Very high	39 Å²	39	27.5 Å²	27.5	15%	0.153	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-4.3	-180	-58.8	-50.3	0	0	0	114	C673 F681 R684 C733 D735 L775 T776	C673-Y675 PolarHBondContact O-N 2.59Å; Y675-F681 HydrophobicContact CG-CE2 4.36Å; Y675-R684 PolarHBondContact O-NH2 2.88Å; Y675-C733 HydrophobicContact CD1-CB 4.22Å; Y675-C733 HydrophobicContact CE1-CB 3.61Å; Y675-D735 HydrophobicContact CD1-CB 4.44Å; Y675-D735 HydrophobicContact CE1-CB 3.78Å; Y675-L775 HydrophobicContact CD2-CB 4.2Å; Y675-L775 PolarHBondContact N-O 3.31Å; Y675-T776 VanDerWaalsContact CD2-O 3.32Å; Y675-T776 WeakPolarHBondContact CD2-O 3.43Å; Y675-T776 VanDerWaalsContact CE2-O 3.23Å; Y675-T776 WeakPolarHBondContact CE2-O 3.46Å
676	G	90.4	Very high	91.8	Very high	22 Å²	22	26 Å²	26	23%	0.227	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.4	-156.8	-175.7	0	0	0	0	0	112.7	L774 L775	G676-L774 VanDerWaalsContact C-CD2 3.44Å; G676-L774 WeakPolarHBondContact O-CA 3.32Å; G676-L774 WeakPolarHBondContact O-CD2 3.2Å; G676-L775 PolarHBondContact O-N 3.33Å
677	D	91.5	Very high	91.5	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.016	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	148.7	-178.6	62.6	100.8	0	0	0	113.7	L679 N680 F681 M720 V773 L774	D677-L679 VanDerWaalsContact C-N 3.33Å; D677-L679 PolarHBondContact O-N 3.49Å; D677-N680 PolarHBondContact O-N 3.08Å; D677-N680 WeakPolarHBondContact OD1-CB 3.31Å; D677-N680 PolarHBondContact OD1-N 3.26Å; D677-N680 PolarHBondContact OD1-ND2 3.5Å; D677-N680 PolarHBondContact OD2-ND2 3.12Å; D677-F681 WeakPolarHBondContact O-CB 3.5Å; D677-F681 PolarHBondContact O-N 3.4Å; D677-M720 HydrophobicContact CB-CE 3.94Å; D677-M720 WeakPolarHBondContact OD2-CE 3.46Å; D677-V773 CarbonylContact C-O 3.58Å; D677-V773 VanDerWaalsContact CA-O 3.31Å; D677-V773 WeakPolarHBondContact CA-O 3.39Å; D677-L774 HydrophobicContact CB-CD2 4.35Å
678	L	94.7	Very high	90.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-39.1	-178.2	175.2	62.5	0	0	0	111.8	N680 F681 L682 F747 A770 V773 L775 I837	L678-N680 PolarHBondContact O-N 3.41Å; L678-F681 PolarHBondContact O-N 3.36Å; L678-L682 HydrophobicContact CD1-CD1 3.95Å; L678-L682 HydrophobicContact CD1-CD2 4.35Å; L678-L682 HydrophobicContact CD1-CG 3.88Å; L678-L682 HydrophobicContact CG-CD1 3.89Å; L678-L682 HydrophobicContact CG-CG 4.3Å; L678-L682 WeakPolarHBondContact O-CB 3.42Å; L678-L682 VanDerWaalsContact O-CG 3.3Å; L678-L682 WeakPolarHBondContact O-CG 3.38Å; L678-L682 PolarHBondContact O-N 2.66Å; L678-F747 HydrophobicContact CD1-CD2 3.59Å; L678-F747 HydrophobicContact CD1-CE2 3.8Å; L678-F747 HydrophobicContact CD1-CG 3.99Å; L678-F747 HydrophobicContact CD1-CZ 4.37Å; L678-F747 HydrophobicContact CD2-CB 4.45Å; L678-A770 HydrophobicContact CD2-CB 4.48Å; L678-V773 HydrophobicContact CB-CB 4.07Å; L678-V773 HydrophobicContact CB-CG1 4.24Å; L678-V773 HydrophobicContact CD2-CB 4.1Å; L678-V773 HydrophobicContact CD2-CG1 4.02Å; L678-V773 PolarHBondContact N-O 2.93Å; L678-L775 HydrophobicContact CD1-CD1 3.79Å; L678-L775 HydrophobicContact CD1-CG 4.34Å; L678-I837 HydrophobicContact CD2-CD1 4.15Å; L678-I837 HydrophobicContact CD2-CG1 4.08Å
679	L	92.8	Very high	90.5	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-58.2	-49.4	176.6	-179.3	62.6	0	0	0	112.2	D677 R683 Y717 A770 R771	D677-L679 VanDerWaalsContact C-N 3.33Å; D677-L679 PolarHBondContact O-N 3.49Å; L679-R683 VanDerWaalsContact O-CG 3.31Å; L679-R683 WeakPolarHBondContact O-CG 3.4Å; L679-R683 PolarHBondContact O-N 3.12Å; L679-Y717 HydrophobicContact CD2-CE2 4.34Å; L679-A770 HydrophobicContact CB-CB 4.11Å; L679-A770 PolarHBondContact N-O 2.98Å; L679-A770 VanDerWaalsContact N-O 3.11Å; L679-R771 HydrophobicContact CD2-CB 4.14Å
680	N	89.8	Confident	89.9	Confident	20 Å²	20	35.3 Å²	35.3	11%	0.107	17%	0.166	C	C	.	.	H	α-helix	trans	-70.5	-30.1	175	-75	-52.1	0	0	0	112.7	D677 L678 R684 Y717	D677-N680 PolarHBondContact O-N 3.08Å; D677-N680 WeakPolarHBondContact OD1-CB 3.31Å; D677-N680 PolarHBondContact OD1-N 3.26Å; D677-N680 PolarHBondContact OD1-ND2 3.5Å; D677-N680 PolarHBondContact OD2-ND2 3.12Å; L678-N680 PolarHBondContact O-N 3.41Å; N680-R684 WeakPolarHBondContact O-CB 3.11Å; N680-R684 VanDerWaalsContact O-CG 3.22Å; N680-R684 WeakPolarHBondContact O-CG 3.48Å; N680-R684 PolarHBondContact O-N 3.14Å; N680-R684 VanDerWaalsContact O-N 3.1Å; N680-R684 PolarHBondContact O-NE 3.14Å; N680-Y717 PolarHBondContact ND2-OH 3.49Å
681	F	93	Very high	89	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-51.8	174.9	-175.4	-91.6	0	0	0	111.9	Y675 D677 L678 R683 R684 K685 D735 L739 F747 L775	Y675-F681 HydrophobicContact CG-CE2 4.36Å; D677-F681 WeakPolarHBondContact O-CB 3.5Å; D677-F681 PolarHBondContact O-N 3.4Å; L678-F681 PolarHBondContact O-N 3.36Å; F681-R683 VanDerWaalsContact C-N 3.35Å; F681-R683 PolarHBondContact O-N 3.17Å; F681-R684 PolarHBondContact O-N 3.2Å; F681-R684 VanDerWaalsContact O-N 3.13Å; F681-K685 HydrophobicContact CD1-CG 4.35Å; F681-K685 HydrophobicContact CE1-CG 4.03Å; F681-K685 HydrophobicContact CZ-CG 4.12Å; F681-K685 PolarHBondContact O-N 2.93Å; F681-D735 WeakPolarHBondContact CZ-OD2 3.39Å; F681-L739 HydrophobicContact CE1-CD1 4.07Å; F681-F747 HydrophobicContact CD1-CZ 4.44Å; F681-F747 HydrophobicContact CE1-CE2 4.38Å; F681-F747 HydrophobicContact CE1-CZ 4.04Å; F681-L775 HydrophobicContact CB-CD1 3.73Å; F681-L775 HydrophobicContact CD1-CD1 3.4Å; F681-L775 VanDerWaalsContact CD1-CD1 3.4Å; F681-L775 HydrophobicContact CD2-CD1 3.83Å; F681-L775 HydrophobicContact CE1-CD1 3.87Å; F681-L775 HydrophobicContact CE2-CD1 4.27Å; F681-L775 HydrophobicContact CG-CD1 3.38Å; F681-L775 HydrophobicContact CZ-CD1 4.29Å
682	L	93.9	Very high	87.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-56.1	-47.7	176.9	-70.1	165.6	0	0	0	111.3	L678 R684 K685 R686 L739 L744 F747 I837 L840	L678-L682 HydrophobicContact CD1-CD1 3.95Å; L678-L682 HydrophobicContact CD1-CD2 4.35Å; L678-L682 HydrophobicContact CD1-CG 3.88Å; L678-L682 HydrophobicContact CG-CD1 3.89Å; L678-L682 HydrophobicContact CG-CG 4.3Å; L678-L682 WeakPolarHBondContact O-CB 3.42Å; L678-L682 VanDerWaalsContact O-CG 3.3Å; L678-L682 WeakPolarHBondContact O-CG 3.38Å; L678-L682 PolarHBondContact O-N 2.66Å; L682-R684 VanDerWaalsContact C-N 3.32Å; L682-R684 PolarHBondContact O-N 2.84Å; L682-K685 PolarHBondContact O-N 3.44Å; L682-K685 VanDerWaalsContact O-N 3.15Å; L682-R686 PolarHBondContact O-N 3.48Å; L682-L739 HydrophobicContact CD2-CD2 4.04Å; L682-L744 HydrophobicContact CD2-CD2 3.62Å; L682-F747 HydrophobicContact CD2-CE2 4.45Å; L682-I837 HydrophobicContact CD1-CG1 4.4Å; L682-L840 HydrophobicContact CD2-CD2 4.38Å
683	R	92.8	Very high	85.9	Confident	76 Å²	76	44.1 Å²	44.1	29%	0.287	22%	0.219	S	C	.	.	H	α-helix	trans	-60.2	-37	177.2	-73.3	174.3	178.6	174.4	1.7	113.3	L679 F681 G841	L679-R683 VanDerWaalsContact O-CG 3.31Å; L679-R683 WeakPolarHBondContact O-CG 3.4Å; L679-R683 PolarHBondContact O-N 3.12Å; F681-R683 VanDerWaalsContact C-N 3.35Å; F681-R683 PolarHBondContact O-N 3.17Å; R683-G841 PolarHBondContact NE-O 3.44Å; R683-G841 PolarHBondContact NH2-O 3.18Å
684	R	90.8	Very high	84	Confident	144 Å²	144	49.5 Å²	49.5	54%	0.543	25%	0.252	S	S	.	.	H	α-helix	trans	-73.5	-29.7	176.2	-72	180	-46.7	-121.4	7.3	113.2	Y675 N680 F681 L682	Y675-R684 PolarHBondContact O-NH2 2.88Å; N680-R684 WeakPolarHBondContact O-CB 3.11Å; N680-R684 VanDerWaalsContact O-CG 3.22Å; N680-R684 WeakPolarHBondContact O-CG 3.48Å; N680-R684 PolarHBondContact O-N 3.14Å; N680-R684 VanDerWaalsContact O-N 3.1Å; N680-R684 PolarHBondContact O-NE 3.14Å; F681-R684 PolarHBondContact O-N 3.2Å; F681-R684 VanDerWaalsContact O-N 3.13Å; L682-R684 VanDerWaalsContact C-N 3.32Å; L682-R684 PolarHBondContact O-N 2.84Å
685	K	88.8	Confident	81.9	Confident	30 Å²	30	52.4 Å²	52.4	13%	0.13	28%	0.284	C	S	.	.	H	α-helix	trans	-93.4	-11.1	-177.8	-71.1	-76.3	-177.6	176.7	0	114.1	F681 L682 E687 S688 F689 D735 L737 L739	F681-K685 HydrophobicContact CD1-CG 4.35Å; F681-K685 HydrophobicContact CE1-CG 4.03Å; F681-K685 HydrophobicContact CZ-CG 4.12Å; F681-K685 PolarHBondContact O-N 2.93Å; L682-K685 PolarHBondContact O-N 3.44Å; L682-K685 VanDerWaalsContact O-N 3.15Å; K685-E687 PolarHBondContact O-N 2.85Å; K685-S688 WeakPolarHBondContact O-CA 3.33Å; K685-S688 VanDerWaalsContact O-CB 3.32Å; K685-S688 WeakPolarHBondContact O-CB 3.12Å; K685-S688 PolarHBondContact O-N 3.3Å; K685-F689 PolarHBondContact O-N 2.9Å; K685-D735 WeakPolarHBondContact CE-OD2 3.32Å; K685-D735 PolarHBondContact NZ-O 2.92Å; K685-D735 IonicContact NZ-OD2 3.48Å; K685-D735 PolarHBondContact NZ-OD2 3.22Å; K685-L737 PolarHBondContact NZ-O 3.19Å; K685-L739 HydrophobicContact CB-CB 3.7Å; K685-L739 HydrophobicContact CB-CD2 3.9Å; K685-L739 HydrophobicContact CB-CG 4.35Å; K685-L739 HydrophobicContact CD-CB 4.39Å; K685-L739 HydrophobicContact CG-CB 4.22Å
686	R	89.5	Confident	79.4	Confident	62 Å²	62	56.6 Å²	56.6	23%	0.234	31%	0.309	C	S	.	.	H	α-helix	trans	-44.4	-54.4	-178.9	-177.4	179	-66.5	-156.2	-3.5	114	L682 S688 F689 L690 S839 L840 N842	L682-R686 PolarHBondContact O-N 3.48Å; R686-S688 VanDerWaalsContact C-N 3.28Å; R686-S688 PolarHBondContact O-N 2.99Å; R686-F689 WeakPolarHBondContact O-CB 3.46Å; R686-F689 PolarHBondContact O-N 2.85Å; R686-L690 HydrophobicContact CG-CD1 4.1Å; R686-L690 WeakPolarHBondContact O-CG 3.48Å; R686-L690 PolarHBondContact O-N 3.03Å; R686-S839 PolarHBondContact NH2-O 3.2Å; R686-L840 HydrophobicContact CB-CB 4.45Å; R686-L840 HydrophobicContact CG-CB 4.27Å; R686-L840 HydrophobicContact CG-CD1 4.05Å; R686-L840 PolarHBondContact NE-O 3.39Å; R686-L840 PolarHBondContact NH2-O 3.45Å; R686-N842 VanDerWaalsContact CZ-OD1 3.29Å; R686-N842 PolarHBondContact NH1-OD1 3.12Å; R686-N842 PolarHBondContact NH2-OD1 3.11Å
687	E	82.3	Confident	77.1	Confident	122 Å²	122	58.9 Å²	58.9	57%	0.57	33%	0.332	S	S	*	.	H	α-helix	trans	-61.3	-35.7	179.1	-58.7	-53.2	132	0	0	112.6	K685 N691	K685-E687 PolarHBondContact O-N 2.85Å; E687-N691 WeakPolarHBondContact O-CB 3.45Å; E687-N691 PolarHBondContact O-N 3.33Å; E687-N691 VanDerWaalsContact O-N 3.07Å; E687-N691 PolarHBondContact O-ND2 2.8Å
688	S	82.3	Confident	74.7	Confident	48 Å²	48	68.4 Å²	68.4	34%	0.336	37%	0.369	S	S	.	.	H	α-helix	trans	-69.2	-36.3	177.6	-177.7	0	0	0	0	112.3	K685 R686 S692	K685-S688 WeakPolarHBondContact O-CA 3.33Å; K685-S688 VanDerWaalsContact O-CB 3.32Å; K685-S688 WeakPolarHBondContact O-CB 3.12Å; K685-S688 PolarHBondContact O-N 3.3Å; R686-S688 VanDerWaalsContact C-N 3.28Å; R686-S688 PolarHBondContact O-N 2.99Å; S688-S692 WeakPolarHBondContact O-CB 3.33Å; S688-S692 PolarHBondContact O-N 3.02Å
689	F	84.6	Confident	71.8	Confident	3 Å²	3	77.8 Å²	77.8	1%	0.013	41%	0.406	C	S	.	.	H	α-helix	trans	-66.6	-49.9	175.8	-178.1	-77.1	0	0	0	110.5	K685 R686 N691 S692 Q693 L739 D740 L744 L840 F869	K685-F689 PolarHBondContact O-N 2.9Å; R686-F689 WeakPolarHBondContact O-CB 3.46Å; R686-F689 PolarHBondContact O-N 2.85Å; F689-N691 PolarHBondContact O-N 2.71Å; F689-S692 PolarHBondContact O-N 3.38Å; F689-Q693 HydrophobicContact CD1-CG 4.17Å; F689-Q693 HydrophobicContact CE1-CG 3.92Å; F689-Q693 WeakPolarHBondContact O-CG 3.47Å; F689-Q693 PolarHBondContact O-N 3.38Å; F689-L739 HydrophobicContact CB-CB 4.49Å; F689-L739 HydrophobicContact CB-CD2 4.32Å; F689-L739 HydrophobicContact CD2-CB 4.5Å; F689-L739 HydrophobicContact CD2-CD2 4.04Å; F689-L739 HydrophobicContact CD2-CG 4.06Å; F689-L739 WeakPolarHBondContact CD2-O 3.35Å; F689-D740 VanDerWaalsContact CE2-C 3.49Å; F689-D740 WeakPolarHBondContact CE2-O 3.43Å; F689-L744 HydrophobicContact CE2-CD1 3.8Å; F689-L744 HydrophobicContact CE2-CG 4.39Å; F689-L744 HydrophobicContact CZ-CD1 4.16Å; F689-L840 HydrophobicContact CB-CD1 4.22Å; F689-L840 HydrophobicContact CD1-CD1 3.78Å; F689-L840 HydrophobicContact CD2-CD2 4.27Å; F689-L840 HydrophobicContact CE1-CD1 4.33Å; F689-L840 HydrophobicContact CE2-CD2 4.49Å; F689-L840 HydrophobicContact CG-CD1 4.01Å; F689-L840 HydrophobicContact CG-CD2 4.35Å; F689-F869 HydrophobicContact CE1-CB 4.37Å; F689-F869 AromaticContact CE1-CD1 3.55Å; F689-F869 HydrophobicContact CE1-CD1 3.55Å; F689-F869 HydrophobicContact CE1-CD2 4.35Å; F689-F869 AromaticContact CE1-CE1 3.93Å; F689-F869 HydrophobicContact CE1-CE1 3.93Å; F689-F869 AromaticContact CE1-CG 3.8Å; F689-F869 HydrophobicContact CE1-CG 3.8Å; F689-F869 HydrophobicContact CE1-CZ 4.49Å; F689-F869 HydrophobicContact CZ-CB 4.18Å; F689-F869 HydrophobicContact CZ-CD1 4.16Å; F689-F869 HydrophobicContact CZ-CG 4.11Å
690	L	82.3	Confident	69.1	Low	61 Å²	61	88.6 Å²	88.6	32%	0.319	45%	0.447	S	S	.	.	H	α-helix	trans	-59	-46.1	-179.7	-69.2	173.5	0	0	0	112.2	R686 S692 Q693 F869	R686-L690 HydrophobicContact CG-CD1 4.1Å; R686-L690 WeakPolarHBondContact O-CG 3.48Å; R686-L690 PolarHBondContact O-N 3.03Å; L690-S692 VanDerWaalsContact C-N 3.32Å; L690-S692 PolarHBondContact O-N 3.3Å; L690-Q693 PolarHBondContact O-N 3.23Å; L690-F869 HydrophobicContact CD2-CE1 4.17Å; L690-F869 HydrophobicContact CD2-CZ 3.68Å
691	N	74.1	Confident	66.5	Low	114 Å²	114	95.2 Å²	95.2	61%	0.61	48%	0.482	S	S	*	.	H	α-helix	trans	-68.1	-29.9	179.1	-75.7	-69.7	0	0	0	112.9	E687 F689	E687-N691 WeakPolarHBondContact O-CB 3.45Å; E687-N691 PolarHBondContact O-N 3.33Å; E687-N691 VanDerWaalsContact O-N 3.07Å; E687-N691 PolarHBondContact O-ND2 2.8Å; F689-N691 PolarHBondContact O-N 2.71Å
692	S	64.6	Low	63.7	Low	66 Å²	66	101.5 Å²	101.5	46%	0.462	52%	0.52	S	S	.	.	H	α-helix	trans	-68.1	-38.5	176.3	-161.4	0	0	0	0	112.2	S688 F689 L690 V694 G695	S688-S692 WeakPolarHBondContact O-CB 3.33Å; S688-S692 PolarHBondContact O-N 3.02Å; F689-S692 PolarHBondContact O-N 3.38Å; L690-S692 VanDerWaalsContact C-N 3.32Å; L690-S692 PolarHBondContact O-N 3.3Å; S692-V694 PolarHBondContact O-N 2.83Å; S692-G695 PolarHBondContact O-N 2.97Å
693	Q	57.9	Low	60.7	Low	84 Å²	84	106.8 Å²	106.8	39%	0.393	56%	0.555	S	S	.	*	H	α-helix	trans	-65.6	-17.8	180	-70.5	-80	-36.1	0	0	113.8	F689 L690 G695	F689-Q693 HydrophobicContact CD1-CG 4.17Å; F689-Q693 HydrophobicContact CE1-CG 3.92Å; F689-Q693 WeakPolarHBondContact O-CG 3.47Å; F689-Q693 PolarHBondContact O-N 3.38Å; L690-Q693 PolarHBondContact O-N 3.23Å; Q693-G695 VanDerWaalsContact C-N 3.31Å
694	V	52.7	Low	57.8	Low	124 Å²	124	113.4 Å²	113.4	75%	0.752	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-19.2	178.5	-179.3	0	0	0	0	112.3	S692	S692-V694 PolarHBondContact O-N 2.83Å
695	G	42.3	Very low	55	Low	75 Å²	75	115.4 Å²	115.4	77%	0.773	60%	0.601	S	S	*	*	S	Bend	trans	-80.7	-26.4	-178.9	0	0	0	0	0	115	S692 Q693	S692-G695 PolarHBondContact O-N 2.97Å; Q693-G695 VanDerWaalsContact C-N 3.31Å
696	D	37.1	Very low	52.2	Low	127 Å²	127	119.3 Å²	119.3	68%	0.679	63%	0.632	S	S	*	*	S	Bend	trans	-107.4	130.9	-169.4	-137.7	-26.6	0	0	0	112.5	Y698	D696-Y698 PolarHBondContact O-N 2.75Å
697	G	41.4	Very low	49.2	Very low	69 Å²	69	125.1 Å²	125.1	71%	0.711	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	7.8	-153.8	0	0	0	0	0	117.7
698	Y	41.5	Very low	46.6	Very low	203 Å²	203	125 Å²	125	80%	0.796	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-15.2	-163.1	-97.4	-92	0	0	0	116.3	D696	D696-Y698 PolarHBondContact O-N 2.75Å
699	Y	33.7	Very low	43.8	Very low	198 Å²	198	128.7 Å²	128.7	78%	0.776	69%	0.692	S	S	*	*			trans	-121.7	59.8	-176.6	-68.6	-71	0	0	0	114.6	N701	Y699-N701 PolarHBondContact O-N 2.72Å
700	R	34.9	Very low	41.5	Very low	231 Å²	231	140.5 Å²	140.5	87%	0.872	74%	0.737	S	S	*	*			trans	-78.9	101.4	158.6	-79.1	-171.7	175.8	-175	0.5	110.3
701	N	35.5	Very low	38.9	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	76%	0.758	S	S	*	*			trans	167.4	79.4	139.9	-84.8	-22.5	0	0	0	112.2	Y699	Y699-N701 PolarHBondContact O-N 2.72Å
702	V	34.6	Very low	37.1	Very low	135 Å²	135	143.8 Å²	143.8	82%	0.818	77%	0.769	S	S	*	*			trans	-136.1	128.6	162.6	-174.6	0	0	0	0	108.9
703	P	32.1	Very low	35.5	Very low	112 Å²	112	146.9 Å²	146.9	73%	0.727	79%	0.786	S	S	*	*			trans	-69	143.4	173.7	-16	30.1	0	0	0	111.3	Q705	P703-Q705 PolarHBondContact O-N 2.89Å
704	K	31.9	Very low	34.3	Very low	215 Å²	215	146.7 Å²	146.7	94%	0.935	81%	0.806	S	S	*	*			trans	-64.6	104.1	165.6	-73.7	-173.8	175.6	-175	0	109.5
705	Q	30.3	Very low	33.5	Very low	185 Å²	185	145.8 Å²	145.8	86%	0.864	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.7	143.6	159.1	-69.7	-168.1	-8.4	0	0	109.5	P703	P703-Q705 PolarHBondContact O-N 2.89Å
706	S	29.9	Very low	33.4	Very low	112 Å²	112	144 Å²	144	78%	0.783	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.2	148.7	-177.5	48.4	0	0	0	0	112.5
707	E	27.3	Very low	33.6	Very low	184 Å²	184	139.2 Å²	139.2	86%	0.86	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-55	136.5	171.3	-61.4	-176	132.5	0	0	112.2
708	P	26.9	Very low	33.7	Very low	119 Å²	119	141 Å²	141	77%	0.773	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-77.3	144.2	142.7	-7.7	26.3	0	0	0	109.4
709	T	25	Very low	33.8	Very low	126 Å²	126	133.1 Å²	133.1	77%	0.773	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-56.5	151.2	179.9	30.8	0	0	0	0	114	D711	T709-D711 PolarHBondContact O-N 3.33Å
710	R	36.7	Very low	34	Very low	252 Å²	252	125.9 Å²	125.9	95%	0.951	70%	0.695	S	S	*	*			trans	-60.7	100.4	171.8	-67.7	177.1	177.4	174.1	-1.4	111.2
711	D	25.6	Very low	34.1	Very low	141 Å²	141	123.4 Å²	123.4	75%	0.754	69%	0.686	S	S	*	*			trans	-125.1	144.9	167.4	-113.1	-44.6	0	0	0	111.9	T709 T713	T709-D711 PolarHBondContact O-N 3.33Å; D711-T713 PolarHBondContact O-N 3.39Å
712	A	38.2	Very low	33.9	Very low	103 Å²	103	120.5 Å²	120.5	85%	0.851	68%	0.675	S	S	*	*			trans	-95.8	88.2	-166	0	0	0	0	0	112.7
713	T	29.6	Very low	33.6	Very low	131 Å²	131	119.5 Å²	119.5	80%	0.804	68%	0.675	S	S	*	*			trans	-127.4	107.9	178.1	56	0	0	0	0	115	D711	D711-T713 PolarHBondContact O-N 3.39Å
714	G	32.7	Very low	33.5	Very low	80 Å²	80	122.4 Å²	122.4	83%	0.825	68%	0.678	S	S	*	*				91	28.7	115.7	0	0	0	0	0	121.2
715	T	37.1	Very low	33.6	Very low	104 Å²	104	121.4 Å²	121.4	64%	0.638	67%	0.674	S	S	*	*			trans	-92.8	94.5	155	59.7	0	0	0	0	110.2	Y717	T715-Y717 PolarHBondContact O-N 2.93Å
716	G	39	Very low	33.5	Very low	39 Å²	39	120.5 Å²	120.5	40%	0.402	67%	0.67	S	S	.	*			trans	-73.6	62.9	178.6	0	0	0	0	0	112.8	S796	G716-S796 WeakPolarHBondContact CA-OG 3.34Å; G716-S796 PolarHBondContact N-OG 3.1Å; G716-S796 WeakPolarHBondContact O-CB 3.43Å; G716-S796 PolarHBondContact O-N 2.89Å; G716-S796 PolarHBondContact O-OG 3.19Å
717	Y	41.7	Very low	33.5	Very low	25 Å²	25	126.8 Å²	126.8	10%	0.098	68%	0.677	C	S	.	*			trans	-125.3	122.1	177.9	163	-92.3	0	0	0	108	L679 N680 T715 P719	L679-Y717 HydrophobicContact CD2-CE2 4.34Å; N680-Y717 PolarHBondContact ND2-OH 3.49Å; T715-Y717 PolarHBondContact O-N 2.93Å; Y717-P719 HydrophobicContact CE1-CB 4.02Å; Y717-P719 WeakPolarHBondContact O-CD 3.46Å
718	I	44.1	Very low	33.7	Very low	107 Å²	107	122.4 Å²	122.4	55%	0.549	67%	0.666	S	S	.	*			trans	-88.7	113.4	178.8	-56	-174.5	0	0	0	108.5	T794	I718-T794 HydrophobicContact CD1-CG2 4.44Å; I718-T794 VanDerWaalsContact CD1-OG1 3.29Å; I718-T794 WeakPolarHBondContact CD1-OG1 3.13Å
719	P	42.5	Very low	33.9	Very low	38 Å²	38	121.8 Å²	121.8	25%	0.247	67%	0.665	C	S	.	*			trans	-70.7	155.5	177.6	31.2	-36.2	0	0	0	111.2	Y717 R721	Y717-P719 HydrophobicContact CE1-CB 4.02Å; Y717-P719 WeakPolarHBondContact O-CD 3.46Å; P719-R721 HydrophobicContact CB-CG 4.42Å; P719-R721 HydrophobicContact CG-CG 4.13Å; P719-R721 PolarHBondContact O-N 3.43Å
720	M	37.9	Very low	34.4	Very low	45 Å²	45	123.7 Å²	123.7	22%	0.222	67%	0.665	C	S	.	*	S	Bend	trans	-66.1	96.2	170	-78.4	-172.4	-68.3	0	0	110.3	L595 D677 L774 F786	L595-M720 WeakPolarHBondContact O-CB 3.24Å; D677-M720 HydrophobicContact CB-CE 3.94Å; D677-M720 WeakPolarHBondContact OD2-CE 3.46Å; M720-L774 HydrophobicContact CE-CD2 4.49Å; M720-F786 HydrophobicContact CE-CD2 4.39Å; M720-F786 HydrophobicContact CE-CE2 4.16Å; M720-F786 HydrophobicContact CE-CZ 4.3Å; M720-F786 HydrophobicContact SD-CD1 4.26Å; M720-F786 HydrophobicContact SD-CE1 4.14Å; M720-F786 HydrophobicContact SD-CZ 4.32Å
721	R	36.7	Very low	34.4	Very low	180 Å²	180	115.2 Å²	115.2	68%	0.679	64%	0.644	S	S	*	*			trans	-138	153.7	179.5	-77.3	-173.2	175.4	169.2	-0.6	110.9	P719	P719-R721 HydrophobicContact CB-CG 4.42Å; P719-R721 HydrophobicContact CG-CG 4.13Å; P719-R721 PolarHBondContact O-N 3.43Å
722	P	31.4	Very low	35.2	Very low	97 Å²	97	112.7 Å²	112.7	63%	0.63	63%	0.63	S	S	*	*			trans	-65	164.2	165.3	30.9	-35.8	0	0	0	111.3
723	S	28	Very low	35.7	Very low	115 Å²	115	108.9 Å²	108.9	80%	0.804	60%	0.598	S	S	*	*			trans	-58	148.9	175.1	-169.4	0	0	0	0	111.7	K725	S723-K725 VanDerWaalsContact C-N 3.25Å; S723-K725 PolarHBondContact O-N 2.96Å
724	E	31.8	Very low	36.8	Very low	172 Å²	172	107.9 Å²	107.9	80%	0.804	59%	0.586	S	S	*	*	S	Bend	trans	-76.5	60.4	-167.3	-61.5	-162.1	113.2	0	0	114.7
725	K	32.3	Very low	38.2	Very low	194 Å²	194	105.3 Å²	105.3	84%	0.843	55%	0.554	S	S	*	*	S	Bend	trans	-139.1	43.1	169.2	-76.4	-161.1	175.1	-173.9	0	113.8	S723	S723-K725 VanDerWaalsContact C-N 3.25Å; S723-K725 PolarHBondContact O-N 2.96Å
726	E	28.9	Very low	39.3	Very low	167 Å²	167	108.6 Å²	108.6	78%	0.78	56%	0.562	S	S	*	*			trans	-160.9	106.3	164.3	-109.4	152.4	-138.5	0	0	110.1
727	R	30.6	Very low	41	Very low	244 Å²	244	112.5 Å²	112.5	92%	0.921	57%	0.572	S	S	*	*			trans	-112.2	50.3	173.6	-82.9	-162.3	-178.9	-170.7	4.6	111.8
728	S	30.3	Very low	42.8	Very low	91 Å²	91	113.7 Å²	113.7	64%	0.636	58%	0.584	S	S	*	*			trans	-157.9	150	169.2	49.6	0	0	0	0	110.1
729	S	31	Very low	44.8	Very low	107 Å²	107	108.6 Å²	108.6	75%	0.748	56%	0.558	S	S	*	*	S	Bend	trans	79.1	99.8	172.7	-52.5	0	0	0	0	118.2
730	Q	37.1	Very low	46.9	Very low	166 Å²	166	110 Å²	110	78%	0.776	56%	0.564	S	S	*	*			trans	58.7	119.7	139.6	-65.9	173.2	-22.4	0	0	120.6
731	S	35.7	Very low	49.2	Very low	73 Å²	73	110 Å²	110	51%	0.51	57%	0.571	S	S	.	*			trans	-69.5	136.5	140	52.4	0	0	0	0	109.2	C733	S731-C733 WeakPolarHBondContact CB-O 3.47Å; S731-C733 PolarHBondContact O-N 3.44Å; S731-C733 VanDerWaalsContact O-N 3.08Å; S731-C733 PolarHBondContact OG-O 2.93Å
732	D	43.5	Very low	51.6	Low	88 Å²	88	104.5 Å²	104.5	47%	0.471	55%	0.553	S	S	.	*	S	Bend	trans	-60.8	-19.5	-179.2	-64.9	-100.2	0	0	0	113.7	K593 R605	K593-D732 IonicContact NZ-OD2 2.99Å; K593-D732 PolarHBondContact NZ-OD2 3.07Å; R605-D732 IonicContact CZ-OD1 2.7Å; R605-D732 IonicContact NH1-OD1 3.51Å; R605-D732 PolarHBondContact NH1-OD1 3.21Å; R605-D732 IonicContact NH1-OD2 3.66Å; R605-D732 PolarHBondContact NH1-OD2 3.48Å; R605-D732 VanDerWaalsContact NH1-OD2 3.16Å; R605-D732 IonicContact NH2-OD1 3.76Å
733	C	47.9	Very low	54.4	Low	24 Å²	24	100.7 Å²	100.7	16%	0.162	53%	0.527	C	S	.	.	S	Bend	trans	-122.4	131.7	169.9	-58.7	0	0	0	0	108.2	C674 Y675 S731 H777	C674-C733 HydrophobicContact CB-CB 4.26Å; C674-C733 VanDerWaalsContact CB-SG 3.52Å; Y675-C733 HydrophobicContact CD1-CB 4.22Å; Y675-C733 HydrophobicContact CE1-CB 3.61Å; S731-C733 WeakPolarHBondContact CB-O 3.47Å; S731-C733 PolarHBondContact O-N 3.44Å; S731-C733 VanDerWaalsContact O-N 3.08Å; S731-C733 PolarHBondContact OG-O 2.93Å; C733-H777 PolarHBondContact SG-CE1 2.75Å
734	I	52.7	Low	57.6	Low	110 Å²	110	95.2 Å²	95.2	56%	0.564	49%	0.489	S	S	*	.			trans	-108.7	109.3	172.4	-52.7	178.8	0	0	0	106.6	E736	I734-E736 HydrophobicContact CB-CG 4.43Å; I734-E736 HydrophobicContact CG2-CG 3.59Å; I734-E736 PolarHBondContact O-N 3.32Å
735	D	61.3	Low	60.5	Low	26 Å²	26	88.2 Å²	88.2	14%	0.139	46%	0.457	C	S	.	.			trans	-84.2	94.3	166.5	175.2	27.3	0	0	0	108.1	Y675 F681 K685 L737 R779	Y675-D735 HydrophobicContact CD1-CB 4.44Å; Y675-D735 HydrophobicContact CE1-CB 3.78Å; F681-D735 WeakPolarHBondContact CZ-OD2 3.39Å; K685-D735 WeakPolarHBondContact CE-OD2 3.32Å; K685-D735 PolarHBondContact NZ-O 2.92Å; K685-D735 IonicContact NZ-OD2 3.48Å; K685-D735 PolarHBondContact NZ-OD2 3.22Å; D735-L737 VanDerWaalsContact C-N 3.31Å; D735-L737 PolarHBondContact OD1-N 2.94Å; D735-R779 IonicContact OD1-CZ 2.69Å; D735-R779 IonicContact OD1-NE 2.74Å; D735-R779 IonicContact OD1-NH2 2.4Å; D735-R779 PolarHBondContact OD1-NH2 3.19Å; D735-R779 IonicContact OD2-CZ 3.51Å; D735-R779 IonicContact OD2-NE 3.46Å; D735-R779 PolarHBondContact OD2-NE 2.92Å; D735-R779 IonicContact OD2-NH2 2.74Å; D735-R779 PolarHBondContact OD2-NH2 3.43Å
736	E	61.3	Low	63.4	Low	173 Å²	173	79.9 Å²	79.9	81%	0.808	42%	0.423	S	S	*	.			trans	-75.1	-18	-179.4	-64.3	-173.2	157.9	0	0	113	I734	I734-E736 HydrophobicContact CB-CG 4.43Å; I734-E736 HydrophobicContact CG2-CG 3.59Å; I734-E736 PolarHBondContact O-N 3.32Å
737	L	73.4	Confident	66.6	Low	120 Å²	120	71.9 Å²	71.9	63%	0.628	39%	0.386	S	S	*	.	S	Bend	trans	-70.5	146.6	-177.9	-65.3	170.5	0	0	0	111.7	K685 D735 R779	K685-L737 PolarHBondContact NZ-O 3.19Å; D735-L737 VanDerWaalsContact C-N 3.31Å; D735-L737 PolarHBondContact OD1-N 2.94Å; L737-R779 PolarHBondContact O-NH2 3.05Å; L737-R779 VanDerWaalsContact O-NH2 3.08Å
738	S	81.1	Confident	69.8	Low	50 Å²	50	60.3 Å²	60.3	35%	0.35	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-60.6	162.8	169.5	43.4	0	0	0	0	112.1	R779	S738-R779 PolarHBondContact O-NH1 3.08Å; S738-R779 PolarHBondContact O-NH2 2.96Å
739	L	86.4	Confident	72.9	Confident	1 Å²	1	56 Å²	56	1%	0.005	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-94.2	133.5	164.2	178.8	82	0	0	0	107.8	F681 L682 K685 F689 D743 L744 F747 L840	F681-L739 HydrophobicContact CE1-CD1 4.07Å; L682-L739 HydrophobicContact CD2-CD2 4.04Å; K685-L739 HydrophobicContact CB-CB 3.7Å; K685-L739 HydrophobicContact CB-CD2 3.9Å; K685-L739 HydrophobicContact CB-CG 4.35Å; K685-L739 HydrophobicContact CD-CB 4.39Å; K685-L739 HydrophobicContact CG-CB 4.22Å; F689-L739 HydrophobicContact CB-CB 4.49Å; F689-L739 HydrophobicContact CB-CD2 4.32Å; F689-L739 HydrophobicContact CD2-CB 4.5Å; F689-L739 HydrophobicContact CD2-CD2 4.04Å; F689-L739 HydrophobicContact CD2-CG 4.06Å; F689-L739 WeakPolarHBondContact CD2-O 3.35Å; L739-D743 WeakPolarHBondContact CA-OD2 3.48Å; L739-D743 HydrophobicContact CD1-CB 3.54Å; L739-D743 HydrophobicContact CG-CB 4.41Å; L739-L744 HydrophobicContact CD1-CD2 4.48Å; L739-L744 HydrophobicContact CD2-CD2 4.24Å; L739-F747 HydrophobicContact CD1-CE2 3.91Å; L739-F747 HydrophobicContact CD1-CZ 4.41Å; L739-L840 HydrophobicContact CD2-CD2 3.87Å
740	D	86.1	Confident	76.1	Confident	68 Å²	68	51.2 Å²	51.2	36%	0.364	28%	0.278	S	S	.	.			trans	-122.5	-173.6	176.7	64.3	48.6	0	0	0	112.3	F689 E742 D743	F689-D740 VanDerWaalsContact CE2-C 3.49Å; F689-D740 WeakPolarHBondContact CE2-O 3.43Å; D740-E742 WeakPolarHBondContact OD1-CA 3.39Å; D740-E742 WeakPolarHBondContact OD1-CB 3.44Å; D740-E742 PolarHBondContact OD1-N 2.98Å; D740-D743 PolarHBondContact N-OD2 2.98Å; D740-D743 PolarHBondContact OD1-N 3.13Å
741	A	85.1	Confident	79	Confident	45 Å²	45	43.3 Å²	43.3	37%	0.372	24%	0.241	S	C	.	.	H	α-helix	trans	-77.4	-23.3	-178.7	0	0	0	0	0	113.3	L744 L745	A741-L744 PolarHBondContact O-N 2.77Å; A741-L745 PolarHBondContact O-N 3.23Å
742	E	87.5	Confident	81.9	Confident	64 Å²	64	39.9 Å²	39.9	30%	0.299	22%	0.216	S	C	.	.	H	α-helix	trans	-76.6	-33.1	177.7	-171.5	162.7	-162.6	0	0	111	D740 L744 L745 S746 S904 T907	D740-E742 WeakPolarHBondContact OD1-CA 3.39Å; D740-E742 WeakPolarHBondContact OD1-CB 3.44Å; D740-E742 PolarHBondContact OD1-N 2.98Å; E742-L744 VanDerWaalsContact C-N 3.31Å; E742-L744 PolarHBondContact O-N 3.36Å; E742-L745 PolarHBondContact O-N 3.03Å; E742-S746 VanDerWaalsContact O-CB 3.24Å; E742-S746 WeakPolarHBondContact O-CB 3.42Å; E742-S746 PolarHBondContact O-N 2.88Å; E742-S904 WeakPolarHBondContact OE1-CB 2.91Å; E742-S904 PolarHBondContact OE1-OG 3.25Å; E742-T907 HydrophobicContact CG-CG2 4.47Å; E742-T907 WeakPolarHBondContact OE1-CB 3.34Å; E742-T907 PolarHBondContact OE1-OG1 3.16Å
743	D	91.2	Very high	84.4	Confident	16 Å²	16	37.4 Å²	37.4	9%	0.086	20%	0.201	C	C	.	.	H	α-helix	trans	-53.1	-46.5	165.2	-73.8	-60.4	0	0	0	111.9	L739 D740 L745 S746 F747 R779	L739-D743 WeakPolarHBondContact CA-OD2 3.48Å; L739-D743 HydrophobicContact CD1-CB 3.54Å; L739-D743 HydrophobicContact CG-CB 4.41Å; D740-D743 PolarHBondContact N-OD2 2.98Å; D740-D743 PolarHBondContact OD1-N 3.13Å; D743-L745 PolarHBondContact O-N 3.12Å; D743-S746 WeakPolarHBondContact O-CB 3.39Å; D743-S746 PolarHBondContact O-N 3.27Å; D743-F747 HydrophobicContact CB-CE2 4.05Å; D743-F747 HydrophobicContact CB-CZ 4.2Å; D743-F747 VanDerWaalsContact O-CD2 3.24Å; D743-F747 WeakPolarHBondContact O-CD2 3.32Å; D743-F747 WeakPolarHBondContact O-CG 3.46Å; D743-F747 PolarHBondContact O-N 3.5Å; D743-R779 WeakPolarHBondContact OD1-CD 3.32Å; D743-R779 IonicContact OD1-CZ 3.52Å; D743-R779 IonicContact OD1-NE 3.21Å; D743-R779 IonicContact OD1-NH1 2.65Å; D743-R779 PolarHBondContact OD1-NH1 2.88Å; D743-R779 IonicContact OD2-CZ 3.44Å; D743-R779 IonicContact OD2-NH1 3.16Å; D743-R779 PolarHBondContact OD2-NH1 2.89Å
744	L	94.8	Very high	86.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.6	-41	-177.1	-57.5	-177.7	0	0	0	111.6	L682 F689 L739 A741 E742 S748 I837 F838 L840	L682-L744 HydrophobicContact CD2-CD2 3.62Å; F689-L744 HydrophobicContact CE2-CD1 3.8Å; F689-L744 HydrophobicContact CE2-CG 4.39Å; F689-L744 HydrophobicContact CZ-CD1 4.16Å; L739-L744 HydrophobicContact CD1-CD2 4.48Å; L739-L744 HydrophobicContact CD2-CD2 4.24Å; A741-L744 PolarHBondContact O-N 2.77Å; E742-L744 VanDerWaalsContact C-N 3.31Å; E742-L744 PolarHBondContact O-N 3.36Å; L744-S748 WeakPolarHBondContact O-CB 3.46Å; L744-S748 PolarHBondContact O-N 3.43Å; L744-S748 VanDerWaalsContact O-N 3.13Å; L744-S748 PolarHBondContact O-OG 3.38Å; L744-I837 HydrophobicContact CB-CG2 3.78Å; L744-I837 HydrophobicContact CD2-CG2 3.81Å; L744-I837 HydrophobicContact CG-CG2 4.31Å; L744-F838 HydrophobicContact CB-CD1 4.03Å; L744-F838 HydrophobicContact CB-CE1 3.47Å; L744-F838 VanDerWaalsContact CB-CE1 3.47Å; L744-F838 HydrophobicContact CB-CZ 3.78Å; L744-F838 HydrophobicContact CD1-CD1 3.8Å; L744-F838 HydrophobicContact CD1-CE1 4Å; L744-F838 HydrophobicContact CG-CE1 4.4Å; L744-L840 HydrophobicContact CD1-CD2 4.05Å; L744-L840 HydrophobicContact CD2-CD2 3.99Å
745	L	91.8	Very high	88.8	Confident	26 Å²	26	31 Å²	31	14%	0.136	17%	0.167	C	C	.	.	H	α-helix	trans	-65.3	-42.1	173.4	-68.2	164.4	0	0	0	111.1	A741 E742 D743 S748 Y749 F838 M874 L902 L903	A741-L745 PolarHBondContact O-N 3.23Å; E742-L745 PolarHBondContact O-N 3.03Å; D743-L745 PolarHBondContact O-N 3.12Å; L745-S748 WeakPolarHBondContact O-CB 3.48Å; L745-S748 PolarHBondContact O-N 3.13Å; L745-Y749 WeakPolarHBondContact O-CB 3.27Å; L745-Y749 PolarHBondContact O-N 3.08Å; L745-F838 HydrophobicContact CD2-CZ 4.01Å; L745-F838 HydrophobicContact CG-CZ 4.29Å; L745-M874 HydrophobicContact CD2-CE 3.65Å; L745-L902 HydrophobicContact CD2-CB 4.04Å; L745-L902 HydrophobicContact CD2-CD1 4.37Å; L745-L903 HydrophobicContact CB-CD2 3.7Å
746	S	93.1	Very high	90.5	Very high	18 Å²	18	32.6 Å²	32.6	13%	0.126	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-47.8	177	-178.7	0	0	0	0	111.9	E742 D743 S748 Y749 Q750	E742-S746 VanDerWaalsContact O-CB 3.24Å; E742-S746 WeakPolarHBondContact O-CB 3.42Å; E742-S746 PolarHBondContact O-N 2.88Å; D743-S746 WeakPolarHBondContact O-CB 3.39Å; D743-S746 PolarHBondContact O-N 3.27Å; S746-S748 VanDerWaalsContact C-N 3.3Å; S746-S748 PolarHBondContact O-N 3.39Å; S746-Y749 PolarHBondContact O-N 2.92Å; S746-Q750 VanDerWaalsContact O-CB 3.27Å; S746-Q750 WeakPolarHBondContact O-CB 3.37Å; S746-Q750 WeakPolarHBondContact O-CG 3.25Å; S746-Q750 PolarHBondContact O-N 3.21Å; S746-Q750 PolarHBondContact OG-NE2 3.42Å
747	F	96.9	Very high	92.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-40.5	174.9	-60.6	-31.1	0	0	0	112.1	L678 F681 L682 L739 D743 V751 L775 R779 A781 I837	L678-F747 HydrophobicContact CD1-CD2 3.59Å; L678-F747 HydrophobicContact CD1-CE2 3.8Å; L678-F747 HydrophobicContact CD1-CG 3.99Å; L678-F747 HydrophobicContact CD1-CZ 4.37Å; L678-F747 HydrophobicContact CD2-CB 4.45Å; F681-F747 HydrophobicContact CD1-CZ 4.44Å; F681-F747 HydrophobicContact CE1-CE2 4.38Å; F681-F747 HydrophobicContact CE1-CZ 4.04Å; L682-F747 HydrophobicContact CD2-CE2 4.45Å; L739-F747 HydrophobicContact CD1-CE2 3.91Å; L739-F747 HydrophobicContact CD1-CZ 4.41Å; D743-F747 HydrophobicContact CB-CE2 4.05Å; D743-F747 HydrophobicContact CB-CZ 4.2Å; D743-F747 VanDerWaalsContact O-CD2 3.24Å; D743-F747 WeakPolarHBondContact O-CD2 3.32Å; D743-F747 WeakPolarHBondContact O-CG 3.46Å; D743-F747 PolarHBondContact O-N 3.5Å; F747-V751 VanDerWaalsContact O-CG2 3.29Å; F747-V751 WeakPolarHBondContact O-CG2 3.34Å; F747-V751 PolarHBondContact O-N 2.71Å; F747-L775 HydrophobicContact CD1-CD2 3.8Å; F747-L775 HydrophobicContact CE1-CD1 4.15Å; F747-L775 HydrophobicContact CE1-CD2 3.38Å; F747-L775 HydrophobicContact CE1-CG 4.43Å; F747-L775 HydrophobicContact CZ-CD1 3.97Å; F747-L775 HydrophobicContact CZ-CD2 4.07Å; F747-R779 HydrophobicContact CE1-CB 4.16Å; F747-A781 HydrophobicContact CD1-CB 4.39Å; F747-I837 HydrophobicContact CB-CD1 4.01Å
748	S	97.1	Very high	92.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.9	-54.2	178.5	-58	0	0	0	0	111.4	L744 L745 S746 Q750 V751 A752 Y830 L834 F838	L744-S748 WeakPolarHBondContact O-CB 3.46Å; L744-S748 PolarHBondContact O-N 3.43Å; L744-S748 VanDerWaalsContact O-N 3.13Å; L744-S748 PolarHBondContact O-OG 3.38Å; L745-S748 WeakPolarHBondContact O-CB 3.48Å; L745-S748 PolarHBondContact O-N 3.13Å; S746-S748 VanDerWaalsContact C-N 3.3Å; S746-S748 PolarHBondContact O-N 3.39Å; S748-Q750 PolarHBondContact O-N 3.04Å; S748-V751 PolarHBondContact O-N 3.06Å; S748-A752 PolarHBondContact O-N 2.94Å; S748-Y830 PolarHBondContact O-OH 3.12Å; S748-L834 WeakPolarHBondContact OG-CD2 3.16Å; S748-F838 VanDerWaalsContact OG-CE2 3.32Å; S748-F838 WeakPolarHBondContact OG-CE2 3.44Å
749	Y	96.4	Very high	93.3	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-43.8	177.2	165.8	-104.1	0	0	0	113.3	L745 S746 V751 A752 K753 V896 E900 L903 Y911	L745-Y749 WeakPolarHBondContact O-CB 3.27Å; L745-Y749 PolarHBondContact O-N 3.08Å; S746-Y749 PolarHBondContact O-N 2.92Å; Y749-V751 PolarHBondContact O-N 3.31Å; Y749-A752 WeakPolarHBondContact O-CB 3.5Å; Y749-A752 PolarHBondContact O-N 3.17Å; Y749-K753 HydrophobicContact CE1-CD 4.28Å; Y749-K753 HydrophobicContact CE2-CD 4.05Å; Y749-K753 VanDerWaalsContact CE2-CE 3.48Å; Y749-K753 HydrophobicContact CE2-CG 4.46Å; Y749-K753 PolarHBondContact O-N 3.11Å; Y749-K753 WeakPolarHBondContact OH-CE 3.43Å; Y749-K753 PolarHBondContact OH-NZ 3.17Å; Y749-V896 HydrophobicContact CE2-CG1 4.31Å; Y749-E900 HydrophobicContact CD2-CB 4.04Å; Y749-E900 HydrophobicContact CD2-CG 4.45Å; Y749-E900 HydrophobicContact CE2-CB 3.61Å; Y749-E900 HydrophobicContact CE2-CG 3.59Å; Y749-E900 WeakPolarHBondContact CE2-OE1 3.19Å; Y749-E900 VanDerWaalsContact CZ-OE1 3.27Å; Y749-E900 PolarHBondContact OH-OE1 3.18Å; Y749-L903 HydrophobicContact CD1-CD1 3.51Å; Y749-L903 HydrophobicContact CD2-CD1 3.99Å; Y749-L903 HydrophobicContact CE1-CD1 3.84Å; Y749-L903 HydrophobicContact CE2-CD1 4.29Å; Y749-L903 HydrophobicContact CG-CD1 3.53Å; Y749-Y911 AromaticContact CE1-CD1 3.73Å; Y749-Y911 HydrophobicContact CE1-CD1 3.73Å; Y749-Y911 HydrophobicContact CE1-CD2 4.02Å; Y749-Y911 HydrophobicContact CE1-CE1 4.05Å; Y749-Y911 HydrophobicContact CE1-CE2 4.3Å; Y749-Y911 AromaticContact CE1-CG 3.73Å; Y749-Y911 HydrophobicContact CE1-CG 3.73Å
750	Q	96.8	Very high	93.5	Very high	6 Å²	6	24 Å²	24	3%	0.028	13%	0.134	C	C	.	.	H	α-helix	trans	-63.3	-40.2	178.1	-77.2	-173.8	72.5	0	0	112.4	N652 S746 S748 K753 G754 R779 V780 A781 Y911	N652-Q750 VanDerWaalsContact CB-O 3.23Å; N652-Q750 WeakPolarHBondContact CB-O 3.49Å; N652-Q750 WeakPolarHBondContact ND2-CB 3.38Å; N652-Q750 PolarHBondContact ND2-OE1 2.57Å; N652-Q750 VanDerWaalsContact ND2-OE1 3.16Å; N652-Q750 PolarHBondContact OD1-O 2.66Å; S746-Q750 VanDerWaalsContact O-CB 3.27Å; S746-Q750 WeakPolarHBondContact O-CB 3.37Å; S746-Q750 WeakPolarHBondContact O-CG 3.25Å; S746-Q750 PolarHBondContact O-N 3.21Å; S746-Q750 PolarHBondContact OG-NE2 3.42Å; S748-Q750 PolarHBondContact O-N 3.04Å; Q750-K753 PolarHBondContact O-N 3.4Å; Q750-G754 PolarHBondContact O-N 3.31Å; Q750-R779 PolarHBondContact NE2-O 3.44Å; Q750-V780 VanDerWaalsContact OE1-CA 3.29Å; Q750-A781 HydrophobicContact CB-CB 3.98Å; Q750-Y911 HydrophobicContact CG-CD2 3.98Å; Q750-Y911 HydrophobicContact CG-CE2 3.93Å
751	V	97.9	Very high	93.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.6	-36.8	174.4	174.6	0	0	0	0	110.9	F747 S748 Y749 G754 M755 L768 V773 I783 Y830 L833	F747-V751 VanDerWaalsContact O-CG2 3.29Å; F747-V751 WeakPolarHBondContact O-CG2 3.34Å; F747-V751 PolarHBondContact O-N 2.71Å; S748-V751 PolarHBondContact O-N 3.06Å; Y749-V751 PolarHBondContact O-N 3.31Å; V751-G754 PolarHBondContact O-N 2.8Å; V751-M755 PolarHBondContact O-N 3.18Å; V751-L768 HydrophobicContact CG1-CD1 4.37Å; V751-V773 HydrophobicContact CG2-CB 4.5Å; V751-V773 HydrophobicContact CG2-CG1 3.9Å; V751-V773 HydrophobicContact CG2-CG2 3.79Å; V751-I783 HydrophobicContact CG1-CD1 4.03Å; V751-I783 HydrophobicContact CG1-CG1 4.45Å; V751-Y830 HydrophobicContact CB-CE2 4.27Å; V751-Y830 HydrophobicContact CG1-CD2 3.9Å; V751-Y830 HydrophobicContact CG1-CE2 4.01Å; V751-L833 HydrophobicContact CB-CD2 4.43Å; V751-L833 HydrophobicContact CG1-CD1 3.9Å; V751-L833 HydrophobicContact CG1-CD2 4.03Å; V751-L833 HydrophobicContact CG2-CD2 4.46Å
752	A	97.7	Very high	93.4	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.8	-46.4	173.3	0	0	0	0	0	112	S748 Y749 M755 E756 Y830 L895 V896	S748-A752 PolarHBondContact O-N 2.94Å; Y749-A752 WeakPolarHBondContact O-CB 3.5Å; Y749-A752 PolarHBondContact O-N 3.17Å; A752-M755 PolarHBondContact O-N 3.25Å; A752-E756 WeakPolarHBondContact O-CB 3.3Å; A752-E756 PolarHBondContact O-N 3.3Å; A752-Y830 HydrophobicContact CB-CE2 4.18Å; A752-L895 HydrophobicContact CB-CB 4.47Å; A752-V896 VanDerWaalsContact C-CG2 3.41Å; A752-V896 HydrophobicContact CB-CG2 3.66Å
753	K	96	Very high	93.2	Very high	36 Å²	36	22 Å²	22	16%	0.157	12%	0.117	C	C	.	.	H	α-helix	trans	-65.4	-37.4	176.1	-77.7	-165.5	169.7	178.9	0	112.5	H650 Y749 Q750 E756 Y757 V896 E900 Y911	H650-K753 PolarHBondContact CE1-O 3.38Å; Y749-K753 HydrophobicContact CE1-CD 4.28Å; Y749-K753 HydrophobicContact CE2-CD 4.05Å; Y749-K753 VanDerWaalsContact CE2-CE 3.48Å; Y749-K753 HydrophobicContact CE2-CG 4.46Å; Y749-K753 PolarHBondContact O-N 3.11Å; Y749-K753 WeakPolarHBondContact OH-CE 3.43Å; Y749-K753 PolarHBondContact OH-NZ 3.17Å; Q750-K753 PolarHBondContact O-N 3.4Å; K753-E756 PolarHBondContact O-N 2.64Å; K753-Y757 PolarHBondContact O-N 2.94Å; K753-Y757 VanDerWaalsContact O-N 3.14Å; K753-V896 HydrophobicContact CB-CG2 4.31Å; K753-V896 HydrophobicContact CD-CG1 4.16Å; K753-V896 HydrophobicContact CG-CB 4.32Å; K753-V896 HydrophobicContact CG-CG1 3.67Å; K753-V896 HydrophobicContact CG-CG2 3.61Å; K753-E900 IonicContact NZ-OE1 3.47Å; K753-E900 PolarHBondContact NZ-OE1 2.04Å; K753-Y911 HydrophobicContact CD-CE1 3.95Å
754	G	95.9	Very high	92.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58	-46.9	171.2	0	0	0	0	0	112.7	Q750 V751 Y757 I758	Q750-G754 PolarHBondContact O-N 3.31Å; V751-G754 PolarHBondContact O-N 2.8Å; G754-Y757 PolarHBondContact O-N 3.13Å; G754-I758 WeakPolarHBondContact O-CD1 3.27Å; G754-I758 VanDerWaalsContact O-CG1 3.25Å; G754-I758 WeakPolarHBondContact O-CG1 3.41Å; G754-I758 PolarHBondContact O-N 2.86Å; G754-I758 VanDerWaalsContact O-N 3.12Å
755	M	96.8	Very high	92.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-74.8	-30.1	179.9	-71.3	-54.3	-53.4	0	0	114.2	V751 A752 I758 T759 H765 L768 I783 D826 F892	V751-M755 PolarHBondContact O-N 3.18Å; A752-M755 PolarHBondContact O-N 3.25Å; M755-I758 HydrophobicContact CE-CB 4.43Å; M755-I758 HydrophobicContact CE-CD1 4.49Å; M755-I758 HydrophobicContact CE-CG2 4.22Å; M755-I758 PolarHBondContact O-N 3.45Å; M755-I758 HydrophobicContact SD-CD1 3.68Å; M755-T759 WeakPolarHBondContact O-CB 3.4Å; M755-T759 PolarHBondContact O-N 3.15Å; M755-T759 PolarHBondContact O-OG1 3.21Å; M755-H765 HydrophobicContact CE-CB 4.03Å; M755-H765 HydrophobicContact SD-CB 4.29Å; M755-L768 HydrophobicContact CE-CD2 4.22Å; M755-L768 HydrophobicContact CG-CD1 4.34Å; M755-L768 HydrophobicContact CG-CD2 3.71Å; M755-L768 HydrophobicContact SD-CD1 3.94Å; M755-L768 HydrophobicContact SD-CD2 3.8Å; M755-L768 HydrophobicContact SD-CG 4.43Å; M755-I783 HydrophobicContact CG-CD1 3.71Å; M755-I783 HydrophobicContact SD-CD1 3.77Å; M755-I783 HydrophobicContact SD-CG2 4.48Å; M755-D826 HydrophobicContact CE-CB 3.88Å; M755-D826 WeakPolarHBondContact CE-OD2 3.46Å; M755-F892 HydrophobicContact CB-CB 4.46Å; M755-F892 HydrophobicContact CB-CD1 3.37Å; M755-F892 HydrophobicContact CB-CD2 3.84Å; M755-F892 HydrophobicContact CB-CE1 3.35Å; M755-F892 HydrophobicContact CB-CE2 3.82Å; M755-F892 HydrophobicContact CB-CG 3.62Å; M755-F892 HydrophobicContact CB-CZ 3.57Å; M755-F892 HydrophobicContact CE-CE2 3.9Å; M755-F892 HydrophobicContact CE-CZ 4Å; M755-F892 HydrophobicContact CG-CD1 4.27Å; M755-F892 HydrophobicContact CG-CE1 3.76Å; M755-F892 HydrophobicContact CG-CE2 4.39Å; M755-F892 HydrophobicContact CG-CZ 3.82Å
756	E	96.8	Very high	92.3	Very high	60 Å²	60	21.6 Å²	21.6	28%	0.28	11%	0.112	S	C	.	.	H	α-helix	trans	-59.1	-47.9	169.3	-178.5	178.6	-143.3	0	0	110.5	A752 K753 I758 T759 S760 F892 R893 V896	A752-E756 WeakPolarHBondContact O-CB 3.3Å; A752-E756 PolarHBondContact O-N 3.3Å; K753-E756 PolarHBondContact O-N 2.64Å; E756-I758 PolarHBondContact O-N 2.99Å; E756-T759 PolarHBondContact O-N 3.18Å; E756-S760 WeakPolarHBondContact O-CB 3.45Å; E756-S760 PolarHBondContact O-N 3.35Å; E756-F892 HydrophobicContact CB-CB 4.06Å; E756-R893 VanDerWaalsContact OE1-CA 3.3Å; E756-R893 WeakPolarHBondContact OE1-CA 3.28Å; E756-R893 WeakPolarHBondContact OE1-CB 3.45Å; E756-R893 VanDerWaalsContact OE1-CG 3.3Å; E756-R893 WeakPolarHBondContact OE1-CG 3.08Å; E756-V896 HydrophobicContact CB-CG2 4.2Å
757	Y	94.8	Very high	92	Very high	47 Å²	47	20.8 Å²	20.8	18%	0.184	11%	0.106	C	C	.	.	H	α-helix	trans	-59.1	-48.6	175.1	-173.3	-81.4	0	0	0	111.7	L647 N649 H650 I653 K753 G754 T759 S760 K761	L647-Y757 WeakPolarHBondContact O-CE1 3.5Å; L647-Y757 PolarHBondContact O-OH 2.98Å; N649-Y757 VanDerWaalsContact O-CZ 3.31Å; N649-Y757 PolarHBondContact O-OH 2.69Å; H650-Y757 HydrophobicContact CB-CD1 3.91Å; H650-Y757 HydrophobicContact CB-CD2 3.81Å; H650-Y757 HydrophobicContact CB-CE1 4Å; H650-Y757 HydrophobicContact CB-CE2 3.87Å; H650-Y757 HydrophobicContact CB-CG 3.8Å; H650-Y757 AromaticContact CD2-CD2 3.38Å; H650-Y757 WeakPolarHBondContact CD2-CD2 3.28Å; H650-Y757 AromaticContact CD2-CE2 3.93Å; H650-Y757 AromaticContact CD2-CG 3.87Å; H650-Y757 AromaticContact CG-CD2 3.62Å; H650-Y757 AromaticContact CG-CG 3.67Å; I653-Y757 HydrophobicContact CD1-CD1 3.58Å; I653-Y757 HydrophobicContact CD1-CE1 4.11Å; I653-Y757 HydrophobicContact CD1-CG 4.34Å; K753-Y757 PolarHBondContact O-N 2.94Å; K753-Y757 VanDerWaalsContact O-N 3.14Å; G754-Y757 PolarHBondContact O-N 3.13Å; Y757-T759 VanDerWaalsContact C-N 3.3Å; Y757-T759 PolarHBondContact O-N 2.76Å; Y757-S760 WeakPolarHBondContact O-CB 3.38Å; Y757-S760 PolarHBondContact O-N 3.02Å; Y757-S760 VanDerWaalsContact O-N 3.12Å; Y757-S760 PolarHBondContact O-OG 3.49Å; Y757-K761 HydrophobicContact CD1-CG 4.08Å; Y757-K761 HydrophobicContact CE1-CD 4.4Å; Y757-K761 HydrophobicContact CE1-CG 3.86Å; Y757-K761 WeakPolarHBondContact O-CG 3.39Å; Y757-K761 PolarHBondContact O-N 3.34Å; Y757-K761 PolarHBondContact OH-NZ 2.99Å
758	I	91.1	Very high	91.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.7	-42.6	179.5	-68.2	163.4	0	0	0	111.2	W557 I653 G754 M755 E756 K761 C763 I783	W557-I758 HydrophobicContact CE3-CG2 4.41Å; W557-I758 HydrophobicContact CH2-CD1 3.58Å; W557-I758 HydrophobicContact CH2-CG1 4.16Å; W557-I758 HydrophobicContact CZ3-CB 4.47Å; W557-I758 HydrophobicContact CZ3-CD1 3.69Å; W557-I758 HydrophobicContact CZ3-CG1 3.83Å; W557-I758 HydrophobicContact CZ3-CG2 3.78Å; I653-I758 HydrophobicContact CD1-CD1 4.06Å; I653-I758 HydrophobicContact CD1-CG1 3.61Å; I653-I758 HydrophobicContact CG1-CD1 4.29Å; I653-I758 HydrophobicContact CG1-CG1 4.37Å; G754-I758 WeakPolarHBondContact O-CD1 3.27Å; G754-I758 VanDerWaalsContact O-CG1 3.25Å; G754-I758 WeakPolarHBondContact O-CG1 3.41Å; G754-I758 PolarHBondContact O-N 2.86Å; G754-I758 VanDerWaalsContact O-N 3.12Å; M755-I758 HydrophobicContact CE-CB 4.43Å; M755-I758 HydrophobicContact CE-CD1 4.49Å; M755-I758 HydrophobicContact CE-CG2 4.22Å; M755-I758 PolarHBondContact O-N 3.45Å; M755-I758 HydrophobicContact SD-CD1 3.68Å; E756-I758 PolarHBondContact O-N 2.99Å; I758-K761 PolarHBondContact O-N 2.74Å; I758-C763 HydrophobicContact CG2-CB 4.07Å; I758-C763 WeakPolarHBondContact CG2-O 3.32Å; I758-C763 PolarHBondContact O-N 2.82Å; I758-I783 HydrophobicContact CD1-CB 4.42Å; I758-I783 HydrophobicContact CD1-CD1 4.15Å; I758-I783 HydrophobicContact CD1-CG2 4.04Å
759	T	88.6	Confident	91.8	Very high	33 Å²	33	20.8 Å²	20.8	20%	0.202	11%	0.106	C	C	.	.	H	α-helix	trans	-65.3	-41.4	176.1	-58.6	0	0	0	0	111.4	M755 E756 Y757 K761 N762 F823 F892	M755-T759 WeakPolarHBondContact O-CB 3.4Å; M755-T759 PolarHBondContact O-N 3.15Å; M755-T759 PolarHBondContact O-OG1 3.21Å; E756-T759 PolarHBondContact O-N 3.18Å; Y757-T759 VanDerWaalsContact C-N 3.3Å; Y757-T759 PolarHBondContact O-N 2.76Å; T759-K761 PolarHBondContact O-N 2.96Å; T759-K761 VanDerWaalsContact O-N 3.14Å; T759-N762 PolarHBondContact O-N 3.47Å; T759-F823 HydrophobicContact CG2-CB 4.35Å; T759-F823 HydrophobicContact CG2-CD1 3.81Å; T759-F823 HydrophobicContact CG2-CD2 4.38Å; T759-F823 HydrophobicContact CG2-CE1 4.11Å; T759-F823 HydrophobicContact CG2-CG 3.94Å; T759-F892 WeakPolarHBondContact OG1-CD2 3.39Å
760	S	90.8	Very high	91.7	Very high	83 Å²	83	20.7 Å²	20.7	58%	0.58	11%	0.106	S	C	*	.	H	α-helix	trans	-63.8	-16.2	175.9	80.8	0	0	0	0	114.1	E756 Y757	E756-S760 WeakPolarHBondContact O-CB 3.45Å; E756-S760 PolarHBondContact O-N 3.35Å; Y757-S760 WeakPolarHBondContact O-CB 3.38Å; Y757-S760 PolarHBondContact O-N 3.02Å; Y757-S760 VanDerWaalsContact O-N 3.12Å; Y757-S760 PolarHBondContact O-OG 3.49Å
761	K	86.5	Confident	91.4	Very high	61 Å²	61	20.5 Å²	20.5	27%	0.265	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	18.7	173.5	-59.7	-70.2	176.7	139.5	0	112.5	Y646 L647 Y757 I758 T759 C763	Y646-K761 WeakPolarHBondContact CE1-O 3.46Å; L647-K761 HydrophobicContact CD2-CB 3.69Å; L647-K761 HydrophobicContact CD2-CG 4.15Å; L647-K761 WeakPolarHBondContact O-CD 3.36Å; L647-K761 VanDerWaalsContact O-CE 3.23Å; L647-K761 WeakPolarHBondContact O-CE 3.41Å; L647-K761 PolarHBondContact O-NZ 3.42Å; Y757-K761 HydrophobicContact CD1-CG 4.08Å; Y757-K761 HydrophobicContact CE1-CD 4.4Å; Y757-K761 HydrophobicContact CE1-CG 3.86Å; Y757-K761 WeakPolarHBondContact O-CG 3.39Å; Y757-K761 PolarHBondContact O-N 3.34Å; Y757-K761 PolarHBondContact OH-NZ 2.99Å; I758-K761 PolarHBondContact O-N 2.74Å; T759-K761 PolarHBondContact O-N 2.96Å; T759-K761 VanDerWaalsContact O-N 3.14Å; K761-C763 PolarHBondContact O-N 2.82Å; K761-C763 VanDerWaalsContact O-N 3.14Å
762	N	83.7	Confident	91.1	Very high	74 Å²	74	20.5 Å²	20.5	40%	0.396	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	35.4	-178	-66.7	-13.7	0	0	0	113.5	I560 T759	I560-N762 HydrophobicContact CB-CB 4.37Å; I560-N762 PolarHBondContact N-O 3.3Å; T759-N762 PolarHBondContact O-N 3.47Å
763	C	83.6	Confident	91	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	147.8	-174.3	-163	0	0	0	0	111.5	K558 L647 I758 K761	K558-C763 VanDerWaalsContact O-CA 3.31Å; K558-C763 WeakPolarHBondContact O-CA 3.31Å; K558-C763 PolarHBondContact O-SG 2.78Å; L647-C763 HydrophobicContact CD2-CB 3.78Å; I758-C763 HydrophobicContact CG2-CB 4.07Å; I758-C763 WeakPolarHBondContact CG2-O 3.32Å; I758-C763 PolarHBondContact O-N 2.82Å; K761-C763 PolarHBondContact O-N 2.82Å; K761-C763 VanDerWaalsContact O-N 3.14Å
764	I	83.5	Confident	91	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.4	179.8	-50	164.9	0	0	0	108.4	W557 K558 I560 Y570 R766 Y821 F823 D826	W557-I764 WeakPolarHBondContact CA-O 3.4Å; K558-I764 PolarHBondContact N-O 3.36Å; K558-I764 VanDerWaalsContact N-O 3.15Å; K558-I764 PolarHBondContact O-N 3.13Å; I560-I764 HydrophobicContact CD1-CD1 3.9Å; I560-I764 HydrophobicContact CD1-CG1 4.08Å; I560-I764 HydrophobicContact CG1-CD1 4.28Å; Y570-I764 HydrophobicContact CE1-CD1 4.09Å; I764-R766 HydrophobicContact CB-CG 4.13Å; I764-R766 HydrophobicContact CG2-CG 3.54Å; I764-Y821 WeakPolarHBondContact CD1-O 3.21Å; I764-F823 HydrophobicContact CG1-CD1 3.96Å; I764-F823 HydrophobicContact CG1-CE1 4.07Å; I764-D826 WeakPolarHBondContact CA-OD2 3.38Å; I764-D826 WeakPolarHBondContact CG2-OD2 3.25Å
765	H	88.4	Confident	90.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.			trans	-80.5	-38.3	-175.5	-169.8	-73.5	0	0	0	113.4	Q556 W557 M755 D767 L768 I783 C784 D826	Q556-H765 WeakPolarHBondContact CB-O 3.34Å; W557-H765 AromaticContact CE2-CD2 3.81Å; W557-H765 AromaticContact CH2-CD2 3.49Å; W557-H765 VanDerWaalsContact CH2-CD2 3.49Å; W557-H765 WeakPolarHBondContact CH2-CD2 3.41Å; W557-H765 AromaticContact CZ2-CD2 3.31Å; W557-H765 WeakPolarHBondContact CZ2-CD2 3.36Å; W557-H765 AromaticContact CZ2-NE2 3.57Å; M755-H765 HydrophobicContact CE-CB 4.03Å; M755-H765 HydrophobicContact SD-CB 4.29Å; H765-D767 PolarHBondContact CE1-O 3.29Å; H765-D767 VanDerWaalsContact ND1-C 3.29Å; H765-D767 PolarHBondContact ND1-O 2.92Å; H765-D767 PolarHBondContact O-N 2.77Å; H765-L768 PolarHBondContact ND1-N 3.25Å; H765-I783 VanDerWaalsContact CD2-CG2 3.4Å; H765-I783 WeakPolarHBondContact CD2-CG2 3.31Å; H765-I783 WeakPolarHBondContact NE2-CG2 3.39Å; H765-C784 PolarHBondContact NE2-O 2.95Å; H765-D826 PolarHBondContact N-OD2 3.22Å
766	R	84.9	Confident	90.6	Very high	33 Å²	33	20.1 Å²	20.1	13%	0.125	11%	0.106	C	C	.	.	S	Bend	trans	65.2	-17.2	172.1	-56.5	-178.8	46.6	-111.9	-4	117.6	Q556 I764 Y821 D826	Q556-R766 VanDerWaalsContact O-CD 3.27Å; Q556-R766 WeakPolarHBondContact O-CD 3.35Å; Q556-R766 PolarHBondContact O-NH1 3.22Å; I764-R766 HydrophobicContact CB-CG 4.13Å; I764-R766 HydrophobicContact CG2-CG 3.54Å; R766-Y821 HydrophobicContact CB-CD1 3.9Å; R766-Y821 HydrophobicContact CB-CE1 4.27Å; R766-Y821 HydrophobicContact CG-CD1 3.71Å; R766-Y821 HydrophobicContact CG-CG 4.09Å; R766-Y821 VanDerWaalsContact NE-CD1 3.27Å; R766-D826 PolarHBondContact N-OD1 2.96Å
767	D	88.4	Confident	90	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.011	12%	0.117	C	C	.	.	S	Bend	trans	-129.5	46.7	170.4	-171.5	24.6	0	0	0	111.6	Q556 H765 A769 R771 N772 Y798 P807	Q556-D767 HydrophobicContact CB-CB 4.36Å; Q556-D767 HydrophobicContact CG-CB 3.94Å; H765-D767 PolarHBondContact CE1-O 3.29Å; H765-D767 VanDerWaalsContact ND1-C 3.29Å; H765-D767 PolarHBondContact ND1-O 2.92Å; H765-D767 PolarHBondContact O-N 2.77Å; D767-A769 PolarHBondContact O-N 3.02Å; D767-R771 IonicContact OD1-CZ 3.37Å; D767-R771 IonicContact OD1-NE 3.5Å; D767-R771 IonicContact OD1-NH2 2.85Å; D767-R771 PolarHBondContact OD1-NH2 2.88Å; D767-N772 VanDerWaalsContact CG-ND2 3.27Å; D767-N772 PolarHBondContact O-ND2 3.21Å; D767-N772 PolarHBondContact OD2-ND2 3.46Å; D767-Y798 PolarHBondContact OD1-OH 3.32Å; D767-Y798 PolarHBondContact OD2-OH 3Å; D767-P807 WeakPolarHBondContact OD1-CB 3.38Å; D767-P807 WeakPolarHBondContact OD1-CG 3.13Å
768	L	94.1	Very high	89.6	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.136	C	C	.	.			trans	-75.4	118.4	-179	-179.4	64.5	0	0	0	111.1	V751 M755 H765 I783 L833 F892	V751-L768 HydrophobicContact CG1-CD1 4.37Å; M755-L768 HydrophobicContact CE-CD2 4.22Å; M755-L768 HydrophobicContact CG-CD1 4.34Å; M755-L768 HydrophobicContact CG-CD2 3.71Å; M755-L768 HydrophobicContact SD-CD1 3.94Å; M755-L768 HydrophobicContact SD-CD2 3.8Å; M755-L768 HydrophobicContact SD-CG 4.43Å; H765-L768 PolarHBondContact ND1-N 3.25Å; L768-I783 HydrophobicContact CD1-CG2 4.38Å; L768-L833 HydrophobicContact CD1-CD1 3.75Å; L768-L833 HydrophobicContact CG-CD1 3.87Å; L768-F892 HydrophobicContact CD2-CZ 4.37Å
769	A	94.3	Very high	89.5	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-162.1	162	-175.8	0	0	0	0	0	111	D767 R771 N772 W810	D767-A769 PolarHBondContact O-N 3.02Å; A769-R771 HydrophobicContact CB-CG 3.75Å; A769-R771 VanDerWaalsContact CB-CZ 3.42Å; A769-R771 PolarHBondContact O-N 3.31Å; A769-R771 VanDerWaalsContact O-N 3.13Å; A769-N772 WeakPolarHBondContact O-CA 3.39Å; A769-N772 PolarHBondContact O-N 2.96Å; A769-W810 VanDerWaalsContact CB-CD1 3.5Å; A769-W810 HydrophobicContact CB-CD2 4.34Å; A769-W810 HydrophobicContact CB-CG 4.13Å; A769-W810 VanDerWaalsContact CB-NE1 3.34Å
770	A	94.9	Very high	89.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-63.1	-20.7	179.2	0	0	0	0	0	113.6	L678 L679 N772 E836	L678-A770 HydrophobicContact CD2-CB 4.48Å; L679-A770 HydrophobicContact CB-CB 4.11Å; L679-A770 PolarHBondContact N-O 2.98Å; L679-A770 VanDerWaalsContact N-O 3.11Å; A770-N772 VanDerWaalsContact C-N 3.28Å; A770-N772 PolarHBondContact O-N 2.53Å; A770-E836 HydrophobicContact CB-CB 3.82Å; A770-E836 HydrophobicContact CB-CG 4.35Å; A770-E836 WeakPolarHBondContact CB-OE2 3.36Å; A770-E836 PolarHBondContact N-OE2 3.34Å
771	R	90.6	Very high	90	Very high	1 Å²	1	19.7 Å²	19.7	0%	0.004	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-66.7	-26	168.3	60.5	176.4	174.1	-81.1	-10.6	113.3	L679 D767 A769 R790 Y798 P807 W810	L679-R771 HydrophobicContact CD2-CB 4.14Å; D767-R771 IonicContact OD1-CZ 3.37Å; D767-R771 IonicContact OD1-NE 3.5Å; D767-R771 IonicContact OD1-NH2 2.85Å; D767-R771 PolarHBondContact OD1-NH2 2.88Å; A769-R771 HydrophobicContact CB-CG 3.75Å; A769-R771 VanDerWaalsContact CB-CZ 3.42Å; A769-R771 PolarHBondContact O-N 3.31Å; A769-R771 VanDerWaalsContact O-N 3.13Å; R771-R790 PolarHBondContact O-NH2 3.09Å; R771-Y798 PolarHBondContact NE-OH 3.22Å; R771-P807 VanDerWaalsContact NH2-CB 3.34Å; R771-W810 VanDerWaalsContact NH1-CZ3 3.29Å
772	N	92.4	Very high	90.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-103.7	13.6	-174.9	-80.3	-13.1	0	0	0	112.6	D767 A769 A770 C784 R790	D767-N772 VanDerWaalsContact CG-ND2 3.27Å; D767-N772 PolarHBondContact O-ND2 3.21Å; D767-N772 PolarHBondContact OD2-ND2 3.46Å; A769-N772 WeakPolarHBondContact O-CA 3.39Å; A769-N772 PolarHBondContact O-N 2.96Å; A770-N772 VanDerWaalsContact C-N 3.28Å; A770-N772 PolarHBondContact O-N 2.53Å; N772-C784 WeakPolarHBondContact CB-O 3.45Å; N772-C784 PolarHBondContact O-N 3.32Å; N772-C784 PolarHBondContact O-SG 3.49Å; N772-R790 PolarHBondContact OD1-NH1 3.43Å
773	V	95.6	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	-112.2	128.5	167	-178.1	0	0	0	0	108.2	D677 L678 V751 A781 K782 I783 L833	D677-V773 CarbonylContact C-O 3.58Å; D677-V773 VanDerWaalsContact CA-O 3.31Å; D677-V773 WeakPolarHBondContact CA-O 3.39Å; L678-V773 HydrophobicContact CB-CB 4.07Å; L678-V773 HydrophobicContact CB-CG1 4.24Å; L678-V773 HydrophobicContact CD2-CB 4.1Å; L678-V773 HydrophobicContact CD2-CG1 4.02Å; L678-V773 PolarHBondContact N-O 2.93Å; V751-V773 HydrophobicContact CG2-CB 4.5Å; V751-V773 HydrophobicContact CG2-CG1 3.9Å; V751-V773 HydrophobicContact CG2-CG2 3.79Å; V773-A781 HydrophobicContact CG1-CB 3.87Å; V773-K782 CarbonylContact C-O 3.6Å; V773-K782 WeakPolarHBondContact CA-O 3.49Å; V773-I783 HydrophobicContact CG2-CG1 4.46Å; V773-L833 HydrophobicContact CG2-CD1 3.96Å
774	L	94.8	Very high	91.3	Very high	11 Å²	11	14.4 Å²	14.4	6%	0.058	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	158.3	172	-71.1	177.8	0	0	0	111.7	V654 C673 G676 D677 M720 A781 K782 F786	V654-L774 HydrophobicContact CG2-CB 4.45Å; V654-L774 HydrophobicContact CG2-CD1 3.7Å; V654-L774 HydrophobicContact CG2-CG 4.4Å; C673-L774 HydrophobicContact CB-CB 3.53Å; C673-L774 HydrophobicContact CB-CD1 3.64Å; C673-L774 HydrophobicContact CB-CD2 4.47Å; C673-L774 HydrophobicContact CB-CG 4.07Å; G676-L774 VanDerWaalsContact C-CD2 3.44Å; G676-L774 WeakPolarHBondContact O-CA 3.32Å; G676-L774 WeakPolarHBondContact O-CD2 3.2Å; D677-L774 HydrophobicContact CB-CD2 4.35Å; M720-L774 HydrophobicContact CE-CD2 4.49Å; L774-A781 CarbonylContact O-C 3.29Å; L774-A781 WeakPolarHBondContact O-CA 3.32Å; L774-K782 PolarHBondContact N-O 3.08Å; L774-K782 PolarHBondContact O-N 2.86Å; L774-F786 HydrophobicContact CD1-CE2 3.66Å; L774-F786 HydrophobicContact CD1-CZ 3.63Å; L774-F786 HydrophobicContact CD2-CE2 3.51Å; L774-F786 HydrophobicContact CD2-CZ 3.85Å; L774-F786 HydrophobicContact CG-CE2 3.63Å; L774-F786 HydrophobicContact CG-CZ 4.07Å
775	L	93.9	Very high	90.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	134.4	169.4	-71.5	170.6	0	0	0	111.5	C673 C674 Y675 G676 L678 F681 F747 V780 A781	C673-L775 CarbonylContact C-O 3.55Å; C673-L775 WeakPolarHBondContact CB-O 3.46Å; C674-L775 PolarHBondContact N-O 2.91Å; Y675-L775 HydrophobicContact CD2-CB 4.2Å; Y675-L775 PolarHBondContact N-O 3.31Å; G676-L775 PolarHBondContact O-N 3.33Å; L678-L775 HydrophobicContact CD1-CD1 3.79Å; L678-L775 HydrophobicContact CD1-CG 4.34Å; F681-L775 HydrophobicContact CB-CD1 3.73Å; F681-L775 HydrophobicContact CD1-CD1 3.4Å; F681-L775 VanDerWaalsContact CD1-CD1 3.4Å; F681-L775 HydrophobicContact CD2-CD1 3.83Å; F681-L775 HydrophobicContact CE1-CD1 3.87Å; F681-L775 HydrophobicContact CE2-CD1 4.27Å; F681-L775 HydrophobicContact CG-CD1 3.38Å; F681-L775 HydrophobicContact CZ-CD1 4.29Å; F747-L775 HydrophobicContact CD1-CD2 3.8Å; F747-L775 HydrophobicContact CE1-CD1 4.15Å; F747-L775 HydrophobicContact CE1-CD2 3.38Å; F747-L775 HydrophobicContact CE1-CG 4.43Å; F747-L775 HydrophobicContact CZ-CD1 3.97Å; F747-L775 HydrophobicContact CZ-CD2 4.07Å; L775-V780 WeakPolarHBondContact CA-O 3.3Å; L775-A781 HydrophobicContact CD2-CB 3.98Å
776	T	91.1	Very high	89.5	Confident	18 Å²	18	15.5 Å²	15.5	11%	0.11	9%	0.088	C	C	.	.			trans	-122.4	-171.8	175	-161.4	0	0	0	0	111.8	Y672 Y675 R779 V780 K782	Y672-T776 PolarHBondContact O-OG1 2.9Å; Y675-T776 VanDerWaalsContact CD2-O 3.32Å; Y675-T776 WeakPolarHBondContact CD2-O 3.43Å; Y675-T776 VanDerWaalsContact CE2-O 3.23Å; Y675-T776 WeakPolarHBondContact CE2-O 3.46Å; T776-R779 WeakPolarHBondContact O-CA 3.32Å; T776-R779 PolarHBondContact O-N 2.95Å; T776-R779 VanDerWaalsContact O-N 3.1Å; T776-V780 HydrophobicContact CG2-CB 3.97Å; T776-V780 PolarHBondContact N-O 3.04Å; T776-K782 HydrophobicContact CG2-CD 4.17Å
777	H	85	Confident	88.3	Confident	113 Å²	113	14.1 Å²	14.1	52%	0.523	8%	0.084	S	C	.	.	G	3₁₀ helix	trans	-49.2	143.2	178.8	-62.3	-85.6	0	0	0	111.9	C674 C733 R779	C674-H777 VanDerWaalsContact SG-CD2 3.51Å; C674-H777 PolarHBondContact SG-NE2 3.09Å; C674-H777 VanDerWaalsContact SG-NE2 3.4Å; C733-H777 PolarHBondContact SG-CE1 2.75Å; H777-R779 PolarHBondContact O-N 3.14Å
778	G	84.7	Confident	86.7	Confident	56 Å²	56	14.1 Å²	14.1	58%	0.577	8%	0.084	S	C	*	.	G	3₁₀ helix	trans	70.4	14.9	-173.6	0	0	0	0	0	114.9	V780	G778-V780 PolarHBondContact O-N 2.78Å
779	R	89.6	Confident	84.7	Confident	30 Å²	30	14.3 Å²	14.3	11%	0.113	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	56.7	29.3	-174.7	-65.7	-175.8	175.7	168.7	-2.7	113.1	D735 L737 S738 D743 F747 Q750 T776 H777 A781	D735-R779 IonicContact OD1-CZ 2.69Å; D735-R779 IonicContact OD1-NE 2.74Å; D735-R779 IonicContact OD1-NH2 2.4Å; D735-R779 PolarHBondContact OD1-NH2 3.19Å; D735-R779 IonicContact OD2-CZ 3.51Å; D735-R779 IonicContact OD2-NE 3.46Å; D735-R779 PolarHBondContact OD2-NE 2.92Å; D735-R779 IonicContact OD2-NH2 2.74Å; D735-R779 PolarHBondContact OD2-NH2 3.43Å; L737-R779 PolarHBondContact O-NH2 3.05Å; L737-R779 VanDerWaalsContact O-NH2 3.08Å; S738-R779 PolarHBondContact O-NH1 3.08Å; S738-R779 PolarHBondContact O-NH2 2.96Å; D743-R779 WeakPolarHBondContact OD1-CD 3.32Å; D743-R779 IonicContact OD1-CZ 3.52Å; D743-R779 IonicContact OD1-NE 3.21Å; D743-R779 IonicContact OD1-NH1 2.65Å; D743-R779 PolarHBondContact OD1-NH1 2.88Å; D743-R779 IonicContact OD2-CZ 3.44Å; D743-R779 IonicContact OD2-NH1 3.16Å; D743-R779 PolarHBondContact OD2-NH1 2.89Å; F747-R779 HydrophobicContact CE1-CB 4.16Å; Q750-R779 PolarHBondContact NE2-O 3.44Å; T776-R779 WeakPolarHBondContact O-CA 3.32Å; T776-R779 PolarHBondContact O-N 2.95Å; T776-R779 VanDerWaalsContact O-N 3.1Å; H777-R779 PolarHBondContact O-N 3.14Å; R779-A781 PolarHBondContact O-N 3.05Å
780	V	93.4	Very high	83	Confident	14 Å²	14	14.9 Å²	14.9	9%	0.085	9%	0.088	C	C	.	.			trans	-71.1	124.4	175.9	178.1	0	0	0	0	109.8	V651 Q750 L775 T776 G778 K782 L914	V651-V780 HydrophobicContact CG2-CG1 4.19Å; Q750-V780 VanDerWaalsContact OE1-CA 3.29Å; L775-V780 WeakPolarHBondContact CA-O 3.3Å; T776-V780 HydrophobicContact CG2-CB 3.97Å; T776-V780 PolarHBondContact N-O 3.04Å; G778-V780 PolarHBondContact O-N 2.78Å; V780-K782 HydrophobicContact CG1-CG 4.43Å; V780-L914 HydrophobicContact CG2-CD1 4.01Å
781	A	96.4	Very high	81.2	Confident	1 Å²	1	17.4 Å²	17.4	1%	0.008	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.8	179.4	0	0	0	0	0	111.2	N652 F747 Q750 V773 L774 L775 R779	N652-A781 VanDerWaalsContact CA-O 3.29Å; N652-A781 WeakPolarHBondContact CA-O 3.33Å; N652-A781 WeakPolarHBondContact CB-O 3.08Å; N652-A781 PolarHBondContact ND2-O 3.23Å; F747-A781 HydrophobicContact CD1-CB 4.39Å; Q750-A781 HydrophobicContact CB-CB 3.98Å; V773-A781 HydrophobicContact CG1-CB 3.87Å; L774-A781 CarbonylContact O-C 3.29Å; L774-A781 WeakPolarHBondContact O-CA 3.32Å; L775-A781 HydrophobicContact CD2-CB 3.98Å; R779-A781 PolarHBondContact O-N 3.05Å
782	K	96.1	Very high	79.7	Confident	13 Å²	13	18.5 Å²	18.5	6%	0.057	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	122.3	-175.1	-76.3	176.2	167.5	-73.4	0	112.2	V651 N652 I653 V654 N655 E671 V773 L774 T776 V780	V651-K782 VanDerWaalsContact O-CE 3.29Å; V651-K782 WeakPolarHBondContact O-CE 3.38Å; V651-K782 WeakPolarHBondContact O-CG 3.13Å; V651-K782 PolarHBondContact O-NZ 3.01Å; N652-K782 WeakPolarHBondContact O-CA 3.33Å; I653-K782 PolarHBondContact O-NZ 2.86Å; V654-K782 HydrophobicContact CG2-CB 3.68Å; N655-K782 PolarHBondContact ND2-NZ 2.75Å; E671-K782 IonicContact OE1-NZ 2.73Å; E671-K782 PolarHBondContact OE1-NZ 2.86Å; E671-K782 WeakPolarHBondContact OE2-CD 3.43Å; E671-K782 WeakPolarHBondContact OE2-CE 3.47Å; E671-K782 IonicContact OE2-NZ 3.36Å; E671-K782 PolarHBondContact OE2-NZ 2.55Å; V773-K782 CarbonylContact C-O 3.6Å; V773-K782 WeakPolarHBondContact CA-O 3.49Å; L774-K782 PolarHBondContact N-O 3.08Å; L774-K782 PolarHBondContact O-N 2.86Å; T776-K782 HydrophobicContact CG2-CD 4.17Å; V780-K782 HydrophobicContact CG1-CG 4.43Å
783	I	95.1	Very high	78	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	142.5	-178.9	-57.1	176.8	0	0	0	110.9	W557 N652 V654 V751 M755 I758 H765 L768 V773	W557-I783 HydrophobicContact CH2-CG2 4.4Å; N652-I783 PolarHBondContact O-N 2.77Å; V654-I783 PolarHBondContact N-O 2.84Å; V751-I783 HydrophobicContact CG1-CD1 4.03Å; V751-I783 HydrophobicContact CG1-CG1 4.45Å; M755-I783 HydrophobicContact CG-CD1 3.71Å; M755-I783 HydrophobicContact SD-CD1 3.77Å; M755-I783 HydrophobicContact SD-CG2 4.48Å; I758-I783 HydrophobicContact CD1-CB 4.42Å; I758-I783 HydrophobicContact CD1-CD1 4.15Å; I758-I783 HydrophobicContact CD1-CG2 4.04Å; H765-I783 VanDerWaalsContact CD2-CG2 3.4Å; H765-I783 WeakPolarHBondContact CD2-CG2 3.31Å; H765-I783 WeakPolarHBondContact NE2-CG2 3.39Å; L768-I783 HydrophobicContact CD1-CG2 4.38Å; V773-I783 HydrophobicContact CG2-CG1 4.46Å
784	C	89.1	Confident	76.1	Confident	10 Å²	10	24.9 Å²	24.9	7%	0.068	15%	0.146	C	C	.	.			trans	-165	162.1	-178.2	59.9	0	0	0	0	113.7	V654 H765 N772 F786	V654-C784 HydrophobicContact CB-CB 3.9Å; V654-C784 HydrophobicContact CG2-CB 3.6Å; H765-C784 PolarHBondContact NE2-O 2.95Å; N772-C784 WeakPolarHBondContact CB-O 3.45Å; N772-C784 PolarHBondContact O-N 3.32Å; N772-C784 PolarHBondContact O-SG 3.49Å; C784-F786 VanDerWaalsContact SG-CD2 3.54Å; C784-F786 WeakPolarHBondContact SG-CE2 3.49Å
785	D	76.3	Confident	74.5	Confident	4 Å²	4	24.7 Å²	24.7	2%	0.021	15%	0.145	C	C	.	.			trans	-102.8	132.4	167.1	177.9	3.3	0	0	0	110.7	Q556 K623 G787	Q556-D785 WeakPolarHBondContact CG-OD2 3.45Å; K623-D785 PolarHBondContact NZ-O 2.8Å; D785-G787 PolarHBondContact OD1-N 3.17Å
786	F	58.9	Low	73	Confident	18 Å²	18	28.4 Å²	28.4	8%	0.079	17%	0.171	C	C	.	.			trans	-116.5	18	178.3	-88.3	-65.6	0	0	0	114	V603 M720 L774 C784 L788 A789 R790	V603-F786 HydrophobicContact CG2-CD1 4.4Å; V603-F786 HydrophobicContact CG2-CE1 4.3Å; M720-F786 HydrophobicContact CE-CD2 4.39Å; M720-F786 HydrophobicContact CE-CE2 4.16Å; M720-F786 HydrophobicContact CE-CZ 4.3Å; M720-F786 HydrophobicContact SD-CD1 4.26Å; M720-F786 HydrophobicContact SD-CE1 4.14Å; M720-F786 HydrophobicContact SD-CZ 4.32Å; L774-F786 HydrophobicContact CD1-CE2 3.66Å; L774-F786 HydrophobicContact CD1-CZ 3.63Å; L774-F786 HydrophobicContact CD2-CE2 3.51Å; L774-F786 HydrophobicContact CD2-CZ 3.85Å; L774-F786 HydrophobicContact CG-CE2 3.63Å; L774-F786 HydrophobicContact CG-CZ 4.07Å; C784-F786 VanDerWaalsContact SG-CD2 3.54Å; C784-F786 WeakPolarHBondContact SG-CE2 3.49Å; F786-L788 PolarHBondContact O-N 2.79Å; F786-L788 VanDerWaalsContact O-N 3.1Å; F786-A789 HydrophobicContact CB-CB 4.31Å; F786-A789 HydrophobicContact CD1-CB 3.59Å; F786-A789 HydrophobicContact CE1-CB 4.41Å; F786-A789 HydrophobicContact CG-CB 4.4Å; F786-A789 WeakPolarHBondContact O-CA 3.23Å; F786-A789 WeakPolarHBondContact O-CB 3.18Å; F786-A789 PolarHBondContact O-N 3.08Å; F786-R790 PolarHBondContact O-N 3.27Å
787	G	59.1	Low	71.5	Confident	4 Å²	4	28.6 Å²	28.6	4%	0.041	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-33	-178.6	0	0	0	0	0	114.7	D785	D785-G787 PolarHBondContact OD1-N 3.17Å
788	L	55.9	Low	70.7	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-23.8	173.8	-70.9	176.8	0	0	0	114.4	F553 F600 G601 L625 L637 F786	F553-L788 HydrophobicContact CD1-CD2 3.63Å; F553-L788 HydrophobicContact CD1-CG 4.44Å; F553-L788 HydrophobicContact CD2-CD2 4.24Å; F553-L788 HydrophobicContact CE1-CD1 4.35Å; F553-L788 HydrophobicContact CE1-CD2 3.4Å; F553-L788 HydrophobicContact CE1-CG 3.72Å; F553-L788 HydrophobicContact CE2-CD2 4.04Å; F553-L788 HydrophobicContact CE2-CG 4.25Å; F553-L788 HydrophobicContact CG-CD2 4.07Å; F553-L788 HydrophobicContact CZ-CD2 3.63Å; F553-L788 HydrophobicContact CZ-CG 3.62Å; F600-L788 HydrophobicContact CB-CD2 3.86Å; G601-L788 CarbonylContact C-O 3.54Å; G601-L788 VanDerWaalsContact C-O 3.27Å; G601-L788 WeakPolarHBondContact CA-O 3.22Å; G601-L788 PolarHBondContact N-O 3.3Å; L625-L788 HydrophobicContact CD2-CD2 3.77Å; L637-L788 HydrophobicContact CB-CD1 4.38Å; L637-L788 HydrophobicContact CD1-CD1 3.71Å; F786-L788 PolarHBondContact O-N 2.79Å; F786-L788 VanDerWaalsContact O-N 3.1Å
789	A	51.2	Low	70.1	Confident	4 Å²	4	22.9 Å²	22.9	3%	0.033	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-7.2	-171.6	0	0	0	0	0	114.2	S597 G598 V603 F786	S597-A789 CarbonylContact C-O 3.58Å; S597-A789 PolarHBondContact N-O 3.32Å; G598-A789 VanDerWaalsContact CA-C 3.45Å; G598-A789 PolarHBondContact N-O 3.15Å; V603-A789 HydrophobicContact CB-CB 4.44Å; V603-A789 HydrophobicContact CG2-CB 3.62Å; F786-A789 HydrophobicContact CB-CB 4.31Å; F786-A789 HydrophobicContact CD1-CB 3.59Å; F786-A789 HydrophobicContact CE1-CB 4.41Å; F786-A789 HydrophobicContact CG-CB 4.4Å; F786-A789 WeakPolarHBondContact O-CA 3.23Å; F786-A789 WeakPolarHBondContact O-CB 3.18Å; F786-A789 PolarHBondContact O-N 3.08Å
790	R	58.7	Low	68.9	Low	13 Å²	13	26.9 Å²	26.9	5%	0.049	16%	0.156	C	C	.	.	S	Bend	trans	-113.4	148.3	178.9	-64.1	-170.4	-174.6	114.9	17.3	111.6	G598 A599 R771 N772 F786 I792	G598-R790 WeakPolarHBondContact CA-O 3.49Å; A599-R790 PolarHBondContact N-O 2.98Å; R771-R790 PolarHBondContact O-NH2 3.09Å; N772-R790 PolarHBondContact OD1-NH1 3.43Å; F786-R790 PolarHBondContact O-N 3.27Å; R790-I792 PolarHBondContact O-N 2.91Å
791	D	57.2	Low	67.5	Low	53 Å²	53	30 Å²	30	28%	0.283	17%	0.167	S	C	.	.			trans	-88.8	86.1	166.6	-161.4	-30.3	0	0	0	109.5	T793 T794 D795	D791-T793 PolarHBondContact O-N 2.88Å; D791-T793 WeakPolarHBondContact OD1-CA 3.46Å; D791-T793 WeakPolarHBondContact OD1-CB 3.15Å; D791-T793 WeakPolarHBondContact OD1-CG2 3.24Å; D791-T793 PolarHBondContact OD1-N 3.5Å; D791-T793 PolarHBondContact OD1-OG1 2.99Å; D791-T794 HydrophobicContact CB-CG2 4.42Å; D791-T794 PolarHBondContact O-N 2.7Å; D791-T794 PolarHBondContact O-OG1 2.76Å; D791-D795 PolarHBondContact O-N 3Å
792	I	59	Low	66	Low	23 Å²	23	33 Å²	33	12%	0.118	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.1	176.1	-43.6	179.6	0	0	0	111	F600 R790 T794 Y798 R805	F600-I792 HydrophobicContact CE2-CD1 4.39Å; R790-I792 PolarHBondContact O-N 2.91Å; I792-T794 VanDerWaalsContact C-N 3.26Å; I792-T794 PolarHBondContact O-N 3.28Å; I792-Y798 HydrophobicContact CG2-CD1 3.98Å; I792-Y798 HydrophobicContact CG2-CD2 4.07Å; I792-Y798 HydrophobicContact CG2-CG 3.69Å; I792-R805 HydrophobicContact CG2-CB 4.01Å; I792-R805 WeakPolarHBondContact O-CD 3.49Å; I792-R805 PolarHBondContact O-NE 2.74Å
793	T	56.1	Low	64.1	Low	67 Å²	67	40.6 Å²	40.6	41%	0.411	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-23.5	174.8	78.3	0	0	0	0	113.5	D791 R805	D791-T793 PolarHBondContact O-N 2.88Å; D791-T793 WeakPolarHBondContact OD1-CA 3.46Å; D791-T793 WeakPolarHBondContact OD1-CB 3.15Å; D791-T793 WeakPolarHBondContact OD1-CG2 3.24Å; D791-T793 PolarHBondContact OD1-N 3.5Å; D791-T793 PolarHBondContact OD1-OG1 2.99Å; T793-R805 PolarHBondContact O-NH2 2.88Å
794	T	57.3	Low	62.5	Low	67 Å²	67	42.7 Å²	42.7	41%	0.411	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-20.4	-176.2	65.8	0	0	0	0	114.6	I718 D791 I792 S796	I718-T794 HydrophobicContact CD1-CG2 4.44Å; I718-T794 VanDerWaalsContact CD1-OG1 3.29Å; I718-T794 WeakPolarHBondContact CD1-OG1 3.13Å; D791-T794 HydrophobicContact CB-CG2 4.42Å; D791-T794 PolarHBondContact O-N 2.7Å; D791-T794 PolarHBondContact O-OG1 2.76Å; I792-T794 VanDerWaalsContact C-N 3.26Å; I792-T794 PolarHBondContact O-N 3.28Å; T794-S796 PolarHBondContact O-N 3.1Å
795	D	59.9	Low	61.6	Low	7 Å²	7	46.8 Å²	46.8	4%	0.037	27%	0.271	C	S	.	.			trans	-77.5	107.5	-176.9	-171.1	-13	0	0	0	111.6	D791 S797 Y798	D791-D795 PolarHBondContact O-N 3Å; D795-S797 PolarHBondContact O-N 3.46Å; D795-S797 WeakPolarHBondContact OD1-CB 3.19Å; D795-S797 PolarHBondContact OD1-N 2.9Å; D795-S797 PolarHBondContact OD1-OG 3.07Å; D795-Y798 HydrophobicContact CB-CD2 4Å; D795-Y798 HydrophobicContact CB-CE2 4.48Å; D795-Y798 PolarHBondContact O-N 3Å
796	S	62.8	Low	61.8	Low	78 Å²	78	48 Å²	48	55%	0.545	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-10.1	176.4	59.1	0	0	0	0	115	G716 T794 Y798	G716-S796 WeakPolarHBondContact CA-OG 3.34Å; G716-S796 PolarHBondContact N-OG 3.1Å; G716-S796 WeakPolarHBondContact O-CB 3.43Å; G716-S796 PolarHBondContact O-N 2.89Å; G716-S796 PolarHBondContact O-OG 3.19Å; T794-S796 PolarHBondContact O-N 3.1Å; S796-Y798 VanDerWaalsContact C-N 3.26Å; S796-Y798 PolarHBondContact O-N 3.43Å
797	S	60.7	Low	63.1	Low	22 Å²	22	47.4 Å²	47.4	15%	0.154	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-21.7	170.5	-44.9	0	0	0	0	113.1	D795	D795-S797 PolarHBondContact O-N 3.46Å; D795-S797 WeakPolarHBondContact OD1-CB 3.19Å; D795-S797 PolarHBondContact OD1-N 2.9Å; D795-S797 PolarHBondContact OD1-OG 3.07Å
798	Y	67.3	Low	64.5	Low	12 Å²	12	47.2 Å²	47.2	5%	0.047	27%	0.273	C	S	.	.	S	Bend	trans	-112.7	123.4	-177.1	-61.8	-99.7	0	0	0	111.4	D767 R771 I792 D795 S796 L806 P807	D767-Y798 PolarHBondContact OD1-OH 3.32Å; D767-Y798 PolarHBondContact OD2-OH 3Å; R771-Y798 PolarHBondContact NE-OH 3.22Å; I792-Y798 HydrophobicContact CG2-CD1 3.98Å; I792-Y798 HydrophobicContact CG2-CD2 4.07Å; I792-Y798 HydrophobicContact CG2-CG 3.69Å; D795-Y798 HydrophobicContact CB-CD2 4Å; D795-Y798 HydrophobicContact CB-CE2 4.48Å; D795-Y798 PolarHBondContact O-N 3Å; S796-Y798 VanDerWaalsContact C-N 3.26Å; S796-Y798 PolarHBondContact O-N 3.43Å; Y798-L806 CarbonylContact C-O 3.58Å; Y798-L806 WeakPolarHBondContact CA-O 3.15Å; Y798-P807 HydrophobicContact CD1-CB 4Å; Y798-P807 HydrophobicContact CE1-CB 3.84Å; Y798-P807 HydrophobicContact CE1-CG 4.29Å
799	V	72.3	Confident	66.2	Low	38 Å²	38	48.4 Å²	48.4	23%	0.23	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	136.6	-173.1	-175	0	0	0	0	109.9	R801 R805 L806 V808 V850	V799-R801 PolarHBondContact O-N 3.49Å; V799-R805 WeakPolarHBondContact O-CA 2.89Å; V799-L806 PolarHBondContact N-O 3.16Å; V799-L806 PolarHBondContact O-N 2.97Å; V799-V808 HydrophobicContact CB-CG2 4.03Å; V799-V808 HydrophobicContact CG2-CG2 4.48Å; V799-V850 HydrophobicContact CB-CG1 4.45Å; V799-V850 HydrophobicContact CG1-CB 4.47Å; V799-V850 HydrophobicContact CG1-CG1 4.16Å; V799-V850 HydrophobicContact CG2-CB 3.85Å; V799-V850 HydrophobicContact CG2-CG1 4.06Å; V799-V850 HydrophobicContact CG2-CG2 3.98Å
800	L	65.3	Low	68.3	Low	113 Å²	113	48.5 Å²	48.5	59%	0.592	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	125.5	176.2	-174	73.1	0	0	0	110.2	A804 R805	L800-A804 WeakPolarHBondContact CA-O 3.31Å; L800-R805 HydrophobicContact CB-CG 4.43Å; L800-R805 HydrophobicContact CD1-CG 4.14Å
801	R	62.2	Low	69.8	Low	79 Å²	79	48.3 Å²	48.3	30%	0.298	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	119.7	175.1	-174.8	158.2	167.7	-114.1	-1.9	110	V799 N803 A804 I816	V799-R801 PolarHBondContact O-N 3.49Å; R801-N803 PolarHBondContact O-N 2.83Å; R801-A804 PolarHBondContact N-O 3.35Å; R801-A804 PolarHBondContact O-N 2.76Å; R801-I816 PolarHBondContact NH1-O 3.37Å; R801-I816 PolarHBondContact NH2-O 3.17Å
802	G	65.4	Low	71.6	Confident	65 Å²	65	45.8 Å²	45.8	67%	0.67	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	-133.7	-162.8	0	0	0	0	0	110.3
803	N	56.2	Low	73.1	Confident	172 Å²	172	45.5 Å²	45.5	92%	0.92	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	6.8	-179.4	-62.7	-14.1	0	0	0	113.9	R801	R801-N803 PolarHBondContact O-N 2.83Å
804	A	62.8	Low	74.7	Confident	45 Å²	45	43.3 Å²	43.3	37%	0.372	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	153.8	-175.2	0	0	0	0	0	112.4	L800 R801 L806	L800-A804 WeakPolarHBondContact CA-O 3.31Å; R801-A804 PolarHBondContact N-O 3.35Å; R801-A804 PolarHBondContact O-N 2.76Å; A804-L806 HydrophobicContact CB-CD2 4.21Å; A804-L806 HydrophobicContact CB-CG 4.25Å
805	R	69.8	Low	76.1	Confident	97 Å²	97	40.2 Å²	40.2	37%	0.366	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.1	165	-82.9	-171.5	171.7	89.2	-15.1	108.9	I792 T793 V799 L800	I792-R805 HydrophobicContact CG2-CB 4.01Å; I792-R805 WeakPolarHBondContact O-CD 3.49Å; I792-R805 PolarHBondContact O-NE 2.74Å; T793-R805 PolarHBondContact O-NH2 2.88Å; V799-R805 WeakPolarHBondContact O-CA 2.89Å; L800-R805 HydrophobicContact CB-CG 4.43Å; L800-R805 HydrophobicContact CD1-CG 4.14Å
806	L	79.1	Confident	77.2	Confident	30 Å²	30	40 Å²	40	16%	0.157	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	145.7	-169.2	-62.6	175.6	0	0	0	111.8	Y798 V799 A804 V808 M811	Y798-L806 CarbonylContact C-O 3.58Å; Y798-L806 WeakPolarHBondContact CA-O 3.15Å; V799-L806 PolarHBondContact N-O 3.16Å; V799-L806 PolarHBondContact O-N 2.97Å; A804-L806 HydrophobicContact CB-CD2 4.21Å; A804-L806 HydrophobicContact CB-CG 4.25Å; L806-V808 HydrophobicContact CB-CG2 4.11Å; L806-V808 PolarHBondContact O-N 2.87Å; L806-M811 HydrophobicContact CB-SD 3.79Å; L806-M811 HydrophobicContact CD1-CE 4.32Å; L806-M811 HydrophobicContact CD1-SD 4.49Å
807	P	87.3	Confident	78.2	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.032	22%	0.215	C	C	.	.			trans	-79	56.4	-178.9	34.7	-37.1	0	0	0	111.9	D767 R771 Y798 K809 W810 M811	D767-P807 WeakPolarHBondContact OD1-CB 3.38Å; D767-P807 WeakPolarHBondContact OD1-CG 3.13Å; R771-P807 VanDerWaalsContact NH2-CB 3.34Å; Y798-P807 HydrophobicContact CD1-CB 4Å; Y798-P807 HydrophobicContact CE1-CB 3.84Å; Y798-P807 HydrophobicContact CE1-CG 4.29Å; P807-K809 PolarHBondContact O-N 3.25Å; P807-W810 HydrophobicContact CB-CE3 4.3Å; P807-W810 PolarHBondContact O-N 3.09Å; P807-M811 HydrophobicContact CG-CG 4.17Å; P807-M811 HydrophobicContact CG-SD 4.39Å; P807-M811 PolarHBondContact O-N 3.29Å
808	V	88.5	Confident	79.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-31.9	-162.8	176.8	0	0	0	0	114.8	V799 L806 W810 M811 I816 V850 F854 Y855	V799-V808 HydrophobicContact CB-CG2 4.03Å; V799-V808 HydrophobicContact CG2-CG2 4.48Å; L806-V808 HydrophobicContact CB-CG2 4.11Å; L806-V808 PolarHBondContact O-N 2.87Å; V808-W810 VanDerWaalsContact C-N 3.27Å; V808-W810 PolarHBondContact O-N 3.29Å; V808-M811 HydrophobicContact CG2-SD 4.36Å; V808-M811 PolarHBondContact O-N 3.2Å; V808-I816 HydrophobicContact CG1-CD1 4.25Å; V808-V850 HydrophobicContact CB-CG1 4.11Å; V808-V850 HydrophobicContact CG1-CG1 3.69Å; V808-F854 HydrophobicContact CG1-CD1 4.37Å; V808-F854 HydrophobicContact CG1-CE1 3.86Å; V808-Y855 HydrophobicContact CG1-CE1 3.71Å
809	K	92.1	Very high	79.7	Confident	26 Å²	26	46.8 Å²	46.8	11%	0.113	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-16.1	177.6	-73.7	-171	165.2	-164	0	115.1	P807 P844 Y845 M848 V850 F854	P807-K809 PolarHBondContact O-N 3.25Å; K809-P844 HydrophobicContact CB-CB 4.46Å; K809-P844 WeakPolarHBondContact CD-O 3.35Å; K809-P844 WeakPolarHBondContact CE-O 3.27Å; K809-P844 PolarHBondContact NZ-O 3.05Å; K809-Y845 HydrophobicContact CB-CD2 4.46Å; K809-Y845 HydrophobicContact CG-CD2 4.44Å; K809-Y845 PolarHBondContact NZ-O 2.99Å; K809-M848 VanDerWaalsContact CE-O 3.27Å; K809-M848 WeakPolarHBondContact CE-O 3.21Å; K809-M848 PolarHBondContact NZ-O 2.91Å; K809-V850 HydrophobicContact CD-CG2 4.4Å; K809-V850 HydrophobicContact CG-CG2 3.78Å; K809-F854 HydrophobicContact CG-CE2 4.21Å; K809-F854 HydrophobicContact CG-CZ 4.21Å
810	W	94.3	Very high	80	Confident	7 Å²	7	47.8 Å²	47.8	3%	0.027	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-20.1	176.9	-70.9	-100.4	0	0	0	113	A769 R771 P807 V808 W828 S829 I832 E836 P844	A769-W810 VanDerWaalsContact CB-CD1 3.5Å; A769-W810 HydrophobicContact CB-CD2 4.34Å; A769-W810 HydrophobicContact CB-CG 4.13Å; A769-W810 VanDerWaalsContact CB-NE1 3.34Å; R771-W810 VanDerWaalsContact NH1-CZ3 3.29Å; P807-W810 HydrophobicContact CB-CE3 4.3Å; P807-W810 PolarHBondContact O-N 3.09Å; V808-W810 VanDerWaalsContact C-N 3.27Å; V808-W810 PolarHBondContact O-N 3.29Å; W810-W828 VanDerWaalsContact O-CD1 3.29Å; W810-S829 WeakPolarHBondContact O-CA 3.46Å; W810-S829 PolarHBondContact O-OG 2.89Å; W810-I832 VanDerWaalsContact CD1-CG2 3.41Å; W810-I832 HydrophobicContact CD2-CG2 4.35Å; W810-I832 HydrophobicContact CG-CB 4.45Å; W810-I832 HydrophobicContact CG-CG2 3.89Å; W810-E836 WeakPolarHBondContact CZ2-OE1 3.37Å; W810-E836 PolarHBondContact NE1-OE2 3.03Å; W810-P844 HydrophobicContact CH2-CG 4.27Å; W810-P844 HydrophobicContact CZ2-CG 3.65Å
811	M	91.3	Very high	80.8	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.039	24%	0.242	C	C	.	.	S	Bend	trans	-73.9	148.2	-175.3	-63.3	170.9	64.6	0	0	112.5	L806 P807 V808 S815 I816 Y821 W828	L806-M811 HydrophobicContact CB-SD 3.79Å; L806-M811 HydrophobicContact CD1-CE 4.32Å; L806-M811 HydrophobicContact CD1-SD 4.49Å; P807-M811 HydrophobicContact CG-CG 4.17Å; P807-M811 HydrophobicContact CG-SD 4.39Å; P807-M811 PolarHBondContact O-N 3.29Å; V808-M811 HydrophobicContact CG2-SD 4.36Å; V808-M811 PolarHBondContact O-N 3.2Å; M811-S815 WeakPolarHBondContact CE-O 3.3Å; M811-I816 HydrophobicContact CB-CD1 4.14Å; M811-I816 HydrophobicContact CB-CG1 3.69Å; M811-I816 HydrophobicContact CE-CG1 4.33Å; M811-Y821 HydrophobicContact CE-CE1 4.26Å; M811-Y821 WeakPolarHBondContact CE-OH 3.3Å; M811-W828 PolarHBondContact O-NE1 3.49Å
812	S	93.3	Very high	81.9	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.			trans	-76.1	164.4	173.2	61.1	0	0	0	0	113	E814 S815 I816 S825	S812-E814 VanDerWaalsContact C-N 3.34Å; S812-E814 WeakPolarHBondContact CB-OE1 3.16Å; S812-E814 WeakPolarHBondContact CB-OE2 3.3Å; S812-E814 PolarHBondContact O-N 3.31Å; S812-E814 PolarHBondContact OG-OE1 3.24Å; S812-E814 PolarHBondContact OG-OE2 3.1Å; S812-S815 PolarHBondContact O-N 2.59Å; S812-S815 WeakPolarHBondContact OG-CB 3.41Å; S812-S815 PolarHBondContact OG-N 2.93Å; S812-S815 PolarHBondContact OG-OG 2.92Å; S812-I816 WeakPolarHBondContact O-CB 3.27Å; S812-I816 VanDerWaalsContact O-CG1 3.27Å; S812-I816 WeakPolarHBondContact O-CG1 3.32Å; S812-I816 PolarHBondContact O-N 3.37Å; S812-S825 VanDerWaalsContact OG-CB 3.31Å; S812-S825 WeakPolarHBondContact OG-CB 3Å
813	P	91.3	Very high	83	Confident	18 Å²	18	38.2 Å²	38.2	12%	0.117	20%	0.204	C	C	.	.	H	α-helix	trans	-55.1	-45.6	178.4	-26.4	35.9	0	0	0	112.7	I816 F817 W828 I858	P813-I816 CarbonylContact O-C 3.56Å; P813-I816 PolarHBondContact O-N 2.8Å; P813-I816 VanDerWaalsContact O-N 3.13Å; P813-F817 HydrophobicContact CB-CD2 4.28Å; P813-F817 HydrophobicContact CB-CE2 4.39Å; P813-F817 WeakPolarHBondContact O-CD2 3.43Å; P813-F817 PolarHBondContact O-N 3.42Å; P813-W828 HydrophobicContact CG-CE3 4.33Å; P813-W828 HydrophobicContact CG-CH2 3.59Å; P813-W828 HydrophobicContact CG-CZ2 4.23Å; P813-W828 HydrophobicContact CG-CZ3 3.65Å; P813-I858 HydrophobicContact CB-CG2 4.48Å; P813-I858 HydrophobicContact CG-CG2 4.04Å
814	E	88.9	Confident	84.8	Confident	21 Å²	21	32 Å²	32	10%	0.098	17%	0.17	C	C	.	.	H	α-helix	trans	-70.8	-31.8	179.9	71	-69.2	163.5	0	0	113.3	S812 I816 D818 C819 V820 P886 R889	S812-E814 VanDerWaalsContact C-N 3.34Å; S812-E814 WeakPolarHBondContact CB-OE1 3.16Å; S812-E814 WeakPolarHBondContact CB-OE2 3.3Å; S812-E814 PolarHBondContact O-N 3.31Å; S812-E814 PolarHBondContact OG-OE1 3.24Å; S812-E814 PolarHBondContact OG-OE2 3.1Å; E814-I816 VanDerWaalsContact C-N 3.31Å; E814-D818 CarbonylContact O-C 3.55Å; E814-D818 WeakPolarHBondContact O-CA 3.48Å; E814-D818 WeakPolarHBondContact O-CB 3.27Å; E814-D818 PolarHBondContact O-N 2.89Å; E814-D818 VanDerWaalsContact O-N 3.12Å; E814-C819 PolarHBondContact O-N 3.14Å; E814-V820 HydrophobicContact CG-CB 4.49Å; E814-V820 PolarHBondContact O-N 3.26Å; E814-V820 VanDerWaalsContact O-N 3.08Å; E814-P886 HydrophobicContact CG-CG 4.31Å; E814-R889 IonicContact OE1-CZ 3.41Å; E814-R889 IonicContact OE1-NH1 3.58Å; E814-R889 PolarHBondContact OE1-NH1 3.16Å; E814-R889 IonicContact OE1-NH2 3.89Å; E814-R889 IonicContact OE2-CZ 2.68Å; E814-R889 IonicContact OE2-NH1 3.78Å; E814-R889 PolarHBondContact OE2-NH1 3.35Å; E814-R889 IonicContact OE2-NH2 3.43Å; E814-R889 PolarHBondContact OE2-NH2 3.04Å
815	S	87.4	Confident	86.2	Confident	2 Å²	2	30 Å²	30	1%	0.014	15%	0.153	C	C	.	.	H	α-helix	trans	-69.8	-29.7	169	-68.7	0	0	0	0	112.5	M811 S812 V820 S825	M811-S815 WeakPolarHBondContact CE-O 3.3Å; S812-S815 PolarHBondContact O-N 2.59Å; S812-S815 WeakPolarHBondContact OG-CB 3.41Å; S812-S815 PolarHBondContact OG-N 2.93Å; S812-S815 PolarHBondContact OG-OG 2.92Å; S815-V820 WeakPolarHBondContact CA-O 3.44Å; S815-V820 WeakPolarHBondContact CB-O 3.18Å; S815-V820 PolarHBondContact N-O 3.16Å; S815-V820 PolarHBondContact OG-O 2.65Å; S815-S825 WeakPolarHBondContact OG-CB 2.98Å
816	I	84.3	Confident	87.4	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-76.2	-64.5	175.2	-69.1	168.8	0	0	0	109.9	R801 V808 M811 S812 P813 E814 Y855	R801-I816 PolarHBondContact NH1-O 3.37Å; R801-I816 PolarHBondContact NH2-O 3.17Å; V808-I816 HydrophobicContact CG1-CD1 4.25Å; M811-I816 HydrophobicContact CB-CD1 4.14Å; M811-I816 HydrophobicContact CB-CG1 3.69Å; M811-I816 HydrophobicContact CE-CG1 4.33Å; S812-I816 WeakPolarHBondContact O-CB 3.27Å; S812-I816 VanDerWaalsContact O-CG1 3.27Å; S812-I816 WeakPolarHBondContact O-CG1 3.32Å; S812-I816 PolarHBondContact O-N 3.37Å; P813-I816 CarbonylContact O-C 3.56Å; P813-I816 PolarHBondContact O-N 2.8Å; P813-I816 VanDerWaalsContact O-N 3.13Å; E814-I816 VanDerWaalsContact C-N 3.31Å; I816-Y855 HydrophobicContact CG2-CD1 3.77Å; I816-Y855 HydrophobicContact CG2-CE1 3.72Å
817	F	83.8	Confident	88.3	Confident	62 Å²	62	24.1 Å²	24.1	27%	0.272	13%	0.129	S	C	.	.	H	α-helix	trans	-78.2	-42.7	-167.3	-59.7	-64.7	0	0	0	112.3	P813 Y855 I858 Q859	P813-F817 HydrophobicContact CB-CD2 4.28Å; P813-F817 HydrophobicContact CB-CE2 4.39Å; P813-F817 WeakPolarHBondContact O-CD2 3.43Å; P813-F817 PolarHBondContact O-N 3.42Å; F817-Y855 HydrophobicContact CE1-CD1 4.14Å; F817-Y855 HydrophobicContact CZ-CD1 4.22Å; F817-I858 HydrophobicContact CE2-CG2 4.37Å; F817-Q859 HydrophobicContact CD2-CG 4.33Å; F817-Q859 HydrophobicContact CE1-CG 4.05Å; F817-Q859 HydrophobicContact CE2-CG 3.56Å; F817-Q859 HydrophobicContact CZ-CG 3.42Å; F817-Q859 VanDerWaalsContact CZ-CG 3.42Å
818	D	79.6	Confident	88.8	Confident	112 Å²	112	23.9 Å²	23.9	60%	0.599	13%	0.127	S	C	*	.	S	Bend	trans	-103.7	-4	-171.3	-44.8	-66.5	0	0	0	113.3	E814 V820	E814-D818 CarbonylContact O-C 3.55Å; E814-D818 WeakPolarHBondContact O-CA 3.48Å; E814-D818 WeakPolarHBondContact O-CB 3.27Å; E814-D818 PolarHBondContact O-N 2.89Å; E814-D818 VanDerWaalsContact O-N 3.12Å; D818-V820 HydrophobicContact CB-CG2 3.93Å; D818-V820 PolarHBondContact O-N 2.83Å
819	C	77.8	Confident	89.2	Confident	81 Å²	81	24.2 Å²	24.2	55%	0.547	13%	0.129	S	C	.	.			trans	60	21.4	-176	-60.4	0	0	0	0	114.9	E814 Y821	E814-C819 PolarHBondContact O-N 3.14Å; C819-Y821 VanDerWaalsContact O-CD2 3.23Å; C819-Y821 WeakPolarHBondContact O-CD2 3.17Å; C819-Y821 VanDerWaalsContact O-CE2 3.31Å; C819-Y821 WeakPolarHBondContact O-CE2 3.12Å
820	V	79.1	Confident	89.5	Confident	59 Å²	59	23 Å²	23	36%	0.358	12%	0.124	S	C	.	.			trans	-85.2	132.8	-179.4	-178.5	0	0	0	0	110.3	E814 S815 D818 T822	E814-V820 HydrophobicContact CG-CB 4.49Å; E814-V820 PolarHBondContact O-N 3.26Å; E814-V820 VanDerWaalsContact O-N 3.08Å; S815-V820 WeakPolarHBondContact CA-O 3.44Å; S815-V820 WeakPolarHBondContact CB-O 3.18Å; S815-V820 PolarHBondContact N-O 3.16Å; S815-V820 PolarHBondContact OG-O 2.65Å; D818-V820 HydrophobicContact CB-CG2 3.93Å; D818-V820 PolarHBondContact O-N 2.83Å; V820-T822 HydrophobicContact CG1-CG2 3.69Å
821	Y	81.6	Confident	89.6	Confident	21 Å²	21	22.6 Å²	22.6	8%	0.082	12%	0.123	C	C	.	.			trans	-123.3	124.9	177.2	-63	-98	0	0	0	110	Y570 I764 R766 M811 C819	Y570-Y821 PolarHBondContact OH-O 3.09Å; I764-Y821 WeakPolarHBondContact CD1-O 3.21Å; R766-Y821 HydrophobicContact CB-CD1 3.9Å; R766-Y821 HydrophobicContact CB-CE1 4.27Å; R766-Y821 HydrophobicContact CG-CD1 3.71Å; R766-Y821 HydrophobicContact CG-CG 4.09Å; R766-Y821 VanDerWaalsContact NE-CD1 3.27Å; M811-Y821 HydrophobicContact CE-CE1 4.26Å; M811-Y821 WeakPolarHBondContact CE-OH 3.3Å; C819-Y821 VanDerWaalsContact O-CD2 3.23Å; C819-Y821 WeakPolarHBondContact O-CD2 3.17Å; C819-Y821 VanDerWaalsContact O-CE2 3.31Å; C819-Y821 WeakPolarHBondContact O-CE2 3.12Å
822	T	86.1	Confident	90	Very high	7 Å²	7	22.2 Å²	22.2	4%	0.043	12%	0.121	C	C	.	.			trans	-140.6	174.9	-173.6	80.3	0	0	0	0	111.1	Y568 V820 E824 S825 D826	Y568-T822 HydrophobicContact CD2-CG2 3.85Å; Y568-T822 HydrophobicContact CE2-CG2 3.3Å; V820-T822 HydrophobicContact CG1-CG2 3.69Å; T822-E824 WeakPolarHBondContact CB-OE2 3.16Å; T822-E824 PolarHBondContact O-N 2.89Å; T822-E824 WeakPolarHBondContact OG1-CB 3.42Å; T822-E824 PolarHBondContact OG1-N 3.07Å; T822-E824 VanDerWaalsContact OG1-N 3.1Å; T822-E824 PolarHBondContact OG1-OE2 3.34Å; T822-S825 PolarHBondContact N-OG 3.14Å; T822-S825 WeakPolarHBondContact O-CB 3.39Å; T822-S825 PolarHBondContact O-N 3.07Å; T822-S825 VanDerWaalsContact O-N 3.13Å; T822-S825 PolarHBondContact O-OG 3.1Å; T822-S825 PolarHBondContact OG1-N 2.89Å; T822-D826 PolarHBondContact O-N 3.07Å
823	F	88.6	Confident	90.2	Very high	28 Å²	28	22.2 Å²	22.2	12%	0.123	12%	0.121	C	C	.	.	H	α-helix	trans	-59.6	-36.4	171.7	-50.8	-58	0	0	0	112	I560 Y568 T759 I764 S825 D826 V827	I560-F823 HydrophobicContact CD1-CE1 3.64Å; I560-F823 HydrophobicContact CD1-CE2 3.9Å; I560-F823 HydrophobicContact CD1-CZ 3.27Å; Y568-F823 HydrophobicContact CE1-CD2 4.47Å; Y568-F823 HydrophobicContact CE1-CE2 4.35Å; T759-F823 HydrophobicContact CG2-CB 4.35Å; T759-F823 HydrophobicContact CG2-CD1 3.81Å; T759-F823 HydrophobicContact CG2-CD2 4.38Å; T759-F823 HydrophobicContact CG2-CE1 4.11Å; T759-F823 HydrophobicContact CG2-CG 3.94Å; I764-F823 HydrophobicContact CG1-CD1 3.96Å; I764-F823 HydrophobicContact CG1-CE1 4.07Å; F823-S825 VanDerWaalsContact C-N 3.27Å; F823-S825 PolarHBondContact O-N 3.14Å; F823-D826 WeakPolarHBondContact O-CB 3.47Å; F823-D826 PolarHBondContact O-N 2.64Å; F823-V827 WeakPolarHBondContact O-CG2 3.47Å; F823-V827 PolarHBondContact O-N 3.2Å
824	E	93.7	Very high	90.5	Very high	42 Å²	42	21.4 Å²	21.4	20%	0.196	12%	0.115	C	C	.	.	H	α-helix	trans	-68.5	-24.7	178.2	-55.7	68.2	-143.4	0	0	112.2	Y568 T822 W828 P886 R889	Y568-E824 PolarHBondContact OH-OE2 3.14Å; T822-E824 WeakPolarHBondContact CB-OE2 3.16Å; T822-E824 PolarHBondContact O-N 2.89Å; T822-E824 WeakPolarHBondContact OG1-CB 3.42Å; T822-E824 PolarHBondContact OG1-N 3.07Å; T822-E824 VanDerWaalsContact OG1-N 3.1Å; T822-E824 PolarHBondContact OG1-OE2 3.34Å; E824-W828 PolarHBondContact O-N 3.2Å; E824-P886 HydrophobicContact CB-CB 3.75Å; E824-P886 HydrophobicContact CG-CB 4.16Å; E824-P886 WeakPolarHBondContact CG-O 3.42Å; E824-R889 WeakPolarHBondContact O-CD 3.1Å; E824-R889 PolarHBondContact O-NH1 2.89Å
825	S	92.1	Very high	90.9	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.014	11%	0.113	C	C	.	.	H	α-helix	trans	-75.5	-34.1	171.1	75.3	0	0	0	0	112.7	S812 S815 T822 F823 S829	S812-S825 VanDerWaalsContact OG-CB 3.31Å; S812-S825 WeakPolarHBondContact OG-CB 3Å; S815-S825 WeakPolarHBondContact OG-CB 2.98Å; T822-S825 PolarHBondContact N-OG 3.14Å; T822-S825 WeakPolarHBondContact O-CB 3.39Å; T822-S825 PolarHBondContact O-N 3.07Å; T822-S825 VanDerWaalsContact O-N 3.13Å; T822-S825 PolarHBondContact O-OG 3.1Å; T822-S825 PolarHBondContact OG1-N 2.89Å; F823-S825 VanDerWaalsContact C-N 3.27Å; F823-S825 PolarHBondContact O-N 3.14Å; S825-S829 PolarHBondContact O-N 3.34Å; S825-S829 VanDerWaalsContact O-N 3.11Å; S825-S829 PolarHBondContact O-OG 3.23Å
826	D	94.6	Very high	91.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-70	-35.3	169.9	-84.7	-13.1	0	0	0	111.1	M755 I764 H765 R766 T822 F823 S829 Y830 F892	M755-D826 HydrophobicContact CE-CB 3.88Å; M755-D826 WeakPolarHBondContact CE-OD2 3.46Å; I764-D826 WeakPolarHBondContact CA-OD2 3.38Å; I764-D826 WeakPolarHBondContact CG2-OD2 3.25Å; H765-D826 PolarHBondContact N-OD2 3.22Å; R766-D826 PolarHBondContact N-OD1 2.96Å; T822-D826 PolarHBondContact O-N 3.07Å; F823-D826 WeakPolarHBondContact O-CB 3.47Å; F823-D826 PolarHBondContact O-N 2.64Å; D826-S829 CarbonylContact O-C 3.5Å; D826-S829 WeakPolarHBondContact O-CB 3.3Å; D826-S829 PolarHBondContact O-N 2.87Å; D826-Y830 PolarHBondContact O-N 2.83Å; D826-F892 HydrophobicContact CB-CE2 3.96Å; D826-F892 HydrophobicContact CB-CZ 4.15Å
827	V	97.9	Very high	92	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.024	11%	0.112	C	C	.	.	H	α-helix	trans	-61	-43.2	173.4	167.1	0	0	0	0	111.6	F823 S829 Y830 G831 C881 R889 P890 F892 L895	F823-V827 WeakPolarHBondContact O-CG2 3.47Å; F823-V827 PolarHBondContact O-N 3.2Å; V827-S829 VanDerWaalsContact C-N 3.33Å; V827-Y830 WeakPolarHBondContact O-CB 3.46Å; V827-Y830 PolarHBondContact O-N 3.43Å; V827-G831 PolarHBondContact O-N 2.99Å; V827-C881 HydrophobicContact CG1-CB 4.14Å; V827-C881 WeakPolarHBondContact O-CB 3.28Å; V827-R889 HydrophobicContact CG1-CB 3.87Å; V827-P890 HydrophobicContact CG1-CG 4.36Å; V827-P890 WeakPolarHBondContact CG1-O 3.42Å; V827-P890 WeakPolarHBondContact CG2-O 3.23Å; V827-F892 HydrophobicContact CB-CE2 4.48Å; V827-F892 HydrophobicContact CB-CZ 4.44Å; V827-F892 HydrophobicContact CG2-CD2 3.84Å; V827-F892 HydrophobicContact CG2-CE1 4.4Å; V827-F892 HydrophobicContact CG2-CE2 3.55Å; V827-F892 HydrophobicContact CG2-CG 4.39Å; V827-F892 HydrophobicContact CG2-CZ 3.86Å; V827-L895 HydrophobicContact CG1-CD1 4.15Å; V827-L895 HydrophobicContact CG2-CD1 4.4Å
828	W	97.8	Very high	92.6	Very high	1 Å²	1	18 Å²	18	0%	0.004	10%	0.1	C	C	.	.	H	α-helix	trans	-59.4	-46.1	172.2	175.1	-72.6	0	0	0	111.2	W810 M811 P813 E824 Y830 G831 I832 R863 C881 W882	W810-W828 VanDerWaalsContact O-CD1 3.29Å; M811-W828 PolarHBondContact O-NE1 3.49Å; P813-W828 HydrophobicContact CG-CE3 4.33Å; P813-W828 HydrophobicContact CG-CH2 3.59Å; P813-W828 HydrophobicContact CG-CZ2 4.23Å; P813-W828 HydrophobicContact CG-CZ3 3.65Å; E824-W828 PolarHBondContact O-N 3.2Å; W828-Y830 VanDerWaalsContact C-N 3.29Å; W828-Y830 PolarHBondContact O-N 3.15Å; W828-G831 WeakPolarHBondContact O-CA 3.47Å; W828-G831 PolarHBondContact O-N 3.45Å; W828-I832 PolarHBondContact O-N 3.05Å; W828-I832 VanDerWaalsContact O-N 3.13Å; W828-R863 VanDerWaalsContact CH2-CZ 3.46Å; W828-C881 WeakPolarHBondContact CA-O 3.4Å; W828-W882 HydrophobicContact CD2-CB 4.46Å; W828-W882 AromaticContact CD2-CD1 3.79Å; W828-W882 HydrophobicContact CD2-CG 4.48Å; W828-W882 AromaticContact CE2-CD1 3.94Å; W828-W882 VanDerWaalsContact CE3-CA 3.48Å; W828-W882 HydrophobicContact CE3-CB 4.03Å; W828-W882 HydrophobicContact CH2-CB 4.19Å; W828-W882 HydrophobicContact CZ3-CB 3.88Å; W828-W882 WeakPolarHBondContact CZ3-O 3.47Å; W828-W882 PolarHBondContact O-NE1 2.71Å
829	S	97.3	Very high	93.4	Very high	6 Å²	6	12.9 Å²	12.9	4%	0.042	7%	0.073	C	C	.	.	H	α-helix	trans	-60.5	-37.8	178.1	-54.3	0	0	0	0	112	W810 S825 D826 V827 I832 L833	W810-S829 WeakPolarHBondContact O-CA 3.46Å; W810-S829 PolarHBondContact O-OG 2.89Å; S825-S829 PolarHBondContact O-N 3.34Å; S825-S829 VanDerWaalsContact O-N 3.11Å; S825-S829 PolarHBondContact O-OG 3.23Å; D826-S829 CarbonylContact O-C 3.5Å; D826-S829 WeakPolarHBondContact O-CB 3.3Å; D826-S829 PolarHBondContact O-N 2.87Å; V827-S829 VanDerWaalsContact C-N 3.33Å; S829-I832 WeakPolarHBondContact O-CB 3.44Å; S829-I832 PolarHBondContact O-N 3.24Å; S829-L833 PolarHBondContact O-N 2.67Å
830	Y	98.3	Very high	94.1	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-63.6	-39.4	172.2	173.1	-99.9	0	0	0	112.3	S748 V751 A752 D826 V827 W828 I832 L833 L834 F892 L895	S748-Y830 PolarHBondContact O-OH 3.12Å; V751-Y830 HydrophobicContact CB-CE2 4.27Å; V751-Y830 HydrophobicContact CG1-CD2 3.9Å; V751-Y830 HydrophobicContact CG1-CE2 4.01Å; A752-Y830 HydrophobicContact CB-CE2 4.18Å; D826-Y830 PolarHBondContact O-N 2.83Å; V827-Y830 WeakPolarHBondContact O-CB 3.46Å; V827-Y830 PolarHBondContact O-N 3.43Å; W828-Y830 VanDerWaalsContact C-N 3.29Å; W828-Y830 PolarHBondContact O-N 3.15Å; Y830-I832 VanDerWaalsContact C-N 3.29Å; Y830-I832 PolarHBondContact O-N 2.64Å; Y830-L833 HydrophobicContact CD2-CD2 4.47Å; Y830-L833 WeakPolarHBondContact O-CB 3.45Å; Y830-L833 PolarHBondContact O-N 3.41Å; Y830-L833 VanDerWaalsContact O-N 3.15Å; Y830-L834 HydrophobicContact CD1-CD1 4.08Å; Y830-L834 HydrophobicContact CD1-CG 4.27Å; Y830-L834 HydrophobicContact CE1-CD1 3.51Å; Y830-L834 HydrophobicContact CE1-CD2 4.24Å; Y830-L834 HydrophobicContact CE1-CG 3.82Å; Y830-L834 HydrophobicContact CE2-CD2 4.25Å; Y830-L834 HydrophobicContact CE2-CG 4.32Å; Y830-L834 WeakPolarHBondContact O-CG 3.36Å; Y830-L834 PolarHBondContact O-N 3.12Å; Y830-F892 HydrophobicContact CD1-CE1 4.22Å; Y830-F892 HydrophobicContact CD2-CE1 4.12Å; Y830-F892 AromaticContact CG-CE1 3.74Å; Y830-F892 HydrophobicContact CG-CE1 3.74Å; Y830-L895 HydrophobicContact CD1-CD1 3.72Å; Y830-L895 HydrophobicContact CE1-CB 4.26Å; Y830-L895 HydrophobicContact CE1-CD1 3.87Å; Y830-L895 HydrophobicContact CE1-CD2 4.15Å; Y830-L895 HydrophobicContact CE1-CG 4.33Å
831	G	97.9	Very high	94.8	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-58.5	-39.9	171.3	0	0	0	0	0	112.7	V827 W828 L834 W835 W882	V827-G831 PolarHBondContact O-N 2.99Å; W828-G831 WeakPolarHBondContact O-CA 3.47Å; W828-G831 PolarHBondContact O-N 3.45Å; G831-L834 PolarHBondContact O-N 2.91Å; G831-W835 PolarHBondContact O-N 3.41Å; G831-W882 VanDerWaalsContact C-NE1 3.34Å; G831-W882 VanDerWaalsContact O-CZ2 3.24Å; G831-W882 WeakPolarHBondContact O-CZ2 3.37Å
832	I	97.9	Very high	95.3	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-67.3	-40.1	174.2	-54.9	-68.4	0	0	0	111.2	W810 W828 S829 Y830 W835 E836 P844 Y845 M864 W882	W810-I832 VanDerWaalsContact CD1-CG2 3.41Å; W810-I832 HydrophobicContact CD2-CG2 4.35Å; W810-I832 HydrophobicContact CG-CB 4.45Å; W810-I832 HydrophobicContact CG-CG2 3.89Å; W828-I832 PolarHBondContact O-N 3.05Å; W828-I832 VanDerWaalsContact O-N 3.13Å; S829-I832 WeakPolarHBondContact O-CB 3.44Å; S829-I832 PolarHBondContact O-N 3.24Å; Y830-I832 VanDerWaalsContact C-N 3.29Å; Y830-I832 PolarHBondContact O-N 2.64Å; I832-W835 WeakPolarHBondContact O-CB 3.46Å; I832-W835 PolarHBondContact O-N 2.77Å; I832-W835 VanDerWaalsContact O-N 3.13Å; I832-E836 PolarHBondContact O-N 3.5Å; I832-P844 HydrophobicContact CG2-CB 3.8Å; I832-P844 HydrophobicContact CG2-CG 3.46Å; I832-P844 VanDerWaalsContact CG2-CG 3.46Å; I832-Y845 HydrophobicContact CD1-CE2 4Å; I832-M864 HydrophobicContact CD1-CE 3.56Å; I832-W882 HydrophobicContact CD1-CZ2 3.86Å
833	L	97.9	Very high	95.5	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-63.1	-40.5	175.9	-179.8	158.8	0	0	0	112.2	V751 L768 V773 S829 Y830 W835 E836 I837	V751-L833 HydrophobicContact CB-CD2 4.43Å; V751-L833 HydrophobicContact CG1-CD1 3.9Å; V751-L833 HydrophobicContact CG1-CD2 4.03Å; V751-L833 HydrophobicContact CG2-CD2 4.46Å; L768-L833 HydrophobicContact CD1-CD1 3.75Å; L768-L833 HydrophobicContact CG-CD1 3.87Å; V773-L833 HydrophobicContact CG2-CD1 3.96Å; S829-L833 PolarHBondContact O-N 2.67Å; Y830-L833 HydrophobicContact CD2-CD2 4.47Å; Y830-L833 WeakPolarHBondContact O-CB 3.45Å; Y830-L833 PolarHBondContact O-N 3.41Å; Y830-L833 VanDerWaalsContact O-N 3.15Å; L833-W835 VanDerWaalsContact C-N 3.27Å; L833-W835 PolarHBondContact O-N 3.06Å; L833-E836 WeakPolarHBondContact O-CB 3.24Å; L833-E836 PolarHBondContact O-N 3.15Å; L833-E836 VanDerWaalsContact O-N 3.14Å; L833-I837 HydrophobicContact CD2-CD1 3.59Å; L833-I837 HydrophobicContact CD2-CG1 4.22Å; L833-I837 WeakPolarHBondContact O-CG1 3.39Å; L833-I837 PolarHBondContact O-N 2.86Å
834	L	97.9	Very high	95.7	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-58.3	-41.2	171.1	-73.9	-179.9	0	0	0	111.4	S748 Y830 G831 I837 F838 M874 M877 M878	S748-L834 WeakPolarHBondContact OG-CD2 3.16Å; Y830-L834 HydrophobicContact CD1-CD1 4.08Å; Y830-L834 HydrophobicContact CD1-CG 4.27Å; Y830-L834 HydrophobicContact CE1-CD1 3.51Å; Y830-L834 HydrophobicContact CE1-CD2 4.24Å; Y830-L834 HydrophobicContact CE1-CG 3.82Å; Y830-L834 HydrophobicContact CE2-CD2 4.25Å; Y830-L834 HydrophobicContact CE2-CG 4.32Å; Y830-L834 WeakPolarHBondContact O-CG 3.36Å; Y830-L834 PolarHBondContact O-N 3.12Å; G831-L834 PolarHBondContact O-N 2.91Å; L834-I837 PolarHBondContact O-N 3.24Å; L834-F838 HydrophobicContact CD2-CE2 4.47Å; L834-F838 WeakPolarHBondContact O-CD2 3.42Å; L834-F838 PolarHBondContact O-N 3.29Å; L834-M874 HydrophobicContact CD1-SD 3.79Å; L834-M874 HydrophobicContact CD2-SD 3.78Å; L834-M874 HydrophobicContact CG-SD 4.35Å; L834-M877 HydrophobicContact CD1-SD 4.3Å; L834-M878 HydrophobicContact CB-CE 4.06Å; L834-M878 HydrophobicContact CB-CG 3.85Å; L834-M878 HydrophobicContact CB-SD 4.38Å; L834-M878 HydrophobicContact CD1-CG 4.12Å
835	W	97.9	Very high	95.6	Very high	11 Å²	11	7.5 Å²	7.5	4%	0.042	4%	0.043	C	C	.	.	H	α-helix	trans	-65	-37.5	175.1	-165.1	98.2	0	0	0	112.1	G831 I832 L833 S839 N842 S843 P844 P846 M864 S865 P867 M878 W882	G831-W835 PolarHBondContact O-N 3.41Å; I832-W835 WeakPolarHBondContact O-CB 3.46Å; I832-W835 PolarHBondContact O-N 2.77Å; I832-W835 VanDerWaalsContact O-N 3.13Å; L833-W835 VanDerWaalsContact C-N 3.27Å; L833-W835 PolarHBondContact O-N 3.06Å; W835-S839 WeakPolarHBondContact CZ3-OG 3.37Å; W835-S839 WeakPolarHBondContact O-CB 3.24Å; W835-S839 PolarHBondContact O-N 3.5Å; W835-S839 VanDerWaalsContact O-N 3.1Å; W835-S839 PolarHBondContact O-OG 3.42Å; W835-N842 HydrophobicContact CH2-CB 4.07Å; W835-N842 HydrophobicContact CZ3-CB 3.89Å; W835-S843 WeakPolarHBondContact CZ3-O 3.34Å; W835-P844 HydrophobicContact CE3-CG 4.5Å; W835-P846 HydrophobicContact CH2-CG 3.97Å; W835-P846 HydrophobicContact CZ2-CG 4.26Å; W835-M864 HydrophobicContact CB-CE 3.77Å; W835-M864 HydrophobicContact CD2-CE 3.87Å; W835-M864 HydrophobicContact CD2-SD 3.7Å; W835-M864 HydrophobicContact CE3-CE 4.42Å; W835-M864 HydrophobicContact CE3-SD 4.1Å; W835-M864 HydrophobicContact CG-CE 3.54Å; W835-M864 HydrophobicContact CG-SD 3.99Å; W835-M864 HydrophobicContact CZ2-SD 4.26Å; W835-S865 PolarHBondContact NE1-O 3.13Å; W835-P867 HydrophobicContact CD2-CB 4.4Å; W835-P867 HydrophobicContact CG-CB 4.39Å; W835-P867 HydrophobicContact CG-CG 4.2Å; W835-M878 HydrophobicContact CB-SD 4.03Å; W835-M878 HydrophobicContact CG-SD 4.49Å; W835-W882 HydrophobicContact CB-CH2 4.23Å; W835-W882 HydrophobicContact CB-CZ2 4.19Å; W835-W882 AromaticContact CD1-CH2 3.97Å; W835-W882 HydrophobicContact CG-CH2 4.37Å
836	E	97.6	Very high	95.4	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-61.4	-42.7	170.9	-68.3	-175.5	96.6	0	0	112.2	A770 W810 I832 L833 S839 L840 G841 P844	A770-E836 HydrophobicContact CB-CB 3.82Å; A770-E836 HydrophobicContact CB-CG 4.35Å; A770-E836 WeakPolarHBondContact CB-OE2 3.36Å; A770-E836 PolarHBondContact N-OE2 3.34Å; W810-E836 WeakPolarHBondContact CZ2-OE1 3.37Å; W810-E836 PolarHBondContact NE1-OE2 3.03Å; I832-E836 PolarHBondContact O-N 3.5Å; L833-E836 WeakPolarHBondContact O-CB 3.24Å; L833-E836 PolarHBondContact O-N 3.15Å; L833-E836 VanDerWaalsContact O-N 3.14Å; E836-S839 PolarHBondContact O-OG 2.9Å; E836-L840 PolarHBondContact O-N 2.84Å; E836-G841 WeakPolarHBondContact O-CA 3.28Å; E836-G841 PolarHBondContact O-N 3.06Å; E836-P844 HydrophobicContact CG-CG 3.9Å
837	I	97.3	Very high	95	Very high	0 Å²	0	16 Å²	16	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-58.3	178.4	-70.7	175.4	0	0	0	110.7	L678 L682 L744 F747 L833 L834 S839 L840	L678-I837 HydrophobicContact CD2-CD1 4.15Å; L678-I837 HydrophobicContact CD2-CG1 4.08Å; L682-I837 HydrophobicContact CD1-CG1 4.4Å; L744-I837 HydrophobicContact CB-CG2 3.78Å; L744-I837 HydrophobicContact CD2-CG2 3.81Å; L744-I837 HydrophobicContact CG-CG2 4.31Å; F747-I837 HydrophobicContact CB-CD1 4.01Å; L833-I837 HydrophobicContact CD2-CD1 3.59Å; L833-I837 HydrophobicContact CD2-CG1 4.22Å; L833-I837 WeakPolarHBondContact O-CG1 3.39Å; L833-I837 PolarHBondContact O-N 2.86Å; L834-I837 PolarHBondContact O-N 3.24Å; I837-S839 PolarHBondContact O-N 3.27Å; I837-L840 PolarHBondContact O-N 3.49Å
838	F	96.3	Very high	94.3	Very high	3 Å²	3	19 Å²	19	1%	0.013	13%	0.13	C	C	.	.	H	α-helix	trans	-79.7	0.8	-173.9	-70	-79.3	0	0	0	114.6	L744 L745 S748 L834 P867 F869 A870 M874 M878	L744-F838 HydrophobicContact CB-CD1 4.03Å; L744-F838 HydrophobicContact CB-CE1 3.47Å; L744-F838 VanDerWaalsContact CB-CE1 3.47Å; L744-F838 HydrophobicContact CB-CZ 3.78Å; L744-F838 HydrophobicContact CD1-CD1 3.8Å; L744-F838 HydrophobicContact CD1-CE1 4Å; L744-F838 HydrophobicContact CG-CE1 4.4Å; L745-F838 HydrophobicContact CD2-CZ 4.01Å; L745-F838 HydrophobicContact CG-CZ 4.29Å; S748-F838 VanDerWaalsContact OG-CE2 3.32Å; S748-F838 WeakPolarHBondContact OG-CE2 3.44Å; L834-F838 HydrophobicContact CD2-CE2 4.47Å; L834-F838 WeakPolarHBondContact O-CD2 3.42Å; L834-F838 PolarHBondContact O-N 3.29Å; F838-P867 HydrophobicContact CB-CB 4.48Å; F838-P867 HydrophobicContact CB-CG 3.82Å; F838-F869 WeakPolarHBondContact CD1-O 3.27Å; F838-F869 WeakPolarHBondContact O-CD2 3.47Å; F838-F869 PolarHBondContact O-N 2.92Å; F838-A870 HydrophobicContact CB-CB 3.71Å; F838-A870 HydrophobicContact CD1-CB 4.29Å; F838-A870 HydrophobicContact CG-CB 3.94Å; F838-M874 HydrophobicContact CD2-CG 3.84Å; F838-M874 HydrophobicContact CE2-CE 3.84Å; F838-M874 HydrophobicContact CE2-CG 3.51Å; F838-M874 HydrophobicContact CE2-SD 4.02Å; F838-M874 HydrophobicContact CZ-CE 3.95Å; F838-M874 HydrophobicContact CZ-CG 4.07Å; F838-M878 HydrophobicContact CB-CE 4.39Å; F838-M878 HydrophobicContact CD2-CE 4.14Å
839	S	95.1	Very high	93.7	Very high	5 Å²	5	27.3 Å²	27.3	4%	0.035	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	13.2	164.3	68.1	0	0	0	0	113.1	R686 W835 E836 I837 G841 N842	R686-S839 PolarHBondContact NH2-O 3.2Å; W835-S839 WeakPolarHBondContact CZ3-OG 3.37Å; W835-S839 WeakPolarHBondContact O-CB 3.24Å; W835-S839 PolarHBondContact O-N 3.5Å; W835-S839 VanDerWaalsContact O-N 3.1Å; W835-S839 PolarHBondContact O-OG 3.42Å; E836-S839 PolarHBondContact O-OG 2.9Å; I837-S839 PolarHBondContact O-N 3.27Å; S839-G841 PolarHBondContact O-N 3.29Å; S839-N842 PolarHBondContact O-N 3.26Å; S839-N842 PolarHBondContact O-ND2 3.17Å; S839-N842 PolarHBondContact OG-N 3.4Å
840	L	94.1	Very high	93	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	38.1	-179	-55.9	176.5	0	0	0	112.8	L682 R686 F689 L739 L744 E836 I837 F869	L682-L840 HydrophobicContact CD2-CD2 4.38Å; R686-L840 HydrophobicContact CB-CB 4.45Å; R686-L840 HydrophobicContact CG-CB 4.27Å; R686-L840 HydrophobicContact CG-CD1 4.05Å; R686-L840 PolarHBondContact NE-O 3.39Å; R686-L840 PolarHBondContact NH2-O 3.45Å; F689-L840 HydrophobicContact CB-CD1 4.22Å; F689-L840 HydrophobicContact CD1-CD1 3.78Å; F689-L840 HydrophobicContact CD2-CD2 4.27Å; F689-L840 HydrophobicContact CE1-CD1 4.33Å; F689-L840 HydrophobicContact CE2-CD2 4.49Å; F689-L840 HydrophobicContact CG-CD1 4.01Å; F689-L840 HydrophobicContact CG-CD2 4.35Å; L739-L840 HydrophobicContact CD2-CD2 3.87Å; L744-L840 HydrophobicContact CD1-CD2 4.05Å; L744-L840 HydrophobicContact CD2-CD2 3.99Å; E836-L840 PolarHBondContact O-N 2.84Å; I837-L840 PolarHBondContact O-N 3.49Å; L840-F869 HydrophobicContact CD1-CD2 3.78Å; L840-F869 HydrophobicContact CD1-CE2 3.52Å; L840-F869 HydrophobicContact CD1-CZ 4.24Å; L840-F869 HydrophobicContact CG-CD2 3.79Å; L840-F869 HydrophobicContact CG-CE2 3.93Å
841	G	92.9	Very high	92.4	Very high	0 Å²	0	30 Å²	30	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	85.8	26.9	177.6	0	0	0	0	0	116.1	R683 E836 S839	R683-G841 PolarHBondContact NE-O 3.44Å; R683-G841 PolarHBondContact NH2-O 3.18Å; E836-G841 WeakPolarHBondContact O-CA 3.28Å; E836-G841 PolarHBondContact O-N 3.06Å; S839-G841 PolarHBondContact O-N 3.29Å
842	N	91.8	Very high	91.7	Very high	63 Å²	63	35.2 Å²	35.2	34%	0.337	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-66.2	156.6	168	-74.1	-24.7	0	0	0	111	R686 W835 S839	R686-N842 VanDerWaalsContact CZ-OD1 3.29Å; R686-N842 PolarHBondContact NH1-OD1 3.12Å; R686-N842 PolarHBondContact NH2-OD1 3.11Å; W835-N842 HydrophobicContact CH2-CB 4.07Å; W835-N842 HydrophobicContact CZ3-CB 3.89Å; S839-N842 PolarHBondContact O-N 3.26Å; S839-N842 PolarHBondContact O-ND2 3.17Å; S839-N842 PolarHBondContact OG-N 3.4Å
843	S	89.9	Confident	91.2	Very high	49 Å²	49	38.6 Å²	38.6	34%	0.343	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-67.9	132.9	169.3	173.9	0	0	0	0	109.6	W835	W835-S843 WeakPolarHBondContact CZ3-O 3.34Å
844	P	93.7	Very high	90.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-52.2	149.7	167.8	-27.5	36.3	0	0	0	111.9	K809 W810 I832 W835 E836 M864	K809-P844 HydrophobicContact CB-CB 4.46Å; K809-P844 WeakPolarHBondContact CD-O 3.35Å; K809-P844 WeakPolarHBondContact CE-O 3.27Å; K809-P844 PolarHBondContact NZ-O 3.05Å; W810-P844 HydrophobicContact CH2-CG 4.27Å; W810-P844 HydrophobicContact CZ2-CG 3.65Å; I832-P844 HydrophobicContact CG2-CB 3.8Å; I832-P844 HydrophobicContact CG2-CG 3.46Å; I832-P844 VanDerWaalsContact CG2-CG 3.46Å; W835-P844 HydrophobicContact CE3-CG 4.5Å; E836-P844 HydrophobicContact CG-CG 3.9Å; P844-M864 HydrophobicContact CB-CE 4.2Å; P844-M864 HydrophobicContact CB-SD 3.91Å
845	Y	92.2	Very high	90.4	Very high	12 Å²	12	40.8 Å²	40.8	5%	0.047	26%	0.264	C	S	.	.	S	Bend	trans	47	65.6	-174.5	-55.7	-89.4	0	0	0	111.2	K809 I832 M848 F854 M857 I858 M864	K809-Y845 HydrophobicContact CB-CD2 4.46Å; K809-Y845 HydrophobicContact CG-CD2 4.44Å; K809-Y845 PolarHBondContact NZ-O 2.99Å; I832-Y845 HydrophobicContact CD1-CE2 4Å; Y845-M848 PolarHBondContact O-N 3.05Å; Y845-F854 HydrophobicContact CD1-CE2 4.13Å; Y845-F854 AromaticContact CD2-CE2 3.72Å; Y845-F854 HydrophobicContact CD2-CE2 3.72Å; Y845-F854 HydrophobicContact CD2-CZ 4.21Å; Y845-F854 HydrophobicContact CE1-CE2 4.47Å; Y845-F854 HydrophobicContact CE2-CE2 4.11Å; Y845-F854 HydrophobicContact CE2-CZ 4.22Å; Y845-F854 AromaticContact CG-CE2 3.73Å; Y845-F854 HydrophobicContact CG-CE2 3.73Å; Y845-M857 HydrophobicContact CD1-CE 3.41Å; Y845-M857 VanDerWaalsContact CD1-CE 3.41Å; Y845-M857 HydrophobicContact CD1-SD 4.23Å; Y845-M857 HydrophobicContact CE1-CE 3.52Å; Y845-M857 HydrophobicContact CE1-SD 4.47Å; Y845-M857 HydrophobicContact CG-CE 4.27Å; Y845-I858 HydrophobicContact CE1-CD1 3.98Å; Y845-I858 WeakPolarHBondContact OH-CD1 3.32Å; Y845-M864 HydrophobicContact CD1-CG 3.5Å; Y845-M864 VanDerWaalsContact CD1-CG 3.5Å; Y845-M864 HydrophobicContact CD1-SD 4.19Å; Y845-M864 HydrophobicContact CD2-CG 4.21Å; Y845-M864 HydrophobicContact CD2-SD 3.86Å; Y845-M864 HydrophobicContact CE1-CG 3.46Å; Y845-M864 VanDerWaalsContact CE1-CG 3.46Å; Y845-M864 HydrophobicContact CE1-SD 4.35Å; Y845-M864 HydrophobicContact CE2-CE 4.15Å; Y845-M864 HydrophobicContact CE2-CG 4.16Å; Y845-M864 HydrophobicContact CE2-SD 4.01Å; Y845-M864 HydrophobicContact CG-CG 3.89Å; Y845-M864 HydrophobicContact CG-SD 3.96Å; Y845-M864 PolarHBondContact N-SD 2.89Å
846	P	88.2	Confident	89.9	Confident	88 Å²	88	46 Å²	46	57%	0.571	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	143.9	-176.4	26.2	-35	0	0	0	111	W835 M848	W835-P846 HydrophobicContact CH2-CG 3.97Å; W835-P846 HydrophobicContact CZ2-CG 4.26Å; P846-M848 PolarHBondContact O-N 2.9Å
847	G	84.3	Confident	89.6	Confident	92 Å²	92	47.2 Å²	47.2	95%	0.948	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-18.9	-173.9	0	0	0	0	0	115.5
848	M	84.7	Confident	89.3	Confident	67 Å²	67	47.3 Å²	47.3	33%	0.33	29%	0.293	S	S	.	.			trans	-94.1	125.3	-178.3	-167.2	167.8	-66.7	0	0	112.7	K809 Y845 P846 F854 M857	K809-M848 VanDerWaalsContact CE-O 3.27Å; K809-M848 WeakPolarHBondContact CE-O 3.21Å; K809-M848 PolarHBondContact NZ-O 2.91Å; Y845-M848 PolarHBondContact O-N 3.05Å; P846-M848 PolarHBondContact O-N 2.9Å; M848-F854 HydrophobicContact CG-CB 4.42Å; M848-F854 HydrophobicContact CG-CD2 4.15Å; M848-F854 HydrophobicContact SD-CB 4.08Å; M848-F854 HydrophobicContact SD-CD2 3.79Å; M848-F854 HydrophobicContact SD-CG 4.41Å; M848-M857 HydrophobicContact CE-CE 4.4Å; M848-M857 HydrophobicContact CE-SD 3.51Å; M848-M857 VanDerWaalsContact CE-SD 3.51Å; M848-M857 HydrophobicContact SD-CE 3.52Å; M848-M857 VanDerWaalsContact SD-CE 3.52Å; M848-M857 HydrophobicContact SD-SD 3.44Å
849	Q	83.8	Confident	88.9	Confident	175 Å²	175	53 Å²	53	82%	0.818	32%	0.32	S	S	*	.			trans	-85	151.6	168.5	-63.1	-172.6	2.4	0	0	111	G851	Q849-G851 PolarHBondContact O-N 2.7Å
850	V	83.7	Confident	88.6	Confident	34 Å²	34	56.6 Å²	56.6	21%	0.206	34%	0.339	C	S	.	.	S	Bend	trans	-78.7	114.1	176.9	179.7	0	0	0	0	109.5	V799 V808 K809 F854 Y855	V799-V850 HydrophobicContact CB-CG1 4.45Å; V799-V850 HydrophobicContact CG1-CB 4.47Å; V799-V850 HydrophobicContact CG1-CG1 4.16Å; V799-V850 HydrophobicContact CG2-CB 3.85Å; V799-V850 HydrophobicContact CG2-CG1 4.06Å; V799-V850 HydrophobicContact CG2-CG2 3.98Å; V808-V850 HydrophobicContact CB-CG1 4.11Å; V808-V850 HydrophobicContact CG1-CG1 3.69Å; K809-V850 HydrophobicContact CD-CG2 4.4Å; K809-V850 HydrophobicContact CG-CG2 3.78Å; V850-F854 HydrophobicContact CG1-CD1 4.14Å; V850-F854 HydrophobicContact CG2-CD1 4.42Å; V850-F854 HydrophobicContact CG2-CG 4.45Å; V850-Y855 HydrophobicContact CG1-CE1 4.48Å; V850-Y855 HydrophobicContact CG1-CE2 4.2Å
851	G	84.5	Confident	88.4	Confident	30 Å²	30	58.2 Å²	58.2	31%	0.309	36%	0.356	S	S	.	.	S	Bend	trans	-165.3	-167.4	178.7	0	0	0	0	0	110.4	Q849 A853 F854 Y855	Q849-G851 PolarHBondContact O-N 2.7Å; G851-A853 VanDerWaalsContact C-N 3.26Å; G851-A853 PolarHBondContact O-N 3Å; G851-F854 WeakPolarHBondContact O-CB 3.48Å; G851-F854 PolarHBondContact O-N 3.22Å; G851-Y855 WeakPolarHBondContact O-CD2 3.45Å; G851-Y855 PolarHBondContact O-N 3.36Å
852	S	85.2	Confident	88.2	Confident	109 Å²	109	65.7 Å²	65.7	76%	0.762	38%	0.384	S	S	*	.	H	α-helix	trans	-52.2	-41.4	-178.7	51.6	0	0	0	0	113.5	F854 Y855 K856	S852-F854 PolarHBondContact O-N 2.91Å; S852-Y855 PolarHBondContact O-N 3.19Å; S852-K856 WeakPolarHBondContact O-CB 3.45Å; S852-K856 PolarHBondContact O-N 2.95Å
853	A	87.2	Confident	88.3	Confident	71 Å²	71	65 Å²	65	59%	0.587	38%	0.376	S	S	*	.	H	α-helix	trans	-63.9	-36.4	176	0	0	0	0	0	113.5	G851 M857	G851-A853 VanDerWaalsContact C-N 3.26Å; G851-A853 PolarHBondContact O-N 3Å; A853-M857 VanDerWaalsContact O-CB 3.27Å; A853-M857 WeakPolarHBondContact O-CB 3.36Å; A853-M857 PolarHBondContact O-N 2.02Å
854	F	89.2	Confident	88.5	Confident	2 Å²	2	63 Å²	63	1%	0.009	36%	0.362	C	S	.	.	H	α-helix	trans	-68.9	-48	175.5	176.9	-88.2	0	0	0	111	V808 K809 Y845 M848 V850 G851 S852 K856 M857 I858	V808-F854 HydrophobicContact CG1-CD1 4.37Å; V808-F854 HydrophobicContact CG1-CE1 3.86Å; K809-F854 HydrophobicContact CG-CE2 4.21Å; K809-F854 HydrophobicContact CG-CZ 4.21Å; Y845-F854 HydrophobicContact CD1-CE2 4.13Å; Y845-F854 AromaticContact CD2-CE2 3.72Å; Y845-F854 HydrophobicContact CD2-CE2 3.72Å; Y845-F854 HydrophobicContact CD2-CZ 4.21Å; Y845-F854 HydrophobicContact CE1-CE2 4.47Å; Y845-F854 HydrophobicContact CE2-CE2 4.11Å; Y845-F854 HydrophobicContact CE2-CZ 4.22Å; Y845-F854 AromaticContact CG-CE2 3.73Å; Y845-F854 HydrophobicContact CG-CE2 3.73Å; M848-F854 HydrophobicContact CG-CB 4.42Å; M848-F854 HydrophobicContact CG-CD2 4.15Å; M848-F854 HydrophobicContact SD-CB 4.08Å; M848-F854 HydrophobicContact SD-CD2 3.79Å; M848-F854 HydrophobicContact SD-CG 4.41Å; V850-F854 HydrophobicContact CG1-CD1 4.14Å; V850-F854 HydrophobicContact CG2-CD1 4.42Å; V850-F854 HydrophobicContact CG2-CG 4.45Å; G851-F854 WeakPolarHBondContact O-CB 3.48Å; G851-F854 PolarHBondContact O-N 3.22Å; S852-F854 PolarHBondContact O-N 2.91Å; F854-K856 VanDerWaalsContact C-N 3.33Å; F854-K856 PolarHBondContact O-N 3.15Å; F854-M857 HydrophobicContact CD2-CE 3.61Å; F854-M857 HydrophobicContact CE2-CE 3.73Å; F854-M857 HydrophobicContact CG-CE 4.36Å; F854-M857 WeakPolarHBondContact O-CB 3.34Å; F854-M857 PolarHBondContact O-N 2.88Å; F854-I858 HydrophobicContact CD1-CG1 4.33Å; F854-I858 HydrophobicContact CE1-CG1 3.87Å; F854-I858 HydrophobicContact CE2-CG1 4.49Å; F854-I858 HydrophobicContact CZ-CD1 4.13Å; F854-I858 HydrophobicContact CZ-CG1 3.96Å; F854-I858 WeakPolarHBondContact O-CG1 3.37Å; F854-I858 PolarHBondContact O-N 2.83Å; F854-I858 VanDerWaalsContact O-N 3.07Å
855	Y	88.4	Confident	88.5	Confident	43 Å²	43	67.3 Å²	67.3	17%	0.169	39%	0.392	C	S	.	.	H	α-helix	trans	-60.1	-44.8	178.2	-66.7	-61	0	0	0	111.5	V808 I816 F817 V850 G851 S852 I858 Q859	V808-Y855 HydrophobicContact CG1-CE1 3.71Å; I816-Y855 HydrophobicContact CG2-CD1 3.77Å; I816-Y855 HydrophobicContact CG2-CE1 3.72Å; F817-Y855 HydrophobicContact CE1-CD1 4.14Å; F817-Y855 HydrophobicContact CZ-CD1 4.22Å; V850-Y855 HydrophobicContact CG1-CE1 4.48Å; V850-Y855 HydrophobicContact CG1-CE2 4.2Å; G851-Y855 WeakPolarHBondContact O-CD2 3.45Å; G851-Y855 PolarHBondContact O-N 3.36Å; S852-Y855 PolarHBondContact O-N 3.19Å; Y855-I858 PolarHBondContact O-N 2.99Å; Y855-Q859 WeakPolarHBondContact O-CG 2.96Å; Y855-Q859 PolarHBondContact O-N 3Å; Y855-Q859 VanDerWaalsContact O-N 3.08Å
856	K	88.3	Confident	88.6	Confident	122 Å²	122	72.1 Å²	72.1	53%	0.53	41%	0.41	S	S	.	.	H	α-helix	trans	-63.1	-42.7	174.6	-179.5	166.3	-179.9	171.6	0	112.4	S852 F854 I858 Q859 D860	S852-K856 WeakPolarHBondContact O-CB 3.45Å; S852-K856 PolarHBondContact O-N 2.95Å; F854-K856 VanDerWaalsContact C-N 3.33Å; F854-K856 PolarHBondContact O-N 3.15Å; K856-I858 VanDerWaalsContact C-N 3.27Å; K856-I858 PolarHBondContact O-N 2.87Å; K856-Q859 PolarHBondContact O-N 2.87Å; K856-D860 VanDerWaalsContact CE-OD1 3.32Å; K856-D860 WeakPolarHBondContact CE-OD1 3.37Å; K856-D860 VanDerWaalsContact CE-OD2 3.25Å; K856-D860 WeakPolarHBondContact CE-OD2 3.31Å; K856-D860 WeakPolarHBondContact O-CB 3.46Å; K856-D860 VanDerWaalsContact O-CG 3.23Å; K856-D860 PolarHBondContact O-N 2.87Å
857	M	91.9	Very high	88.9	Confident	25 Å²	25	68.2 Å²	68.2	12%	0.123	38%	0.384	C	S	.	.	H	α-helix	trans	-55.4	-42.4	175.9	171.9	-165.5	69.4	0	0	112.2	Y845 M848 A853 F854 R862	Y845-M857 HydrophobicContact CD1-CE 3.41Å; Y845-M857 VanDerWaalsContact CD1-CE 3.41Å; Y845-M857 HydrophobicContact CD1-SD 4.23Å; Y845-M857 HydrophobicContact CE1-CE 3.52Å; Y845-M857 HydrophobicContact CE1-SD 4.47Å; Y845-M857 HydrophobicContact CG-CE 4.27Å; M848-M857 HydrophobicContact CE-CE 4.4Å; M848-M857 HydrophobicContact CE-SD 3.51Å; M848-M857 VanDerWaalsContact CE-SD 3.51Å; M848-M857 HydrophobicContact SD-CE 3.52Å; M848-M857 VanDerWaalsContact SD-CE 3.52Å; M848-M857 HydrophobicContact SD-SD 3.44Å; A853-M857 VanDerWaalsContact O-CB 3.27Å; A853-M857 WeakPolarHBondContact O-CB 3.36Å; A853-M857 PolarHBondContact O-N 2.02Å; F854-M857 HydrophobicContact CD2-CE 3.61Å; F854-M857 HydrophobicContact CE2-CE 3.73Å; F854-M857 HydrophobicContact CG-CE 4.36Å; F854-M857 WeakPolarHBondContact O-CB 3.34Å; F854-M857 PolarHBondContact O-N 2.88Å; M857-R862 HydrophobicContact CG-CB 3.68Å; M857-R862 HydrophobicContact CG-CG 4.34Å; M857-R862 WeakPolarHBondContact O-CB 3.28Å; M857-R862 PolarHBondContact O-N 3.26Å; M857-R862 VanDerWaalsContact O-N 3.15Å
858	I	90.2	Very high	88.9	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.015	37%	0.371	C	S	.	.	H	α-helix	trans	-67.9	-41.8	178.3	-62.7	-63.5	0	0	0	111.1	P813 F817 Y845 F854 Y855 K856 G861 R863	P813-I858 HydrophobicContact CB-CG2 4.48Å; P813-I858 HydrophobicContact CG-CG2 4.04Å; F817-I858 HydrophobicContact CE2-CG2 4.37Å; Y845-I858 HydrophobicContact CE1-CD1 3.98Å; Y845-I858 WeakPolarHBondContact OH-CD1 3.32Å; F854-I858 HydrophobicContact CD1-CG1 4.33Å; F854-I858 HydrophobicContact CE1-CG1 3.87Å; F854-I858 HydrophobicContact CE2-CG1 4.49Å; F854-I858 HydrophobicContact CZ-CD1 4.13Å; F854-I858 HydrophobicContact CZ-CG1 3.96Å; F854-I858 WeakPolarHBondContact O-CG1 3.37Å; F854-I858 PolarHBondContact O-N 2.83Å; F854-I858 VanDerWaalsContact O-N 3.07Å; Y855-I858 PolarHBondContact O-N 2.99Å; K856-I858 VanDerWaalsContact C-N 3.27Å; K856-I858 PolarHBondContact O-N 2.87Å; I858-G861 PolarHBondContact O-N 3.32Å; I858-R863 PolarHBondContact O-NH1 2.83Å
859	Q	87.2	Confident	89.1	Confident	122 Å²	122	69.6 Å²	69.6	57%	0.57	37%	0.365	S	S	*	.	H	α-helix	trans	-66	-35.9	175.1	-69.6	175.9	-42.9	0	0	113.2	F817 Y855 K856 G861	F817-Q859 HydrophobicContact CD2-CG 4.33Å; F817-Q859 HydrophobicContact CE1-CG 4.05Å; F817-Q859 HydrophobicContact CE2-CG 3.56Å; F817-Q859 HydrophobicContact CZ-CG 3.42Å; F817-Q859 VanDerWaalsContact CZ-CG 3.42Å; Y855-Q859 WeakPolarHBondContact O-CG 2.96Å; Y855-Q859 PolarHBondContact O-N 3Å; Y855-Q859 VanDerWaalsContact O-N 3.08Å; K856-Q859 PolarHBondContact O-N 2.87Å; Q859-G861 PolarHBondContact O-N 2.83Å
860	D	90.3	Very high	89.5	Confident	81 Å²	81	61.5 Å²	61.5	43%	0.433	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	15.3	174.5	-69	-7.6	0	0	0	112.3	K856 R862	K856-D860 VanDerWaalsContact CE-OD1 3.32Å; K856-D860 WeakPolarHBondContact CE-OD1 3.37Å; K856-D860 VanDerWaalsContact CE-OD2 3.25Å; K856-D860 WeakPolarHBondContact CE-OD2 3.31Å; K856-D860 WeakPolarHBondContact O-CB 3.46Å; K856-D860 VanDerWaalsContact O-CG 3.23Å; K856-D860 PolarHBondContact O-N 2.87Å; D860-R862 HydrophobicContact CB-CG 4.25Å; D860-R862 PolarHBondContact O-N 3.47Å; D860-R862 VanDerWaalsContact O-N 3.15Å
861	G	89.1	Confident	89.7	Confident	35 Å²	35	61.9 Å²	61.9	36%	0.361	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	6	176.9	0	0	0	0	0	115.7	I858 Q859 R863	I858-G861 PolarHBondContact O-N 3.32Å; Q859-G861 PolarHBondContact O-N 2.83Å; G861-R863 PolarHBondContact O-NH1 2.74Å
862	R	88.9	Confident	90	Very high	156 Å²	156	65.6 Å²	65.6	59%	0.589	34%	0.343	S	S	*	.			trans	-77.5	148	-173.3	-54.3	179.7	-177.6	-152	2.1	111.6	M857 D860	M857-R862 HydrophobicContact CG-CB 3.68Å; M857-R862 HydrophobicContact CG-CG 4.34Å; M857-R862 WeakPolarHBondContact O-CB 3.28Å; M857-R862 PolarHBondContact O-N 3.26Å; M857-R862 VanDerWaalsContact O-N 3.15Å; D860-R862 HydrophobicContact CB-CG 4.25Å; D860-R862 PolarHBondContact O-N 3.47Å; D860-R862 VanDerWaalsContact O-N 3.15Å
863	R	92.8	Very high	90.2	Very high	48 Å²	48	65.5 Å²	65.5	18%	0.181	33%	0.33	C	S	.	.			trans	-133	168.4	-176.7	-57.9	-59.5	179	-102.7	-0.5	111.7	W828 I858 G861 L879 W882 D884	W828-R863 VanDerWaalsContact CH2-CZ 3.46Å; I858-R863 PolarHBondContact O-NH1 2.83Å; G861-R863 PolarHBondContact O-NH1 2.74Å; R863-L879 HydrophobicContact CB-CD2 4.43Å; R863-W882 HydrophobicContact CB-CE3 4Å; R863-W882 HydrophobicContact CB-CZ3 4.4Å; R863-W882 HydrophobicContact CG-CB 4.4Å; R863-W882 HydrophobicContact CG-CE3 4.29Å; R863-W882 PolarHBondContact NE-O 2.97Å; R863-W882 PolarHBondContact NH2-O 2.95Å; R863-D884 IonicContact CZ-OD1 3.95Å; R863-D884 IonicContact CZ-OD2 3Å; R863-D884 IonicContact NH1-OD1 2.65Å; R863-D884 IonicContact NH2-OD1 2.61Å; R863-D884 PolarHBondContact NH2-OD1 3.36Å; R863-D884 IonicContact NH2-OD2 2.96Å; R863-D884 PolarHBondContact NH2-OD2 2.62Å
864	M	94.7	Very high	90.5	Very high	9 Å²	9	62.1 Å²	62.1	4%	0.044	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-71.5	145.5	174.3	-63.9	-174.9	-73.1	0	0	110.9	I832 W835 P844 Y845 Y875 W882	I832-M864 HydrophobicContact CD1-CE 3.56Å; W835-M864 HydrophobicContact CB-CE 3.77Å; W835-M864 HydrophobicContact CD2-CE 3.87Å; W835-M864 HydrophobicContact CD2-SD 3.7Å; W835-M864 HydrophobicContact CE3-CE 4.42Å; W835-M864 HydrophobicContact CE3-SD 4.1Å; W835-M864 HydrophobicContact CG-CE 3.54Å; W835-M864 HydrophobicContact CG-SD 3.99Å; W835-M864 HydrophobicContact CZ2-SD 4.26Å; P844-M864 HydrophobicContact CB-CE 4.2Å; P844-M864 HydrophobicContact CB-SD 3.91Å; Y845-M864 HydrophobicContact CD1-CG 3.5Å; Y845-M864 VanDerWaalsContact CD1-CG 3.5Å; Y845-M864 HydrophobicContact CD1-SD 4.19Å; Y845-M864 HydrophobicContact CD2-CG 4.21Å; Y845-M864 HydrophobicContact CD2-SD 3.86Å; Y845-M864 HydrophobicContact CE1-CG 3.46Å; Y845-M864 VanDerWaalsContact CE1-CG 3.46Å; Y845-M864 HydrophobicContact CE1-SD 4.35Å; Y845-M864 HydrophobicContact CE2-CE 4.15Å; Y845-M864 HydrophobicContact CE2-CG 4.16Å; Y845-M864 HydrophobicContact CE2-SD 4.01Å; Y845-M864 HydrophobicContact CG-CG 3.89Å; Y845-M864 HydrophobicContact CG-SD 3.96Å; Y845-M864 PolarHBondContact N-SD 2.89Å; M864-Y875 PolarHBondContact O-OH 2.83Å; M864-Y875 VanDerWaalsContact O-OH 3.09Å; M864-W882 HydrophobicContact CB-CH2 4.17Å; M864-W882 HydrophobicContact CB-CZ3 4.32Å; M864-W882 HydrophobicContact CE-CH2 3.59Å; M864-W882 HydrophobicContact CE-CZ2 3.48Å; M864-W882 VanDerWaalsContact CE-CZ2 3.48Å
865	S	93.9	Very high	90.8	Very high	89 Å²	89	64.1 Å²	64.1	62%	0.622	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-67	159.3	169.9	56.1	0	0	0	0	112	W835	W835-S865 PolarHBondContact NE1-O 3.13Å
866	R	95.1	Very high	91.2	Very high	114 Å²	114	65.9 Å²	65.9	43%	0.43	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-50.4	124.8	174	-173.8	173.4	73.1	70.6	8.3	110.1	E868 A870 Y875	R866-E868 PolarHBondContact NH1-O 2.97Å; R866-A870 HydrophobicContact CG-CB 4.08Å; R866-A870 PolarHBondContact NH1-O 3Å; R866-Y875 VanDerWaalsContact CA-CD2 3.46Å; R866-Y875 HydrophobicContact CB-CD1 3.83Å; R866-Y875 HydrophobicContact CB-CD2 3.75Å; R866-Y875 HydrophobicContact CB-CE1 4.01Å; R866-Y875 HydrophobicContact CB-CE2 3.94Å; R866-Y875 HydrophobicContact CB-CG 3.68Å; R866-Y875 HydrophobicContact CG-CD1 4.2Å; R866-Y875 HydrophobicContact CG-CD2 4.05Å; R866-Y875 HydrophobicContact CG-CG 3.74Å
867	P	93.2	Very high	91.5	Very high	5 Å²	5	60.1 Å²	60.1	3%	0.032	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-72.9	148.3	173.8	32.1	-32.7	0	0	0	109.3	W835 F838 F869 A870 M878	W835-P867 HydrophobicContact CD2-CB 4.4Å; W835-P867 HydrophobicContact CG-CB 4.39Å; W835-P867 HydrophobicContact CG-CG 4.2Å; F838-P867 HydrophobicContact CB-CB 4.48Å; F838-P867 HydrophobicContact CB-CG 3.82Å; P867-F869 VanDerWaalsContact C-N 3.3Å; P867-F869 PolarHBondContact O-N 2.81Å; P867-F869 VanDerWaalsContact O-N 3.08Å; P867-A870 HydrophobicContact CG-CB 3.78Å; P867-A870 PolarHBondContact O-N 3.24Å; P867-M878 HydrophobicContact CG-CE 3.87Å; P867-M878 HydrophobicContact CG-SD 4.27Å
868	E	85.3	Confident	91.8	Very high	141 Å²	141	59 Å²	59	66%	0.659	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	-49.9	-165	-167.2	174	172.2	0	0	114.1	R866	R866-E868 PolarHBondContact NH1-O 2.97Å
869	F	89.2	Confident	92.1	Very high	48 Å²	48	62 Å²	62	21%	0.211	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	4.6	-171.8	-45.8	-67.2	0	0	0	114.8	F689 L690 F838 L840 P867	F689-F869 HydrophobicContact CE1-CB 4.37Å; F689-F869 AromaticContact CE1-CD1 3.55Å; F689-F869 HydrophobicContact CE1-CD1 3.55Å; F689-F869 HydrophobicContact CE1-CD2 4.35Å; F689-F869 AromaticContact CE1-CE1 3.93Å; F689-F869 HydrophobicContact CE1-CE1 3.93Å; F689-F869 AromaticContact CE1-CG 3.8Å; F689-F869 HydrophobicContact CE1-CG 3.8Å; F689-F869 HydrophobicContact CE1-CZ 4.49Å; F689-F869 HydrophobicContact CZ-CB 4.18Å; F689-F869 HydrophobicContact CZ-CD1 4.16Å; F689-F869 HydrophobicContact CZ-CG 4.11Å; L690-F869 HydrophobicContact CD2-CE1 4.17Å; L690-F869 HydrophobicContact CD2-CZ 3.68Å; F838-F869 WeakPolarHBondContact CD1-O 3.27Å; F838-F869 WeakPolarHBondContact O-CD2 3.47Å; F838-F869 PolarHBondContact O-N 2.92Å; L840-F869 HydrophobicContact CD1-CD2 3.78Å; L840-F869 HydrophobicContact CD1-CE2 3.52Å; L840-F869 HydrophobicContact CD1-CZ 4.24Å; L840-F869 HydrophobicContact CG-CD2 3.79Å; L840-F869 HydrophobicContact CG-CE2 3.93Å; P867-F869 VanDerWaalsContact C-N 3.3Å; P867-F869 PolarHBondContact O-N 2.81Å; P867-F869 VanDerWaalsContact O-N 3.08Å
870	A	90.3	Very high	92.6	Very high	4 Å²	4	58.3 Å²	58.3	3%	0.033	29%	0.294	C	S	.	.			trans	-76.3	130.5	177.5	0	0	0	0	0	112	F838 R866 P867 M878	F838-A870 HydrophobicContact CB-CB 3.71Å; F838-A870 HydrophobicContact CD1-CB 4.29Å; F838-A870 HydrophobicContact CG-CB 3.94Å; R866-A870 HydrophobicContact CG-CB 4.08Å; R866-A870 PolarHBondContact NH1-O 3Å; P867-A870 HydrophobicContact CG-CB 3.78Å; P867-A870 PolarHBondContact O-N 3.24Å; A870-M878 HydrophobicContact CB-CE 3.87Å
871	P	89.8	Confident	93	Very high	43 Å²	43	54.4 Å²	54.4	28%	0.279	27%	0.274	S	S	.	.			trans	-54.6	158.3	160.1	-23.4	34.2	0	0	0	111.9	E873 M874 Y875	P871-E873 VanDerWaalsContact C-N 3.33Å; P871-E873 WeakPolarHBondContact CB-OE2 3.34Å; P871-M874 HydrophobicContact CB-CB 4.3Å; P871-M874 HydrophobicContact CG-CB 4.49Å; P871-M874 PolarHBondContact O-N 3.26Å; P871-Y875 PolarHBondContact O-N 2.79Å; P871-Y875 VanDerWaalsContact O-N 3.1Å
872	I	88.9	Confident	93.4	Very high	108 Å²	108	52.9 Å²	52.9	55%	0.554	26%	0.257	S	S	*	.	H	α-helix	trans	-65.7	-43.6	-177.7	-61.7	174.5	0	0	0	109.5	M874 Y875 D876	I872-M874 PolarHBondContact O-N 3.01Å; I872-Y875 PolarHBondContact O-N 2.84Å; I872-D876 PolarHBondContact O-N 3.03Å
873	E	90.7	Very high	93.7	Very high	106 Å²	106	48 Å²	48	50%	0.495	24%	0.243	S	C	.	.	H	α-helix	trans	-57.4	-35.2	177.7	-53.6	74.1	-164.8	0	0	111.8	P871 M877 L902	P871-E873 VanDerWaalsContact C-N 3.33Å; P871-E873 WeakPolarHBondContact CB-OE2 3.34Å; E873-M877 PolarHBondContact O-N 3.03Å; E873-L902 HydrophobicContact CB-CD1 4.13Å; E873-L902 HydrophobicContact CB-CD2 4.02Å; E873-L902 HydrophobicContact CG-CD2 4.2Å
874	M	92.8	Very high	93.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-77.5	-35.4	176.5	-171.6	61.8	74.8	0	0	111.9	L745 L834 F838 P871 I872 M877 M878 T899 L902	L745-M874 HydrophobicContact CD2-CE 3.65Å; L834-M874 HydrophobicContact CD1-SD 3.79Å; L834-M874 HydrophobicContact CD2-SD 3.78Å; L834-M874 HydrophobicContact CG-SD 4.35Å; F838-M874 HydrophobicContact CD2-CG 3.84Å; F838-M874 HydrophobicContact CE2-CE 3.84Å; F838-M874 HydrophobicContact CE2-CG 3.51Å; F838-M874 HydrophobicContact CE2-SD 4.02Å; F838-M874 HydrophobicContact CZ-CE 3.95Å; F838-M874 HydrophobicContact CZ-CG 4.07Å; P871-M874 HydrophobicContact CB-CB 4.3Å; P871-M874 HydrophobicContact CG-CB 4.49Å; P871-M874 PolarHBondContact O-N 3.26Å; I872-M874 PolarHBondContact O-N 3.01Å; M874-M877 HydrophobicContact CE-CE 4.45Å; M874-M877 VanDerWaalsContact O-CB 3.3Å; M874-M877 WeakPolarHBondContact O-CB 3.49Å; M874-M877 PolarHBondContact O-N 2.95Å; M874-M877 HydrophobicContact SD-CE 4.02Å; M874-M877 HydrophobicContact SD-SD 4.18Å; M874-M878 HydrophobicContact CG-CE 3.99Å; M874-M878 WeakPolarHBondContact O-CG 3.38Å; M874-M878 PolarHBondContact O-N 2.02Å; M874-T899 HydrophobicContact CE-CG2 4.17Å; M874-L902 HydrophobicContact CE-CD1 4.11Å
875	Y	96.8	Very high	93.6	Very high	45 Å²	45	51.6 Å²	51.6	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-70.8	-39.3	175	-178.8	-118.8	0	0	0	112.3	M864 R866 P871 I872 M877 M878 L879 W882	M864-Y875 PolarHBondContact O-OH 2.83Å; M864-Y875 VanDerWaalsContact O-OH 3.09Å; R866-Y875 VanDerWaalsContact CA-CD2 3.46Å; R866-Y875 HydrophobicContact CB-CD1 3.83Å; R866-Y875 HydrophobicContact CB-CD2 3.75Å; R866-Y875 HydrophobicContact CB-CE1 4.01Å; R866-Y875 HydrophobicContact CB-CE2 3.94Å; R866-Y875 HydrophobicContact CB-CG 3.68Å; R866-Y875 HydrophobicContact CG-CD1 4.2Å; R866-Y875 HydrophobicContact CG-CD2 4.05Å; R866-Y875 HydrophobicContact CG-CG 3.74Å; P871-Y875 PolarHBondContact O-N 2.79Å; P871-Y875 VanDerWaalsContact O-N 3.1Å; I872-Y875 PolarHBondContact O-N 2.84Å; Y875-M877 PolarHBondContact O-N 2.93Å; Y875-M878 HydrophobicContact CD2-CB 4.5Å; Y875-M878 HydrophobicContact CD2-SD 4.13Å; Y875-M878 WeakPolarHBondContact O-CB 3.5Å; Y875-M878 PolarHBondContact O-N 3.46Å; Y875-L879 HydrophobicContact CD1-CD1 4.05Å; Y875-L879 HydrophobicContact CE1-CD1 3.66Å; Y875-L879 HydrophobicContact CE1-CG 4.18Å; Y875-L879 HydrophobicContact CE2-CD2 4.36Å; Y875-L879 HydrophobicContact CE2-CG 4.31Å; Y875-L879 WeakPolarHBondContact O-CG 3.43Å; Y875-L879 PolarHBondContact O-N 2.86Å; Y875-W882 HydrophobicContact CE2-CZ3 4.5Å
876	D	95.1	Very high	93.5	Very high	79 Å²	79	49.1 Å²	49.1	42%	0.422	25%	0.247	S	C	.	.	H	α-helix	trans	-60	-34.5	170.5	-69.1	-19.2	0	0	0	111	I872 L879 C880	I872-D876 PolarHBondContact O-N 3.03Å; D876-L879 PolarHBondContact O-N 2.83Å; D876-C880 PolarHBondContact O-N 2.93Å; D876-C880 PolarHBondContact O-SG 2.9Å
877	M	95.5	Very high	93.4	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-44.5	171	-160.5	-176.4	-47	0	0	112.5	L834 E873 M874 Y875 L879 C880 C881 L895 R898 T899 L902	L834-M877 HydrophobicContact CD1-SD 4.3Å; E873-M877 PolarHBondContact O-N 3.03Å; M874-M877 HydrophobicContact CE-CE 4.45Å; M874-M877 VanDerWaalsContact O-CB 3.3Å; M874-M877 WeakPolarHBondContact O-CB 3.49Å; M874-M877 PolarHBondContact O-N 2.95Å; M874-M877 HydrophobicContact SD-CE 4.02Å; M874-M877 HydrophobicContact SD-SD 4.18Å; Y875-M877 PolarHBondContact O-N 2.93Å; M877-L879 VanDerWaalsContact C-N 3.33Å; M877-L879 PolarHBondContact O-N 3.26Å; M877-C880 PolarHBondContact O-N 2.82Å; M877-C881 PolarHBondContact O-N 3.46Å; M877-C881 PolarHBondContact O-SG 2.95Å; M877-L895 HydrophobicContact CG-CD2 3.42Å; M877-L895 VanDerWaalsContact CG-CD2 3.42Å; M877-L895 HydrophobicContact SD-CD2 3.59Å; M877-L895 VanDerWaalsContact SD-CD2 3.59Å; M877-R898 HydrophobicContact CE-CB 3.69Å; M877-R898 HydrophobicContact SD-CB 4.47Å; M877-T899 HydrophobicContact CE-CG2 3.68Å; M877-T899 HydrophobicContact SD-CG2 3.69Å; M877-L902 HydrophobicContact CE-CD1 4.42Å
878	M	97.9	Very high	93.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-44.2	173.2	-62.3	175.7	-149.8	0	0	111.4	L834 W835 F838 P867 A870 M874 Y875 C881 W882	L834-M878 HydrophobicContact CB-CE 4.06Å; L834-M878 HydrophobicContact CB-CG 3.85Å; L834-M878 HydrophobicContact CB-SD 4.38Å; L834-M878 HydrophobicContact CD1-CG 4.12Å; W835-M878 HydrophobicContact CB-SD 4.03Å; W835-M878 HydrophobicContact CG-SD 4.49Å; F838-M878 HydrophobicContact CB-CE 4.39Å; F838-M878 HydrophobicContact CD2-CE 4.14Å; P867-M878 HydrophobicContact CG-CE 3.87Å; P867-M878 HydrophobicContact CG-SD 4.27Å; A870-M878 HydrophobicContact CB-CE 3.87Å; M874-M878 HydrophobicContact CG-CE 3.99Å; M874-M878 WeakPolarHBondContact O-CG 3.38Å; M874-M878 PolarHBondContact O-N 2.02Å; Y875-M878 HydrophobicContact CD2-CB 4.5Å; Y875-M878 HydrophobicContact CD2-SD 4.13Å; Y875-M878 WeakPolarHBondContact O-CB 3.5Å; Y875-M878 PolarHBondContact O-N 3.46Å; M878-C881 WeakPolarHBondContact O-CB 3.11Å; M878-C881 PolarHBondContact O-N 2.82Å; M878-C881 VanDerWaalsContact O-N 3.16Å; M878-W882 HydrophobicContact CB-CE3 4.28Å; M878-W882 HydrophobicContact CB-CH2 3.78Å; M878-W882 HydrophobicContact CB-CZ2 4.04Å; M878-W882 HydrophobicContact CB-CZ3 3.92Å; M878-W882 HydrophobicContact CG-CH2 4.36Å; M878-W882 VanDerWaalsContact O-CD2 3.27Å; M878-W882 VanDerWaalsContact O-CG 3.31Å; M878-W882 PolarHBondContact O-N 3Å; M878-W882 HydrophobicContact SD-CH2 4.11Å
879	L	97.3	Very high	94	Very high	66 Å²	66	50.5 Å²	50.5	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-64	-39.7	177.1	-68	176	0	0	0	112.3	R863 Y875 D876 M877 C881 W882 N883	R863-L879 HydrophobicContact CB-CD2 4.43Å; Y875-L879 HydrophobicContact CD1-CD1 4.05Å; Y875-L879 HydrophobicContact CE1-CD1 3.66Å; Y875-L879 HydrophobicContact CE1-CG 4.18Å; Y875-L879 HydrophobicContact CE2-CD2 4.36Å; Y875-L879 HydrophobicContact CE2-CG 4.31Å; Y875-L879 WeakPolarHBondContact O-CG 3.43Å; Y875-L879 PolarHBondContact O-N 2.86Å; D876-L879 PolarHBondContact O-N 2.83Å; M877-L879 VanDerWaalsContact C-N 3.33Å; M877-L879 PolarHBondContact O-N 3.26Å; L879-C881 VanDerWaalsContact C-N 3.33Å; L879-C881 PolarHBondContact O-N 2.84Å; L879-W882 HydrophobicContact CD2-CE3 4.25Å; L879-W882 CarbonylContact O-C 3.53Å; L879-W882 PolarHBondContact O-N 2.89Å; L879-N883 PolarHBondContact O-N 3.44Å
880	C	96.9	Very high	94.4	Very high	45 Å²	45	48.9 Å²	48.9	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-61.6	-38.8	171.1	-72.6	0	0	0	0	112.5	D876 M877 W882 P890	D876-C880 PolarHBondContact O-N 2.93Å; D876-C880 PolarHBondContact O-SG 2.9Å; M877-C880 PolarHBondContact O-N 2.82Å; C880-W882 VanDerWaalsContact C-N 3.31Å; C880-P890 HydrophobicContact CB-CG 4.1Å; C880-P890 VanDerWaalsContact O-CD 3.27Å; C880-P890 WeakPolarHBondContact O-CD 3.5Å
881	C	97.9	Very high	94.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.6	-30.5	174.9	-69.5	0	0	0	0	112.8	V827 W828 M877 M878 L879 R889	V827-C881 HydrophobicContact CG1-CB 4.14Å; V827-C881 WeakPolarHBondContact O-CB 3.28Å; W828-C881 WeakPolarHBondContact CA-O 3.4Å; M877-C881 PolarHBondContact O-N 3.46Å; M877-C881 PolarHBondContact O-SG 2.95Å; M878-C881 WeakPolarHBondContact O-CB 3.11Å; M878-C881 PolarHBondContact O-N 2.82Å; M878-C881 VanDerWaalsContact O-N 3.16Å; L879-C881 VanDerWaalsContact C-N 3.33Å; L879-C881 PolarHBondContact O-N 2.84Å; C881-R889 VanDerWaalsContact O-CD 3.32Å; C881-R889 WeakPolarHBondContact O-CD 3.47Å
882	W	97.7	Very high	95	Very high	3 Å²	3	49.8 Å²	49.8	1%	0.011	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	27.6	-179.4	-52.1	-38.1	0	0	0	114.9	W828 G831 I832 W835 R863 M864 Y875 M878 L879 C880 D884	W828-W882 HydrophobicContact CD2-CB 4.46Å; W828-W882 AromaticContact CD2-CD1 3.79Å; W828-W882 HydrophobicContact CD2-CG 4.48Å; W828-W882 AromaticContact CE2-CD1 3.94Å; W828-W882 VanDerWaalsContact CE3-CA 3.48Å; W828-W882 HydrophobicContact CE3-CB 4.03Å; W828-W882 HydrophobicContact CH2-CB 4.19Å; W828-W882 HydrophobicContact CZ3-CB 3.88Å; W828-W882 WeakPolarHBondContact CZ3-O 3.47Å; W828-W882 PolarHBondContact O-NE1 2.71Å; G831-W882 VanDerWaalsContact C-NE1 3.34Å; G831-W882 VanDerWaalsContact O-CZ2 3.24Å; G831-W882 WeakPolarHBondContact O-CZ2 3.37Å; I832-W882 HydrophobicContact CD1-CZ2 3.86Å; W835-W882 HydrophobicContact CB-CH2 4.23Å; W835-W882 HydrophobicContact CB-CZ2 4.19Å; W835-W882 AromaticContact CD1-CH2 3.97Å; W835-W882 HydrophobicContact CG-CH2 4.37Å; R863-W882 HydrophobicContact CB-CE3 4Å; R863-W882 HydrophobicContact CB-CZ3 4.4Å; R863-W882 HydrophobicContact CG-CB 4.4Å; R863-W882 HydrophobicContact CG-CE3 4.29Å; R863-W882 PolarHBondContact NE-O 2.97Å; R863-W882 PolarHBondContact NH2-O 2.95Å; M864-W882 HydrophobicContact CB-CH2 4.17Å; M864-W882 HydrophobicContact CB-CZ3 4.32Å; M864-W882 HydrophobicContact CE-CH2 3.59Å; M864-W882 HydrophobicContact CE-CZ2 3.48Å; M864-W882 VanDerWaalsContact CE-CZ2 3.48Å; Y875-W882 HydrophobicContact CE2-CZ3 4.5Å; M878-W882 HydrophobicContact CB-CE3 4.28Å; M878-W882 HydrophobicContact CB-CH2 3.78Å; M878-W882 HydrophobicContact CB-CZ2 4.04Å; M878-W882 HydrophobicContact CB-CZ3 3.92Å; M878-W882 HydrophobicContact CG-CH2 4.36Å; M878-W882 VanDerWaalsContact O-CD2 3.27Å; M878-W882 VanDerWaalsContact O-CG 3.31Å; M878-W882 PolarHBondContact O-N 3Å; M878-W882 HydrophobicContact SD-CH2 4.11Å; L879-W882 HydrophobicContact CD2-CE3 4.25Å; L879-W882 CarbonylContact O-C 3.53Å; L879-W882 PolarHBondContact O-N 2.89Å; C880-W882 VanDerWaalsContact C-N 3.31Å; W882-D884 PolarHBondContact O-N 2.79Å
883	N	96.7	Very high	95.3	Very high	53 Å²	53	52 Å²	52	28%	0.283	26%	0.261	S	S	.	.			trans	-62.8	135.1	171.4	-154.7	-59.1	0	0	0	110.2	L879 D885 K888 R889	L879-N883 PolarHBondContact O-N 3.44Å; N883-D885 VanDerWaalsContact C-N 3.27Å; N883-D885 PolarHBondContact O-N 3.4Å; N883-D885 PolarHBondContact OD1-N 3.31Å; N883-K888 HydrophobicContact CB-CB 4.29Å; N883-R889 HydrophobicContact CB-CG 3.94Å; N883-R889 PolarHBondContact O-NE 2.83Å; N883-R889 PolarHBondContact O-NH2 2.82Å
884	D	92.1	Very high	95.5	Very high	80 Å²	80	52.6 Å²	52.6	43%	0.428	26%	0.262	S	S	.	.	S	Bend	trans	-60	-40.3	176.1	-62.6	-81.9	0	0	0	111.3	R863 W882 P886 R889	R863-D884 IonicContact CZ-OD1 3.95Å; R863-D884 IonicContact CZ-OD2 3Å; R863-D884 IonicContact NH1-OD1 2.65Å; R863-D884 IonicContact NH2-OD1 2.61Å; R863-D884 PolarHBondContact NH2-OD1 3.36Å; R863-D884 IonicContact NH2-OD2 2.96Å; R863-D884 PolarHBondContact NH2-OD2 2.62Å; W882-D884 PolarHBondContact O-N 2.79Å; D884-P886 WeakPolarHBondContact O-CD 2.98Å; D884-R889 PolarHBondContact O-NH2 2.73Å
885	D	92.4	Very high	95.7	Very high	52 Å²	52	52.6 Å²	52.6	28%	0.278	26%	0.262	S	S	.	.	S	Bend	trans	-76.8	115	173.6	-177.4	-18.6	0	0	0	110.3	N883 L887 K888	N883-D885 VanDerWaalsContact C-N 3.27Å; N883-D885 PolarHBondContact O-N 3.4Å; N883-D885 PolarHBondContact OD1-N 3.31Å; D885-L887 VanDerWaalsContact C-N 3.27Å; D885-L887 PolarHBondContact O-N 2.84Å; D885-L887 WeakPolarHBondContact OD1-CB 3.39Å; D885-L887 PolarHBondContact OD1-N 2.76Å; D885-K888 HydrophobicContact CB-CB 4.2Å; D885-K888 HydrophobicContact CB-CD 4.06Å; D885-K888 HydrophobicContact CB-CG 3.99Å; D885-K888 PolarHBondContact O-N 2.81Å; D885-K888 IonicContact OD2-NZ 3.74Å; D885-K888 PolarHBondContact OD2-NZ 3.09Å
886	P	92.4	Very high	95.7	Very high	37 Å²	37	50.8 Å²	50.8	24%	0.24	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-58.8	-36.9	179.8	-21.9	33.4	0	0	0	113	E814 E824 D884 K888 R889	E814-P886 HydrophobicContact CG-CG 4.31Å; E824-P886 HydrophobicContact CB-CB 3.75Å; E824-P886 HydrophobicContact CG-CB 4.16Å; E824-P886 WeakPolarHBondContact CG-O 3.42Å; D884-P886 WeakPolarHBondContact O-CD 2.98Å; P886-K888 PolarHBondContact O-N 2.99Å; P886-R889 WeakPolarHBondContact O-CB 3.35Å; P886-R889 WeakPolarHBondContact O-CG 3.49Å; P886-R889 PolarHBondContact O-N 3.04Å
887	L	91.5	Very high	95.6	Very high	138 Å²	138	50.9 Å²	50.9	72%	0.723	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-73	-14.4	-175.8	-57.1	177.5	0	0	0	112.8	D885	D885-L887 VanDerWaalsContact C-N 3.27Å; D885-L887 PolarHBondContact O-N 2.84Å; D885-L887 WeakPolarHBondContact OD1-CB 3.39Å; D885-L887 PolarHBondContact OD1-N 2.76Å
888	K	94.8	Very high	95.4	Very high	136 Å²	136	56.3 Å²	56.3	59%	0.591	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-88.6	-8.7	172.1	-67.3	-172.2	-177.7	84.8	0	113.4	N883 D885 P886	N883-K888 HydrophobicContact CB-CB 4.29Å; D885-K888 HydrophobicContact CB-CB 4.2Å; D885-K888 HydrophobicContact CB-CD 4.06Å; D885-K888 HydrophobicContact CB-CG 3.99Å; D885-K888 PolarHBondContact O-N 2.81Å; D885-K888 IonicContact OD2-NZ 3.74Å; D885-K888 PolarHBondContact OD2-NZ 3.09Å; P886-K888 PolarHBondContact O-N 2.99Å
889	R	97.4	Very high	95.1	Very high	15 Å²	15	56.4 Å²	56.4	6%	0.057	28%	0.275	C	S	.	.	S	Bend	trans	-73	144.3	177.9	-58.2	178	-166.2	149.5	12.6	110	E814 E824 V827 C881 N883 D884 P886	E814-R889 IonicContact OE1-CZ 3.41Å; E814-R889 IonicContact OE1-NH1 3.58Å; E814-R889 PolarHBondContact OE1-NH1 3.16Å; E814-R889 IonicContact OE1-NH2 3.89Å; E814-R889 IonicContact OE2-CZ 2.68Å; E814-R889 IonicContact OE2-NH1 3.78Å; E814-R889 PolarHBondContact OE2-NH1 3.35Å; E814-R889 IonicContact OE2-NH2 3.43Å; E814-R889 PolarHBondContact OE2-NH2 3.04Å; E824-R889 WeakPolarHBondContact O-CD 3.1Å; E824-R889 PolarHBondContact O-NH1 2.89Å; V827-R889 HydrophobicContact CG1-CB 3.87Å; C881-R889 VanDerWaalsContact O-CD 3.32Å; C881-R889 WeakPolarHBondContact O-CD 3.47Å; N883-R889 HydrophobicContact CB-CG 3.94Å; N883-R889 PolarHBondContact O-NE 2.83Å; N883-R889 PolarHBondContact O-NH2 2.82Å; D884-R889 PolarHBondContact O-NH2 2.73Å; P886-R889 WeakPolarHBondContact O-CB 3.35Å; P886-R889 WeakPolarHBondContact O-CG 3.49Å; P886-R889 PolarHBondContact O-N 3.04Å
890	P	96.9	Very high	94.7	Very high	15 Å²	15	56.3 Å²	56.3	10%	0.097	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-72.8	135.3	-179.9	29.8	-35.4	0	0	0	111.3	V827 C880 K894 L895	V827-P890 HydrophobicContact CG1-CG 4.36Å; V827-P890 WeakPolarHBondContact CG1-O 3.42Å; V827-P890 WeakPolarHBondContact CG2-O 3.23Å; C880-P890 HydrophobicContact CB-CG 4.1Å; C880-P890 VanDerWaalsContact O-CD 3.27Å; C880-P890 WeakPolarHBondContact O-CD 3.5Å; P890-K894 HydrophobicContact CB-CB 4.26Å; P890-L895 HydrophobicContact CB-CD2 4.15Å; P890-L895 HydrophobicContact CB-CG 4.16Å; P890-L895 HydrophobicContact CG-CD1 4.25Å; P890-L895 HydrophobicContact CG-CD2 3.61Å; P890-L895 HydrophobicContact CG-CG 3.96Å
891	S	96.6	Very high	94.3	Very high	60 Å²	60	60.9 Å²	60.9	42%	0.42	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-63.7	154	171	58.5	0	0	0	0	111.6	R893 K894 L895	S891-R893 PolarHBondContact O-N 2.97Å; S891-R893 VanDerWaalsContact O-N 3.14Å; S891-K894 WeakPolarHBondContact O-CA 3.35Å; S891-K894 WeakPolarHBondContact O-CB 3.1Å; S891-K894 PolarHBondContact O-N 2.92Å; S891-L895 PolarHBondContact O-N 3.22Å; S891-L895 VanDerWaalsContact O-N 3.14Å
892	F	97.1	Very high	93.7	Very high	5 Å²	5	63.4 Å²	63.4	2%	0.022	31%	0.306	C	S	.	.	H	α-helix	trans	-55.2	-34.8	-178.8	-80.5	-69.3	0	0	0	113.9	M755 E756 T759 L768 D826 V827 Y830 K894 L895 V896	M755-F892 HydrophobicContact CB-CB 4.46Å; M755-F892 HydrophobicContact CB-CD1 3.37Å; M755-F892 HydrophobicContact CB-CD2 3.84Å; M755-F892 HydrophobicContact CB-CE1 3.35Å; M755-F892 HydrophobicContact CB-CE2 3.82Å; M755-F892 HydrophobicContact CB-CG 3.62Å; M755-F892 HydrophobicContact CB-CZ 3.57Å; M755-F892 HydrophobicContact CE-CE2 3.9Å; M755-F892 HydrophobicContact CE-CZ 4Å; M755-F892 HydrophobicContact CG-CD1 4.27Å; M755-F892 HydrophobicContact CG-CE1 3.76Å; M755-F892 HydrophobicContact CG-CE2 4.39Å; M755-F892 HydrophobicContact CG-CZ 3.82Å; E756-F892 HydrophobicContact CB-CB 4.06Å; T759-F892 WeakPolarHBondContact OG1-CD2 3.39Å; L768-F892 HydrophobicContact CD2-CZ 4.37Å; D826-F892 HydrophobicContact CB-CE2 3.96Å; D826-F892 HydrophobicContact CB-CZ 4.15Å; V827-F892 HydrophobicContact CB-CE2 4.48Å; V827-F892 HydrophobicContact CB-CZ 4.44Å; V827-F892 HydrophobicContact CG2-CD2 3.84Å; V827-F892 HydrophobicContact CG2-CE1 4.4Å; V827-F892 HydrophobicContact CG2-CE2 3.55Å; V827-F892 HydrophobicContact CG2-CG 4.39Å; V827-F892 HydrophobicContact CG2-CZ 3.86Å; Y830-F892 HydrophobicContact CD1-CE1 4.22Å; Y830-F892 HydrophobicContact CD2-CE1 4.12Å; Y830-F892 AromaticContact CG-CE1 3.74Å; Y830-F892 HydrophobicContact CG-CE1 3.74Å; F892-K894 PolarHBondContact O-N 2.86Å; F892-L895 HydrophobicContact CD1-CD1 3.89Å; F892-L895 HydrophobicContact CE1-CD1 4.15Å; F892-L895 CarbonylContact O-C 3.53Å; F892-L895 WeakPolarHBondContact O-CA 3.42Å; F892-L895 WeakPolarHBondContact O-CB 3.24Å; F892-L895 PolarHBondContact O-N 3.31Å; F892-L895 VanDerWaalsContact O-N 3.07Å; F892-V896 WeakPolarHBondContact O-CG2 3.06Å; F892-V896 PolarHBondContact O-N 3.26Å
893	R	95.1	Very high	93.1	Very high	154 Å²	154	63.7 Å²	63.7	58%	0.581	31%	0.308	S	S	*	.	H	α-helix	trans	-54.3	-48.3	169.8	178.5	167.8	169.9	154.7	4.5	113.5	E756 S891 L895 V896 E897	E756-R893 VanDerWaalsContact OE1-CA 3.3Å; E756-R893 WeakPolarHBondContact OE1-CA 3.28Å; E756-R893 WeakPolarHBondContact OE1-CB 3.45Å; E756-R893 VanDerWaalsContact OE1-CG 3.3Å; E756-R893 WeakPolarHBondContact OE1-CG 3.08Å; S891-R893 PolarHBondContact O-N 2.97Å; S891-R893 VanDerWaalsContact O-N 3.14Å; R893-L895 PolarHBondContact O-N 2.71Å; R893-V896 WeakPolarHBondContact O-CB 3.32Å; R893-V896 PolarHBondContact O-N 3.4Å; R893-E897 HydrophobicContact CG-CG 4.49Å; R893-E897 WeakPolarHBondContact CG-OE1 3.01Å; R893-E897 IonicContact CZ-OE1 3.7Å; R893-E897 IonicContact NE-OE1 2.73Å; R893-E897 PolarHBondContact NE-OE1 3.21Å; R893-E897 IonicContact NH2-OE1 3.63Å; R893-E897 PolarHBondContact NH2-OE1 2.55Å; R893-E897 VanDerWaalsContact O-CG 3.3Å; R893-E897 WeakPolarHBondContact O-CG 3.41Å; R893-E897 PolarHBondContact O-N 2.97Å
894	K	95.3	Very high	92.2	Very high	119 Å²	119	63.3 Å²	63.3	52%	0.517	31%	0.31	S	S	.	.	H	α-helix	trans	-66.6	-26.9	177.2	-68.4	176.6	177.5	175.5	0	112.2	P890 S891 F892 R898	P890-K894 HydrophobicContact CB-CB 4.26Å; S891-K894 WeakPolarHBondContact O-CA 3.35Å; S891-K894 WeakPolarHBondContact O-CB 3.1Å; S891-K894 PolarHBondContact O-N 2.92Å; F892-K894 PolarHBondContact O-N 2.86Å; K894-R898 WeakPolarHBondContact O-CB 3.42Å; K894-R898 VanDerWaalsContact O-CG 3.31Å; K894-R898 WeakPolarHBondContact O-CG 3.34Å; K894-R898 PolarHBondContact O-N 2.91Å
895	L	96.8	Very high	91.2	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-75.8	-37.9	174.3	-65.8	168.7	0	0	0	111.7	A752 V827 Y830 M877 P890 S891 F892 R893 T899	A752-L895 HydrophobicContact CB-CB 4.47Å; V827-L895 HydrophobicContact CG1-CD1 4.15Å; V827-L895 HydrophobicContact CG2-CD1 4.4Å; Y830-L895 HydrophobicContact CD1-CD1 3.72Å; Y830-L895 HydrophobicContact CE1-CB 4.26Å; Y830-L895 HydrophobicContact CE1-CD1 3.87Å; Y830-L895 HydrophobicContact CE1-CD2 4.15Å; Y830-L895 HydrophobicContact CE1-CG 4.33Å; M877-L895 HydrophobicContact CG-CD2 3.42Å; M877-L895 VanDerWaalsContact CG-CD2 3.42Å; M877-L895 HydrophobicContact SD-CD2 3.59Å; M877-L895 VanDerWaalsContact SD-CD2 3.59Å; P890-L895 HydrophobicContact CB-CD2 4.15Å; P890-L895 HydrophobicContact CB-CG 4.16Å; P890-L895 HydrophobicContact CG-CD1 4.25Å; P890-L895 HydrophobicContact CG-CD2 3.61Å; P890-L895 HydrophobicContact CG-CG 3.96Å; S891-L895 PolarHBondContact O-N 3.22Å; S891-L895 VanDerWaalsContact O-N 3.14Å; F892-L895 HydrophobicContact CD1-CD1 3.89Å; F892-L895 HydrophobicContact CE1-CD1 4.15Å; F892-L895 CarbonylContact O-C 3.53Å; F892-L895 WeakPolarHBondContact O-CA 3.42Å; F892-L895 WeakPolarHBondContact O-CB 3.24Å; F892-L895 PolarHBondContact O-N 3.31Å; F892-L895 VanDerWaalsContact O-N 3.07Å; R893-L895 PolarHBondContact O-N 2.71Å; L895-T899 WeakPolarHBondContact O-CB 3.38Å; L895-T899 WeakPolarHBondContact O-CG2 3.48Å; L895-T899 PolarHBondContact O-N 2.82Å; L895-T899 PolarHBondContact O-OG1 3.04Å
896	V	95.9	Very high	89.9	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-55	168.9	171.2	0	0	0	0	110	Y749 A752 K753 E756 F892 R893 R898 T899 E900	Y749-V896 HydrophobicContact CE2-CG1 4.31Å; A752-V896 VanDerWaalsContact C-CG2 3.41Å; A752-V896 HydrophobicContact CB-CG2 3.66Å; K753-V896 HydrophobicContact CB-CG2 4.31Å; K753-V896 HydrophobicContact CD-CG1 4.16Å; K753-V896 HydrophobicContact CG-CB 4.32Å; K753-V896 HydrophobicContact CG-CG1 3.67Å; K753-V896 HydrophobicContact CG-CG2 3.61Å; E756-V896 HydrophobicContact CB-CG2 4.2Å; F892-V896 WeakPolarHBondContact O-CG2 3.06Å; F892-V896 PolarHBondContact O-N 3.26Å; R893-V896 WeakPolarHBondContact O-CB 3.32Å; R893-V896 PolarHBondContact O-N 3.4Å; V896-R898 VanDerWaalsContact C-N 3.28Å; V896-R898 PolarHBondContact O-N 3.01Å; V896-T899 PolarHBondContact O-N 2.95Å; V896-T899 VanDerWaalsContact O-N 3.14Å; V896-T899 PolarHBondContact O-OG1 2.95Å; V896-E900 VanDerWaalsContact O-CB 3.31Å; V896-E900 WeakPolarHBondContact O-CB 3.46Å; V896-E900 PolarHBondContact O-N 2.82Å
897	E	92.7	Very high	88.9	Confident	82 Å²	82	67.7 Å²	67.7	38%	0.383	33%	0.328	S	S	.	.	H	α-helix	trans	-53.4	-42.8	178.5	-70.7	164.3	177.9	0	0	111.7	R893 L901	R893-E897 HydrophobicContact CG-CG 4.49Å; R893-E897 WeakPolarHBondContact CG-OE1 3.01Å; R893-E897 IonicContact CZ-OE1 3.7Å; R893-E897 IonicContact NE-OE1 2.73Å; R893-E897 PolarHBondContact NE-OE1 3.21Å; R893-E897 IonicContact NH2-OE1 3.63Å; R893-E897 PolarHBondContact NH2-OE1 2.55Å; R893-E897 VanDerWaalsContact O-CG 3.3Å; R893-E897 WeakPolarHBondContact O-CG 3.41Å; R893-E897 PolarHBondContact O-N 2.97Å; E897-L901 WeakPolarHBondContact O-CG 3.37Å; E897-L901 PolarHBondContact O-N 3.42Å
898	R	92.8	Very high	87.8	Confident	116 Å²	116	62.7 Å²	62.7	44%	0.438	30%	0.3	S	S	.	.	H	α-helix	trans	-73.3	-37.9	176.7	-76.5	-177.8	173.7	-164	-0.5	114.7	M877 K894 V896	M877-R898 HydrophobicContact CE-CB 3.69Å; M877-R898 HydrophobicContact SD-CB 4.47Å; K894-R898 WeakPolarHBondContact O-CB 3.42Å; K894-R898 VanDerWaalsContact O-CG 3.31Å; K894-R898 WeakPolarHBondContact O-CG 3.34Å; K894-R898 PolarHBondContact O-N 2.91Å; V896-R898 VanDerWaalsContact C-N 3.28Å; V896-R898 PolarHBondContact O-N 3.01Å
899	T	90.5	Very high	86.3	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-74.5	-32.6	179.3	48.7	0	0	0	0	112	M874 M877 L895 V896 L901 L902	M874-T899 HydrophobicContact CE-CG2 4.17Å; M877-T899 HydrophobicContact CE-CG2 3.68Å; M877-T899 HydrophobicContact SD-CG2 3.69Å; L895-T899 WeakPolarHBondContact O-CB 3.38Å; L895-T899 WeakPolarHBondContact O-CG2 3.48Å; L895-T899 PolarHBondContact O-N 2.82Å; L895-T899 PolarHBondContact O-OG1 3.04Å; V896-T899 PolarHBondContact O-N 2.95Å; V896-T899 VanDerWaalsContact O-N 3.14Å; V896-T899 PolarHBondContact O-OG1 2.95Å; T899-L901 VanDerWaalsContact C-N 3.32Å; T899-L901 PolarHBondContact O-N 2.8Å; T899-L902 PolarHBondContact O-N 2.94Å; T899-L902 VanDerWaalsContact O-N 3.15Å
900	E	89	Confident	85	Confident	63 Å²	63	63.4 Å²	63.4	29%	0.294	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-39.3	174.8	-158.9	159.6	-111.9	0	0	111.6	Y749 K753 V896 L902 L903 K908	Y749-E900 HydrophobicContact CD2-CB 4.04Å; Y749-E900 HydrophobicContact CD2-CG 4.45Å; Y749-E900 HydrophobicContact CE2-CB 3.61Å; Y749-E900 HydrophobicContact CE2-CG 3.59Å; Y749-E900 WeakPolarHBondContact CE2-OE1 3.19Å; Y749-E900 VanDerWaalsContact CZ-OE1 3.27Å; Y749-E900 PolarHBondContact OH-OE1 3.18Å; K753-E900 IonicContact NZ-OE1 3.47Å; K753-E900 PolarHBondContact NZ-OE1 2.04Å; V896-E900 VanDerWaalsContact O-CB 3.31Å; V896-E900 WeakPolarHBondContact O-CB 3.46Å; V896-E900 PolarHBondContact O-N 2.82Å; E900-L902 PolarHBondContact O-N 2.94Å; E900-L903 PolarHBondContact O-N 3.28Å; E900-K908 WeakPolarHBondContact O-CE 3.49Å; E900-K908 PolarHBondContact O-NZ 2.9Å
901	L	88.3	Confident	83.6	Confident	141 Å²	141	63.5 Å²	63.5	74%	0.738	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.8	176.1	-72	169.8	0	0	0	114.2	E897 T899	E897-L901 WeakPolarHBondContact O-CG 3.37Å; E897-L901 PolarHBondContact O-N 3.42Å; T899-L901 VanDerWaalsContact C-N 3.32Å; T899-L901 PolarHBondContact O-N 2.8Å
902	L	85.6	Confident	82.3	Confident	53 Å²	53	64.1 Å²	64.1	28%	0.277	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-5.5	179.2	-59.8	176.1	0	0	0	113.5	L745 E873 M874 M877 T899 E900	L745-L902 HydrophobicContact CD2-CB 4.04Å; L745-L902 HydrophobicContact CD2-CD1 4.37Å; E873-L902 HydrophobicContact CB-CD1 4.13Å; E873-L902 HydrophobicContact CB-CD2 4.02Å; E873-L902 HydrophobicContact CG-CD2 4.2Å; M874-L902 HydrophobicContact CE-CD1 4.11Å; M877-L902 HydrophobicContact CE-CD1 4.42Å; T899-L902 PolarHBondContact O-N 2.94Å; T899-L902 VanDerWaalsContact O-N 3.15Å; E900-L902 PolarHBondContact O-N 2.94Å
903	L	84.8	Confident	80.8	Confident	9 Å²	9	68.5 Å²	68.5	5%	0.047	34%	0.339	C	S	.	.	S	Bend	trans	-88.5	149.5	177.1	-70.2	175.7	0	0	0	112.2	L745 Y749 E900 T907 K908	L745-L903 HydrophobicContact CB-CD2 3.7Å; Y749-L903 HydrophobicContact CD1-CD1 3.51Å; Y749-L903 HydrophobicContact CD2-CD1 3.99Å; Y749-L903 HydrophobicContact CE1-CD1 3.84Å; Y749-L903 HydrophobicContact CE2-CD1 4.29Å; Y749-L903 HydrophobicContact CG-CD1 3.53Å; E900-L903 PolarHBondContact O-N 3.28Å; L903-T907 HydrophobicContact CD2-CG2 4.03Å; L903-K908 HydrophobicContact CB-CG 4.07Å; L903-K908 WeakPolarHBondContact O-CE 3.46Å; L903-K908 PolarHBondContact O-NZ 2.8Å
904	S	77.4	Confident	79	Confident	46 Å²	46	64.4 Å²	64.4	32%	0.322	33%	0.328	S	S	.	.			trans	-68.9	154.5	168.9	82.9	0	0	0	0	111.6	E742 N906 T907 K908	E742-S904 WeakPolarHBondContact OE1-CB 2.91Å; E742-S904 PolarHBondContact OE1-OG 3.25Å; S904-N906 PolarHBondContact O-N 3.11Å; S904-N906 PolarHBondContact OG-N 3.47Å; S904-T907 PolarHBondContact O-N 3.25Å; S904-T907 PolarHBondContact OG-N 3.05Å; S904-K908 WeakPolarHBondContact O-CG 3.4Å; S904-K908 PolarHBondContact O-N 2.85Å
905	E	71.1	Confident	77.2	Confident	121 Å²	121	60.8 Å²	60.8	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-59.2	-28.4	172.8	-62.2	-51.1	125.8	0	0	112.6	K908 N909	E905-K908 IonicContact OE1-NZ 3.83Å; E905-K908 PolarHBondContact OE1-NZ 2.89Å; E905-N909 WeakPolarHBondContact O-CB 3.4Å; E905-N909 PolarHBondContact O-N 2.83Å; E905-N909 VanDerWaalsContact O-N 3.08Å; E905-N909 PolarHBondContact O-ND2 2.88Å
906	N	66.6	Low	74.7	Confident	116 Å²	116	66.5 Å²	66.5	62%	0.62	35%	0.348	S	S	*	.	H	α-helix	trans	-66.4	-50.2	175.8	-173.6	49.9	0	0	0	111	S904 K908 N909 V910	S904-N906 PolarHBondContact O-N 3.11Å; S904-N906 PolarHBondContact OG-N 3.47Å; N906-K908 PolarHBondContact O-N 2.77Å; N906-N909 PolarHBondContact O-N 3.32Å; N906-V910 WeakPolarHBondContact O-CG2 3.4Å; N906-V910 PolarHBondContact O-N 2.86Å
907	T	70.9	Confident	71.7	Confident	23 Å²	23	70.1 Å²	70.1	14%	0.141	37%	0.37	C	S	.	.	H	α-helix	trans	-69.2	-33.6	-179.4	-66.4	0	0	0	0	112.6	E742 L903 S904 V910 Y911	E742-T907 HydrophobicContact CG-CG2 4.47Å; E742-T907 WeakPolarHBondContact OE1-CB 3.34Å; E742-T907 PolarHBondContact OE1-OG1 3.16Å; L903-T907 HydrophobicContact CD2-CG2 4.03Å; S904-T907 PolarHBondContact O-N 3.25Å; S904-T907 PolarHBondContact OG-N 3.05Å; T907-V910 PolarHBondContact O-N 3.36Å; T907-Y911 WeakPolarHBondContact O-CB 3.27Å; T907-Y911 PolarHBondContact O-N 3.43Å
908	K	68.5	Low	68.8	Low	33 Å²	33	70.4 Å²	70.4	14%	0.143	38%	0.379	C	S	.	.	H	α-helix	trans	-57.2	-50.2	168.2	-70	170.4	-169.1	166.3	0	111.2	E900 L903 S904 E905 N906 Y911 L912	E900-K908 WeakPolarHBondContact O-CE 3.49Å; E900-K908 PolarHBondContact O-NZ 2.9Å; L903-K908 HydrophobicContact CB-CG 4.07Å; L903-K908 WeakPolarHBondContact O-CE 3.46Å; L903-K908 PolarHBondContact O-NZ 2.8Å; S904-K908 WeakPolarHBondContact O-CG 3.4Å; S904-K908 PolarHBondContact O-N 2.85Å; E905-K908 IonicContact OE1-NZ 3.83Å; E905-K908 PolarHBondContact OE1-NZ 2.89Å; N906-K908 PolarHBondContact O-N 2.77Å; K908-Y911 PolarHBondContact O-N 3.19Å; K908-L912 WeakPolarHBondContact O-CB 3.24Å; K908-L912 VanDerWaalsContact O-CG 3.27Å; K908-L912 WeakPolarHBondContact O-CG 3.42Å; K908-L912 PolarHBondContact O-N 2.88Å
909	N	63.9	Low	66	Low	91 Å²	91	68.9 Å²	68.9	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-67	-36.1	-179.6	-77.9	-59.4	0	0	0	112.9	E905 N906 T913	E905-N909 WeakPolarHBondContact O-CB 3.4Å; E905-N909 PolarHBondContact O-N 2.83Å; E905-N909 VanDerWaalsContact O-N 3.08Å; E905-N909 PolarHBondContact O-ND2 2.88Å; N906-N909 PolarHBondContact O-N 3.32Å; N909-T913 WeakPolarHBondContact O-CB 3.47Å; N909-T913 PolarHBondContact O-N 2.72Å; N909-T913 PolarHBondContact O-OG1 3.42Å
910	V	69.3	Low	63.1	Low	75 Å²	75	72.2 Å²	72.2	46%	0.455	41%	0.408	S	S	.	.	H	α-helix	trans	-63.5	-47.2	172.3	170.9	0	0	0	0	111	N906 T907 T913 L914	N906-V910 WeakPolarHBondContact O-CG2 3.4Å; N906-V910 PolarHBondContact O-N 2.86Å; T907-V910 PolarHBondContact O-N 3.36Å; V910-T913 PolarHBondContact O-N 3.19Å; V910-L914 HydrophobicContact CG1-CD1 4Å; V910-L914 WeakPolarHBondContact O-CG 3.42Å; V910-L914 PolarHBondContact O-N 2.71Å
911	Y	68.1	Low	60.6	Low	18 Å²	18	71.7 Å²	71.7	7%	0.071	41%	0.411	C	S	.	.	H	α-helix	trans	-61	-46.8	175.9	175.4	-89.7	0	0	0	111.9	V651 N652 Y749 Q750 K753 T907 K908 T913 L914 S915	V651-Y911 HydrophobicContact CG1-CE2 4.37Å; V651-Y911 VanDerWaalsContact CG1-OH 3.28Å; V651-Y911 WeakPolarHBondContact CG1-OH 3.27Å; N652-Y911 PolarHBondContact OD1-OH 3.16Å; N652-Y911 VanDerWaalsContact OD1-OH 3.08Å; Y749-Y911 AromaticContact CE1-CD1 3.73Å; Y749-Y911 HydrophobicContact CE1-CD1 3.73Å; Y749-Y911 HydrophobicContact CE1-CD2 4.02Å; Y749-Y911 HydrophobicContact CE1-CE1 4.05Å; Y749-Y911 HydrophobicContact CE1-CE2 4.3Å; Y749-Y911 AromaticContact CE1-CG 3.73Å; Y749-Y911 HydrophobicContact CE1-CG 3.73Å; Q750-Y911 HydrophobicContact CG-CD2 3.98Å; Q750-Y911 HydrophobicContact CG-CE2 3.93Å; K753-Y911 HydrophobicContact CD-CE1 3.95Å; T907-Y911 WeakPolarHBondContact O-CB 3.27Å; T907-Y911 PolarHBondContact O-N 3.43Å; K908-Y911 PolarHBondContact O-N 3.19Å; Y911-T913 VanDerWaalsContact C-N 3.29Å; Y911-T913 PolarHBondContact O-N 3.26Å; Y911-L914 PolarHBondContact O-N 3.21Å; Y911-L914 VanDerWaalsContact O-N 3.12Å; Y911-S915 PolarHBondContact O-N 2.85Å; Y911-S915 PolarHBondContact O-OG 3.07Å
912	L	68.3	Low	57.7	Low	72 Å²	72	71.9 Å²	71.9	38%	0.377	41%	0.408	S	S	.	.	H	α-helix	trans	-62.7	-35.8	177.8	-72.2	169.6	0	0	0	112.1	K908 S915 N916	K908-L912 WeakPolarHBondContact O-CB 3.24Å; K908-L912 VanDerWaalsContact O-CG 3.27Å; K908-L912 WeakPolarHBondContact O-CG 3.42Å; K908-L912 PolarHBondContact O-N 2.88Å; L912-S915 WeakPolarHBondContact CA-OG 3.29Å; L912-S915 PolarHBondContact O-OG 2.91Å; L912-S915 VanDerWaalsContact O-OG 3.1Å; L912-N916 WeakPolarHBondContact O-CB 3.34Å; L912-N916 PolarHBondContact O-N 2.8Å; L912-N916 PolarHBondContact O-ND2 3.46Å; L912-N916 PolarHBondContact O-OD1 2.62Å
913	T	64.9	Low	54.9	Low	98 Å²	98	77 Å²	77	60%	0.601	43%	0.431	S	S	*	.	H	α-helix	trans	-64.8	-43.9	173.3	-57.3	0	0	0	0	110.7	N909 V910 Y911 N916 T917	N909-T913 WeakPolarHBondContact O-CB 3.47Å; N909-T913 PolarHBondContact O-N 2.72Å; N909-T913 PolarHBondContact O-OG1 3.42Å; V910-T913 PolarHBondContact O-N 3.19Å; Y911-T913 VanDerWaalsContact C-N 3.29Å; Y911-T913 PolarHBondContact O-N 3.26Å; T913-N916 PolarHBondContact O-N 3.33Å; T913-T917 PolarHBondContact O-N 2.79Å; T913-T917 PolarHBondContact O-OG1 3.33Å; T913-T917 VanDerWaalsContact O-OG1 3.05Å
914	L	58.6	Low	52.3	Low	67 Å²	67	83.3 Å²	83.3	35%	0.351	46%	0.46	S	S	.	.	H	α-helix	trans	-66.4	-36.6	177.6	-70.9	166	0	0	0	112.9	V780 V910 Y911 T917	V780-L914 HydrophobicContact CG2-CD1 4.01Å; V910-L914 HydrophobicContact CG1-CD1 4Å; V910-L914 WeakPolarHBondContact O-CG 3.42Å; V910-L914 PolarHBondContact O-N 2.71Å; Y911-L914 PolarHBondContact O-N 3.21Å; Y911-L914 VanDerWaalsContact O-N 3.12Å; L914-T917 WeakPolarHBondContact CA-OG1 3.49Å; L914-T917 PolarHBondContact O-OG1 2.95Å
915	S	57.6	Low	50	Low	43 Å²	43	89.4 Å²	89.4	30%	0.301	48%	0.476	S	S	.	.	H	α-helix	trans	-75	-28.2	174.7	67.3	0	0	0	0	113.5	Y911 L912	Y911-S915 PolarHBondContact O-N 2.85Å; Y911-S915 PolarHBondContact O-OG 3.07Å; L912-S915 WeakPolarHBondContact CA-OG 3.29Å; L912-S915 PolarHBondContact O-OG 2.91Å; L912-S915 VanDerWaalsContact O-OG 3.1Å
916	N	42.9	Very low	47.7	Very low	121 Å²	121	87.9 Å²	87.9	65%	0.647	48%	0.484	S	S	*	.	H	α-helix	trans	-93.3	-8.3	-178	-63.4	-5.2	0	0	0	113.3	L912 T913 P918	L912-N916 WeakPolarHBondContact O-CB 3.34Å; L912-N916 PolarHBondContact O-N 2.8Å; L912-N916 PolarHBondContact O-ND2 3.46Å; L912-N916 PolarHBondContact O-OD1 2.62Å; T913-N916 PolarHBondContact O-N 3.33Å; N916-P918 WeakPolarHBondContact O-CD 3.33Å
917	T	34.3	Very low	45.8	Very low	82 Å²	82	88 Å²	88	50%	0.503	49%	0.491	S	S	.	.	S	Bend	trans	-56.6	117.8	160.5	-2.7	0	0	0	0	108.4	T913 L914 N919	T913-T917 PolarHBondContact O-N 2.79Å; T913-T917 PolarHBondContact O-OG1 3.33Å; T913-T917 VanDerWaalsContact O-OG1 3.05Å; L914-T917 WeakPolarHBondContact CA-OG1 3.49Å; L914-T917 PolarHBondContact O-OG1 2.95Å; T917-N919 PolarHBondContact O-N 2.92Å
918	P	31.6	Very low	43.6	Very low	89 Å²	89	92.8 Å²	92.8	58%	0.578	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-63.2	127	-177.6	24.7	-33.1	0	0	0	109.7	N916 A920	N916-P918 WeakPolarHBondContact O-CD 3.33Å; P918-A920 PolarHBondContact O-N 3.22Å; P918-A920 VanDerWaalsContact O-N 3.09Å
919	N	33.7	Very low	41.6	Very low	83 Å²	83	102.7 Å²	102.7	44%	0.444	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-54.3	119.9	170.9	-77	-46.3	0	0	0	108.6	T917 S921 E922	T917-N919 PolarHBondContact O-N 2.92Å; N919-S921 PolarHBondContact O-N 2.99Å; N919-E922 PolarHBondContact O-N 3.03Å
920	A	30.7	Very low	39.8	Very low	72 Å²	72	110 Å²	110	60%	0.595	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-10.7	-178	0	0	0	0	0	113.7	P918	P918-A920 PolarHBondContact O-N 3.22Å; P918-A920 VanDerWaalsContact O-N 3.09Å
921	S	34.5	Very low	37.6	Very low	53 Å²	53	114.6 Å²	114.6	37%	0.371	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	-20.8	174.2	54.6	0	0	0	0	115.6	N919	N919-S921 PolarHBondContact O-N 2.99Å
922	E	28.1	Very low	35.5	Very low	145 Å²	145	119 Å²	119	68%	0.678	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-19.3	-169.1	-69.9	-170.1	152.4	0	0	115.7	N919	N919-E922 PolarHBondContact O-N 3.03Å
923	Q	27.4	Very low	33.4	Very low	161 Å²	161	121.1 Å²	121.1	75%	0.752	66%	0.658	S	S	*	*	S	Bend	trans	-106.9	4.2	-179.4	-81.5	-173.6	-22.8	0	0	115.9
924	Q	30.7	Very low	31.5	Very low	140 Å²	140	123.2 Å²	123.2	65%	0.654	67%	0.67	S	S	*	*			trans	-124.8	9.9	179.1	-69.8	-165.7	-12.8	0	0	116.1	A926	Q924-A926 VanDerWaalsContact C-N 3.31Å; Q924-A926 PolarHBondContact O-N 3.38Å
925	R	27.5	Very low	29.8	Very low	175 Å²	175	125.8 Å²	125.8	66%	0.66	69%	0.692	S	S	*	*			trans	-80.3	77.6	166.1	-77.5	-173.4	172.2	-170.9	-3	111
926	A	23.4	Very low	28.2	Very low	88 Å²	88	129.4 Å²	129.4	73%	0.727	72%	0.718	S	S	*	*			trans	-62.2	130.6	168.6	0	0	0	0	0	110.3	Q924 S928	Q924-A926 VanDerWaalsContact C-N 3.31Å; Q924-A926 PolarHBondContact O-N 3.38Å; A926-S928 PolarHBondContact O-N 3.27Å
927	P	26.9	Very low	27.3	Very low	120 Å²	120	129 Å²	129	78%	0.779	72%	0.72	S	S	*	*			trans	-70.5	121	178.9	27.6	-33.4	0	0	0	110.5	R929	P927-R929 PolarHBondContact O-N 2.79Å
928	S	25.6	Very low	26.9	Very low	123 Å²	123	131.2 Å²	131.2	86%	0.86	73%	0.733	S	S	*	*			trans	-69.5	99	-179.6	55.7	0	0	0	0	111.4	A926 R930	A926-S928 PolarHBondContact O-N 3.27Å; S928-R930 PolarHBondContact O-N 3.2Å
929	R	25.6	Very low	26.5	Very low	240 Å²	240	131.5 Å²	131.5	91%	0.906	74%	0.744	S	S	*	*			trans	-62.5	119.7	174.3	-76.6	-179.6	167.8	-178.6	-4.1	111.6	P927	P927-R929 PolarHBondContact O-N 2.79Å
930	R	25.4	Very low	26.5	Very low	246 Å²	246	133.7 Å²	133.7	93%	0.928	76%	0.762	S	S	*	*			trans	-127.1	156	142.1	-77.6	-165.5	172.9	-163.4	-1.2	109	S928	S928-R930 PolarHBondContact O-N 3.2Å
931	L	24.5	Very low	26.4	Very low	170 Å²	170	136.3 Å²	136.3	89%	0.89	77%	0.771	S	S	*	*			trans	-91.3	125.8	-158.4	-72.5	69.3	0	0	0	113.5
932	S	24.1	Very low	26	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	79%	0.794	S	S	*	*			trans	-178.2	103.8	133.1	54.5	0	0	0	0	108.5
933	S	23.8	Very low	26.6	Very low	115 Å²	115	140.7 Å²	140.7	80%	0.804	80%	0.795	S	S	*	*				77.8	86.3	74.9	-178.1	0	0	0	0	114.2
934	V	25.3	Very low	26.5	Very low	142 Å²	142	140.3 Å²	140.3	86%	0.861	80%	0.797	S	S	*	*			trans	167.4	149.5	130.1	156.2	0	0	0	0	109.4
935	C	21.7	Very low	26.3	Very low	121 Å²	121	142 Å²	142	82%	0.818	81%	0.81	S	S	*	*			trans	-79.4	153.7	-173.4	-54.7	0	0	0	0	114.6
936	S	24	Very low	26.2	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	81%	0.814	S	S	*	*				-159	179.1	116.5	-155.6	0	0	0	0	111.2
937	T	24.9	Very low	26.3	Very low	113 Å²	113	144.5 Å²	144.5	69%	0.693	82%	0.819	S	S	*	*			trans	-119.8	161.6	-154.8	52.7	0	0	0	0	116.4
938	T	25.6	Very low	26.2	Very low	128 Å²	128	144.4 Å²	144.4	79%	0.785	82%	0.821	S	S	*	*			trans	59.5	103.7	148.8	47.7	0	0	0	0	121
939	A	22.3	Very low	26.2	Very low	96 Å²	96	144.3 Å²	144.3	79%	0.793	82%	0.815	S	S	*	*				47.8	163.3	119.7	0	0	0	0	0	122.5
940	P	35	Very low	26.3	Very low	129 Å²	129	139.9 Å²	139.9	84%	0.838	81%	0.809	S	S	*	*			cis	-123.1	-151.5	-21.6	37.3	-18.7	0	0	0	111.9
941	T	28	Very low	26.3	Very low	127 Å²	127	133.9 Å²	133.9	78%	0.779	80%	0.8	S	S	*	*			trans	-98.5	145.2	-169.1	48.3	0	0	0	0	116.7
942	Q	25.6	Very low	26.4	Very low	182 Å²	182	135.7 Å²	135.7	85%	0.85	80%	0.801	S	S	*	*			trans	67.3	161.7	155.9	-77.9	-168.9	-6.6	0	0	118.8
943	P	42.2	Very low	26.5	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	80%	0.799	S	S	*	*			cis	-132.6	173.5	-37.7	37.9	-23.9	0	0	0	111.9
944	L	24.5	Very low	27.1	Very low	153 Å²	153	138.4 Å²	138.4	80%	0.801	80%	0.797	S	S	*	*			trans	177.6	140.3	145	-105	165.8	0	0	0	112.1
945	L	26.8	Very low	27.2	Very low	176 Å²	176	142.3 Å²	142.3	92%	0.921	80%	0.798	S	S	*	*				-169.4	129.6	124	-107.5	168	0	0	0	109.2
946	Q	25	Very low	27.6	Very low	161 Å²	161	146.7 Å²	146.7	75%	0.752	82%	0.82	S	S	*	*			trans	-134.4	129.1	179.7	-175.3	174.2	-1.9	0	0	108.8
947	N	25.5	Very low	27.7	Very low	154 Å²	154	148.1 Å²	148.1	82%	0.824	82%	0.82	S	S	*	*			trans	9.2	124.5	173.7	-57.9	6.5	0	0	0	119.7
948	S	24.5	Very low	27.9	Very low	117 Å²	117	149.9 Å²	149.9	82%	0.818	83%	0.826	S	S	*	*			trans	-137.9	126.8	150.9	60	0	0	0	0	110.2
949	V	26.8	Very low	28	Very low	122 Å²	122	151.2 Å²	151.2	74%	0.739	83%	0.828	S	S	*	*			trans	-157	143.6	-176	174.3	0	0	0	0	106.9
950	D	26.6	Very low	28.3	Very low	147 Å²	147	154.4 Å²	154.4	79%	0.786	83%	0.831	S	S	*	*			cis	-85.9	-140.9	-8.1	-59.3	-84.4	0	0	0	109.8
951	V	26.4	Very low	27.9	Very low	119 Å²	119	156 Å²	156	72%	0.721	83%	0.83	S	S	*	*			cis	-144.4	145.6	6.4	177.6	0	0	0	0	108.7
952	F	25.9	Very low	27.9	Very low	209 Å²	209	157.9 Å²	157.9	92%	0.917	83%	0.833	S	S	*	*			trans	-134.8	141.6	154.4	-117.4	-90.5	0	0	0	109.6
953	L	26.3	Very low	28.1	Very low	142 Å²	142	156.2 Å²	156.2	74%	0.743	83%	0.832	S	S	*	*			trans	-92.6	159.8	161.9	-117.8	93	0	0	0	109.4
954	D	35.8	Very low	27	Very low	141 Å²	141	159.9 Å²	159.9	75%	0.754	84%	0.842	S	S	*	*			trans	-29.9	137.8	-179.4	-48.3	-45.3	0	0	0	117.2
955	Y	26.9	Very low	27.2	Very low	225 Å²	225	160.5 Å²	160.5	88%	0.882	85%	0.846	S	S	*	*				-169.7	134.1	123.2	-110	-69	0	0	0	113.3
956	V	30.1	Very low	27.2	Very low	213 Å²	213	159.1 Å²	159.1	100%	1.291	84%	0.839	S	S	*	*			trans	65.1	0	169.3	-165.9	0	0	0	0	117

Retrieved 956 of 956 residues in 402 ms (Link to these results)

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