A0A077ZHA2_TRITR Loading...

LBP

AlphaFold DB , UniProt , Accession A0A077ZHA2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 543 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.7	Very low	46.5	Very low	222 Å²	222	136.7 Å²	136.7	100%	1.094	68%	0.675	S	S	*	*				0	-39.9	0	-104.5	169.8	131.4	0	0	114.7	Y3 A4	M1-Y3 PolarHBondContact O-N 3.08Å; M1-A4 PolarHBondContact O-N 3.4Å
2	K	43.6	Very low	46.2	Very low	186 Å²	186	130.2 Å²	130.2	81%	0.809	66%	0.658	S	S	*	*	H	α-helix	trans	-63.5	-32.9	178.6	-77.9	-177	174.8	180	0	115.1
3	Y	47.6	Very low	45.8	Very low	208 Å²	208	122.8 Å²	122.8	82%	0.816	64%	0.635	S	S	*	*	H	α-helix	trans	-73.6	-28.9	178.8	-78.2	-81	0	0	0	114.4	M1 L5 V7	M1-Y3 PolarHBondContact O-N 3.08Å; Y3-L5 VanDerWaalsContact C-N 3.35Å; Y3-V7 WeakPolarHBondContact O-CG2 3.39Å; Y3-V7 PolarHBondContact O-N 3.49Å
4	A	46.9	Very low	45.2	Very low	71 Å²	71	122.5 Å²	122.5	59%	0.587	63%	0.634	S	S	*	*	H	α-helix	trans	-71.5	-30.7	177.5	0	0	0	0	0	112.3	M1 W8	M1-A4 PolarHBondContact O-N 3.4Å; A4-W8 PolarHBondContact O-N 3.3Å
5	L	41.8	Very low	44.8	Very low	115 Å²	115	124.7 Å²	124.7	60%	0.602	64%	0.637	S	S	*	*	H	α-helix	trans	-73.7	-33.9	-179.9	-153.1	78.7	0	0	0	112.4	Y3 W8 L9	Y3-L5 VanDerWaalsContact C-N 3.35Å; L5-W8 PolarHBondContact O-N 3.01Å; L5-L9 PolarHBondContact O-N 3.23Å
6	H	48	Very low	44.4	Very low	134 Å²	134	119.4 Å²	119.4	62%	0.62	62%	0.624	S	S	*	*	H	α-helix	trans	-72.9	-36.2	176	-83.9	2.5	0	0	0	113.2	W8 L9 C10	H6-W8 VanDerWaalsContact C-N 3.31Å; H6-W8 PolarHBondContact O-N 3.38Å; H6-L9 PolarHBondContact O-N 3.49Å; H6-C10 PolarHBondContact O-N 3.36Å; H6-C10 PolarHBondContact O-SG 3.07Å
7	V	59.6	Low	43.8	Very low	89 Å²	89	119.6 Å²	119.6	54%	0.539	62%	0.621	S	S	.	*	H	α-helix	trans	-66.6	-36.4	173.8	177.2	0	0	0	0	110.8	Y3 C10 L11	Y3-V7 WeakPolarHBondContact O-CG2 3.39Å; Y3-V7 PolarHBondContact O-N 3.49Å; V7-C10 PolarHBondContact O-N 3.47Å; V7-L11 HydrophobicContact CG1-CD1 3.86Å; V7-L11 HydrophobicContact CG1-CG 4.46Å; V7-L11 WeakPolarHBondContact O-CB 3.48Å; V7-L11 WeakPolarHBondContact O-CG 2.92Å; V7-L11 PolarHBondContact O-N 3.19Å
8	W	43.8	Very low	43.4	Very low	199 Å²	199	118.8 Å²	118.8	75%	0.754	62%	0.621	S	S	*	*	H	α-helix	trans	-70.7	-37.4	177.6	-141.2	70.2	0	0	0	113	A4 L5 H6 L11 A12	A4-W8 PolarHBondContact O-N 3.3Å; L5-W8 PolarHBondContact O-N 3.01Å; H6-W8 VanDerWaalsContact C-N 3.31Å; H6-W8 PolarHBondContact O-N 3.38Å; W8-L11 PolarHBondContact O-N 3.4Å; W8-A12 VanDerWaalsContact O-CB 3.29Å; W8-A12 WeakPolarHBondContact O-CB 3.46Å; W8-A12 PolarHBondContact O-N 2.02Å
9	L	46.5	Very low	43.3	Very low	112 Å²	112	119.4 Å²	119.4	59%	0.586	62%	0.615	S	S	*	*	H	α-helix	trans	-67.7	-37.9	173.4	-81.9	158.8	0	0	0	112.5	L5 H6 G13	L5-L9 PolarHBondContact O-N 3.23Å; H6-L9 PolarHBondContact O-N 3.49Å; L9-G13 PolarHBondContact O-N 3.2Å; L9-G13 VanDerWaalsContact O-N 3.09Å
10	C	48	Very low	42.8	Very low	88 Å²	88	119 Å²	119	60%	0.595	61%	0.613	S	S	*	*	H	α-helix	trans	-69.2	-37.5	174.8	-74.8	0	0	0	0	112.8	H6 V7 G13 L14	H6-C10 PolarHBondContact O-N 3.36Å; H6-C10 PolarHBondContact O-SG 3.07Å; V7-C10 PolarHBondContact O-N 3.47Å; C10-G13 PolarHBondContact O-N 2.92Å; C10-L14 PolarHBondContact O-N 3.07Å; C10-L14 VanDerWaalsContact O-N 3.11Å
11	L	40.7	Very low	42.2	Very low	80 Å²	80	123.1 Å²	123.1	42%	0.419	62%	0.621	S	S	.	*	H	α-helix	trans	-72.5	-36.9	176.3	-73.2	169.4	0	0	0	112.2	V7 W8 G13 L14 F15	V7-L11 HydrophobicContact CG1-CD1 3.86Å; V7-L11 HydrophobicContact CG1-CG 4.46Å; V7-L11 WeakPolarHBondContact O-CB 3.48Å; V7-L11 WeakPolarHBondContact O-CG 2.92Å; V7-L11 PolarHBondContact O-N 3.19Å; W8-L11 PolarHBondContact O-N 3.4Å; L11-G13 VanDerWaalsContact C-N 3.27Å; L11-G13 PolarHBondContact O-N 2.91Å; L11-L14 PolarHBondContact O-N 3.03Å; L11-F15 HydrophobicContact CD2-CE2 4.4Å; L11-F15 WeakPolarHBondContact O-CD2 3.01Å; L11-F15 PolarHBondContact O-N 2.79Å
12	A	43.5	Very low	42.2	Very low	58 Å²	58	121.6 Å²	121.6	48%	0.479	60%	0.603	S	S	.	*	H	α-helix	trans	-63	-34.7	172.6	0	0	0	0	0	111.9	W8 G16	W8-A12 VanDerWaalsContact O-CB 3.29Å; W8-A12 WeakPolarHBondContact O-CB 3.46Å; W8-A12 PolarHBondContact O-N 2.02Å; A12-G16 PolarHBondContact O-N 2.86Å
13	G	40.5	Very low	42.2	Very low	35 Å²	35	116 Å²	116	36%	0.361	58%	0.579	S	S	.	*	H	α-helix	trans	-64.4	-44.4	171.2	0	0	0	0	0	113	L9 C10 L11 H17	L9-G13 PolarHBondContact O-N 3.2Å; L9-G13 VanDerWaalsContact O-N 3.09Å; C10-G13 PolarHBondContact O-N 2.92Å; L11-G13 VanDerWaalsContact C-N 3.27Å; L11-G13 PolarHBondContact O-N 2.91Å; G13-H17 PolarHBondContact O-CD2 3.09Å; G13-H17 PolarHBondContact O-N 2.94Å
14	L	37.3	Very low	41.6	Very low	118 Å²	118	110 Å²	110	62%	0.618	57%	0.567	S	S	*	*	H	α-helix	trans	-70	-37.4	-178.1	-82.1	157.9	0	0	0	113.4	C10 L11	C10-L14 PolarHBondContact O-N 3.07Å; C10-L14 VanDerWaalsContact O-N 3.11Å; L11-L14 PolarHBondContact O-N 3.03Å
15	F	39.9	Very low	41.3	Very low	155 Å²	155	114.5 Å²	114.5	68%	0.68	58%	0.576	S	S	*	*	H	α-helix	trans	-81.3	-25.2	177	-76	-76	0	0	0	113.5	L11 H17	L11-F15 HydrophobicContact CD2-CE2 4.4Å; L11-F15 WeakPolarHBondContact O-CD2 3.01Å; L11-F15 PolarHBondContact O-N 2.79Å; F15-H17 VanDerWaalsContact C-N 3.31Å
16	G	38	Very low	41.3	Very low	41 Å²	41	113.7 Å²	113.7	42%	0.423	58%	0.58	S	S	.	*	H	α-helix	trans	-67.4	-30.5	171.5	0	0	0	0	0	113.2	A12	A12-G16 PolarHBondContact O-N 2.86Å
17	H	33.7	Very low	41.3	Very low	123 Å²	123	116.7 Å²	116.7	57%	0.569	59%	0.591	S	S	*	*	H	α-helix	trans	-79.6	-33.7	-178.5	-84.6	-65.8	0	0	0	114.1	G13 F15 W19 L20 W21	G13-H17 PolarHBondContact O-CD2 3.09Å; G13-H17 PolarHBondContact O-N 2.94Å; F15-H17 VanDerWaalsContact C-N 3.31Å; H17-W19 PolarHBondContact O-N 2.93Å; H17-L20 PolarHBondContact O-N 3.13Å; H17-W21 PolarHBondContact O-N 2.81Å
18	V	37.1	Very low	41	Very low	104 Å²	104	120.6 Å²	120.6	63%	0.63	60%	0.601	S	S	*	*	H	α-helix	trans	-64.6	-30.8	179.2	178.6	0	0	0	0	111.8	L20 W21	V18-L20 PolarHBondContact O-N 2.62Å; V18-W21 PolarHBondContact O-N 2.97Å
19	W	41	Very low	42.2	Very low	131 Å²	131	112.9 Å²	112.9	50%	0.496	58%	0.577	S	S	.	*	H	α-helix	trans	-67.2	-34.7	178.3	-120.8	74.9	0	0	0	113.1	H17 E392 V393	H17-W19 PolarHBondContact O-N 2.93Å; W19-E392 HydrophobicContact CZ2-CG 4.29Å; W19-V393 HydrophobicContact CH2-CG2 4.26Å
20	L	33.2	Very low	43.9	Very low	110 Å²	110	112.1 Å²	112.1	58%	0.576	57%	0.574	S	S	*	*	H	α-helix	trans	-74.7	-29	177.1	-77.3	163.6	0	0	0	112.3	H17 V18 R22 F23 S24	H17-L20 PolarHBondContact O-N 3.13Å; V18-L20 PolarHBondContact O-N 2.62Å; L20-R22 VanDerWaalsContact C-N 3.27Å; L20-R22 PolarHBondContact O-N 3.36Å; L20-F23 CarbonylContact O-C 3.54Å; L20-F23 PolarHBondContact O-N 3.28Å; L20-F23 VanDerWaalsContact O-N 3.09Å; L20-S24 WeakPolarHBondContact O-CA 3.33Å; L20-S24 WeakPolarHBondContact O-CB 3.35Å; L20-S24 PolarHBondContact O-N 3.41Å
21	W	31.5	Very low	46	Very low	207 Å²	207	109.6 Å²	109.6	78%	0.784	55%	0.554	S	S	*	*	H	α-helix	trans	-66.9	-23.3	-178.5	-85.9	65.3	0	0	0	114.2	H17 V18 F23	H17-W21 PolarHBondContact O-N 2.81Å; V18-W21 PolarHBondContact O-N 2.97Å; W21-F23 PolarHBondContact O-N 3.36Å
22	R	43.1	Very low	48.5	Very low	189 Å²	189	106.9 Å²	106.9	71%	0.713	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.5	174.2	-126.7	179.7	-171.3	172.3	2.1	113.1	L20 E392	L20-R22 VanDerWaalsContact C-N 3.27Å; L20-R22 PolarHBondContact O-N 3.36Å; R22-E392 IonicContact NH1-OE2 3.8Å; R22-E392 PolarHBondContact NH1-OE2 3.31Å; R22-E392 VanDerWaalsContact NH1-OE2 3.12Å
23	F	45.2	Very low	51	Low	69 Å²	69	104.1 Å²	104.1	30%	0.303	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-8.4	-179.3	-66.5	-70.3	0	0	0	114.5	L20 W21 E25 F304	L20-F23 CarbonylContact O-C 3.54Å; L20-F23 PolarHBondContact O-N 3.28Å; L20-F23 VanDerWaalsContact O-N 3.09Å; W21-F23 PolarHBondContact O-N 3.36Å; F23-E25 PolarHBondContact O-N 2.88Å; F23-F304 HydrophobicContact CB-CB 4.33Å; F23-F304 HydrophobicContact CD1-CB 3.6Å; F23-F304 AromaticContact CD1-CD1 3.66Å; F23-F304 HydrophobicContact CD1-CD1 3.66Å; F23-F304 AromaticContact CD1-CG 3.81Å; F23-F304 HydrophobicContact CD1-CG 3.81Å; F23-F304 HydrophobicContact CE1-CB 4.33Å; F23-F304 AromaticContact CE1-CD1 3.71Å; F23-F304 HydrophobicContact CE1-CD1 3.71Å; F23-F304 HydrophobicContact CE1-CE1 4.21Å; F23-F304 HydrophobicContact CE1-CG 4.06Å; F23-F304 HydrophobicContact CG-CB 4.32Å; F23-F304 HydrophobicContact CG-CD1 4.34Å; F23-F304 HydrophobicContact CZ-CD1 4.45Å
24	S	33.7	Very low	53.6	Low	82 Å²	82	103.3 Å²	103.3	57%	0.573	51%	0.506	S	S	*	.			trans	-81.4	56.7	179.6	176.9	0	0	0	0	112.3	L20	L20-S24 WeakPolarHBondContact O-CA 3.33Å; L20-S24 WeakPolarHBondContact O-CB 3.35Å; L20-S24 PolarHBondContact O-N 3.41Å
25	E	40.6	Very low	56.3	Low	166 Å²	166	97.9 Å²	97.9	78%	0.776	48%	0.478	S	S	*	.			trans	-89.9	105.5	154.4	-88.2	-176.1	168.1	0	0	108.9	F23	F23-E25 PolarHBondContact O-N 2.88Å
26	S	42	Very low	58.8	Low	97 Å²	97	91.7 Å²	91.7	68%	0.678	45%	0.453	S	S	*	.			trans	22	134.4	149.9	75.8	0	0	0	0	120.4
27	K	47.6	Very low	61.5	Low	197 Å²	197	90.3 Å²	90.3	86%	0.857	44%	0.435	S	S	*	.	S	Bend	trans	39.1	114.1	153.7	-71.8	-175.9	178.1	179.8	0	115.9	S29	K27-S29 PolarHBondContact O-N 3.24Å
28	K	55	Low	64.4	Low	172 Å²	172	86.1 Å²	86.1	75%	0.748	42%	0.416	S	S	*	.			trans	-14.4	98.4	169.9	-168.8	176.8	-174.6	177.4	0	111.6	D30	K28-D30 PolarHBondContact O-N 3.15Å
29	S	67.4	Low	67.1	Low	37 Å²	37	81.3 Å²	81.3	26%	0.259	39%	0.387	S	S	.	.			trans	-77.2	125	-175.7	-165.7	0	0	0	0	108.7	K27 N31	K27-S29 PolarHBondContact O-N 3.24Å; S29-N31 PolarHBondContact O-N 3.41Å; S29-N31 VanDerWaalsContact O-N 3.17Å; S29-N31 PolarHBondContact OG-ND2 3.26Å
30	D	82.2	Confident	69.7	Low	95 Å²	95	77.3 Å²	77.3	51%	0.508	38%	0.376	S	S	.	.			trans	-75.7	8.2	173.2	-66	-27.9	0	0	0	112.5	K28 N273	K28-D30 PolarHBondContact O-N 3.15Å; D30-N273 PolarHBondContact O-ND2 2.72Å
31	N	91.9	Very high	72.5	Confident	36 Å²	36	76 Å²	76	19%	0.193	37%	0.366	C	S	.	.			trans	-65.2	132.3	177.5	-68.7	-25.1	0	0	0	109.9	S29 P306 R308	S29-N31 PolarHBondContact O-N 3.41Å; S29-N31 VanDerWaalsContact O-N 3.17Å; S29-N31 PolarHBondContact OG-ND2 3.26Å; N31-P306 HydrophobicContact CB-CB 3.98Å; N31-P306 VanDerWaalsContact CB-O 3.3Å; N31-P306 WeakPolarHBondContact CB-O 3.46Å; N31-P306 PolarHBondContact ND2-O 3.35Å; N31-P306 WeakPolarHBondContact O-CG 3.41Å; N31-R308 WeakPolarHBondContact ND2-CG 3.33Å; N31-R308 PolarHBondContact ND2-N 3.35Å
32	P	94.2	Very high	75.5	Confident	22 Å²	22	66.1 Å²	66.1	14%	0.143	33%	0.329	C	S	.	.			trans	-74.5	140.8	174.3	27.9	-31.6	0	0	0	111.7	I34 A35 V272 A289 I290	P32-I34 VanDerWaalsContact C-N 3.35Å; P32-I34 WeakPolarHBondContact CB-O 3.33Å; P32-A35 HydrophobicContact CG-CB 4.07Å; P32-V272 HydrophobicContact CB-CG2 4.23Å; P32-A289 HydrophobicContact CB-CB 3.87Å; P32-A289 HydrophobicContact CG-CB 4.08Å; P32-I290 CarbonylContact C-O 3.58Å; P32-I290 WeakPolarHBondContact CA-O 3.43Å; P32-I290 WeakPolarHBondContact CB-O 3.38Å
33	G	95.3	Very high	77.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	S	Bend	trans	-74.6	-29.8	165.4	0	0	0	0	0	112.1	I290 K291 T325	G33-I290 PolarHBondContact N-O 2.94Å; G33-K291 WeakPolarHBondContact CA-O 3.46Å; G33-K291 PolarHBondContact N-O 3.35Å; G33-T325 WeakPolarHBondContact CA-OG1 3.46Å; G33-T325 PolarHBondContact O-N 3.07Å; G33-T325 PolarHBondContact O-OG1 3.17Å
34	I	94.8	Very high	80.1	Confident	18 Å²	18	58.1 Å²	58.1	9%	0.092	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.7	172.9	-61	168.6	0	0	0	109.2	P32 V36 V267 I290 I322 V323 I324 P328	P32-I34 VanDerWaalsContact C-N 3.35Å; P32-I34 WeakPolarHBondContact CB-O 3.33Å; I34-V36 HydrophobicContact CG2-CG2 4.45Å; I34-V267 HydrophobicContact CD1-CG1 4.22Å; I34-I290 HydrophobicContact CB-CB 4.08Å; I34-I290 HydrophobicContact CB-CG2 4.25Å; I34-I290 HydrophobicContact CG2-CD1 4.48Å; I34-I290 PolarHBondContact N-O 3.2Å; I34-I290 WeakPolarHBondContact O-CA 3.19Å; I34-I290 VanDerWaalsContact O-CB 3.29Å; I34-I290 WeakPolarHBondContact O-CB 3.22Å; I34-I290 PolarHBondContact O-N 3.3Å; I34-I290 VanDerWaalsContact O-O 3.05Å; I34-I322 HydrophobicContact CG2-CG2 4.09Å; I34-V323 CarbonylContact C-O 3.5Å; I34-V323 VanDerWaalsContact CA-O 3.28Å; I34-V323 WeakPolarHBondContact CA-O 3.37Å; I34-I324 HydrophobicContact CG1-CG2 4.41Å; I34-P328 HydrophobicContact CG1-CG 4.12Å
35	A	94.2	Very high	82.9	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.033	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.4	174.6	0	0	0	0	0	110.7	P32 L287 V323	P32-A35 HydrophobicContact CG-CB 4.07Å; A35-L287 HydrophobicContact CB-CD1 3.89Å; A35-V323 HydrophobicContact CB-CB 4.21Å; A35-V323 PolarHBondContact N-O 3.01Å; A35-V323 PolarHBondContact O-N 3.27Å
36	V	93.7	Very high	85.3	Confident	25 Å²	25	50.7 Å²	50.7	15%	0.152	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	125.1	173.9	-177.2	0	0	0	0	108.8	I34 I38 L288 I290 L320 Y321 I322	I34-V36 HydrophobicContact CG2-CG2 4.45Å; V36-I38 HydrophobicContact CG1-CG1 4.39Å; V36-L288 HydrophobicContact CB-CB 4.2Å; V36-L288 PolarHBondContact N-O 3.35Å; V36-L288 PolarHBondContact O-N 3.27Å; V36-I290 HydrophobicContact CG2-CD1 3.82Å; V36-L320 HydrophobicContact CG1-CD1 3.64Å; V36-Y321 CarbonylContact C-O 3.58Å; V36-Y321 WeakPolarHBondContact CA-O 3.46Å; V36-I322 HydrophobicContact CG2-CG1 4.48Å
37	R	93.9	Very high	87.6	Confident	12 Å²	12	47.5 Å²	47.5	5%	0.045	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	111.2	177.6	-47.3	177.8	176.2	-164.5	-6.7	109.4	Y285 L286 L287 N311 L320 Y321 W518	R37-Y285 HydrophobicContact CB-CD2 3.61Å; R37-Y285 HydrophobicContact CB-CE2 4.13Å; R37-Y285 HydrophobicContact CB-CG 3.92Å; R37-Y285 HydrophobicContact CG-CD2 3.76Å; R37-Y285 HydrophobicContact CG-CE2 3.74Å; R37-Y285 HydrophobicContact CG-CG 4.41Å; R37-Y285 PolarHBondContact NH1-OH 2.9Å; R37-L286 WeakPolarHBondContact CA-O 3.29Å; R37-L287 HydrophobicContact CG-CD1 4.13Å; R37-N311 PolarHBondContact NH2-OD1 3.34Å; R37-L320 WeakPolarHBondContact O-CA 3.48Å; R37-Y321 HydrophobicContact CB-CD2 4.41Å; R37-Y321 PolarHBondContact N-O 2.74Å; R37-Y321 PolarHBondContact O-N 2.92Å; R37-W518 VanDerWaalsContact CZ-CH2 3.49Å
38	I	94.4	Very high	89.6	Confident	36 Å²	36	42.3 Å²	42.3	19%	0.185	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	113.2	173.3	-51.2	173.7	0	0	0	107.3	V36 F43 Y285 L286 L320	V36-I38 HydrophobicContact CG1-CG1 4.39Å; I38-F43 HydrophobicContact CB-CD2 4.34Å; I38-F43 HydrophobicContact CB-CE2 3.72Å; I38-F43 HydrophobicContact CB-CZ 4.45Å; I38-F43 HydrophobicContact CG2-CD2 3.66Å; I38-F43 HydrophobicContact CG2-CE2 3.43Å; I38-F43 VanDerWaalsContact CG2-CE2 3.43Å; I38-F43 HydrophobicContact CG2-CZ 4.15Å; I38-Y285 CarbonylContact O-C 3.58Å; I38-Y285 WeakPolarHBondContact O-CA 3Å; I38-Y285 VanDerWaalsContact O-CB 3.3Å; I38-Y285 WeakPolarHBondContact O-CB 2.92Å; I38-L286 PolarHBondContact N-O 3.1Å; I38-L286 PolarHBondContact O-N 3.41Å; I38-L320 HydrophobicContact CG1-CD1 3.98Å
39	T	95	Very high	91.1	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	165.4	-174.5	73.4	0	0	0	0	112.1	H41 G42 F43 I283 K284 V318 M319 Y321	T39-H41 PolarHBondContact O-N 3.11Å; T39-H41 PolarHBondContact OG1-N 2.84Å; T39-G42 WeakPolarHBondContact O-CA 3.33Å; T39-G42 PolarHBondContact O-N 2.79Å; T39-G42 PolarHBondContact OG1-N 2.85Å; T39-F43 WeakPolarHBondContact O-CD2 3.02Å; T39-F43 PolarHBondContact O-N 3.37Å; T39-I283 HydrophobicContact CG2-CD1 4.16Å; T39-K284 CarbonylContact C-O 3.57Å; T39-K284 WeakPolarHBondContact CA-O 3.3Å; T39-V318 WeakPolarHBondContact CB-O 3.3Å; T39-V318 VanDerWaalsContact CG2-O 3.23Å; T39-V318 WeakPolarHBondContact CG2-O 3.48Å; T39-V318 PolarHBondContact OG1-O 2.8Å; T39-M319 PolarHBondContact N-O 2.8Å; T39-M319 WeakPolarHBondContact OG1-CA 3.35Å; T39-M319 PolarHBondContact OG1-O 2.98Å; T39-Y321 HydrophobicContact CG2-CD2 3.8Å; T39-Y321 HydrophobicContact CG2-CE2 3.57Å
40	N	93.9	Very high	91.9	Very high	47 Å²	47	35.3 Å²	35.3	25%	0.251	18%	0.18	S	C	.	.	H	α-helix	trans	-54.3	-35.4	171.4	-161.9	75.3	0	0	0	112.3	F43 L44 K284	N40-F43 PolarHBondContact O-N 3.29Å; N40-L44 VanDerWaalsContact O-CG 3.31Å; N40-L44 WeakPolarHBondContact O-CG 3.45Å; N40-L44 PolarHBondContact O-N 3.43Å; N40-K284 PolarHBondContact N-O 2.98Å
41	H	93.4	Very high	92	Very high	82 Å²	82	33.6 Å²	33.6	38%	0.38	17%	0.169	S	C	.	.	H	α-helix	trans	-65.6	-40.6	175.4	-168.5	-103.2	0	0	0	111.6	T39 L44 Y45 G317 M319	T39-H41 PolarHBondContact O-N 3.11Å; T39-H41 PolarHBondContact OG1-N 2.84Å; H41-L44 PolarHBondContact O-N 3.45Å; H41-Y45 PolarHBondContact O-N 2.93Å; H41-G317 PolarHBondContact CE1-O 3.34Å; H41-G317 VanDerWaalsContact CE1-O 3.25Å; H41-G317 PolarHBondContact ND1-O 3.15Å; H41-M319 VanDerWaalsContact CE1-CE 3.49Å; H41-M319 WeakPolarHBondContact CE1-CE 3.46Å; H41-M319 VanDerWaalsContact ND1-CG 3.34Å; H41-M319 WeakPolarHBondContact ND1-CG 3.05Å
42	G	93.9	Very high	91.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-44.4	171.7	0	0	0	0	0	112.4	T39 L44 Y45 L46	T39-G42 WeakPolarHBondContact O-CA 3.33Å; T39-G42 PolarHBondContact O-N 2.79Å; T39-G42 PolarHBondContact OG1-N 2.85Å; G42-L44 PolarHBondContact O-N 3.3Å; G42-Y45 PolarHBondContact O-N 2.91Å; G42-L46 VanDerWaalsContact O-CG 3.27Å; G42-L46 WeakPolarHBondContact O-CG 3.44Å; G42-L46 PolarHBondContact O-N 2.87Å
43	F	92.8	Very high	91.2	Very high	22 Å²	22	37.8 Å²	37.8	10%	0.096	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-35.5	176.6	-84.5	-82.8	0	0	0	113.8	I38 T39 N40 L46 K47 V94 L96 I104 L286	I38-F43 HydrophobicContact CB-CD2 4.34Å; I38-F43 HydrophobicContact CB-CE2 3.72Å; I38-F43 HydrophobicContact CB-CZ 4.45Å; I38-F43 HydrophobicContact CG2-CD2 3.66Å; I38-F43 HydrophobicContact CG2-CE2 3.43Å; I38-F43 VanDerWaalsContact CG2-CE2 3.43Å; I38-F43 HydrophobicContact CG2-CZ 4.15Å; T39-F43 WeakPolarHBondContact O-CD2 3.02Å; T39-F43 PolarHBondContact O-N 3.37Å; N40-F43 PolarHBondContact O-N 3.29Å; F43-L46 PolarHBondContact O-N 3.48Å; F43-K47 WeakPolarHBondContact O-CB 3.48Å; F43-K47 PolarHBondContact O-N 3.11Å; F43-V94 HydrophobicContact CB-CG1 4.02Å; F43-V94 HydrophobicContact CD1-CG1 3.89Å; F43-V94 HydrophobicContact CG-CG1 4.31Å; F43-L96 HydrophobicContact CD1-CD2 4.2Å; F43-L96 HydrophobicContact CD2-CD1 3.66Å; F43-L96 HydrophobicContact CD2-CD2 3.68Å; F43-L96 HydrophobicContact CD2-CG 4Å; F43-L96 HydrophobicContact CE1-CD2 4.16Å; F43-L96 HydrophobicContact CE2-CD1 3.94Å; F43-L96 HydrophobicContact CE2-CD2 3.61Å; F43-L96 HydrophobicContact CE2-CG 4.3Å; F43-L96 HydrophobicContact CG-CD1 4.44Å; F43-L96 HydrophobicContact CG-CD2 3.96Å; F43-L96 HydrophobicContact CG-CG 4.35Å; F43-L96 HydrophobicContact CZ-CD2 3.86Å; F43-I104 HydrophobicContact CE1-CD1 3.62Å; F43-I104 HydrophobicContact CE1-CG1 4.47Å; F43-I104 HydrophobicContact CZ-CD1 3.92Å; F43-L286 HydrophobicContact CE2-CB 3.86Å; F43-L286 HydrophobicContact CE2-CD2 4.33Å; F43-L286 HydrophobicContact CZ-CB 4.19Å; F43-L286 HydrophobicContact CZ-CD2 3.84Å
44	L	92	Very high	90.6	Very high	67 Å²	67	39.8 Å²	39.8	35%	0.351	20%	0.197	S	C	.	.	H	α-helix	trans	-64.3	-44.3	173.8	-71.3	171.8	0	0	0	111.2	N40 H41 G42 L46 K47 D48	N40-L44 VanDerWaalsContact O-CG 3.31Å; N40-L44 WeakPolarHBondContact O-CG 3.45Å; N40-L44 PolarHBondContact O-N 3.43Å; H41-L44 PolarHBondContact O-N 3.45Å; G42-L44 PolarHBondContact O-N 3.3Å; L44-L46 PolarHBondContact O-N 2.83Å; L44-K47 WeakPolarHBondContact O-CB 3.19Å; L44-K47 PolarHBondContact O-N 2.91Å; L44-D48 PolarHBondContact O-N 3.18Å
45	Y	92.8	Very high	90	Very high	57 Å²	57	44.7 Å²	44.7	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-43.9	174.1	170.6	-99.1	0	0	0	112.7	H41 G42 K47 D48 T49 M319 I523 K524 L525	H41-Y45 PolarHBondContact O-N 2.93Å; G42-Y45 PolarHBondContact O-N 2.91Å; Y45-K47 VanDerWaalsContact C-N 3.33Å; Y45-K47 PolarHBondContact O-N 3.32Å; Y45-D48 PolarHBondContact O-N 3.46Å; Y45-T49 PolarHBondContact O-N 3.43Å; Y45-T49 VanDerWaalsContact O-N 3.11Å; Y45-T49 PolarHBondContact O-OG1 3.01Å; Y45-M319 HydrophobicContact CD1-SD 3.98Å; Y45-M319 HydrophobicContact CD2-CE 3.98Å; Y45-M319 HydrophobicContact CD2-SD 4.47Å; Y45-M319 HydrophobicContact CG-CE 3.74Å; Y45-M319 HydrophobicContact CG-SD 3.79Å; Y45-I523 HydrophobicContact CD1-CD1 4Å; Y45-I523 HydrophobicContact CD1-CG1 3.68Å; Y45-I523 HydrophobicContact CE1-CD1 4.41Å; Y45-I523 HydrophobicContact CE1-CG1 3.94Å; Y45-I523 WeakPolarHBondContact CE1-O 3.32Å; Y45-K524 WeakPolarHBondContact OH-CA 3.36Å; Y45-L525 HydrophobicContact CE1-CG 4.12Å; Y45-L525 PolarHBondContact OH-N 3Å; Y45-L525 VanDerWaalsContact OH-N 3.14Å
46	L	90.6	Very high	89.5	Confident	35 Å²	35	50.1 Å²	50.1	18%	0.183	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-43.8	175.6	-68.3	175.1	0	0	0	110.9	G42 F43 L44 T49 I50 I523 L525	G42-L46 VanDerWaalsContact O-CG 3.27Å; G42-L46 WeakPolarHBondContact O-CG 3.44Å; G42-L46 PolarHBondContact O-N 2.87Å; F43-L46 PolarHBondContact O-N 3.48Å; L44-L46 PolarHBondContact O-N 2.83Å; L46-T49 PolarHBondContact O-N 3.4Å; L46-I50 HydrophobicContact CB-CD1 4.38Å; L46-I50 VanDerWaalsContact O-CB 3.23Å; L46-I50 WeakPolarHBondContact O-CB 3.36Å; L46-I50 WeakPolarHBondContact O-CD1 3.4Å; L46-I50 WeakPolarHBondContact O-CG1 3.48Å; L46-I50 PolarHBondContact O-N 3.3Å; L46-I523 HydrophobicContact CD1-CD1 4.43Å; L46-I523 HydrophobicContact CD2-CD1 3.76Å; L46-I523 HydrophobicContact CG-CD1 4Å; L46-L525 HydrophobicContact CD2-CD1 3.62Å; L46-L525 HydrophobicContact CD2-CD2 3.89Å; L46-L525 HydrophobicContact CD2-CG 3.98Å
47	K	90.1	Very high	89	Confident	31 Å²	31	51.7 Å²	51.7	14%	0.135	24%	0.242	C	C	.	.	H	α-helix	trans	-54.8	-54.2	176.9	-178.7	-171.3	74.2	62.2	0	111.2	F43 L44 Y45 T49 I50 Q51 V92 V94	F43-K47 WeakPolarHBondContact O-CB 3.48Å; F43-K47 PolarHBondContact O-N 3.11Å; L44-K47 WeakPolarHBondContact O-CB 3.19Å; L44-K47 PolarHBondContact O-N 2.91Å; Y45-K47 VanDerWaalsContact C-N 3.33Å; Y45-K47 PolarHBondContact O-N 3.32Å; K47-T49 PolarHBondContact O-N 3.11Å; K47-I50 PolarHBondContact O-N 3.49Å; K47-Q51 VanDerWaalsContact O-CB 3.22Å; K47-Q51 WeakPolarHBondContact O-CB 3.46Å; K47-Q51 PolarHBondContact O-N 2.67Å; K47-V92 HydrophobicContact CD-CB 4.43Å; K47-V92 HydrophobicContact CD-CG1 3.98Å; K47-V92 WeakPolarHBondContact CD-O 3.45Å; K47-V92 WeakPolarHBondContact CE-O 3.35Å; K47-V92 HydrophobicContact CG-CG1 4.13Å; K47-V94 HydrophobicContact CB-CB 4.41Å; K47-V94 HydrophobicContact CB-CG2 3.75Å; K47-V94 HydrophobicContact CD-CB 4.23Å; K47-V94 HydrophobicContact CD-CG2 3.76Å; K47-V94 HydrophobicContact CG-CG2 3.66Å
48	D	89.4	Confident	88.5	Confident	87 Å²	87	53.6 Å²	53.6	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-63.3	-44.4	-175.1	-63.8	-20.6	0	0	0	111.2	L44 Y45 Q51 E52	L44-D48 PolarHBondContact O-N 3.18Å; Y45-D48 PolarHBondContact O-N 3.46Å; D48-Q51 PolarHBondContact O-N 3.07Å; D48-E52 PolarHBondContact O-N 3.22Å; D48-E52 VanDerWaalsContact O-N 3.15Å
49	T	86.7	Confident	87.9	Confident	13 Å²	13	55.1 Å²	55.1	8%	0.08	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-43.2	178.6	-50.5	0	0	0	0	111.9	Y45 L46 K47 V53 L525 V527 L530	Y45-T49 PolarHBondContact O-N 3.43Å; Y45-T49 VanDerWaalsContact O-N 3.11Å; Y45-T49 PolarHBondContact O-OG1 3.01Å; L46-T49 PolarHBondContact O-N 3.4Å; K47-T49 PolarHBondContact O-N 3.11Å; T49-V53 WeakPolarHBondContact O-CG2 3.37Å; T49-V53 PolarHBondContact O-N 2.83Å; T49-L525 HydrophobicContact CG2-CB 4.16Å; T49-L525 HydrophobicContact CG2-CD1 3.89Å; T49-V527 HydrophobicContact CG2-CG2 4.39Å; T49-L530 HydrophobicContact CG2-CD2 4.45Å
50	I	84.7	Confident	87.3	Confident	50 Å²	50	61 Å²	61	26%	0.256	30%	0.299	S	S	.	.	H	α-helix	trans	-67.6	-40	179.2	-72.2	167.8	0	0	0	110.6	L46 K47 E52 V53 L54 L530 F534	L46-I50 HydrophobicContact CB-CD1 4.38Å; L46-I50 VanDerWaalsContact O-CB 3.23Å; L46-I50 WeakPolarHBondContact O-CB 3.36Å; L46-I50 WeakPolarHBondContact O-CD1 3.4Å; L46-I50 WeakPolarHBondContact O-CG1 3.48Å; L46-I50 PolarHBondContact O-N 3.3Å; K47-I50 PolarHBondContact O-N 3.49Å; I50-E52 VanDerWaalsContact C-N 3.35Å; I50-E52 PolarHBondContact O-N 2.62Å; I50-V53 PolarHBondContact O-N 3.41Å; I50-L54 HydrophobicContact CG2-CD1 3.63Å; I50-L54 HydrophobicContact CG2-CG 4Å; I50-L54 WeakPolarHBondContact O-CB 3.41Å; I50-L54 VanDerWaalsContact O-CG 3.31Å; I50-L54 WeakPolarHBondContact O-CG 3.33Å; I50-L54 PolarHBondContact O-N 2.95Å; I50-L530 HydrophobicContact CG1-CD2 4.09Å; I50-F534 HydrophobicContact CG1-CZ 4.28Å; I50-F534 HydrophobicContact CG2-CE2 3.98Å; I50-F534 HydrophobicContact CG2-CZ 4.03Å
51	Q	84.5	Confident	87	Confident	59 Å²	59	60.2 Å²	60.2	28%	0.276	29%	0.294	S	S	.	.	H	α-helix	trans	-60.3	-44.2	178.6	179.6	178	-33.9	0	0	111.6	K47 D48 V53 L54 R55	K47-Q51 VanDerWaalsContact O-CB 3.22Å; K47-Q51 WeakPolarHBondContact O-CB 3.46Å; K47-Q51 PolarHBondContact O-N 2.67Å; D48-Q51 PolarHBondContact O-N 3.07Å; Q51-V53 PolarHBondContact O-N 2.97Å; Q51-L54 PolarHBondContact O-N 3.48Å; Q51-R55 WeakPolarHBondContact O-CB 3.46Å; Q51-R55 PolarHBondContact O-N 3.46Å
52	E	84.4	Confident	86.8	Confident	141 Å²	141	61 Å²	61	66%	0.659	30%	0.298	S	S	*	.	H	α-helix	trans	-59.2	-47.4	176.5	-172.7	-177.9	173.7	0	0	111.5	D48 I50 R55 K56	D48-E52 PolarHBondContact O-N 3.22Å; D48-E52 VanDerWaalsContact O-N 3.15Å; I50-E52 VanDerWaalsContact C-N 3.35Å; I50-E52 PolarHBondContact O-N 2.62Å; E52-R55 PolarHBondContact O-N 2.86Å; E52-K56 PolarHBondContact O-N 3.18Å
53	V	84.8	Confident	86.5	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	30%	0.299	C	S	.	.	H	α-helix	trans	-65.7	-43.8	178.6	178.6	0	0	0	0	111.6	T49 I50 Q51 R55 K56 H57 V527 L530 E531 F534	T49-V53 WeakPolarHBondContact O-CG2 3.37Å; T49-V53 PolarHBondContact O-N 2.83Å; I50-V53 PolarHBondContact O-N 3.41Å; Q51-V53 PolarHBondContact O-N 2.97Å; V53-R55 PolarHBondContact O-N 2.9Å; V53-K56 PolarHBondContact O-N 2.81Å; V53-H57 PolarHBondContact O-CD2 3.24Å; V53-H57 PolarHBondContact O-N 3.14Å; V53-V527 HydrophobicContact CG2-CG1 3.84Å; V53-L530 HydrophobicContact CB-CD2 4.35Å; V53-L530 HydrophobicContact CG1-CG 4.47Å; V53-L530 HydrophobicContact CG2-CD2 3.96Å; V53-L530 HydrophobicContact CG2-CG 4.5Å; V53-E531 HydrophobicContact CG1-CB 4.47Å; V53-E531 HydrophobicContact CG1-CG 3.71Å; V53-E531 HydrophobicContact CG2-CG 4.39Å; V53-F534 HydrophobicContact CB-CD2 4.31Å; V53-F534 HydrophobicContact CB-CE2 4.38Å; V53-F534 HydrophobicContact CG1-CD2 3.59Å; V53-F534 HydrophobicContact CG1-CE2 4.11Å
54	L	82	Confident	86.4	Confident	43 Å²	43	63.4 Å²	63.4	23%	0.225	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-41.2	178.7	-76.5	177.1	0	0	0	111.9	I50 Q51 K56 H57 L58 F208 F534	I50-L54 HydrophobicContact CG2-CD1 3.63Å; I50-L54 HydrophobicContact CG2-CG 4Å; I50-L54 WeakPolarHBondContact O-CB 3.41Å; I50-L54 VanDerWaalsContact O-CG 3.31Å; I50-L54 WeakPolarHBondContact O-CG 3.33Å; I50-L54 PolarHBondContact O-N 2.95Å; Q51-L54 PolarHBondContact O-N 3.48Å; L54-K56 VanDerWaalsContact C-N 3.29Å; L54-K56 PolarHBondContact O-N 2.98Å; L54-H57 PolarHBondContact O-N 2.97Å; L54-H57 VanDerWaalsContact O-N 3.09Å; L54-L58 WeakPolarHBondContact O-CB 3.4Å; L54-L58 WeakPolarHBondContact O-CG 3.25Å; L54-L58 PolarHBondContact O-N 2.87Å; L54-F208 HydrophobicContact CD2-CE1 3.8Å; L54-F208 HydrophobicContact CD2-CZ 3.65Å; L54-F534 HydrophobicContact CD2-CD2 4.02Å; L54-F534 HydrophobicContact CD2-CE2 4.11Å; L54-F534 HydrophobicContact CG-CD2 4.43Å; L54-F534 HydrophobicContact CG-CE2 4.16Å
55	R	82.7	Confident	86.3	Confident	121 Å²	121	66.3 Å²	66.3	46%	0.457	33%	0.328	S	S	.	.	H	α-helix	trans	-57.7	-43.6	179.1	-171.1	176.5	-176.9	-152.7	-5.2	111.6	Q51 E52 V53 H57 L58 S59 E88	Q51-R55 WeakPolarHBondContact O-CB 3.46Å; Q51-R55 PolarHBondContact O-N 3.46Å; E52-R55 PolarHBondContact O-N 2.86Å; V53-R55 PolarHBondContact O-N 2.9Å; R55-H57 VanDerWaalsContact C-N 3.33Å; R55-H57 PolarHBondContact O-N 2.66Å; R55-L58 PolarHBondContact O-N 2.89Å; R55-S59 PolarHBondContact O-N 2.82Å; R55-S59 PolarHBondContact O-OG 2.74Å; R55-E88 IonicContact CZ-OE1 2.76Å; R55-E88 IonicContact NE-OE1 3.27Å; R55-E88 IonicContact NH1-OE1 3.87Å; R55-E88 PolarHBondContact NH1-OE1 3.39Å
56	K	83.2	Confident	86.1	Confident	118 Å²	118	64.5 Å²	64.5	51%	0.513	32%	0.323	S	S	.	.	H	α-helix	trans	-65.8	-32.6	176.9	-175	179.2	174.3	-172.4	0	113.2	E52 V53 L54 S59 N60 E531	E52-K56 PolarHBondContact O-N 3.18Å; V53-K56 PolarHBondContact O-N 2.81Å; L54-K56 VanDerWaalsContact C-N 3.29Å; L54-K56 PolarHBondContact O-N 2.98Å; K56-S59 PolarHBondContact O-OG 3.18Å; K56-N60 PolarHBondContact O-ND2 3.1Å; K56-E531 IonicContact NZ-OE1 3.77Å; K56-E531 PolarHBondContact NZ-OE1 3.02Å; K56-E531 IonicContact NZ-OE2 2.68Å
57	H	82.9	Confident	86	Confident	58 Å²	58	66.5 Å²	66.5	27%	0.269	33%	0.331	S	S	.	.	H	α-helix	trans	-77.5	-42.5	175.2	-82.8	-68.1	0	0	0	112.4	V53 L54 R55 S59 N60 L61 E531	V53-H57 PolarHBondContact O-CD2 3.24Å; V53-H57 PolarHBondContact O-N 3.14Å; L54-H57 PolarHBondContact O-N 2.97Å; L54-H57 VanDerWaalsContact O-N 3.09Å; R55-H57 VanDerWaalsContact C-N 3.33Å; R55-H57 PolarHBondContact O-N 2.66Å; H57-S59 VanDerWaalsContact C-N 3.34Å; H57-S59 PolarHBondContact O-N 2.84Å; H57-N60 CarbonylContact O-C 3.58Å; H57-N60 PolarHBondContact O-N 3.47Å; H57-L61 PolarHBondContact O-N 3.34Å; H57-E531 PolarHBondContact NE2-O 3.45Å
58	L	84.3	Confident	86.1	Confident	51 Å²	51	70.7 Å²	70.7	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-64.9	-37.3	179.7	-71.2	175	0	0	0	111.8	L54 R55 N60 L61 I83 L86	L54-L58 WeakPolarHBondContact O-CB 3.4Å; L54-L58 WeakPolarHBondContact O-CG 3.25Å; L54-L58 PolarHBondContact O-N 2.87Å; R55-L58 PolarHBondContact O-N 2.89Å; L58-N60 PolarHBondContact O-N 2.89Å; L58-N60 VanDerWaalsContact O-N 3.15Å; L58-L61 HydrophobicContact CD2-CD2 4.08Å; L58-L61 VanDerWaalsContact O-CB 3.27Å; L58-L61 WeakPolarHBondContact O-CB 3.36Å; L58-L61 PolarHBondContact O-N 2.99Å; L58-I83 HydrophobicContact CB-CD1 4.34Å; L58-I83 WeakPolarHBondContact O-CD1 3.37Å; L58-L86 HydrophobicContact CB-CD2 3.79Å; L58-L86 HydrophobicContact CD1-CD2 3.79Å; L58-L86 HydrophobicContact CG-CD2 4.45Å
59	S	81.8	Confident	86.2	Confident	68 Å²	68	67.6 Å²	67.6	48%	0.476	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.7	176.4	63.8	0	0	0	0	114	R55 K56 H57	R55-S59 PolarHBondContact O-N 2.82Å; R55-S59 PolarHBondContact O-OG 2.74Å; K56-S59 PolarHBondContact O-OG 3.18Å; H57-S59 VanDerWaalsContact C-N 3.34Å; H57-S59 PolarHBondContact O-N 2.84Å
60	N	83.2	Confident	86.5	Confident	128 Å²	128	71.3 Å²	71.3	68%	0.684	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	8.7	178	-64.3	-58.2	0	0	0	112.5	K56 H57 L58 H62	K56-N60 PolarHBondContact O-ND2 3.1Å; H57-N60 CarbonylContact O-C 3.58Å; H57-N60 PolarHBondContact O-N 3.47Å; L58-N60 PolarHBondContact O-N 2.89Å; L58-N60 VanDerWaalsContact O-N 3.15Å; N60-H62 PolarHBondContact O-N 2.99Å
61	L	85.9	Confident	86.6	Confident	30 Å²	30	71.4 Å²	71.4	16%	0.157	36%	0.362	C	S	.	.			trans	-70.7	122	-175.6	-178.2	66.6	0	0	0	110.3	H57 L58 I63 F81 I83 L541	H57-L61 PolarHBondContact O-N 3.34Å; L58-L61 HydrophobicContact CD2-CD2 4.08Å; L58-L61 VanDerWaalsContact O-CB 3.27Å; L58-L61 WeakPolarHBondContact O-CB 3.36Å; L58-L61 PolarHBondContact O-N 2.99Å; L61-I63 HydrophobicContact CD1-CD1 4.49Å; L61-I63 HydrophobicContact CD1-CG1 4.14Å; L61-I63 HydrophobicContact CD2-CD1 4.24Å; L61-I63 HydrophobicContact CG-CD1 4.39Å; L61-I63 HydrophobicContact CG-CG1 4.13Å; L61-F81 HydrophobicContact CD2-CE1 4.28Å; L61-I83 HydrophobicContact CB-CD1 4.38Å; L61-I83 HydrophobicContact CB-CG1 4.47Å; L61-I83 HydrophobicContact CD2-CD1 4.15Å; L61-L541 HydrophobicContact CD1-CB 4.22Å
62	H	89.5	Confident	86.8	Confident	99 Å²	99	75.2 Å²	75.2	46%	0.458	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.4	171.2	176.3	-99.7	0	0	0	109.6	N60 S64 F81	N60-H62 PolarHBondContact O-N 2.99Å; H62-S64 PolarHBondContact CE1-OG 3.01Å; H62-F81 CarbonylContact C-O 3.56Å; H62-F81 WeakPolarHBondContact CA-O 3.12Å
63	I	87.8	Confident	87	Confident	6 Å²	6	80 Å²	80	3%	0.031	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	108.1	-179.1	-51.2	-176.2	0	0	0	108	L61 E65 V66 N80 F81 L541 G542	L61-I63 HydrophobicContact CD1-CD1 4.49Å; L61-I63 HydrophobicContact CD1-CG1 4.14Å; L61-I63 HydrophobicContact CD2-CD1 4.24Å; L61-I63 HydrophobicContact CG-CD1 4.39Å; L61-I63 HydrophobicContact CG-CG1 4.13Å; I63-E65 WeakPolarHBondContact CG2-O 3.47Å; I63-V66 HydrophobicContact CB-CG2 4.24Å; I63-V66 HydrophobicContact CG2-CG2 3.9Å; I63-N80 CarbonylContact O-C 3.58Å; I63-N80 WeakPolarHBondContact O-CA 3.23Å; I63-N80 PolarHBondContact O-N 2.82Å; I63-F81 HydrophobicContact CB-CB 4.17Å; I63-F81 HydrophobicContact CB-CD1 4.32Å; I63-F81 HydrophobicContact CD1-CD1 3.95Å; I63-F81 HydrophobicContact CD1-CE1 4.31Å; I63-F81 HydrophobicContact CG1-CD1 4.02Å; I63-F81 PolarHBondContact N-O 2.91Å; I63-F81 PolarHBondContact O-N 3.39Å; I63-L541 WeakPolarHBondContact CD1-O 3.22Å; I63-G542 WeakPolarHBondContact CG2-O 3.41Å
64	S	91.9	Very high	87.4	Confident	65 Å²	65	81.5 Å²	81.5	46%	0.455	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	-41.8	-177.4	-63.4	0	0	0	0	112.7	H62 R79 N80	H62-S64 PolarHBondContact CE1-OG 3.01Å; S64-R79 CarbonylContact O-C 3.52Å; S64-R79 WeakPolarHBondContact O-CA 3.41Å; S64-R79 WeakPolarHBondContact O-CB 3.28Å; S64-R79 WeakPolarHBondContact O-CG 3.41Å; S64-N80 PolarHBondContact O-N 2.8Å
65	E	90	Very high	88	Confident	129 Å²	129	88.2 Å²	88.2	60%	0.603	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	110.1	-179.2	-67.5	178.6	-175	0	0	108.8	I63	I63-E65 WeakPolarHBondContact CG2-O 3.47Å
66	V	87.8	Confident	88.6	Confident	19 Å²	19	84.5 Å²	84.5	12%	0.115	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-52.5	-173.9	-176.3	0	0	0	0	110.1	I63 L78 F81 I117 R204	I63-V66 HydrophobicContact CB-CG2 4.24Å; I63-V66 HydrophobicContact CG2-CG2 3.9Å; V66-L78 HydrophobicContact CB-CB 3.96Å; V66-L78 WeakPolarHBondContact CB-O 3.4Å; V66-L78 HydrophobicContact CG1-CB 4.46Å; V66-L78 PolarHBondContact N-O 2.8Å; V66-F81 HydrophobicContact CG2-CB 3.46Å; V66-F81 VanDerWaalsContact CG2-CB 3.46Å; V66-F81 HydrophobicContact CG2-CG 4.47Å; V66-I117 HydrophobicContact CG1-CD1 4.46Å; V66-I117 HydrophobicContact CG2-CD1 4.35Å; V66-R204 PolarHBondContact O-NH2 2.96Å
67	H	89	Confident	89.2	Confident	77 Å²	77	79.4 Å²	79.4	36%	0.356	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	143.4	-174.7	-173	79.1	0	0	0	110.9	F76 A77 L78	H67-F76 AromaticContact CD2-CE2 3.94Å; H67-A77 CarbonylContact O-C 3.51Å; H67-A77 WeakPolarHBondContact O-CA 3.46Å; H67-L78 HydrophobicContact CB-CB 4.23Å; H67-L78 HydrophobicContact CB-CD1 4.08Å; H67-L78 HydrophobicContact CB-CG 4.31Å; H67-L78 PolarHBondContact N-O 2.81Å; H67-L78 PolarHBondContact O-N 3.06Å
68	E	91.8	Very high	89.7	Confident	118 Å²	118	77 Å²	77	55%	0.551	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.6	169.9	-60.4	-164.1	158.3	0	0	109.7	F76 A77 R79	E68-F76 WeakPolarHBondContact CA-O 3.34Å; E68-A77 HydrophobicContact CG-CB 3.8Å; E68-R79 IonicContact OE1-CZ 3.68Å; E68-R79 IonicContact OE1-NE 2.71Å; E68-R79 IonicContact OE1-NH2 2.69Å; E68-R79 PolarHBondContact OE1-NH2 2.8Å
69	G	91.7	Very high	90.3	Very high	23 Å²	23	78.7 Å²	78.7	24%	0.237	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	-179.6	-175.6	0	0	0	0	0	113.3	R75 F76	G69-R75 WeakPolarHBondContact O-CA 3.11Å; G69-F76 PolarHBondContact N-O 3.04Å; G69-F76 WeakPolarHBondContact O-CD1 3.48Å; G69-F76 PolarHBondContact O-N 3.43Å
70	T	92.4	Very high	90.9	Very high	90 Å²	90	78.1 Å²	78.1	55%	0.552	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	133	174.5	-58.8	0	0	0	0	109.5	V74	T70-V74 CarbonylContact C-O 3.57Å; T70-V74 WeakPolarHBondContact CA-O 3.39Å
71	F	88	Confident	91.4	Very high	53 Å²	53	73 Å²	73	23%	0.232	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	125.3	175.9	-179.3	-105.7	0	0	0	109.9	R73 V74 F76 I188	F71-R73 PolarHBondContact O-N 3.43Å; F71-V74 PolarHBondContact N-O 3.35Å; F71-V74 WeakPolarHBondContact O-CA 3.27Å; F71-V74 VanDerWaalsContact O-CB 3.32Å; F71-V74 WeakPolarHBondContact O-CB 3.37Å; F71-V74 PolarHBondContact O-N 3.14Å; F71-F76 HydrophobicContact CB-CD1 4.31Å; F71-F76 HydrophobicContact CB-CE1 4.08Å; F71-I188 HydrophobicContact CD1-CD1 4.46Å; F71-I188 HydrophobicContact CD1-CG2 4.1Å; F71-I188 HydrophobicContact CE1-CD1 3.88Å; F71-I188 HydrophobicContact CE1-CG1 4.33Å; F71-I188 HydrophobicContact CE1-CG2 3.79Å; F71-I188 HydrophobicContact CZ-CG2 4.26Å
72	L	86.8	Confident	91.8	Very high	138 Å²	138	77.3 Å²	77.3	72%	0.723	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	46.3	-177	-61.6	177.3	0	0	0	113	V74	L72-V74 PolarHBondContact O-N 3Å; L72-V74 VanDerWaalsContact O-N 3.13Å
73	R	90	Very high	92	Very high	241 Å²	241	73.6 Å²	73.6	91%	0.909	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	5.4	-176	-54.1	178.4	176.6	168.8	-1.6	115.6	F71	F71-R73 PolarHBondContact O-N 3.43Å
74	V	92.3	Very high	92.3	Very high	37 Å²	37	77 Å²	77	22%	0.224	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	119.6	170.7	178.6	0	0	0	0	108.6	T70 F71 L72 M123	T70-V74 CarbonylContact C-O 3.57Å; T70-V74 WeakPolarHBondContact CA-O 3.39Å; F71-V74 PolarHBondContact N-O 3.35Å; F71-V74 WeakPolarHBondContact O-CA 3.27Å; F71-V74 VanDerWaalsContact O-CB 3.32Å; F71-V74 WeakPolarHBondContact O-CB 3.37Å; F71-V74 PolarHBondContact O-N 3.14Å; L72-V74 PolarHBondContact O-N 3Å; L72-V74 VanDerWaalsContact O-N 3.13Å; V74-M123 HydrophobicContact CB-CG 4.37Å; V74-M123 HydrophobicContact CG1-CE 4.23Å; V74-M123 HydrophobicContact CG1-CG 3.59Å; V74-M123 HydrophobicContact CG1-SD 4.2Å; V74-M123 HydrophobicContact CG2-CG 3.8Å; V74-M123 HydrophobicContact CG2-SD 4.09Å
75	R	95.2	Very high	92.3	Very high	184 Å²	184	79.4 Å²	79.4	69%	0.694	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	138.2	168.6	-64.9	-179.7	179.5	164.9	0	108.4	G69 T121 S122	G69-R75 WeakPolarHBondContact O-CA 3.11Å; R75-T121 CarbonylContact O-C 3.53Å; R75-T121 WeakPolarHBondContact O-CA 3.15Å; R75-S122 PolarHBondContact N-OG 3Å; R75-S122 PolarHBondContact O-N 2.92Å
76	F	94.8	Very high	92.4	Very high	43 Å²	43	75.1 Å²	75.1	19%	0.189	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	152	175.1	72.4	-85.7	0	0	0	111.1	H67 E68 G69 F71 L78 I119 Y120	H67-F76 AromaticContact CD2-CE2 3.94Å; E68-F76 WeakPolarHBondContact CA-O 3.34Å; G69-F76 PolarHBondContact N-O 3.04Å; G69-F76 WeakPolarHBondContact O-CD1 3.48Å; G69-F76 PolarHBondContact O-N 3.43Å; F71-F76 HydrophobicContact CB-CD1 4.31Å; F71-F76 HydrophobicContact CB-CE1 4.08Å; F76-L78 HydrophobicContact CD2-CD2 4.14Å; F76-L78 HydrophobicContact CD2-CG 4.2Å; F76-L78 HydrophobicContact CE2-CD2 4.34Å; F76-L78 HydrophobicContact CE2-CG 4.09Å; F76-I119 HydrophobicContact CB-CG2 4.43Å; F76-Y120 CarbonylContact C-O 3.58Å; F76-Y120 WeakPolarHBondContact CA-O 3.35Å; F76-Y120 WeakPolarHBondContact CB-O 3.29Å
77	A	95.4	Very high	92.6	Very high	10 Å²	10	76.4 Å²	76.4	8%	0.083	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.5	173.6	0	0	0	0	0	109.6	H67 E68 R79 I119 Y120	H67-A77 CarbonylContact O-C 3.51Å; H67-A77 WeakPolarHBondContact O-CA 3.46Å; E68-A77 HydrophobicContact CG-CB 3.8Å; A77-R79 HydrophobicContact CB-CG 4.35Å; A77-I119 CarbonylContact O-C 3.53Å; A77-I119 WeakPolarHBondContact O-CA 3.17Å; A77-Y120 PolarHBondContact N-O 3.49Å; A77-Y120 PolarHBondContact O-N 2.9Å
78	L	94.8	Very high	92.6	Very high	8 Å²	8	78.1 Å²	78.1	4%	0.042	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.5	171.1	-57.8	-172.9	0	0	0	108.2	V66 H67 F76 I117 T118 I119 F189 L196	V66-L78 HydrophobicContact CB-CB 3.96Å; V66-L78 WeakPolarHBondContact CB-O 3.4Å; V66-L78 HydrophobicContact CG1-CB 4.46Å; V66-L78 PolarHBondContact N-O 2.8Å; H67-L78 HydrophobicContact CB-CB 4.23Å; H67-L78 HydrophobicContact CB-CD1 4.08Å; H67-L78 HydrophobicContact CB-CG 4.31Å; H67-L78 PolarHBondContact N-O 2.81Å; H67-L78 PolarHBondContact O-N 3.06Å; F76-L78 HydrophobicContact CD2-CD2 4.14Å; F76-L78 HydrophobicContact CD2-CG 4.2Å; F76-L78 HydrophobicContact CE2-CD2 4.34Å; F76-L78 HydrophobicContact CE2-CG 4.09Å; L78-I117 HydrophobicContact CB-CD1 3.93Å; L78-I117 HydrophobicContact CB-CG1 4.46Å; L78-I117 HydrophobicContact CD1-CD1 4.19Å; L78-I117 HydrophobicContact CD2-CD1 4.49Å; L78-I117 HydrophobicContact CG-CD1 4.44Å; L78-T118 CarbonylContact C-O 3.54Å; L78-T118 WeakPolarHBondContact CA-O 3.34Å; L78-I119 HydrophobicContact CD2-CB 4.23Å; L78-I119 HydrophobicContact CD2-CD1 3.99Å; L78-I119 HydrophobicContact CD2-CG1 3.62Å; L78-I119 HydrophobicContact CD2-CG2 4.09Å; L78-F189 HydrophobicContact CD1-CE2 4.12Å; L78-F189 HydrophobicContact CD2-CD2 4.41Å; L78-F189 HydrophobicContact CD2-CE2 4.07Å; L78-L196 HydrophobicContact CD1-CD1 4.3Å
79	R	95.4	Very high	92.6	Very high	86 Å²	86	73.4 Å²	73.4	33%	0.325	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	164	-172.9	-65.6	-168.7	179	-162.2	-4.5	111.6	S64 E68 A77 F81 T118 Y120	S64-R79 CarbonylContact O-C 3.52Å; S64-R79 WeakPolarHBondContact O-CA 3.41Å; S64-R79 WeakPolarHBondContact O-CB 3.28Å; S64-R79 WeakPolarHBondContact O-CG 3.41Å; E68-R79 IonicContact OE1-CZ 3.68Å; E68-R79 IonicContact OE1-NE 2.71Å; E68-R79 IonicContact OE1-NH2 2.69Å; E68-R79 PolarHBondContact OE1-NH2 2.8Å; A77-R79 HydrophobicContact CB-CG 4.35Å; R79-F81 VanDerWaalsContact C-N 3.33Å; R79-F81 PolarHBondContact O-N 2.88Å; R79-T118 PolarHBondContact N-O 2.98Å; R79-T118 WeakPolarHBondContact O-CA 3.37Å; R79-T118 WeakPolarHBondContact O-CB 3.43Å; R79-T118 PolarHBondContact O-N 2.9Å; R79-Y120 HydrophobicContact CB-CD2 4.06Å; R79-Y120 HydrophobicContact CB-CE2 3.84Å; R79-Y120 HydrophobicContact CG-CD2 4.06Å; R79-Y120 HydrophobicContact CG-CE2 4.2Å
80	N	95	Very high	92.7	Very high	57 Å²	57	78.5 Å²	78.5	31%	0.305	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.4	48.1	174	-50.7	-38.5	0	0	0	112.8	I63 S64 R82	I63-N80 CarbonylContact O-C 3.58Å; I63-N80 WeakPolarHBondContact O-CA 3.23Å; I63-N80 PolarHBondContact O-N 2.82Å; S64-N80 PolarHBondContact O-N 2.8Å; N80-R82 PolarHBondContact O-N 2.61Å
81	F	94.2	Very high	92.6	Very high	21 Å²	21	78.4 Å²	78.4	9%	0.092	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.2	172.1	169.4	-80.9	0	0	0	109.3	L61 H62 I63 V66 R79 I83 M113 F115 E116 I117	L61-F81 HydrophobicContact CD2-CE1 4.28Å; H62-F81 CarbonylContact C-O 3.56Å; H62-F81 WeakPolarHBondContact CA-O 3.12Å; I63-F81 HydrophobicContact CB-CB 4.17Å; I63-F81 HydrophobicContact CB-CD1 4.32Å; I63-F81 HydrophobicContact CD1-CD1 3.95Å; I63-F81 HydrophobicContact CD1-CE1 4.31Å; I63-F81 HydrophobicContact CG1-CD1 4.02Å; I63-F81 PolarHBondContact N-O 2.91Å; I63-F81 PolarHBondContact O-N 3.39Å; V66-F81 HydrophobicContact CG2-CB 3.46Å; V66-F81 VanDerWaalsContact CG2-CB 3.46Å; V66-F81 HydrophobicContact CG2-CG 4.47Å; R79-F81 VanDerWaalsContact C-N 3.33Å; R79-F81 PolarHBondContact O-N 2.88Å; F81-I83 HydrophobicContact CE1-CD1 4.48Å; F81-I83 HydrophobicContact CE1-CG1 3.89Å; F81-I83 HydrophobicContact CZ-CG1 4.27Å; F81-M113 HydrophobicContact CE1-CE 4.23Å; F81-M113 HydrophobicContact CE2-CE 4.21Å; F81-M113 HydrophobicContact CZ-CE 3.42Å; F81-M113 VanDerWaalsContact CZ-CE 3.42Å; F81-F115 HydrophobicContact CD2-CB 4.25Å; F81-F115 AromaticContact CD2-CD2 3.44Å; F81-F115 HydrophobicContact CD2-CD2 3.44Å; F81-F115 VanDerWaalsContact CD2-CD2 3.44Å; F81-F115 AromaticContact CD2-CE2 3.9Å; F81-F115 HydrophobicContact CD2-CE2 3.9Å; F81-F115 AromaticContact CD2-CG 3.96Å; F81-F115 HydrophobicContact CD2-CG 3.96Å; F81-F115 HydrophobicContact CE2-CB 3.77Å; F81-F115 AromaticContact CE2-CD1 3.94Å; F81-F115 HydrophobicContact CE2-CD1 3.94Å; F81-F115 AromaticContact CE2-CD2 3.32Å; F81-F115 HydrophobicContact CE2-CD2 3.32Å; F81-F115 HydrophobicContact CE2-CE1 4.31Å; F81-F115 AromaticContact CE2-CE2 3.76Å; F81-F115 HydrophobicContact CE2-CE2 3.76Å; F81-F115 AromaticContact CE2-CG 3.4Å; F81-F115 HydrophobicContact CE2-CG 3.4Å; F81-F115 HydrophobicContact CE2-CZ 4.22Å; F81-F115 HydrophobicContact CZ-CB 4.09Å; F81-F115 HydrophobicContact CZ-CD2 4.4Å; F81-F115 HydrophobicContact CZ-CG 4.11Å; F81-E116 CarbonylContact C-O 3.49Å; F81-E116 VanDerWaalsContact CA-O 3.26Å; F81-E116 WeakPolarHBondContact CA-O 3.3Å; F81-I117 HydrophobicContact CB-CD1 4.45Å; F81-I117 HydrophobicContact CB-CG1 4.34Å; F81-I117 HydrophobicContact CD2-CD1 4.31Å
82	R	93.9	Very high	92.8	Very high	120 Å²	120	77.4 Å²	77.4	45%	0.453	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.2	174.4	65.3	179.7	-169.2	141.4	-0.7	110.7	N80 V84 F115 E116	N80-R82 PolarHBondContact O-N 2.61Å; R82-V84 PolarHBondContact O-N 3.34Å; R82-F115 CarbonylContact O-C 3.6Å; R82-F115 WeakPolarHBondContact O-CA 3.29Å; R82-F115 VanDerWaalsContact O-CB 3.24Å; R82-F115 WeakPolarHBondContact O-CB 3.33Å; R82-E116 HydrophobicContact CG-CB 3.8Å; R82-E116 IonicContact CZ-OE1 3.38Å; R82-E116 IonicContact CZ-OE2 3.62Å; R82-E116 PolarHBondContact N-O 3.47Å; R82-E116 VanDerWaalsContact NE-CD 3.32Å; R82-E116 IonicContact NE-OE1 3.24Å; R82-E116 IonicContact NE-OE2 3.66Å; R82-E116 PolarHBondContact NE-OE2 2.95Å; R82-E116 IonicContact NH2-OE1 3.15Å; R82-E116 PolarHBondContact NH2-OE1 2.85Å; R82-E116 IonicContact NH2-OE2 2.96Å; R82-E116 PolarHBondContact NH2-OE2 3.41Å; R82-E116 PolarHBondContact O-N 3.19Å
83	I	92.9	Very high	93.1	Very high	21 Å²	21	74.5 Å²	74.5	11%	0.108	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	123.5	172.5	-55.3	-167.2	0	0	0	108.2	L58 L61 F81 L86 M113	L58-I83 HydrophobicContact CB-CD1 4.34Å; L58-I83 WeakPolarHBondContact O-CD1 3.37Å; L61-I83 HydrophobicContact CB-CD1 4.38Å; L61-I83 HydrophobicContact CB-CG1 4.47Å; L61-I83 HydrophobicContact CD2-CD1 4.15Å; F81-I83 HydrophobicContact CE1-CD1 4.48Å; F81-I83 HydrophobicContact CE1-CG1 3.89Å; F81-I83 HydrophobicContact CZ-CG1 4.27Å; I83-L86 HydrophobicContact CG2-CB 4.02Å; I83-M113 HydrophobicContact CD1-CE 3.48Å; I83-M113 VanDerWaalsContact CD1-CE 3.48Å; I83-M113 HydrophobicContact CG1-CE 3.59Å
84	V	94.1	Very high	93.2	Very high	77 Å²	77	63.9 Å²	63.9	47%	0.467	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-41.4	176.2	177.6	0	0	0	0	110.2	R82 D114 E116 L132	R82-V84 PolarHBondContact O-N 3.34Å; V84-D114 HydrophobicContact CB-CB 4.26Å; V84-D114 PolarHBondContact N-O 2.87Å; V84-E116 HydrophobicContact CG2-CB 4.33Å; V84-E116 HydrophobicContact CG2-CG 3.76Å; V84-L132 HydrophobicContact CG2-CD1 4.22Å
85	R	93.4	Very high	93.3	Very high	115 Å²	115	65.6 Å²	65.6	43%	0.434	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	138.1	179	-174.5	-179.9	60.6	154	2.1	109.5	M113 D114	R85-M113 WeakPolarHBondContact O-CA 3.37Å; R85-D114 HydrophobicContact CB-CB 3.92Å; R85-D114 WeakPolarHBondContact CB-OD2 3.19Å; R85-D114 IonicContact CZ-OD1 3.88Å; R85-D114 IonicContact CZ-OD2 3.35Å; R85-D114 PolarHBondContact N-O 3.42Å; R85-D114 VanDerWaalsContact N-O 3.12Å; R85-D114 IonicContact NE-OD1 3.12Å; R85-D114 IonicContact NE-OD2 3.81Å; R85-D114 PolarHBondContact NE-OD2 3.28Å; R85-D114 VanDerWaalsContact NH2-CG 3.32Å; R85-D114 IonicContact NH2-OD1 3.58Å; R85-D114 PolarHBondContact NH2-OD1 3.42Å; R85-D114 IonicContact NH2-OD2 2.96Å; R85-D114 PolarHBondContact NH2-OD2 2.9Å; R85-D114 PolarHBondContact O-N 3.33Å
86	L	91.8	Very high	93.3	Very high	40 Å²	40	56.8 Å²	56.8	21%	0.209	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	118.4	170.3	179.4	65.2	0	0	0	108.2	L58 I83 F111 M113	L58-L86 HydrophobicContact CB-CD2 3.79Å; L58-L86 HydrophobicContact CD1-CD2 3.79Å; L58-L86 HydrophobicContact CG-CD2 4.45Å; I83-L86 HydrophobicContact CG2-CB 4.02Å; L86-F111 HydrophobicContact CD1-CD2 4Å; L86-M113 HydrophobicContact CD1-CB 4.29Å; L86-M113 HydrophobicContact CD1-CG 4.45Å
87	T	92.6	Very high	93.3	Very high	45 Å²	45	58.5 Å²	58.5	28%	0.276	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-85	161.7	175.5	66.2	0	0	0	0	110.8	D112	T87-D112 HydrophobicContact CG2-CB 4.01Å; T87-D112 PolarHBondContact N-O 3.47Å; T87-D112 PolarHBondContact OG1-N 3.14Å; T87-D112 PolarHBondContact OG1-O 2.94Å
88	E	89.3	Confident	93.2	Very high	113 Å²	113	60.7 Å²	60.7	53%	0.528	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-72.3	138.6	170.4	-63.8	-171.8	155.5	0	0	109.6	R55	R55-E88 IonicContact CZ-OE1 2.76Å; R55-E88 IonicContact NE-OE1 3.27Å; R55-E88 IonicContact NH1-OE1 3.87Å; R55-E88 PolarHBondContact NH1-OE1 3.39Å
89	A	91.2	Very high	92.8	Very high	20 Å²	20	67.5 Å²	67.5	17%	0.165	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-66.7	137.3	173.7	0	0	0	0	0	110.2	K91 V92 A108 F111	A89-K91 PolarHBondContact O-N 2.96Å; A89-V92 HydrophobicContact CB-CG2 3.76Å; A89-A108 HydrophobicContact CB-CB 3.9Å; A89-F111 HydrophobicContact CB-CB 3.97Å; A89-F111 HydrophobicContact CB-CD1 4.15Å
90	E	93.1	Very high	92.6	Very high	130 Å²	130	64.8 Å²	64.8	61%	0.607	32%	0.315	S	S	*	.	S	Bend	trans	-60.1	-30.5	176.9	-166.8	-176.2	145.8	0	0	111.7	D109 R110	E90-D109 PolarHBondContact N-O 2.98Å; E90-D109 VanDerWaalsContact N-O 3.16Å; E90-R110 HydrophobicContact CB-CB 4.1Å; E90-R110 PolarHBondContact N-O 3.28Å; E90-R110 IonicContact OE1-CZ 3.09Å; E90-R110 IonicContact OE1-NE 2.66Å; E90-R110 IonicContact OE1-NH1 2.95Å; E90-R110 PolarHBondContact OE1-NH1 3.32Å; E90-R110 IonicContact OE1-NH2 3.82Å; E90-R110 PolarHBondContact OE1-NH2 2.91Å; E90-R110 WeakPolarHBondContact OE2-CD 3.34Å; E90-R110 IonicContact OE2-CZ 2.66Å; E90-R110 IonicContact OE2-NE 2.79Å; E90-R110 PolarHBondContact OE2-NE 2.98Å; E90-R110 IonicContact OE2-NH1 3.95Å; E90-R110 PolarHBondContact OE2-NH1 3.41Å; E90-R110 IonicContact OE2-NH2 3.42Å; E90-R110 PolarHBondContact OE2-NH2 2.85Å; E90-R110 VanDerWaalsContact OE2-NH2 3.15Å
91	K	91.5	Very high	92.4	Very high	88 Å²	88	64.8 Å²	64.8	38%	0.383	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.7	178.8	-158.6	-169.4	-167.6	-152.8	0	110.7	A89 E93 A108 D109	A89-K91 PolarHBondContact O-N 2.96Å; K91-E93 HydrophobicContact CD-CG 4.21Å; K91-E93 WeakPolarHBondContact CE-OE1 3Å; K91-E93 WeakPolarHBondContact CE-OE2 3.21Å; K91-E93 HydrophobicContact CG-CG 4.1Å; K91-E93 IonicContact NZ-OE1 3.85Å; K91-E93 PolarHBondContact NZ-OE1 2.86Å; K91-E93 IonicContact NZ-OE2 2.61Å; K91-E93 PolarHBondContact NZ-OE2 2.8Å; K91-A108 CarbonylContact O-C 3.51Å; K91-A108 VanDerWaalsContact O-CA 3.29Å; K91-A108 WeakPolarHBondContact O-CA 3.45Å; K91-D109 HydrophobicContact CB-CB 4.29Å; K91-D109 PolarHBondContact N-O 3.44Å; K91-D109 PolarHBondContact O-N 2.9Å
92	V	91.5	Very high	92.5	Very high	32 Å²	32	65.7 Å²	65.7	19%	0.194	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	119.3	170.1	-171.4	0	0	0	0	108.9	K47 A89 S107 A108	K47-V92 HydrophobicContact CD-CB 4.43Å; K47-V92 HydrophobicContact CD-CG1 3.98Å; K47-V92 WeakPolarHBondContact CD-O 3.45Å; K47-V92 WeakPolarHBondContact CE-O 3.35Å; K47-V92 HydrophobicContact CG-CG1 4.13Å; A89-V92 HydrophobicContact CB-CG2 3.76Å; V92-S107 CarbonylContact C-O 3.49Å; V92-S107 WeakPolarHBondContact CA-O 3.4Å; V92-A108 HydrophobicContact CG2-CB 4.18Å
93	E	92	Very high	92.6	Very high	76 Å²	76	60.3 Å²	60.3	36%	0.355	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138	-176.5	-68.1	-171.1	137.5	0	0	111.7	K91 L106 S107	K91-E93 HydrophobicContact CD-CG 4.21Å; K91-E93 WeakPolarHBondContact CE-OE1 3Å; K91-E93 WeakPolarHBondContact CE-OE2 3.21Å; K91-E93 HydrophobicContact CG-CG 4.1Å; K91-E93 IonicContact NZ-OE1 3.85Å; K91-E93 PolarHBondContact NZ-OE1 2.86Å; K91-E93 IonicContact NZ-OE2 2.61Å; K91-E93 PolarHBondContact NZ-OE2 2.8Å; E93-L106 WeakPolarHBondContact O-CA 3.48Å; E93-S107 PolarHBondContact N-O 2.81Å; E93-S107 PolarHBondContact O-N 2.89Å
94	V	93	Very high	92.7	Very high	18 Å²	18	59.9 Å²	59.9	11%	0.109	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106.7	163.1	173.6	0	0	0	0	106.8	F43 K47 I104 R105 L106	F43-V94 HydrophobicContact CB-CG1 4.02Å; F43-V94 HydrophobicContact CD1-CG1 3.89Å; F43-V94 HydrophobicContact CG-CG1 4.31Å; K47-V94 HydrophobicContact CB-CB 4.41Å; K47-V94 HydrophobicContact CB-CG2 3.75Å; K47-V94 HydrophobicContact CD-CB 4.23Å; K47-V94 HydrophobicContact CD-CG2 3.76Å; K47-V94 HydrophobicContact CG-CG2 3.66Å; V94-I104 HydrophobicContact CG1-CG2 4.07Å; V94-R105 WeakPolarHBondContact CA-O 3.4Å; V94-L106 HydrophobicContact CG2-CD1 3.6Å
95	E	93.8	Very high	92.7	Very high	73 Å²	73	60.5 Å²	60.5	34%	0.341	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.3	-177.7	-172.7	-165.3	170.9	0	0	110	R97 I104 R105	E95-R97 HydrophobicContact CG-CG 4.29Å; E95-I104 CarbonylContact O-C 3.5Å; E95-I104 WeakPolarHBondContact O-CA 3.43Å; E95-R105 HydrophobicContact CB-CB 4.28Å; E95-R105 PolarHBondContact N-O 2.9Å; E95-R105 PolarHBondContact O-N 2.77Å; E95-R105 IonicContact OE2-NH1 2.84Å
96	L	95	Very high	92.8	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	125.4	163.2	-60.2	-176.6	0	0	0	110	F43 P98 Q103 I104 V277 K284	F43-L96 HydrophobicContact CD1-CD2 4.2Å; F43-L96 HydrophobicContact CD2-CD1 3.66Å; F43-L96 HydrophobicContact CD2-CD2 3.68Å; F43-L96 HydrophobicContact CD2-CG 4Å; F43-L96 HydrophobicContact CE1-CD2 4.16Å; F43-L96 HydrophobicContact CE2-CD1 3.94Å; F43-L96 HydrophobicContact CE2-CD2 3.61Å; F43-L96 HydrophobicContact CE2-CG 4.3Å; F43-L96 HydrophobicContact CG-CD1 4.44Å; F43-L96 HydrophobicContact CG-CD2 3.96Å; F43-L96 HydrophobicContact CG-CG 4.35Å; F43-L96 HydrophobicContact CZ-CD2 3.86Å; L96-P98 WeakPolarHBondContact O-CD 3.23Å; L96-Q103 WeakPolarHBondContact CA-O 3.46Å; L96-I104 HydrophobicContact CD2-CG1 3.93Å; L96-V277 HydrophobicContact CB-CG1 3.78Å; L96-V277 HydrophobicContact CB-CG2 4.1Å; L96-V277 HydrophobicContact CD2-CG2 4.38Å; L96-K284 HydrophobicContact CB-CD 4.1Å; L96-K284 HydrophobicContact CB-CG 4.24Å; L96-K284 WeakPolarHBondContact O-CD 3.09Å; L96-K284 WeakPolarHBondContact O-CE 3.49Å; L96-K284 PolarHBondContact O-NZ 2.82Å
97	R	95.2	Very high	92.9	Very high	79 Å²	79	55.2 Å²	55.2	30%	0.298	28%	0.281	S	S	.	.			trans	-105.3	102.4	-175	-62.5	-179.9	69.5	-150	5.4	110.8	E95 Q99 A100 Q103 V277	E95-R97 HydrophobicContact CG-CG 4.29Å; R97-Q99 PolarHBondContact O-N 3.21Å; R97-A100 HydrophobicContact CB-CB 3.63Å; R97-A100 PolarHBondContact O-N 3.31Å; R97-Q103 PolarHBondContact N-O 3.31Å; R97-V277 WeakPolarHBondContact O-CB 3.14Å
98	P	93.6	Very high	93	Very high	55 Å²	55	53.3 Å²	53.3	36%	0.357	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	137.7	-178.9	-22.4	34.1	0	0	0	112.1	L96 A100 V277 L279 K284	L96-P98 WeakPolarHBondContact O-CD 3.23Å; P98-A100 PolarHBondContact O-N 3.24Å; P98-V277 WeakPolarHBondContact CA-O 3.48Å; P98-V277 HydrophobicContact CB-CG1 4.28Å; P98-V277 HydrophobicContact CG-CG1 4.06Å; P98-L279 HydrophobicContact CG-CB 4.35Å; P98-K284 HydrophobicContact CG-CD 3.89Å
99	Q	85.7	Confident	93.2	Very high	152 Å²	152	50.1 Å²	50.1	71%	0.71	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	11.6	177.1	-53.5	-58.7	-37	0	0	115.6	R97 V277	R97-Q99 PolarHBondContact O-N 3.21Å; Q99-V277 PolarHBondContact N-O 2.8Å
100	A	91.3	Very high	93.4	Very high	28 Å²	28	54.8 Å²	54.8	23%	0.231	27%	0.269	C	S	.	.			trans	-85.8	148.1	176.6	0	0	0	0	0	111	R97 P98 Q102	R97-A100 HydrophobicContact CB-CB 3.63Å; R97-A100 PolarHBondContact O-N 3.31Å; P98-A100 PolarHBondContact O-N 3.24Å; A100-Q102 VanDerWaalsContact C-N 3.34Å; A100-Q102 WeakPolarHBondContact CB-O 3.43Å
101	A	91.6	Very high	93.5	Very high	58 Å²	58	49.3 Å²	49.3	48%	0.479	24%	0.243	S	C	.	.	S	Bend	trans	-63.9	-41.7	171.7	0	0	0	0	0	111.3	Q103 Q145	A101-Q103 VanDerWaalsContact O-CD 3.28Å; A101-Q103 PolarHBondContact O-OE1 2.74Å; A101-Q145 WeakPolarHBondContact O-CG 3.25Å
102	Q	95.5	Very high	93.6	Very high	39 Å²	39	47.3 Å²	47.3	18%	0.182	24%	0.237	C	C	.	.	S	Bend	trans	-92.3	99	170	-48.5	79.3	14.6	0	0	108.7	A100 I104 I144 H159	A100-Q102 VanDerWaalsContact C-N 3.34Å; A100-Q102 WeakPolarHBondContact CB-O 3.43Å; Q102-I104 VanDerWaalsContact C-N 3.32Å; Q102-I104 PolarHBondContact O-N 2.95Å; Q102-I144 CarbonylContact C-O 3.47Å; Q102-H159 HydrophobicContact CG-CB 3.75Å; Q102-H159 PolarHBondContact NE2-CD2 3.37Å; Q102-H159 PolarHBondContact NE2-NE2 3.39Å
103	Q	95.6	Very high	93.7	Very high	7 Å²	7	46.4 Å²	46.4	3%	0.033	23%	0.231	C	C	.	.			trans	-72	-25.4	-168.7	-63.5	92.1	-16.5	0	0	113.5	L96 R97 A101 I144 L146 P275 V277 L286	L96-Q103 WeakPolarHBondContact CA-O 3.46Å; R97-Q103 PolarHBondContact N-O 3.31Å; A101-Q103 VanDerWaalsContact O-CD 3.28Å; A101-Q103 PolarHBondContact O-OE1 2.74Å; Q103-I144 PolarHBondContact N-O 2.83Å; Q103-L146 HydrophobicContact CB-CD1 4.09Å; Q103-L146 PolarHBondContact NE2-O 3.29Å; Q103-P275 PolarHBondContact NE2-O 3.16Å; Q103-V277 HydrophobicContact CB-CG2 3.85Å; Q103-V277 HydrophobicContact CG-CG2 4.38Å; Q103-L286 HydrophobicContact CB-CD1 4.34Å; Q103-L286 HydrophobicContact CG-CD1 4.45Å
104	I	95.5	Very high	93.9	Very high	12 Å²	12	43.7 Å²	43.7	6%	0.062	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.3	-175	-53.6	175.8	0	0	0	108.6	F43 V94 E95 L96 Q102 T143 I144 L146	F43-I104 HydrophobicContact CE1-CD1 3.62Å; F43-I104 HydrophobicContact CE1-CG1 4.47Å; F43-I104 HydrophobicContact CZ-CD1 3.92Å; V94-I104 HydrophobicContact CG1-CG2 4.07Å; E95-I104 CarbonylContact O-C 3.5Å; E95-I104 WeakPolarHBondContact O-CA 3.43Å; L96-I104 HydrophobicContact CD2-CG1 3.93Å; Q102-I104 VanDerWaalsContact C-N 3.32Å; Q102-I104 PolarHBondContact O-N 2.95Å; I104-T143 CarbonylContact O-C 3.52Å; I104-T143 WeakPolarHBondContact O-CA 3.42Å; I104-I144 HydrophobicContact CB-CB 4.18Å; I104-I144 PolarHBondContact N-O 3.36Å; I104-I144 PolarHBondContact O-N 2.85Å; I104-L146 HydrophobicContact CD1-CD1 3.69Å; I104-L146 HydrophobicContact CG1-CD1 3.98Å
105	R	95.3	Very high	94	Very high	91 Å²	91	42.9 Å²	42.9	34%	0.343	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.9	165.3	177.3	-176.4	-179.3	-157.4	-4.5	108.7	V94 E95 S141 E142 T143	V94-R105 WeakPolarHBondContact CA-O 3.4Å; E95-R105 HydrophobicContact CB-CB 4.28Å; E95-R105 PolarHBondContact N-O 2.9Å; E95-R105 PolarHBondContact O-N 2.77Å; E95-R105 IonicContact OE2-NH1 2.84Å; R105-S141 PolarHBondContact NE-OG 2.71Å; R105-E142 CarbonylContact C-O 3.54Å; R105-E142 WeakPolarHBondContact CA-O 3.42Å; R105-T143 HydrophobicContact CB-CG2 4.45Å; R105-T143 HydrophobicContact CG-CG2 4.37Å
106	L	93.8	Very high	94.2	Very high	41 Å²	41	41 Å²	41	22%	0.215	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.2	169.6	176.1	65.6	0	0	0	107.7	E93 V94 F140 S141 E142	E93-L106 WeakPolarHBondContact O-CA 3.48Å; V94-L106 HydrophobicContact CG2-CD1 3.6Å; L106-F140 HydrophobicContact CD2-CE2 4.02Å; L106-F140 HydrophobicContact CD2-CZ 4.33Å; L106-F140 HydrophobicContact CG-CE2 3.99Å; L106-F140 HydrophobicContact CG-CZ 4.35Å; L106-S141 CarbonylContact O-C 3.59Å; L106-S141 VanDerWaalsContact O-CA 3.28Å; L106-S141 WeakPolarHBondContact O-CA 3.46Å; L106-S141 PolarHBondContact O-OG 3.48Å; L106-E142 PolarHBondContact N-O 3.39Å; L106-E142 PolarHBondContact O-N 2.88Å
107	S	94.9	Very high	94.2	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	147.5	172	51.2	0	0	0	0	112.1	V92 E93 F140	V92-S107 CarbonylContact C-O 3.49Å; V92-S107 WeakPolarHBondContact CA-O 3.4Å; E93-S107 PolarHBondContact N-O 2.81Å; E93-S107 PolarHBondContact O-N 2.89Å; S107-F140 CarbonylContact C-O 3.54Å; S107-F140 WeakPolarHBondContact CA-O 3.25Å; S107-F140 WeakPolarHBondContact CB-O 3.24Å
108	A	94	Very high	94.4	Very high	5 Å²	5	38.1 Å²	38.1	4%	0.041	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.1	168.4	0	0	0	0	0	108.8	A89 K91 V92 F111 S139 F140	A89-A108 HydrophobicContact CB-CB 3.9Å; K91-A108 CarbonylContact O-C 3.51Å; K91-A108 VanDerWaalsContact O-CA 3.29Å; K91-A108 WeakPolarHBondContact O-CA 3.45Å; V92-A108 HydrophobicContact CG2-CB 4.18Å; A108-F111 HydrophobicContact CB-CD1 4.34Å; A108-F111 HydrophobicContact CB-CE1 4.32Å; A108-S139 CarbonylContact O-C 3.6Å; A108-S139 WeakPolarHBondContact O-CA 3.46Å; A108-S139 WeakPolarHBondContact O-CB 3.42Å; A108-F140 HydrophobicContact CB-CD1 3.77Å; A108-F140 HydrophobicContact CB-CE1 3.34Å; A108-F140 HydrophobicContact CB-CZ 3.96Å; A108-F140 PolarHBondContact N-O 2.85Å; A108-F140 PolarHBondContact O-N 2.9Å
109	D	95	Very high	94.5	Very high	46 Å²	46	35.7 Å²	35.7	25%	0.246	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.8	-176.4	-60.4	-43.3	0	0	0	111	E90 K91 S139	E90-D109 PolarHBondContact N-O 2.98Å; E90-D109 VanDerWaalsContact N-O 3.16Å; K91-D109 HydrophobicContact CB-CB 4.29Å; K91-D109 PolarHBondContact N-O 3.44Å; K91-D109 PolarHBondContact O-N 2.9Å; D109-S139 WeakPolarHBondContact OD1-CB 3.48Å
110	R	95	Very high	95.1	Very high	118 Å²	118	32.7 Å²	32.7	45%	0.445	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58	66.8	174.9	-63.2	176.7	-71.9	-175.3	6.8	112.8	E90 A138	E90-R110 HydrophobicContact CB-CB 4.1Å; E90-R110 PolarHBondContact N-O 3.28Å; E90-R110 IonicContact OE1-CZ 3.09Å; E90-R110 IonicContact OE1-NE 2.66Å; E90-R110 IonicContact OE1-NH1 2.95Å; E90-R110 PolarHBondContact OE1-NH1 3.32Å; E90-R110 IonicContact OE1-NH2 3.82Å; E90-R110 PolarHBondContact OE1-NH2 2.91Å; E90-R110 WeakPolarHBondContact OE2-CD 3.34Å; E90-R110 IonicContact OE2-CZ 2.66Å; E90-R110 IonicContact OE2-NE 2.79Å; E90-R110 PolarHBondContact OE2-NE 2.98Å; E90-R110 IonicContact OE2-NH1 3.95Å; E90-R110 PolarHBondContact OE2-NH1 3.41Å; E90-R110 IonicContact OE2-NH2 3.42Å; E90-R110 PolarHBondContact OE2-NH2 2.85Å; E90-R110 VanDerWaalsContact OE2-NH2 3.15Å; R110-A138 WeakPolarHBondContact CA-O 3.36Å; R110-A138 PolarHBondContact N-O 2.86Å
111	F	93.9	Very high	95.3	Very high	15 Å²	15	32.3 Å²	32.3	7%	0.066	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	152.2	163.6	60.3	-84.9	0	0	0	110.5	L86 A89 A108 Q137 A138 F140 F163	L86-F111 HydrophobicContact CD1-CD2 4Å; A89-F111 HydrophobicContact CB-CB 3.97Å; A89-F111 HydrophobicContact CB-CD1 4.15Å; A108-F111 HydrophobicContact CB-CD1 4.34Å; A108-F111 HydrophobicContact CB-CE1 4.32Å; F111-Q137 PolarHBondContact O-N 2.7Å; F111-A138 HydrophobicContact CD1-CB 4.39Å; F111-A138 VanDerWaalsContact CD1-O 3.24Å; F111-A138 WeakPolarHBondContact CD1-O 3.35Å; F111-A138 HydrophobicContact CD2-CB 3.91Å; F111-A138 HydrophobicContact CE1-CB 4.05Å; F111-A138 WeakPolarHBondContact CE1-O 3.47Å; F111-A138 HydrophobicContact CE2-CB 3.52Å; F111-A138 HydrophobicContact CG-CB 4.33Å; F111-A138 HydrophobicContact CZ-CB 3.6Å; F111-A138 PolarHBondContact N-O 3.32Å; F111-A138 WeakPolarHBondContact O-CA 3.4Å; F111-A138 WeakPolarHBondContact O-CB 3.3Å; F111-A138 PolarHBondContact O-N 3.39Å; F111-F140 AromaticContact CE1-CD1 3.9Å; F111-F140 HydrophobicContact CE1-CD1 3.9Å; F111-F140 HydrophobicContact CZ-CD1 4.12Å; F111-F163 HydrophobicContact CE2-CE2 4.3Å; F111-F163 AromaticContact CZ-CE2 3.8Å; F111-F163 HydrophobicContact CZ-CE2 3.8Å
112	D	95.1	Very high	95.5	Very high	46 Å²	46	33.1 Å²	33.1	25%	0.246	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	143.5	177.3	-52.8	-35.1	0	0	0	109.2	T87 I135 E136 Q137	T87-D112 HydrophobicContact CG2-CB 4.01Å; T87-D112 PolarHBondContact N-O 3.47Å; T87-D112 PolarHBondContact OG1-N 3.14Å; T87-D112 PolarHBondContact OG1-O 2.94Å; D112-I135 CarbonylContact C-O 3.47Å; D112-I135 VanDerWaalsContact CA-O 3.28Å; D112-I135 WeakPolarHBondContact CA-O 3.44Å; D112-E136 VanDerWaalsContact OD1-CA 3.27Å; D112-E136 WeakPolarHBondContact OD1-CA 3.13Å; D112-Q137 PolarHBondContact OD1-N 3.26Å
113	M	93.5	Very high	95.3	Very high	13 Å²	13	33.3 Å²	33.3	6%	0.064	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	120.5	-176	-179.6	179.2	-178.3	0	0	110	F81 I83 R85 L86 F115 I135	F81-M113 HydrophobicContact CE1-CE 4.23Å; F81-M113 HydrophobicContact CE2-CE 4.21Å; F81-M113 HydrophobicContact CZ-CE 3.42Å; F81-M113 VanDerWaalsContact CZ-CE 3.42Å; I83-M113 HydrophobicContact CD1-CE 3.48Å; I83-M113 VanDerWaalsContact CD1-CE 3.48Å; I83-M113 HydrophobicContact CG1-CE 3.59Å; R85-M113 WeakPolarHBondContact O-CA 3.37Å; L86-M113 HydrophobicContact CD1-CB 4.29Å; L86-M113 HydrophobicContact CD1-CG 4.45Å; M113-F115 HydrophobicContact CE-CB 4.15Å; M113-F115 HydrophobicContact CE-CD1 3.99Å; M113-F115 HydrophobicContact CE-CG 4.39Å; M113-F115 HydrophobicContact CG-CD1 4.3Å; M113-F115 HydrophobicContact SD-CD1 4.39Å; M113-I135 PolarHBondContact N-O 3.42Å; M113-I135 PolarHBondContact O-N 3.45Å
114	D	95.4	Very high	95.1	Very high	18 Å²	18	43.1 Å²	43.1	10%	0.096	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.8	166.2	-53.6	-26.1	0	0	0	109.4	V84 R85 L132 V133 S134	V84-D114 HydrophobicContact CB-CB 4.26Å; V84-D114 PolarHBondContact N-O 2.87Å; R85-D114 HydrophobicContact CB-CB 3.92Å; R85-D114 WeakPolarHBondContact CB-OD2 3.19Å; R85-D114 IonicContact CZ-OD1 3.88Å; R85-D114 IonicContact CZ-OD2 3.35Å; R85-D114 PolarHBondContact N-O 3.42Å; R85-D114 VanDerWaalsContact N-O 3.12Å; R85-D114 IonicContact NE-OD1 3.12Å; R85-D114 IonicContact NE-OD2 3.81Å; R85-D114 PolarHBondContact NE-OD2 3.28Å; R85-D114 VanDerWaalsContact NH2-CG 3.32Å; R85-D114 IonicContact NH2-OD1 3.58Å; R85-D114 PolarHBondContact NH2-OD1 3.42Å; R85-D114 IonicContact NH2-OD2 2.96Å; R85-D114 PolarHBondContact NH2-OD2 2.9Å; R85-D114 PolarHBondContact O-N 3.33Å; D114-L132 HydrophobicContact CB-CD1 4.43Å; D114-V133 CarbonylContact C-O 3.57Å; D114-V133 VanDerWaalsContact CA-O 3.24Å; D114-V133 WeakPolarHBondContact CA-O 3.27Å; D114-S134 VanDerWaalsContact CG-OG 3.25Å; D114-S134 WeakPolarHBondContact OD1-CA 3.35Å; D114-S134 WeakPolarHBondContact OD1-CB 3.42Å; D114-S134 PolarHBondContact OD1-OG 3.36Å
115	F	95.4	Very high	95	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	151.2	173.6	65.6	-92.4	0	0	0	111.2	F81 R82 M113 I117 V133 I135 L193 M197	F81-F115 HydrophobicContact CD2-CB 4.25Å; F81-F115 AromaticContact CD2-CD2 3.44Å; F81-F115 HydrophobicContact CD2-CD2 3.44Å; F81-F115 VanDerWaalsContact CD2-CD2 3.44Å; F81-F115 AromaticContact CD2-CE2 3.9Å; F81-F115 HydrophobicContact CD2-CE2 3.9Å; F81-F115 AromaticContact CD2-CG 3.96Å; F81-F115 HydrophobicContact CD2-CG 3.96Å; F81-F115 HydrophobicContact CE2-CB 3.77Å; F81-F115 AromaticContact CE2-CD1 3.94Å; F81-F115 HydrophobicContact CE2-CD1 3.94Å; F81-F115 AromaticContact CE2-CD2 3.32Å; F81-F115 HydrophobicContact CE2-CD2 3.32Å; F81-F115 HydrophobicContact CE2-CE1 4.31Å; F81-F115 AromaticContact CE2-CE2 3.76Å; F81-F115 HydrophobicContact CE2-CE2 3.76Å; F81-F115 AromaticContact CE2-CG 3.4Å; F81-F115 HydrophobicContact CE2-CG 3.4Å; F81-F115 HydrophobicContact CE2-CZ 4.22Å; F81-F115 HydrophobicContact CZ-CB 4.09Å; F81-F115 HydrophobicContact CZ-CD2 4.4Å; F81-F115 HydrophobicContact CZ-CG 4.11Å; R82-F115 CarbonylContact O-C 3.6Å; R82-F115 WeakPolarHBondContact O-CA 3.29Å; R82-F115 VanDerWaalsContact O-CB 3.24Å; R82-F115 WeakPolarHBondContact O-CB 3.33Å; M113-F115 HydrophobicContact CE-CB 4.15Å; M113-F115 HydrophobicContact CE-CD1 3.99Å; M113-F115 HydrophobicContact CE-CG 4.39Å; M113-F115 HydrophobicContact CG-CD1 4.3Å; M113-F115 HydrophobicContact SD-CD1 4.39Å; F115-I117 HydrophobicContact CD2-CB 4.21Å; F115-I117 HydrophobicContact CD2-CG2 4.39Å; F115-I117 HydrophobicContact CE2-CB 4.16Å; F115-I117 HydrophobicContact CE2-CG2 3.99Å; F115-V133 HydrophobicContact CD1-CB 4.08Å; F115-V133 HydrophobicContact CD1-CG1 4.33Å; F115-V133 HydrophobicContact CD2-CB 4.07Å; F115-V133 HydrophobicContact CD2-CG2 4.24Å; F115-V133 HydrophobicContact CE1-CB 3.65Å; F115-V133 HydrophobicContact CE1-CG1 3.52Å; F115-V133 HydrophobicContact CE1-CG2 4.45Å; F115-V133 HydrophobicContact CE2-CB 3.64Å; F115-V133 HydrophobicContact CE2-CG1 4.16Å; F115-V133 HydrophobicContact CE2-CG2 3.59Å; F115-V133 HydrophobicContact CG-CB 4.28Å; F115-V133 HydrophobicContact CZ-CB 3.43Å; F115-V133 VanDerWaalsContact CZ-CB 3.43Å; F115-V133 HydrophobicContact CZ-CG1 3.43Å; F115-V133 VanDerWaalsContact CZ-CG1 3.43Å; F115-V133 HydrophobicContact CZ-CG2 3.73Å; F115-V133 PolarHBondContact N-O 3.42Å; F115-V133 PolarHBondContact O-N 3.46Å; F115-I135 HydrophobicContact CE1-CD1 3.8Å; F115-I135 HydrophobicContact CE1-CG1 4.33Å; F115-L193 HydrophobicContact CZ-CD1 4.08Å; F115-M197 HydrophobicContact CE1-SD 4.43Å; F115-M197 HydrophobicContact CZ-SD 4.27Å
116	E	96.8	Very high	94.9	Very high	34 Å²	34	42.2 Å²	42.2	16%	0.159	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	145.9	167.4	-75.2	174.5	-152.7	0	0	110.3	F81 R82 V84 L131 L132 L173	F81-E116 CarbonylContact C-O 3.49Å; F81-E116 VanDerWaalsContact CA-O 3.26Å; F81-E116 WeakPolarHBondContact CA-O 3.3Å; R82-E116 HydrophobicContact CG-CB 3.8Å; R82-E116 IonicContact CZ-OE1 3.38Å; R82-E116 IonicContact CZ-OE2 3.62Å; R82-E116 PolarHBondContact N-O 3.47Å; R82-E116 VanDerWaalsContact NE-CD 3.32Å; R82-E116 IonicContact NE-OE1 3.24Å; R82-E116 IonicContact NE-OE2 3.66Å; R82-E116 PolarHBondContact NE-OE2 2.95Å; R82-E116 IonicContact NH2-OE1 3.15Å; R82-E116 PolarHBondContact NH2-OE1 2.85Å; R82-E116 IonicContact NH2-OE2 2.96Å; R82-E116 PolarHBondContact NH2-OE2 3.41Å; R82-E116 PolarHBondContact O-N 3.19Å; V84-E116 HydrophobicContact CG2-CB 4.33Å; V84-E116 HydrophobicContact CG2-CG 3.76Å; E116-L131 CarbonylContact C-O 3.59Å; E116-L131 VanDerWaalsContact CA-O 3.23Å; E116-L131 WeakPolarHBondContact CA-O 3.26Å; E116-L132 HydrophobicContact CG-CD1 3.89Å; E116-L173 VanDerWaalsContact CD-CD1 3.48Å; E116-L173 HydrophobicContact CG-CD1 3.65Å
117	I	96.6	Very high	95	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	143.1	175.8	-164.7	168.8	0	0	0	110.2	V66 L78 F81 F115 L131 V133 F189	V66-I117 HydrophobicContact CG1-CD1 4.46Å; V66-I117 HydrophobicContact CG2-CD1 4.35Å; L78-I117 HydrophobicContact CB-CD1 3.93Å; L78-I117 HydrophobicContact CB-CG1 4.46Å; L78-I117 HydrophobicContact CD1-CD1 4.19Å; L78-I117 HydrophobicContact CD2-CD1 4.49Å; L78-I117 HydrophobicContact CG-CD1 4.44Å; F81-I117 HydrophobicContact CB-CD1 4.45Å; F81-I117 HydrophobicContact CB-CG1 4.34Å; F81-I117 HydrophobicContact CD2-CD1 4.31Å; F115-I117 HydrophobicContact CD2-CB 4.21Å; F115-I117 HydrophobicContact CD2-CG2 4.39Å; F115-I117 HydrophobicContact CE2-CB 4.16Å; F115-I117 HydrophobicContact CE2-CG2 3.99Å; I117-L131 HydrophobicContact CG2-CB 4.11Å; I117-L131 PolarHBondContact N-O 2.92Å; I117-L131 PolarHBondContact O-N 3.22Å; I117-V133 HydrophobicContact CG2-CG2 4.31Å; I117-F189 HydrophobicContact CG2-CZ 3.97Å
118	T	97.8	Very high	95.1	Very high	12 Å²	12	49.3 Å²	49.3	7%	0.074	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.2	176	-52.5	0	0	0	0	110.5	L78 R79 Y120 R128 L129 V130	L78-T118 CarbonylContact C-O 3.54Å; L78-T118 WeakPolarHBondContact CA-O 3.34Å; R79-T118 PolarHBondContact N-O 2.98Å; R79-T118 WeakPolarHBondContact O-CA 3.37Å; R79-T118 WeakPolarHBondContact O-CB 3.43Å; R79-T118 PolarHBondContact O-N 2.9Å; T118-Y120 HydrophobicContact CG2-CD2 3.94Å; T118-Y120 HydrophobicContact CG2-CE2 3.39Å; T118-R128 HydrophobicContact CG2-CG 3.61Å; T118-L129 CarbonylContact C-O 3.55Å; T118-L129 WeakPolarHBondContact CA-O 3.42Å; T118-V130 HydrophobicContact CG2-CG2 4.2Å
119	I	97.1	Very high	95.3	Very high	5 Å²	5	49 Å²	49	3%	0.026	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.2	172.6	-47.8	-169.9	0	0	0	108	F76 A77 L78 T121 R128 L129 L131 V185 F189	F76-I119 HydrophobicContact CB-CG2 4.43Å; A77-I119 CarbonylContact O-C 3.53Å; A77-I119 WeakPolarHBondContact O-CA 3.17Å; L78-I119 HydrophobicContact CD2-CB 4.23Å; L78-I119 HydrophobicContact CD2-CD1 3.99Å; L78-I119 HydrophobicContact CD2-CG1 3.62Å; L78-I119 HydrophobicContact CD2-CG2 4.09Å; I119-T121 HydrophobicContact CG2-CG2 3.98Å; I119-R128 CarbonylContact O-C 3.5Å; I119-R128 WeakPolarHBondContact O-CA 3.14Å; I119-L129 HydrophobicContact CB-CB 4.36Å; I119-L129 PolarHBondContact N-O 2.86Å; I119-L129 PolarHBondContact O-N 3.46Å; I119-L131 HydrophobicContact CD1-CD1 3.59Å; I119-L131 HydrophobicContact CD1-CG 4.43Å; I119-L131 HydrophobicContact CG1-CD1 4.24Å; I119-V185 HydrophobicContact CD1-CG1 4.13Å; I119-V185 HydrophobicContact CG2-CG1 4.49Å; I119-F189 HydrophobicContact CD1-CB 4.2Å; I119-F189 HydrophobicContact CD1-CD2 3.54Å; I119-F189 HydrophobicContact CD1-CE2 4.1Å; I119-F189 HydrophobicContact CD1-CG 3.92Å
120	Y	97.1	Very high	95.4	Very high	89 Å²	89	47.5 Å²	47.5	35%	0.349	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	141.5	166.3	-65.9	-90.7	0	0	0	109.2	F76 A77 R79 T118 E127 R128	F76-Y120 CarbonylContact C-O 3.58Å; F76-Y120 WeakPolarHBondContact CA-O 3.35Å; F76-Y120 WeakPolarHBondContact CB-O 3.29Å; A77-Y120 PolarHBondContact N-O 3.49Å; A77-Y120 PolarHBondContact O-N 2.9Å; R79-Y120 HydrophobicContact CB-CD2 4.06Å; R79-Y120 HydrophobicContact CB-CE2 3.84Å; R79-Y120 HydrophobicContact CG-CD2 4.06Å; R79-Y120 HydrophobicContact CG-CE2 4.2Å; T118-Y120 HydrophobicContact CG2-CD2 3.94Å; T118-Y120 HydrophobicContact CG2-CE2 3.39Å; Y120-E127 CarbonylContact C-O 3.59Å; Y120-E127 VanDerWaalsContact CA-O 3.31Å; Y120-E127 WeakPolarHBondContact CA-O 3.27Å; Y120-R128 HydrophobicContact CD1-CB 4.43Å; Y120-R128 HydrophobicContact CD1-CG 4.25Å; Y120-R128 HydrophobicContact CE1-CB 4.4Å; Y120-R128 HydrophobicContact CE1-CG 3.91Å
121	T	96.1	Very high	95.6	Very high	20 Å²	20	41.9 Å²	41.9	12%	0.123	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	156	177.8	95.6	0	0	0	0	112.6	R75 I119 M123 L126 E127	R75-T121 CarbonylContact O-C 3.53Å; R75-T121 WeakPolarHBondContact O-CA 3.15Å; I119-T121 HydrophobicContact CG2-CG2 3.98Å; T121-M123 HydrophobicContact CG2-CE 3.8Å; T121-M123 PolarHBondContact O-N 2.92Å; T121-M123 VanDerWaalsContact OG1-CB 3.31Å; T121-M123 WeakPolarHBondContact OG1-CB 3.31Å; T121-M123 VanDerWaalsContact OG1-CE 3.23Å; T121-M123 WeakPolarHBondContact OG1-CE 3.22Å; T121-M123 WeakPolarHBondContact OG1-CG 3.09Å; T121-M123 PolarHBondContact OG1-N 3.24Å; T121-L126 PolarHBondContact OG1-O 3.06Å; T121-E127 PolarHBondContact N-O 3.2Å
122	S	95.3	Very high	95.8	Very high	75 Å²	75	43.2 Å²	43.2	52%	0.524	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	10.3	172.4	69.1	0	0	0	0	113.9	R75	R75-S122 PolarHBondContact N-OG 3Å; R75-S122 PolarHBondContact O-N 2.92Å
123	M	92.7	Very high	95.9	Very high	42 Å²	42	41 Å²	41	21%	0.207	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	123.8	178.8	-61.7	-176.1	-78	0	0	110.8	V74 T121 H125 L126 V185	V74-M123 HydrophobicContact CB-CG 4.37Å; V74-M123 HydrophobicContact CG1-CE 4.23Å; V74-M123 HydrophobicContact CG1-CG 3.59Å; V74-M123 HydrophobicContact CG1-SD 4.2Å; V74-M123 HydrophobicContact CG2-CG 3.8Å; V74-M123 HydrophobicContact CG2-SD 4.09Å; T121-M123 HydrophobicContact CG2-CE 3.8Å; T121-M123 PolarHBondContact O-N 2.92Å; T121-M123 VanDerWaalsContact OG1-CB 3.31Å; T121-M123 WeakPolarHBondContact OG1-CB 3.31Å; T121-M123 VanDerWaalsContact OG1-CE 3.23Å; T121-M123 WeakPolarHBondContact OG1-CE 3.22Å; T121-M123 WeakPolarHBondContact OG1-CG 3.09Å; T121-M123 PolarHBondContact OG1-N 3.24Å; M123-H125 PolarHBondContact O-N 3.04Å; M123-L126 HydrophobicContact CB-CB 4.49Å; M123-L126 HydrophobicContact CE-CB 4.02Å; M123-L126 HydrophobicContact CE-CD2 3.77Å; M123-L126 HydrophobicContact CE-CG 4.4Å; M123-L126 CarbonylContact O-C 3.55Å; M123-L126 PolarHBondContact O-N 3.08Å; M123-V185 HydrophobicContact CE-CG2 3.57Å
124	R	90.9	Very high	96.1	Very high	214 Å²	214	41.3 Å²	41.3	81%	0.808	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-21.2	176.6	-174.1	176.1	179.3	178.4	1.4	115.3
125	H	92.7	Very high	96	Very high	84 Å²	84	40.5 Å²	40.5	39%	0.389	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	12.5	-176.8	-64.1	-42	0	0	0	113.3	M123 G177 R178 L181	M123-H125 PolarHBondContact O-N 3.04Å; H125-G177 CarbonylContact O-C 3.4Å; H125-G177 WeakPolarHBondContact O-CA 3.45Å; H125-R178 HydrophobicContact CB-CG 4.2Å; H125-R178 PolarHBondContact O-N 3.3Å; H125-L181 HydrophobicContact CB-CD1 3.54Å
126	L	94.9	Very high	96	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	77.1	170.5	-173.8	72.8	0	0	0	109.3	T121 M123 D176 L181 A182 V185	T121-L126 PolarHBondContact OG1-O 3.06Å; M123-L126 HydrophobicContact CB-CB 4.49Å; M123-L126 HydrophobicContact CE-CB 4.02Å; M123-L126 HydrophobicContact CE-CD2 3.77Å; M123-L126 HydrophobicContact CE-CG 4.4Å; M123-L126 CarbonylContact O-C 3.55Å; M123-L126 PolarHBondContact O-N 3.08Å; L126-D176 VanDerWaalsContact CA-O 3.28Å; L126-D176 WeakPolarHBondContact CA-O 3.49Å; L126-L181 HydrophobicContact CB-CB 4.1Å; L126-L181 HydrophobicContact CB-CD1 4.39Å; L126-L181 HydrophobicContact CD2-CB 4.16Å; L126-A182 HydrophobicContact CD1-CB 3.81Å; L126-V185 HydrophobicContact CD2-CB 3.95Å; L126-V185 HydrophobicContact CD2-CG2 3.45Å; L126-V185 VanDerWaalsContact CD2-CG2 3.45Å
127	E	95	Very high	96	Very high	109 Å²	109	48.6 Å²	48.6	51%	0.509	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-37.5	-173.5	-62.9	-174.3	-178	0	0	111.8	Y120 T121 D176	Y120-E127 CarbonylContact C-O 3.59Å; Y120-E127 VanDerWaalsContact CA-O 3.31Å; Y120-E127 WeakPolarHBondContact CA-O 3.27Å; T121-E127 PolarHBondContact N-O 3.2Å; E127-D176 PolarHBondContact N-O 2.88Å
128	R	97.2	Very high	95.9	Very high	83 Å²	83	48.4 Å²	48.4	31%	0.313	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	142.6	-179.2	-166.8	-179.5	103	-124.6	9.2	111.8	T118 I119 Y120 E174 Y175 D176	T118-R128 HydrophobicContact CG2-CG 3.61Å; I119-R128 CarbonylContact O-C 3.5Å; I119-R128 WeakPolarHBondContact O-CA 3.14Å; Y120-R128 HydrophobicContact CD1-CB 4.43Å; Y120-R128 HydrophobicContact CD1-CG 4.25Å; Y120-R128 HydrophobicContact CE1-CB 4.4Å; Y120-R128 HydrophobicContact CE1-CG 3.91Å; R128-E174 IonicContact CZ-OE2 3.14Å; R128-E174 IonicContact NH2-OE2 2.92Å; R128-E174 PolarHBondContact NH2-OE2 3.21Å; R128-Y175 CarbonylContact O-C 3.5Å; R128-Y175 WeakPolarHBondContact O-CA 3.25Å; R128-D176 HydrophobicContact CB-CB 4.2Å; R128-D176 PolarHBondContact O-N 3.23Å
129	L	97.5	Very high	95.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	121.9	174	176.9	66.7	0	0	0	109.8	T118 I119 L131 I172 A182 V185	T118-L129 CarbonylContact C-O 3.55Å; T118-L129 WeakPolarHBondContact CA-O 3.42Å; I119-L129 HydrophobicContact CB-CB 4.36Å; I119-L129 PolarHBondContact N-O 2.86Å; I119-L129 PolarHBondContact O-N 3.46Å; L129-L131 HydrophobicContact CD1-CD2 4.13Å; L129-L131 HydrophobicContact CD2-CD2 3.87Å; L129-L131 HydrophobicContact CD2-CG 4.31Å; L129-L131 HydrophobicContact CG-CD2 3.78Å; L129-L131 HydrophobicContact CG-CG 4.15Å; L129-I172 HydrophobicContact CD1-CB 4.37Å; L129-I172 HydrophobicContact CD1-CD1 4.33Å; L129-I172 HydrophobicContact CD1-CG1 4.07Å; L129-I172 HydrophobicContact CD1-CG2 3.51Å; L129-A182 HydrophobicContact CD1-CB 3.92Å; L129-V185 HydrophobicContact CD2-CB 4.04Å; L129-V185 HydrophobicContact CD2-CG1 3.77Å
130	V	98.1	Very high	95.7	Very high	13 Å²	13	50 Å²	50	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126	174.6	-172.8	0	0	0	0	108.8	T118 L173 E174	T118-V130 HydrophobicContact CG2-CG2 4.2Å; V130-L173 HydrophobicContact CB-CB 4.34Å; V130-L173 HydrophobicContact CG1-CB 4.2Å; V130-L173 HydrophobicContact CG1-CD1 4.17Å; V130-L173 PolarHBondContact O-N 3.48Å; V130-E174 HydrophobicContact CB-CB 4.03Å; V130-E174 HydrophobicContact CG2-CB 3.99Å; V130-E174 PolarHBondContact N-O 3.21Å; V130-E174 PolarHBondContact O-N 3.5Å
131	L	98.1	Very high	95.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	139.6	-178.7	-60.5	-179.4	0	0	0	110.5	E116 I117 I119 L129 V133 V170 S171 I172 R186 F189	E116-L131 CarbonylContact C-O 3.59Å; E116-L131 VanDerWaalsContact CA-O 3.23Å; E116-L131 WeakPolarHBondContact CA-O 3.26Å; I117-L131 HydrophobicContact CG2-CB 4.11Å; I117-L131 PolarHBondContact N-O 2.92Å; I117-L131 PolarHBondContact O-N 3.22Å; I119-L131 HydrophobicContact CD1-CD1 3.59Å; I119-L131 HydrophobicContact CD1-CG 4.43Å; I119-L131 HydrophobicContact CG1-CD1 4.24Å; L129-L131 HydrophobicContact CD1-CD2 4.13Å; L129-L131 HydrophobicContact CD2-CD2 3.87Å; L129-L131 HydrophobicContact CD2-CG 4.31Å; L129-L131 HydrophobicContact CG-CD2 3.78Å; L129-L131 HydrophobicContact CG-CG 4.15Å; L131-V133 HydrophobicContact CB-CG2 4.29Å; L131-V170 HydrophobicContact CB-CG1 4.25Å; L131-V170 HydrophobicContact CD1-CG1 3.86Å; L131-V170 HydrophobicContact CD2-CG1 4.09Å; L131-V170 HydrophobicContact CG-CG1 4.3Å; L131-S171 CarbonylContact C-O 3.54Å; L131-S171 VanDerWaalsContact CA-O 3.31Å; L131-S171 WeakPolarHBondContact CA-O 3.44Å; L131-I172 HydrophobicContact CD2-CB 4.47Å; L131-I172 HydrophobicContact CD2-CG1 3.85Å; L131-R186 HydrophobicContact CD2-CG 4.31Å; L131-F189 HydrophobicContact CD1-CB 4.33Å; L131-F189 HydrophobicContact CD1-CD1 3.57Å; L131-F189 HydrophobicContact CD1-CD2 4.47Å; L131-F189 HydrophobicContact CD1-CE1 3.95Å; L131-F189 HydrophobicContact CD1-CG 3.87Å
132	L	98	Very high	95.6	Very high	43 Å²	43	45.3 Å²	45.3	23%	0.225	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.3	158.7	179.4	65.5	0	0	0	107.6	V84 D114 E116 S171 L173	V84-L132 HydrophobicContact CG2-CD1 4.22Å; D114-L132 HydrophobicContact CB-CD1 4.43Å; E116-L132 HydrophobicContact CG-CD1 3.89Å; L132-S171 PolarHBondContact N-O 3Å; L132-S171 PolarHBondContact O-N 3.42Å; L132-L173 HydrophobicContact CB-CD1 3.97Å; L132-L173 HydrophobicContact CB-CD2 3.92Å; L132-L173 HydrophobicContact CB-CG 3.84Å; L132-L173 HydrophobicContact CD2-CD2 4.46Å
133	V	97.4	Very high	95.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121	-179.3	-176.3	0	0	0	0	107.8	D114 F115 I117 L131 I135 V168 V170 F189 L193	D114-V133 CarbonylContact C-O 3.57Å; D114-V133 VanDerWaalsContact CA-O 3.24Å; D114-V133 WeakPolarHBondContact CA-O 3.27Å; F115-V133 HydrophobicContact CD1-CB 4.08Å; F115-V133 HydrophobicContact CD1-CG1 4.33Å; F115-V133 HydrophobicContact CD2-CB 4.07Å; F115-V133 HydrophobicContact CD2-CG2 4.24Å; F115-V133 HydrophobicContact CE1-CB 3.65Å; F115-V133 HydrophobicContact CE1-CG1 3.52Å; F115-V133 HydrophobicContact CE1-CG2 4.45Å; F115-V133 HydrophobicContact CE2-CB 3.64Å; F115-V133 HydrophobicContact CE2-CG1 4.16Å; F115-V133 HydrophobicContact CE2-CG2 3.59Å; F115-V133 HydrophobicContact CG-CB 4.28Å; F115-V133 HydrophobicContact CZ-CB 3.43Å; F115-V133 VanDerWaalsContact CZ-CB 3.43Å; F115-V133 HydrophobicContact CZ-CG1 3.43Å; F115-V133 VanDerWaalsContact CZ-CG1 3.43Å; F115-V133 HydrophobicContact CZ-CG2 3.73Å; F115-V133 PolarHBondContact N-O 3.42Å; F115-V133 PolarHBondContact O-N 3.46Å; I117-V133 HydrophobicContact CG2-CG2 4.31Å; L131-V133 HydrophobicContact CB-CG2 4.29Å; V133-I135 HydrophobicContact CG1-CG1 4.22Å; V133-V168 HydrophobicContact CG1-CG1 4.06Å; V133-V170 HydrophobicContact CG1-CG2 4.32Å; V133-V170 HydrophobicContact CG2-CG1 4.32Å; V133-V170 HydrophobicContact CG2-CG2 4.47Å; V133-F189 HydrophobicContact CG2-CE1 3.73Å; V133-F189 HydrophobicContact CG2-CZ 4.38Å; V133-L193 HydrophobicContact CG1-CD2 3.58Å
134	S	97.3	Very high	95.8	Very high	20 Å²	20	40.8 Å²	40.8	14%	0.14	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	120.4	173.1	-67.6	0	0	0	0	109.1	D114 V168 S169	D114-S134 VanDerWaalsContact CG-OG 3.25Å; D114-S134 WeakPolarHBondContact OD1-CA 3.35Å; D114-S134 WeakPolarHBondContact OD1-CB 3.42Å; D114-S134 PolarHBondContact OD1-OG 3.36Å; S134-V168 WeakPolarHBondContact O-CA 3.29Å; S134-S169 WeakPolarHBondContact CB-OG 3.23Å; S134-S169 PolarHBondContact N-O 2.9Å; S134-S169 PolarHBondContact O-N 3.48Å
135	I	95.1	Very high	96	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	125.4	174.2	-59.6	176	0	0	0	107.5	D112 M113 F115 V133 A138 V165 V168 L193 M197	D112-I135 CarbonylContact C-O 3.47Å; D112-I135 VanDerWaalsContact CA-O 3.28Å; D112-I135 WeakPolarHBondContact CA-O 3.44Å; M113-I135 PolarHBondContact N-O 3.42Å; M113-I135 PolarHBondContact O-N 3.45Å; F115-I135 HydrophobicContact CE1-CD1 3.8Å; F115-I135 HydrophobicContact CE1-CG1 4.33Å; V133-I135 HydrophobicContact CG1-CG1 4.22Å; I135-A138 HydrophobicContact CG2-CB 3.89Å; I135-V165 HydrophobicContact CD1-CG1 4.08Å; I135-V165 HydrophobicContact CD1-CG2 4.3Å; I135-V165 HydrophobicContact CG1-CG1 4.16Å; I135-V165 HydrophobicContact CG2-CB 4.46Å; I135-V165 HydrophobicContact CG2-CG1 3.75Å; I135-V168 HydrophobicContact CG1-CG2 4.41Å; I135-L193 HydrophobicContact CD1-CD2 4.36Å; I135-L193 HydrophobicContact CG1-CD2 4.45Å; I135-M197 HydrophobicContact CD1-CE 4.17Å
136	E	95.5	Very high	96.2	Very high	91 Å²	91	29.3 Å²	29.3	43%	0.425	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	147.8	173.5	-64.1	176.2	-172.5	0	0	110.2	D112 A138 G166 P167	D112-E136 VanDerWaalsContact OD1-CA 3.27Å; D112-E136 WeakPolarHBondContact OD1-CA 3.13Å; E136-A138 PolarHBondContact O-N 3.4Å; E136-A138 VanDerWaalsContact O-N 3.14Å; E136-G166 CarbonylContact O-C 3.48Å; E136-G166 WeakPolarHBondContact O-CA 3.07Å; E136-G166 PolarHBondContact O-N 2.81Å; E136-P167 HydrophobicContact CB-CB 4.23Å; E136-P167 HydrophobicContact CB-CG 4.34Å; E136-P167 PolarHBondContact N-O 2.9Å; E136-P167 WeakPolarHBondContact O-CD 3.48Å
137	Q	95.3	Very high	96.2	Very high	115 Å²	115	31.1 Å²	31.1	54%	0.537	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.2	38.2	172.2	-55.1	-179.5	39	0	0	114.2	F111 D112	F111-Q137 PolarHBondContact O-N 2.7Å; D112-Q137 PolarHBondContact OD1-N 3.26Å
138	A	95	Very high	96.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	151.9	171.9	0	0	0	0	0	110.9	R110 F111 I135 E136 F163 R164	R110-A138 WeakPolarHBondContact CA-O 3.36Å; R110-A138 PolarHBondContact N-O 2.86Å; F111-A138 HydrophobicContact CD1-CB 4.39Å; F111-A138 VanDerWaalsContact CD1-O 3.24Å; F111-A138 WeakPolarHBondContact CD1-O 3.35Å; F111-A138 HydrophobicContact CD2-CB 3.91Å; F111-A138 HydrophobicContact CE1-CB 4.05Å; F111-A138 WeakPolarHBondContact CE1-O 3.47Å; F111-A138 HydrophobicContact CE2-CB 3.52Å; F111-A138 HydrophobicContact CG-CB 4.33Å; F111-A138 HydrophobicContact CZ-CB 3.6Å; F111-A138 PolarHBondContact N-O 3.32Å; F111-A138 WeakPolarHBondContact O-CA 3.4Å; F111-A138 WeakPolarHBondContact O-CB 3.3Å; F111-A138 PolarHBondContact O-N 3.39Å; I135-A138 HydrophobicContact CG2-CB 3.89Å; E136-A138 PolarHBondContact O-N 3.4Å; E136-A138 VanDerWaalsContact O-N 3.14Å; A138-F163 HydrophobicContact CB-CZ 4.32Å; A138-R164 VanDerWaalsContact CA-O 3.3Å; A138-R164 WeakPolarHBondContact CA-O 3.49Å
139	S	95.5	Very high	95.9	Very high	18 Å²	18	26.3 Å²	26.3	13%	0.126	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	150.8	171.2	51.6	0	0	0	0	110.8	A108 D109 F163 R164	A108-S139 CarbonylContact O-C 3.6Å; A108-S139 WeakPolarHBondContact O-CA 3.46Å; A108-S139 WeakPolarHBondContact O-CB 3.42Å; D109-S139 WeakPolarHBondContact OD1-CB 3.48Å; S139-F163 CarbonylContact O-C 3.56Å; S139-F163 WeakPolarHBondContact O-CA 3.27Å; S139-R164 PolarHBondContact N-O 3.24Å; S139-R164 PolarHBondContact O-N 3.06Å
140	F	94.9	Very high	95.5	Very high	34 Å²	34	35.6 Å²	35.6	15%	0.149	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.8	169.1	80.7	-94.9	0	0	0	111.4	L106 S107 A108 F111 T162 F163 F201 L205	L106-F140 HydrophobicContact CD2-CE2 4.02Å; L106-F140 HydrophobicContact CD2-CZ 4.33Å; L106-F140 HydrophobicContact CG-CE2 3.99Å; L106-F140 HydrophobicContact CG-CZ 4.35Å; S107-F140 CarbonylContact C-O 3.54Å; S107-F140 WeakPolarHBondContact CA-O 3.25Å; S107-F140 WeakPolarHBondContact CB-O 3.24Å; A108-F140 HydrophobicContact CB-CD1 3.77Å; A108-F140 HydrophobicContact CB-CE1 3.34Å; A108-F140 HydrophobicContact CB-CZ 3.96Å; A108-F140 PolarHBondContact N-O 2.85Å; A108-F140 PolarHBondContact O-N 2.9Å; F111-F140 AromaticContact CE1-CD1 3.9Å; F111-F140 HydrophobicContact CE1-CD1 3.9Å; F111-F140 HydrophobicContact CZ-CD1 4.12Å; F140-T162 CarbonylContact C-O 3.6Å; F140-T162 WeakPolarHBondContact CA-O 3.1Å; F140-T162 WeakPolarHBondContact CB-O 3.45Å; F140-F163 HydrophobicContact CB-CD2 3.9Å; F140-F201 HydrophobicContact CB-CE1 3.74Å; F140-F201 HydrophobicContact CB-CZ 4.14Å; F140-F201 HydrophobicContact CD1-CE1 4.45Å; F140-F201 HydrophobicContact CD1-CZ 4.06Å; F140-F201 HydrophobicContact CD2-CE1 4.4Å; F140-F201 AromaticContact CG-CE1 3.98Å; F140-F201 HydrophobicContact CG-CE1 3.98Å; F140-F201 HydrophobicContact CG-CZ 4.05Å; F140-L205 HydrophobicContact CD2-CD2 3.74Å; F140-L205 HydrophobicContact CE2-CD2 3.88Å
141	S	95.4	Very high	95.1	Very high	10 Å²	10	40.4 Å²	40.4	7%	0.07	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	126.8	169.3	-171	0	0	0	0	110	R105 L106 C161 T162	R105-S141 PolarHBondContact NE-OG 2.71Å; L106-S141 CarbonylContact O-C 3.59Å; L106-S141 VanDerWaalsContact O-CA 3.28Å; L106-S141 WeakPolarHBondContact O-CA 3.46Å; L106-S141 PolarHBondContact O-OG 3.48Å; S141-C161 CarbonylContact O-C 3.5Å; S141-C161 WeakPolarHBondContact O-CA 3.31Å; S141-T162 PolarHBondContact N-O 3.33Å; S141-T162 PolarHBondContact O-N 3.11Å; S141-T162 PolarHBondContact O-OG1 2.9Å
142	E	95.4	Very high	94.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.7	175.6	-174.5	179.5	-160.1	0	0	109.5	R105 L106 I144 S158 S160 L205 T209	R105-E142 CarbonylContact C-O 3.54Å; R105-E142 WeakPolarHBondContact CA-O 3.42Å; L106-E142 PolarHBondContact N-O 3.39Å; L106-E142 PolarHBondContact O-N 2.88Å; E142-I144 HydrophobicContact CG-CG1 4.24Å; E142-S158 WeakPolarHBondContact CG-OG 3.17Å; E142-S158 WeakPolarHBondContact OE1-CB 3.43Å; E142-S158 PolarHBondContact OE1-OG 2.76Å; E142-S160 CarbonylContact C-O 3.48Å; E142-S160 VanDerWaalsContact CA-O 3.28Å; E142-S160 WeakPolarHBondContact CA-O 3.43Å; E142-L205 HydrophobicContact CB-CD2 4.19Å; E142-T209 PolarHBondContact OE1-OG1 3.26Å; E142-T209 PolarHBondContact OE2-OG1 3.35Å; E142-T209 VanDerWaalsContact OE2-OG1 3.1Å
143	T	96.5	Very high	94.5	Very high	13 Å²	13	45.4 Å²	45.4	8%	0.08	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.4	169.1	69.1	0	0	0	0	109.7	I104 R105 H159 S160	I104-T143 CarbonylContact O-C 3.52Å; I104-T143 WeakPolarHBondContact O-CA 3.42Å; R105-T143 HydrophobicContact CB-CG2 4.45Å; R105-T143 HydrophobicContact CG-CG2 4.37Å; T143-H159 PolarHBondContact O-N 3.12Å; T143-S160 PolarHBondContact N-O 3.28Å; T143-S160 PolarHBondContact OG1-N 3.3Å; T143-S160 PolarHBondContact OG1-OG 3.2Å
144	I	95.6	Very high	94.3	Very high	9 Å²	9	47.2 Å²	47.2	5%	0.046	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.9	-176.2	-59.7	169.3	0	0	0	108.1	Q102 Q103 I104 E142 L146 V156 T209 F213	Q102-I144 CarbonylContact C-O 3.47Å; Q103-I144 PolarHBondContact N-O 2.83Å; I104-I144 HydrophobicContact CB-CB 4.18Å; I104-I144 PolarHBondContact N-O 3.36Å; I104-I144 PolarHBondContact O-N 2.85Å; E142-I144 HydrophobicContact CG-CG1 4.24Å; I144-L146 HydrophobicContact CG2-CD1 4.28Å; I144-V156 HydrophobicContact CG2-CG1 3.38Å; I144-T209 HydrophobicContact CD1-CG2 3.83Å; I144-T209 HydrophobicContact CG1-CG2 4.11Å; I144-F213 HydrophobicContact CD1-CE2 4.45Å
145	Q	96.1	Very high	94.2	Very high	45 Å²	45	51.5 Å²	51.5	21%	0.21	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.9	179	179.8	172.1	11.1	0	0	110.1	A101 T147 V156 T157 H159	A101-Q145 WeakPolarHBondContact O-CG 3.25Å; Q145-T147 HydrophobicContact CG-CG2 3.91Å; Q145-V156 WeakPolarHBondContact O-CA 3.07Å; Q145-T157 PolarHBondContact N-O 3.06Å; Q145-T157 PolarHBondContact O-N 3.04Å; Q145-T157 PolarHBondContact O-OG1 3.02Å; Q145-H159 HydrophobicContact CB-CB 4.22Å; Q145-H159 PolarHBondContact OE1-ND1 3.45Å; Q145-H159 VanDerWaalsContact OE1-ND1 3.14Å
146	L	95.7	Very high	94.2	Very high	11 Å²	11	52 Å²	52	6%	0.058	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.1	176.4	-64.7	88.9	0	0	0	108.8	Q103 I104 I144 L154 K155 V156 P275 L286	Q103-L146 HydrophobicContact CB-CD1 4.09Å; Q103-L146 PolarHBondContact NE2-O 3.29Å; I104-L146 HydrophobicContact CD1-CD1 3.69Å; I104-L146 HydrophobicContact CG1-CD1 3.98Å; I144-L146 HydrophobicContact CG2-CD1 4.28Å; L146-L154 HydrophobicContact CB-CD1 4.14Å; L146-L154 HydrophobicContact CD2-CD1 4.06Å; L146-L154 HydrophobicContact CD2-CD2 4.42Å; L146-K155 CarbonylContact C-O 3.57Å; L146-K155 WeakPolarHBondContact CA-O 3.31Å; L146-V156 HydrophobicContact CD2-CG2 4.26Å; L146-V156 HydrophobicContact CG-CG2 4.15Å; L146-P275 HydrophobicContact CB-CB 3.89Å; L146-P275 HydrophobicContact CB-CG 3.95Å; L146-L286 HydrophobicContact CD2-CD2 3.79Å
147	T	94.9	Very high	94.2	Very high	39 Å²	39	49 Å²	49	24%	0.239	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	175	-177.5	58.4	0	0	0	0	110.5	Q145 K155	Q145-T147 HydrophobicContact CG-CG2 3.91Å; T147-K155 PolarHBondContact N-O 2.94Å; T147-K155 PolarHBondContact O-N 2.96Å; T147-K155 PolarHBondContact OG1-O 2.82Å
148	V	93.8	Very high	94.1	Very high	48 Å²	48	44.4 Å²	44.4	29%	0.291	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.6	177.3	-175	0	0	0	0	107.5	Q153 L271 N273 K274	V148-Q153 CarbonylContact C-O 3.49Å; V148-Q153 VanDerWaalsContact CA-O 3.31Å; V148-Q153 WeakPolarHBondContact CA-O 3.23Å; V148-L271 HydrophobicContact CG1-CB 3.99Å; V148-L271 HydrophobicContact CG2-CB 3.98Å; V148-L271 HydrophobicContact CG2-CD1 3.81Å; V148-N273 WeakPolarHBondContact CG2-O 3.42Å; V148-K274 HydrophobicContact CG2-CB 4.4Å
149	T	92.4	Very high	94	Very high	42 Å²	42	49.3 Å²	49.3	26%	0.258	25%	0.247	S	C	.	.			trans	-72.9	167.7	173.7	68.1	0	0	0	0	110.6	N151 R152 Q153 K155	T149-N151 PolarHBondContact O-N 3.48Å; T149-N151 PolarHBondContact OG1-N 3.28Å; T149-R152 WeakPolarHBondContact O-CA 3.48Å; T149-R152 PolarHBondContact O-N 3.33Å; T149-Q153 HydrophobicContact CG2-CB 4.25Å; T149-Q153 PolarHBondContact N-O 2.8Å; T149-Q153 WeakPolarHBondContact OG1-CB 3.43Å; T149-Q153 PolarHBondContact OG1-N 3.03Å; T149-K155 HydrophobicContact CG2-CB 3.81Å; T149-K155 HydrophobicContact CG2-CD 4.5Å
150	E	89.4	Confident	93.9	Very high	196 Å²	196	51 Å²	51	92%	0.916	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-37	170.1	-63.6	177.6	179.1	0	0	112.5	R152	E150-R152 PolarHBondContact O-N 2.83Å; E150-R152 VanDerWaalsContact O-N 3.07Å
151	N	89.4	Confident	94	Very high	114 Å²	114	50.3 Å²	50.3	61%	0.61	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	11.2	175.5	-65.3	-23.2	0	0	0	114.7	T149 Q153 I222	T149-N151 PolarHBondContact O-N 3.48Å; T149-N151 PolarHBondContact OG1-N 3.28Å; N151-Q153 PolarHBondContact O-N 2.67Å; N151-I222 HydrophobicContact CB-CD1 4.27Å
152	R	92.1	Very high	93.9	Very high	80 Å²	80	52.2 Å²	52.2	30%	0.302	27%	0.27	S	S	.	.	S	Bend	trans	60.4	25	-176	-56.8	-179.6	-63.2	-176.1	9	114.5	T149 E150 D268 G270 L271	T149-R152 WeakPolarHBondContact O-CA 3.48Å; T149-R152 PolarHBondContact O-N 3.33Å; E150-R152 PolarHBondContact O-N 2.83Å; E150-R152 VanDerWaalsContact O-N 3.07Å; R152-D268 IonicContact CZ-OD2 2.78Å; R152-D268 IonicContact NH1-OD2 3.73Å; R152-D268 IonicContact NH2-OD1 2.7Å; R152-D268 PolarHBondContact NH2-OD1 3.14Å; R152-D268 IonicContact NH2-OD2 3.91Å; R152-D268 PolarHBondContact NH2-OD2 2.93Å; R152-G270 CarbonylContact O-C 3.59Å; R152-G270 WeakPolarHBondContact O-CA 3.33Å; R152-L271 WeakPolarHBondContact CB-O 3.5Å; R152-L271 PolarHBondContact O-N 2.89Å
153	Q	91.9	Very high	93.9	Very high	68 Å²	68	52.5 Å²	52.5	32%	0.318	27%	0.271	S	S	.	.			trans	-90.4	154.9	173.7	-71.1	179.5	-45.7	0	0	111.5	V148 T149 N151 I222	V148-Q153 CarbonylContact C-O 3.49Å; V148-Q153 VanDerWaalsContact CA-O 3.31Å; V148-Q153 WeakPolarHBondContact CA-O 3.23Å; T149-Q153 HydrophobicContact CG2-CB 4.25Å; T149-Q153 PolarHBondContact N-O 2.8Å; T149-Q153 WeakPolarHBondContact OG1-CB 3.43Å; T149-Q153 PolarHBondContact OG1-N 3.03Å; N151-Q153 PolarHBondContact O-N 2.67Å; Q153-I222 VanDerWaalsContact CD-CD1 3.49Å; Q153-I222 HydrophobicContact CG-CD1 3.4Å; Q153-I222 HydrophobicContact CG-CG1 3.4Å; Q153-I222 VanDerWaalsContact NE2-CG1 3.33Å
154	L	94	Very high	93.8	Very high	38 Å²	38	59.3 Å²	59.3	20%	0.199	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	132.1	168.9	-174.9	61.8	0	0	0	109.6	L146 V156 I217 L271 P275 L288	L146-L154 HydrophobicContact CB-CD1 4.14Å; L146-L154 HydrophobicContact CD2-CD1 4.06Å; L146-L154 HydrophobicContact CD2-CD2 4.42Å; L154-V156 HydrophobicContact CD2-CG2 4.4Å; L154-V156 HydrophobicContact CG-CG2 4.27Å; L154-I217 HydrophobicContact CB-CD1 4.17Å; L154-I217 HydrophobicContact CB-CG1 4.5Å; L154-I217 HydrophobicContact CB-CG2 4.35Å; L154-I217 HydrophobicContact CD2-CD1 3.93Å; L154-I217 HydrophobicContact CD2-CG1 4.18Å; L154-I217 HydrophobicContact CG-CD1 3.89Å; L154-I217 WeakPolarHBondContact O-CG2 3.48Å; L154-L271 HydrophobicContact CB-CD1 4.02Å; L154-L271 HydrophobicContact CD1-CD1 4.05Å; L154-P275 HydrophobicContact CD1-CG 3.53Å; L154-L288 HydrophobicContact CD1-CD2 4.33Å
155	K	94.2	Very high	93.6	Very high	109 Å²	109	59.6 Å²	59.6	47%	0.474	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	131.8	167.8	178.3	-178.8	-178.6	-175.5	0	108.7	L146 T147 T149 T157	L146-K155 CarbonylContact C-O 3.57Å; L146-K155 WeakPolarHBondContact CA-O 3.31Å; T147-K155 PolarHBondContact N-O 2.94Å; T147-K155 PolarHBondContact O-N 2.96Å; T147-K155 PolarHBondContact OG1-O 2.82Å; T149-K155 HydrophobicContact CG2-CB 3.81Å; T149-K155 HydrophobicContact CG2-CD 4.5Å; K155-T157 HydrophobicContact CD-CG2 4.29Å; K155-T157 HydrophobicContact CG-CG2 4.17Å
156	V	94.6	Very high	93.3	Very high	13 Å²	13	58.6 Å²	58.6	8%	0.079	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.3	178.3	-178.6	0	0	0	0	107.8	I144 Q145 L146 L154 F213 I217	I144-V156 HydrophobicContact CG2-CG1 3.38Å; Q145-V156 WeakPolarHBondContact O-CA 3.07Å; L146-V156 HydrophobicContact CD2-CG2 4.26Å; L146-V156 HydrophobicContact CG-CG2 4.15Å; L154-V156 HydrophobicContact CD2-CG2 4.4Å; L154-V156 HydrophobicContact CG-CG2 4.27Å; V156-F213 HydrophobicContact CB-CB 3.78Å; V156-F213 HydrophobicContact CB-CD2 4.44Å; V156-F213 HydrophobicContact CB-CG 4.08Å; V156-F213 HydrophobicContact CG1-CB 4.01Å; V156-F213 HydrophobicContact CG1-CD2 3.72Å; V156-F213 HydrophobicContact CG1-CE2 4.34Å; V156-F213 HydrophobicContact CG1-CG 3.83Å; V156-F213 HydrophobicContact CG2-CB 4.05Å; V156-F213 HydrophobicContact CG2-CD1 4.3Å; V156-F213 HydrophobicContact CG2-CG 4.17Å; V156-I217 HydrophobicContact CB-CD1 4.44Å; V156-I217 HydrophobicContact CG2-CD1 3.65Å
157	T	95.2	Very high	93.2	Very high	26 Å²	26	61.2 Å²	61.2	16%	0.16	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	141.2	-179.8	51.1	0	0	0	0	110.2	Q145 K155 E210	Q145-T157 PolarHBondContact N-O 3.06Å; Q145-T157 PolarHBondContact O-N 3.04Å; Q145-T157 PolarHBondContact O-OG1 3.02Å; K155-T157 HydrophobicContact CD-CG2 4.29Å; K155-T157 HydrophobicContact CG-CG2 4.17Å; T157-E210 VanDerWaalsContact CA-OE1 3.29Å; T157-E210 WeakPolarHBondContact CA-OE1 3.46Å
158	S	94	Very high	93.3	Very high	20 Å²	20	61.4 Å²	61.4	14%	0.14	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.2	165.5	-169.7	0	0	0	0	108.6	E142 S206 E210	E142-S158 WeakPolarHBondContact CG-OG 3.17Å; E142-S158 WeakPolarHBondContact OE1-CB 3.43Å; E142-S158 PolarHBondContact OE1-OG 2.76Å; S158-S206 PolarHBondContact OG-OG 3.34Å; S158-E210 PolarHBondContact N-OE1 3.18Å
159	H	93.4	Very high	93.3	Very high	102 Å²	102	61.9 Å²	61.9	47%	0.472	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-47	-174.3	-175.3	86.4	0	0	0	112.3	Q102 T143 Q145	Q102-H159 HydrophobicContact CG-CB 3.75Å; Q102-H159 PolarHBondContact NE2-CD2 3.37Å; Q102-H159 PolarHBondContact NE2-NE2 3.39Å; T143-H159 PolarHBondContact O-N 3.12Å; Q145-H159 HydrophobicContact CB-CB 4.22Å; Q145-H159 PolarHBondContact OE1-ND1 3.45Å; Q145-H159 VanDerWaalsContact OE1-ND1 3.14Å
160	S	93.8	Very high	93.6	Very high	55 Å²	55	60.2 Å²	60.2	39%	0.385	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	140.1	174.4	67.3	0	0	0	0	110.3	E142 T143	E142-S160 CarbonylContact C-O 3.48Å; E142-S160 VanDerWaalsContact CA-O 3.28Å; E142-S160 WeakPolarHBondContact CA-O 3.43Å; T143-S160 PolarHBondContact N-O 3.28Å; T143-S160 PolarHBondContact OG1-N 3.3Å; T143-S160 PolarHBondContact OG1-OG 3.2Å
161	C	95.2	Very high	93.9	Very high	19 Å²	19	53.9 Å²	53.9	13%	0.128	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139	174.6	170.4	0	0	0	0	109.8	S141 Q198 C202	S141-C161 CarbonylContact O-C 3.5Å; S141-C161 WeakPolarHBondContact O-CA 3.31Å; C161-Q198 PolarHBondContact O-NE2 2.89Å; C161-C202 HydrophobicContact CB-CB 3.52Å; C161-C202 WeakPolarHBondContact CB-SG 3Å; C161-C202 PolarHBondContact O-SG 3.42Å; C161-C202 VanDerWaalsContact O-SG 3.35Å; C161-C202 WeakPolarHBondContact SG-CA 3.29Å; C161-C202 WeakPolarHBondContact SG-CB 3.34Å; C161-C202 CovalentContact SG-SG 2.05Å; C161-C202 PolarHBondContact SG-SG 2.94Å
162	T	95.2	Very high	94.3	Very high	50 Å²	50	50.8 Å²	50.8	31%	0.307	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.1	172.3	56.2	0	0	0	0	108.8	F140 S141	F140-T162 CarbonylContact C-O 3.6Å; F140-T162 WeakPolarHBondContact CA-O 3.1Å; F140-T162 WeakPolarHBondContact CB-O 3.45Å; S141-T162 PolarHBondContact N-O 3.33Å; S141-T162 PolarHBondContact O-N 3.11Å; S141-T162 PolarHBondContact O-OG1 2.9Å
163	F	94.9	Very high	94.6	Very high	5 Å²	5	50.8 Å²	50.8	2%	0.022	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	109.5	175.6	-178.6	-97.7	0	0	0	108.5	F111 A138 S139 F140 V165 M197 Q198 F201	F111-F163 HydrophobicContact CE2-CE2 4.3Å; F111-F163 AromaticContact CZ-CE2 3.8Å; F111-F163 HydrophobicContact CZ-CE2 3.8Å; A138-F163 HydrophobicContact CB-CZ 4.32Å; S139-F163 CarbonylContact O-C 3.56Å; S139-F163 WeakPolarHBondContact O-CA 3.27Å; F140-F163 HydrophobicContact CB-CD2 3.9Å; F163-V165 HydrophobicContact CD1-CG2 3.81Å; F163-V165 HydrophobicContact CE1-CG2 3.41Å; F163-V165 VanDerWaalsContact CE1-CG2 3.41Å; F163-V165 HydrophobicContact CZ-CG2 4.47Å; F163-M197 HydrophobicContact CD1-CB 3.92Å; F163-M197 HydrophobicContact CE1-CB 3.78Å; F163-M197 HydrophobicContact CE1-CE 3.65Å; F163-M197 HydrophobicContact CE1-CG 4.43Å; F163-M197 HydrophobicContact CZ-CE 3.86Å; F163-Q198 PolarHBondContact O-OE1 3.31Å; F163-F201 HydrophobicContact CB-CB 4.34Å; F163-F201 HydrophobicContact CB-CD1 3.62Å; F163-F201 HydrophobicContact CB-CE1 4.22Å; F163-F201 HydrophobicContact CB-CG 4.17Å; F163-F201 HydrophobicContact CD1-CB 4.34Å; F163-F201 HydrophobicContact CD1-CG 4.41Å; F163-F201 HydrophobicContact CD2-CB 4.31Å; F163-F201 AromaticContact CD2-CD1 3.34Å; F163-F201 HydrophobicContact CD2-CD1 3.34Å; F163-F201 AromaticContact CD2-CD2 3.81Å; F163-F201 HydrophobicContact CD2-CD2 3.81Å; F163-F201 AromaticContact CD2-CE1 3.41Å; F163-F201 HydrophobicContact CD2-CE1 3.41Å; F163-F201 VanDerWaalsContact CD2-CE1 3.41Å; F163-F201 AromaticContact CD2-CE2 3.88Å; F163-F201 HydrophobicContact CD2-CE2 3.88Å; F163-F201 AromaticContact CD2-CG 3.55Å; F163-F201 HydrophobicContact CD2-CG 3.55Å; F163-F201 AromaticContact CD2-CZ 3.68Å; F163-F201 HydrophobicContact CD2-CZ 3.68Å; F163-F201 HydrophobicContact CE2-CD1 4.14Å; F163-F201 AromaticContact CE2-CD2 3.75Å; F163-F201 HydrophobicContact CE2-CD2 3.75Å; F163-F201 HydrophobicContact CE2-CE1 4.11Å; F163-F201 AromaticContact CE2-CE2 3.71Å; F163-F201 HydrophobicContact CE2-CE2 3.71Å; F163-F201 AromaticContact CE2-CG 3.96Å; F163-F201 HydrophobicContact CE2-CG 3.96Å; F163-F201 AromaticContact CE2-CZ 3.89Å; F163-F201 HydrophobicContact CE2-CZ 3.89Å; F163-F201 HydrophobicContact CG-CB 4.09Å; F163-F201 AromaticContact CG-CD1 3.65Å; F163-F201 HydrophobicContact CG-CD1 3.65Å; F163-F201 HydrophobicContact CG-CD2 4.43Å; F163-F201 HydrophobicContact CG-CE1 4.15Å; F163-F201 AromaticContact CG-CG 3.8Å; F163-F201 HydrophobicContact CG-CG 3.8Å; F163-F201 HydrophobicContact CZ-CD2 4.33Å
164	R	94	Very high	94.8	Very high	156 Å²	156	52.5 Å²	52.5	59%	0.589	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.7	178.3	-60.9	-174.3	178.9	92.1	1.7	108.9	A138 S139	A138-R164 VanDerWaalsContact CA-O 3.3Å; A138-R164 WeakPolarHBondContact CA-O 3.49Å; S139-R164 PolarHBondContact N-O 3.24Å; S139-R164 PolarHBondContact O-N 3.06Å
165	V	90.4	Very high	94.9	Very high	16 Å²	16	55.4 Å²	55.4	10%	0.097	30%	0.296	C	S	.	.			trans	-89.7	124.2	172	174.6	0	0	0	0	107.3	I135 F163 V168 H194 M197	I135-V165 HydrophobicContact CD1-CG1 4.08Å; I135-V165 HydrophobicContact CD1-CG2 4.3Å; I135-V165 HydrophobicContact CG1-CG1 4.16Å; I135-V165 HydrophobicContact CG2-CB 4.46Å; I135-V165 HydrophobicContact CG2-CG1 3.75Å; F163-V165 HydrophobicContact CD1-CG2 3.81Å; F163-V165 HydrophobicContact CE1-CG2 3.41Å; F163-V165 VanDerWaalsContact CE1-CG2 3.41Å; F163-V165 HydrophobicContact CZ-CG2 4.47Å; V165-V168 HydrophobicContact CG1-CG2 3.2Å; V165-H194 WeakPolarHBondContact CB-ND1 3.37Å; V165-H194 PolarHBondContact O-CE1 3.01Å; V165-M197 HydrophobicContact CG2-CB 3.88Å; V165-M197 HydrophobicContact CG2-CG 4.24Å
166	G	91.1	Very high	95	Very high	23 Å²	23	54.2 Å²	54.2	24%	0.237	29%	0.294	C	S	.	.			trans	-80.2	-145.6	172.4	0	0	0	0	0	111.6	E136 V168	E136-G166 CarbonylContact O-C 3.48Å; E136-G166 WeakPolarHBondContact O-CA 3.07Å; E136-G166 PolarHBondContact O-N 2.81Å; G166-V168 PolarHBondContact O-N 2.78Å
167	P	94.4	Very high	94.9	Very high	67 Å²	67	55.5 Å²	55.5	44%	0.435	31%	0.311	S	S	.	.	S	Bend	trans	-56	136.5	175.3	-23.6	33.6	0	0	0	112	E136	E136-P167 HydrophobicContact CB-CB 4.23Å; E136-P167 HydrophobicContact CB-CG 4.34Å; E136-P167 PolarHBondContact N-O 2.9Å; E136-P167 WeakPolarHBondContact O-CD 3.48Å
168	V	95	Very high	94.8	Very high	43 Å²	43	61.7 Å²	61.7	26%	0.261	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.1	179.5	-176	0	0	0	0	109.6	V133 S134 I135 V165 G166 V170 L193	V133-V168 HydrophobicContact CG1-CG1 4.06Å; S134-V168 WeakPolarHBondContact O-CA 3.29Å; I135-V168 HydrophobicContact CG1-CG2 4.41Å; V165-V168 HydrophobicContact CG1-CG2 3.2Å; G166-V168 PolarHBondContact O-N 2.78Å; V168-V170 HydrophobicContact CG1-CG2 3.69Å; V168-L193 HydrophobicContact CB-CD2 4.33Å; V168-L193 HydrophobicContact CG1-CD2 3.38Å; V168-L193 HydrophobicContact CG2-CD2 3.99Å
169	S	95.7	Very high	94.8	Very high	57 Å²	57	66.7 Å²	66.7	40%	0.399	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135.7	161.7	74.9	0	0	0	0	110.3	S134	S134-S169 WeakPolarHBondContact CB-OG 3.23Å; S134-S169 PolarHBondContact N-O 2.9Å; S134-S169 PolarHBondContact O-N 3.48Å
170	V	97.3	Very high	94.8	Very high	8 Å²	8	64.1 Å²	64.1	5%	0.048	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	115.1	179.9	-175.7	0	0	0	0	108.6	L131 V133 V168 R186 F189 A190	L131-V170 HydrophobicContact CB-CG1 4.25Å; L131-V170 HydrophobicContact CD1-CG1 3.86Å; L131-V170 HydrophobicContact CD2-CG1 4.09Å; L131-V170 HydrophobicContact CG-CG1 4.3Å; V133-V170 HydrophobicContact CG1-CG2 4.32Å; V133-V170 HydrophobicContact CG2-CG1 4.32Å; V133-V170 HydrophobicContact CG2-CG2 4.47Å; V168-V170 HydrophobicContact CG1-CG2 3.69Å; V170-R186 HydrophobicContact CB-CG 4.21Å; V170-R186 HydrophobicContact CG1-CG 3.72Å; V170-R186 WeakPolarHBondContact O-CD 3.33Å; V170-R186 PolarHBondContact O-NH1 2.76Å; V170-F189 HydrophobicContact CG1-CD1 4.27Å; V170-A190 HydrophobicContact CB-CB 4.46Å; V170-A190 HydrophobicContact CG2-CB 3.85Å
171	S	97	Very high	94.7	Very high	62 Å²	62	63.9 Å²	63.9	43%	0.434	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	143.8	-179.7	-67.2	0	0	0	0	110.4	L131 L132	L131-S171 CarbonylContact C-O 3.54Å; L131-S171 VanDerWaalsContact CA-O 3.31Å; L131-S171 WeakPolarHBondContact CA-O 3.44Å; L132-S171 PolarHBondContact N-O 3Å; L132-S171 PolarHBondContact O-N 3.42Å
172	I	97.9	Very high	94.7	Very high	50 Å²	50	63 Å²	63	26%	0.256	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118.8	175.2	-61.2	169	0	0	0	107.1	L129 L131 Y175 A182 R186	L129-I172 HydrophobicContact CD1-CB 4.37Å; L129-I172 HydrophobicContact CD1-CD1 4.33Å; L129-I172 HydrophobicContact CD1-CG1 4.07Å; L129-I172 HydrophobicContact CD1-CG2 3.51Å; L131-I172 HydrophobicContact CD2-CB 4.47Å; L131-I172 HydrophobicContact CD2-CG1 3.85Å; I172-Y175 HydrophobicContact CG2-CD1 3.76Å; I172-A182 HydrophobicContact CD1-CB 3.99Å; I172-R186 HydrophobicContact CD1-CB 4.23Å; I172-R186 HydrophobicContact CD1-CG 4.47Å; I172-R186 HydrophobicContact CG1-CB 4.32Å; I172-R186 HydrophobicContact CG1-CG 4.17Å
173	L	97.3	Very high	94.8	Very high	80 Å²	80	65.8 Å²	65.8	42%	0.419	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-50.7	173.6	-65.3	-177.2	0	0	0	110.5	E116 V130 L132	E116-L173 VanDerWaalsContact CD-CD1 3.48Å; E116-L173 HydrophobicContact CG-CD1 3.65Å; V130-L173 HydrophobicContact CB-CB 4.34Å; V130-L173 HydrophobicContact CG1-CB 4.2Å; V130-L173 HydrophobicContact CG1-CD1 4.17Å; V130-L173 PolarHBondContact O-N 3.48Å; L132-L173 HydrophobicContact CB-CD1 3.97Å; L132-L173 HydrophobicContact CB-CD2 3.92Å; L132-L173 HydrophobicContact CB-CG 3.84Å; L132-L173 HydrophobicContact CD2-CD2 4.46Å
174	E	96.9	Very high	94.7	Very high	104 Å²	104	69.1 Å²	69.1	49%	0.486	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	151.4	-176.9	-59	179.6	172.5	0	0	109.9	R128 V130	R128-E174 IonicContact CZ-OE2 3.14Å; R128-E174 IonicContact NH2-OE2 2.92Å; R128-E174 PolarHBondContact NH2-OE2 3.21Å; V130-E174 HydrophobicContact CB-CB 4.03Å; V130-E174 HydrophobicContact CG2-CB 3.99Å; V130-E174 PolarHBondContact N-O 3.21Å; V130-E174 PolarHBondContact O-N 3.5Å
175	Y	96.4	Very high	94.7	Very high	99 Å²	99	62.8 Å²	62.8	39%	0.388	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	149.5	170.8	63.3	-88.3	0	0	0	110.5	R128 I172 G177 K179 A182	R128-Y175 CarbonylContact O-C 3.5Å; R128-Y175 WeakPolarHBondContact O-CA 3.25Å; I172-Y175 HydrophobicContact CG2-CD1 3.76Å; Y175-G177 WeakPolarHBondContact CE2-O 3.28Å; Y175-K179 HydrophobicContact CE1-CG 4.38Å; Y175-K179 HydrophobicContact CE2-CB 4.08Å; Y175-A182 HydrophobicContact CD2-CB 4.39Å; Y175-A182 HydrophobicContact CG-CB 4.08Å
176	D	95.6	Very high	95	Very high	83 Å²	83	65.7 Å²	65.7	44%	0.444	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	109.4	172.6	-171.6	-2.2	0	0	0	109.2	L126 E127 R128	L126-D176 VanDerWaalsContact CA-O 3.28Å; L126-D176 WeakPolarHBondContact CA-O 3.49Å; E127-D176 PolarHBondContact N-O 2.88Å; R128-D176 HydrophobicContact CB-CB 4.2Å; R128-D176 PolarHBondContact O-N 3.23Å
177	G	92.9	Very high	95.2	Very high	41 Å²	41	71.2 Å²	71.2	42%	0.423	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	122.9	-145.1	-178.7	0	0	0	0	0	114.5	H125 Y175	H125-G177 CarbonylContact O-C 3.4Å; H125-G177 WeakPolarHBondContact O-CA 3.45Å; Y175-G177 WeakPolarHBondContact CE2-O 3.28Å
178	R	93.2	Very high	95.1	Very high	156 Å²	156	69.7 Å²	69.7	59%	0.589	35%	0.354	S	S	*	.			trans	-84.2	122.5	-172.7	-67.7	-175	-177.7	-162.8	1.7	111.9	H125 G180 L181 A182	H125-R178 HydrophobicContact CB-CG 4.2Å; H125-R178 PolarHBondContact O-N 3.3Å; R178-G180 PolarHBondContact O-N 2.71Å; R178-G180 VanDerWaalsContact O-N 3.08Å; R178-L181 HydrophobicContact CB-CB 4.43Å; R178-L181 HydrophobicContact CB-CD1 4.22Å; R178-L181 HydrophobicContact CB-CG 4.19Å; R178-L181 PolarHBondContact O-N 3.05Å; R178-A182 PolarHBondContact O-N 3.45Å
179	K	92.6	Very high	95	Very high	125 Å²	125	68.3 Å²	68.3	54%	0.543	34%	0.344	S	S	.	.	H	α-helix	trans	-50.6	-36.2	174.3	-168.4	173.7	-175.4	171.5	0	113.7	Y175 A182 K183	Y175-K179 HydrophobicContact CE1-CG 4.38Å; Y175-K179 HydrophobicContact CE2-CB 4.08Å; K179-A182 PolarHBondContact O-N 3.41Å; K179-K183 WeakPolarHBondContact O-CG 3.32Å; K179-K183 PolarHBondContact O-N 2.78Å
180	G	93.8	Very high	94.9	Very high	47 Å²	47	67 Å²	67	49%	0.485	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-44	176.7	0	0	0	0	0	113	R178 K183 I184	R178-G180 PolarHBondContact O-N 2.71Å; R178-G180 VanDerWaalsContact O-N 3.08Å; G180-K183 PolarHBondContact O-N 3.34Å; G180-I184 WeakPolarHBondContact O-CG1 3.47Å; G180-I184 PolarHBondContact O-N 2.75Å
181	L	92.6	Very high	94.7	Very high	50 Å²	50	75.4 Å²	75.4	26%	0.262	37%	0.368	S	S	.	.	H	α-helix	trans	-68.2	-41.7	175.8	-65.9	178.2	0	0	0	111	H125 L126 R178 K183 I184 V185	H125-L181 HydrophobicContact CB-CD1 3.54Å; L126-L181 HydrophobicContact CB-CB 4.1Å; L126-L181 HydrophobicContact CB-CD1 4.39Å; L126-L181 HydrophobicContact CD2-CB 4.16Å; R178-L181 HydrophobicContact CB-CB 4.43Å; R178-L181 HydrophobicContact CB-CD1 4.22Å; R178-L181 HydrophobicContact CB-CG 4.19Å; R178-L181 PolarHBondContact O-N 3.05Å; L181-K183 VanDerWaalsContact C-N 3.29Å; L181-K183 PolarHBondContact O-N 2.86Å; L181-I184 HydrophobicContact CD2-CD1 4.3Å; L181-I184 WeakPolarHBondContact O-CA 3.3Å; L181-I184 WeakPolarHBondContact O-CB 3.49Å; L181-I184 PolarHBondContact O-N 3.06Å; L181-V185 PolarHBondContact O-N 3.31Å
182	A	95.5	Very high	94.3	Very high	0 Å²	0	78 Å²	78	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-55.1	-44.3	175.1	0	0	0	0	0	111.7	L126 L129 I172 Y175 R178 K179 I184 V185 R186	L126-A182 HydrophobicContact CD1-CB 3.81Å; L129-A182 HydrophobicContact CD1-CB 3.92Å; I172-A182 HydrophobicContact CD1-CB 3.99Å; Y175-A182 HydrophobicContact CD2-CB 4.39Å; Y175-A182 HydrophobicContact CG-CB 4.08Å; R178-A182 PolarHBondContact O-N 3.45Å; K179-A182 PolarHBondContact O-N 3.41Å; A182-I184 VanDerWaalsContact C-N 3.34Å; A182-I184 PolarHBondContact O-N 2.84Å; A182-V185 PolarHBondContact O-N 2.98Å; A182-R186 VanDerWaalsContact O-CB 3.28Å; A182-R186 WeakPolarHBondContact O-CB 3.29Å; A182-R186 PolarHBondContact O-N 2.86Å
183	K	96	Very high	94	Very high	110 Å²	110	75.8 Å²	75.8	48%	0.478	36%	0.356	S	S	.	.	H	α-helix	trans	-64.4	-33.7	174.5	-73.3	-179.2	178.8	-174.5	0	113.4	K179 G180 L181 R187	K179-K183 WeakPolarHBondContact O-CG 3.32Å; K179-K183 PolarHBondContact O-N 2.78Å; G180-K183 PolarHBondContact O-N 3.34Å; L181-K183 VanDerWaalsContact C-N 3.29Å; L181-K183 PolarHBondContact O-N 2.86Å; K183-R187 WeakPolarHBondContact O-CG 3.5Å; K183-R187 PolarHBondContact O-N 3.12Å
184	I	93.8	Very high	93.5	Very high	75 Å²	75	76.2 Å²	76.2	39%	0.385	36%	0.356	S	S	.	.	H	α-helix	trans	-68.1	-51.1	175.8	-69.5	164.7	0	0	0	109.9	G180 L181 A182 R186 R187 I188	G180-I184 WeakPolarHBondContact O-CG1 3.47Å; G180-I184 PolarHBondContact O-N 2.75Å; L181-I184 HydrophobicContact CD2-CD1 4.3Å; L181-I184 WeakPolarHBondContact O-CA 3.3Å; L181-I184 WeakPolarHBondContact O-CB 3.49Å; L181-I184 PolarHBondContact O-N 3.06Å; A182-I184 VanDerWaalsContact C-N 3.34Å; A182-I184 PolarHBondContact O-N 2.84Å; I184-R186 VanDerWaalsContact C-N 3.35Å; I184-R186 PolarHBondContact O-N 2.82Å; I184-R187 PolarHBondContact O-N 2.88Å; I184-R187 VanDerWaalsContact O-N 3.16Å; I184-I188 HydrophobicContact CG2-CD1 3.74Å; I184-I188 WeakPolarHBondContact O-CG1 3.11Å; I184-I188 PolarHBondContact O-N 3.19Å
185	V	94.1	Very high	93	Very high	22 Å²	22	77.2 Å²	77.2	13%	0.133	36%	0.361	C	S	.	.	H	α-helix	trans	-60.1	-44.4	177.8	174	0	0	0	0	111.1	I119 M123 L126 L129 L181 A182 R187 I188 F189	I119-V185 HydrophobicContact CD1-CG1 4.13Å; I119-V185 HydrophobicContact CG2-CG1 4.49Å; M123-V185 HydrophobicContact CE-CG2 3.57Å; L126-V185 HydrophobicContact CD2-CB 3.95Å; L126-V185 HydrophobicContact CD2-CG2 3.45Å; L126-V185 VanDerWaalsContact CD2-CG2 3.45Å; L129-V185 HydrophobicContact CD2-CB 4.04Å; L129-V185 HydrophobicContact CD2-CG1 3.77Å; L181-V185 PolarHBondContact O-N 3.31Å; A182-V185 PolarHBondContact O-N 2.98Å; V185-R187 VanDerWaalsContact C-N 3.33Å; V185-R187 PolarHBondContact O-N 3.41Å; V185-I188 PolarHBondContact O-N 2.77Å; V185-I188 VanDerWaalsContact O-N 3.08Å; V185-F189 WeakPolarHBondContact O-CB 3.42Å; V185-F189 PolarHBondContact O-N 2.87Å
186	R	95.9	Very high	92.4	Very high	78 Å²	78	74.7 Å²	74.7	29%	0.294	35%	0.354	S	S	.	.	H	α-helix	trans	-53.7	-46.2	173.8	-171	-163.1	75.3	83.8	0.8	112.5	L131 V170 I172 A182 I184 F189 A190	L131-R186 HydrophobicContact CD2-CG 4.31Å; V170-R186 HydrophobicContact CB-CG 4.21Å; V170-R186 HydrophobicContact CG1-CG 3.72Å; V170-R186 WeakPolarHBondContact O-CD 3.33Å; V170-R186 PolarHBondContact O-NH1 2.76Å; I172-R186 HydrophobicContact CD1-CB 4.23Å; I172-R186 HydrophobicContact CD1-CG 4.47Å; I172-R186 HydrophobicContact CG1-CB 4.32Å; I172-R186 HydrophobicContact CG1-CG 4.17Å; A182-R186 VanDerWaalsContact O-CB 3.28Å; A182-R186 WeakPolarHBondContact O-CB 3.29Å; A182-R186 PolarHBondContact O-N 2.86Å; I184-R186 VanDerWaalsContact C-N 3.35Å; I184-R186 PolarHBondContact O-N 2.82Å; R186-F189 PolarHBondContact O-N 2.84Å; R186-A190 WeakPolarHBondContact O-CB 3.33Å; R186-A190 PolarHBondContact O-N 2.88Å
187	R	95	Very high	92	Very high	138 Å²	138	71.8 Å²	71.8	52%	0.521	34%	0.338	S	S	.	.	H	α-helix	trans	-67.5	-32.5	177.6	-77.7	-173.2	-68.7	174.7	-1.1	113.1	K183 I184 V185 R191	K183-R187 WeakPolarHBondContact O-CG 3.5Å; K183-R187 PolarHBondContact O-N 3.12Å; I184-R187 PolarHBondContact O-N 2.88Å; I184-R187 VanDerWaalsContact O-N 3.16Å; V185-R187 VanDerWaalsContact C-N 3.33Å; V185-R187 PolarHBondContact O-N 3.41Å; R187-R191 WeakPolarHBondContact O-CG 3.4Å; R187-R191 PolarHBondContact O-N 3.21Å; R187-R191 PolarHBondContact O-NE 3.31Å
188	I	93.1	Very high	91.8	Very high	36 Å²	36	72.5 Å²	72.5	19%	0.185	33%	0.33	C	S	.	.	H	α-helix	trans	-71.2	-48.6	175.2	-68.4	161.8	0	0	0	109.6	F71 I184 V185 R191 R192	F71-I188 HydrophobicContact CD1-CD1 4.46Å; F71-I188 HydrophobicContact CD1-CG2 4.1Å; F71-I188 HydrophobicContact CE1-CD1 3.88Å; F71-I188 HydrophobicContact CE1-CG1 4.33Å; F71-I188 HydrophobicContact CE1-CG2 3.79Å; F71-I188 HydrophobicContact CZ-CG2 4.26Å; I184-I188 HydrophobicContact CG2-CD1 3.74Å; I184-I188 WeakPolarHBondContact O-CG1 3.11Å; I184-I188 PolarHBondContact O-N 3.19Å; V185-I188 PolarHBondContact O-N 2.77Å; V185-I188 VanDerWaalsContact O-N 3.08Å; I188-R191 PolarHBondContact O-N 3.44Å; I188-R192 PolarHBondContact O-N 3.35Å; I188-R192 VanDerWaalsContact O-N 3.08Å
189	F	93.7	Very high	91.5	Very high	14 Å²	14	69.6 Å²	69.6	6%	0.061	33%	0.326	C	S	.	.	H	α-helix	trans	-57.4	-51.2	177.9	-178.8	-93.6	0	0	0	111.2	L78 I117 I119 L131 V133 V170 V185 R186 R191 R192 L193	L78-F189 HydrophobicContact CD1-CE2 4.12Å; L78-F189 HydrophobicContact CD2-CD2 4.41Å; L78-F189 HydrophobicContact CD2-CE2 4.07Å; I117-F189 HydrophobicContact CG2-CZ 3.97Å; I119-F189 HydrophobicContact CD1-CB 4.2Å; I119-F189 HydrophobicContact CD1-CD2 3.54Å; I119-F189 HydrophobicContact CD1-CE2 4.1Å; I119-F189 HydrophobicContact CD1-CG 3.92Å; L131-F189 HydrophobicContact CD1-CB 4.33Å; L131-F189 HydrophobicContact CD1-CD1 3.57Å; L131-F189 HydrophobicContact CD1-CD2 4.47Å; L131-F189 HydrophobicContact CD1-CE1 3.95Å; L131-F189 HydrophobicContact CD1-CG 3.87Å; V133-F189 HydrophobicContact CG2-CE1 3.73Å; V133-F189 HydrophobicContact CG2-CZ 4.38Å; V170-F189 HydrophobicContact CG1-CD1 4.27Å; V185-F189 WeakPolarHBondContact O-CB 3.42Å; V185-F189 PolarHBondContact O-N 2.87Å; R186-F189 PolarHBondContact O-N 2.84Å; F189-R191 VanDerWaalsContact C-N 3.3Å; F189-R191 PolarHBondContact O-N 2.93Å; F189-R192 CarbonylContact O-C 3.53Å; F189-R192 PolarHBondContact O-N 3.48Å; F189-L193 HydrophobicContact CE1-CD1 3.84Å; F189-L193 HydrophobicContact CZ-CD1 3.76Å; F189-L193 WeakPolarHBondContact O-CB 3.24Å; F189-L193 PolarHBondContact O-N 3.34Å
190	A	93.5	Very high	91.2	Very high	28 Å²	28	65.6 Å²	65.6	23%	0.231	31%	0.311	C	S	.	.	H	α-helix	trans	-56.4	-41.4	178.2	0	0	0	0	0	112.9	V170 R186 R192	V170-A190 HydrophobicContact CB-CB 4.46Å; V170-A190 HydrophobicContact CG2-CB 3.85Å; R186-A190 WeakPolarHBondContact O-CB 3.33Å; R186-A190 PolarHBondContact O-N 2.88Å; A190-R192 VanDerWaalsContact C-N 3.35Å; A190-R192 PolarHBondContact O-N 3.16Å
191	R	91.9	Very high	90.9	Very high	186 Å²	186	65.9 Å²	65.9	70%	0.702	30%	0.299	S	S	*	.	H	α-helix	trans	-68.7	-31.1	177.8	-78	-176.3	-73.4	166.4	-3.7	113.5	R187 I188 F189	R187-R191 WeakPolarHBondContact O-CG 3.4Å; R187-R191 PolarHBondContact O-N 3.21Å; R187-R191 PolarHBondContact O-NE 3.31Å; I188-R191 PolarHBondContact O-N 3.44Å; F189-R191 VanDerWaalsContact C-N 3.3Å; F189-R191 PolarHBondContact O-N 2.93Å
192	R	89.4	Confident	90.9	Very high	117 Å²	117	64.1 Å²	64.1	44%	0.442	29%	0.29	S	S	.	.	H	α-helix	trans	-95	-9.3	-179.1	-72.4	-173.3	166.7	-133.5	-10.1	113.6	I188 F189 A190 H194 Q195 L196	I188-R192 PolarHBondContact O-N 3.35Å; I188-R192 VanDerWaalsContact O-N 3.08Å; F189-R192 CarbonylContact O-C 3.53Å; F189-R192 PolarHBondContact O-N 3.48Å; A190-R192 VanDerWaalsContact C-N 3.35Å; A190-R192 PolarHBondContact O-N 3.16Å; R192-H194 VanDerWaalsContact C-N 3.28Å; R192-H194 PolarHBondContact O-N 3.27Å; R192-Q195 PolarHBondContact O-N 3Å; R192-Q195 VanDerWaalsContact O-N 3.15Å; R192-L196 HydrophobicContact CB-CD1 4.41Å; R192-L196 PolarHBondContact O-N 2.97Å
193	L	90.3	Very high	90.7	Very high	3 Å²	3	70.7 Å²	70.7	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-56.2	-43.5	-175.6	-178.6	67.6	0	0	0	111.6	F115 V133 I135 V168 F189 Q195 L196 M197	F115-L193 HydrophobicContact CZ-CD1 4.08Å; V133-L193 HydrophobicContact CG1-CD2 3.58Å; I135-L193 HydrophobicContact CD1-CD2 4.36Å; I135-L193 HydrophobicContact CG1-CD2 4.45Å; V168-L193 HydrophobicContact CB-CD2 4.33Å; V168-L193 HydrophobicContact CG1-CD2 3.38Å; V168-L193 HydrophobicContact CG2-CD2 3.99Å; F189-L193 HydrophobicContact CE1-CD1 3.84Å; F189-L193 HydrophobicContact CZ-CD1 3.76Å; F189-L193 WeakPolarHBondContact O-CB 3.24Å; F189-L193 PolarHBondContact O-N 3.34Å; L193-Q195 VanDerWaalsContact C-N 3.33Å; L193-Q195 PolarHBondContact O-N 3.12Å; L193-L196 PolarHBondContact O-N 3.42Å; L193-M197 HydrophobicContact CD1-CG 3.58Å; L193-M197 HydrophobicContact CD1-SD 4.14Å; L193-M197 HydrophobicContact CG-CG 3.85Å; L193-M197 WeakPolarHBondContact O-CB 3.35Å; L193-M197 VanDerWaalsContact O-CG 3.25Å; L193-M197 WeakPolarHBondContact O-CG 3.21Å; L193-M197 PolarHBondContact O-N 3.07Å
194	H	88.2	Confident	90.3	Very high	88 Å²	88	66.4 Å²	66.4	41%	0.407	30%	0.3	S	S	.	.	H	α-helix	trans	-54.1	-47.8	178.6	-70.1	-89.6	0	0	0	112.3	V165 R192 Q198	V165-H194 WeakPolarHBondContact CB-ND1 3.37Å; V165-H194 PolarHBondContact O-CE1 3.01Å; R192-H194 VanDerWaalsContact C-N 3.28Å; R192-H194 PolarHBondContact O-N 3.27Å; H194-Q198 VanDerWaalsContact O-CB 3.31Å; H194-Q198 WeakPolarHBondContact O-CB 3.23Å; H194-Q198 PolarHBondContact O-N 3.22Å
195	Q	86.2	Confident	90.1	Very high	125 Å²	125	63.9 Å²	63.9	58%	0.584	29%	0.287	S	S	*	.	H	α-helix	trans	-69.1	-44.8	-179.6	-174	179	2.8	0	0	111.5	R192 L193 M197 Q198 D199	R192-Q195 PolarHBondContact O-N 3Å; R192-Q195 VanDerWaalsContact O-N 3.15Å; L193-Q195 VanDerWaalsContact C-N 3.33Å; L193-Q195 PolarHBondContact O-N 3.12Å; Q195-M197 VanDerWaalsContact C-N 3.35Å; Q195-M197 PolarHBondContact O-N 3.04Å; Q195-Q198 PolarHBondContact O-N 3.41Å; Q195-D199 PolarHBondContact O-N 3.24Å
196	L	83.7	Confident	90	Very high	46 Å²	46	64 Å²	64	24%	0.241	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-44.9	178.7	-72	171.4	0	0	0	111.6	L78 R192 L193 D200	L78-L196 HydrophobicContact CD1-CD1 4.3Å; R192-L196 HydrophobicContact CB-CD1 4.41Å; R192-L196 PolarHBondContact O-N 2.97Å; L193-L196 PolarHBondContact O-N 3.42Å; L196-D200 WeakPolarHBondContact O-CB 3.24Å; L196-D200 PolarHBondContact O-N 3.2Å
197	M	87.2	Confident	89.7	Confident	22 Å²	22	63.1 Å²	63.1	11%	0.108	29%	0.29	C	S	.	.	H	α-helix	trans	-68	-45.4	179.6	-70.8	-63.4	-64.4	0	0	111.6	F115 I135 F163 V165 L193 Q195 D199 F201	F115-M197 HydrophobicContact CE1-SD 4.43Å; F115-M197 HydrophobicContact CZ-SD 4.27Å; I135-M197 HydrophobicContact CD1-CE 4.17Å; F163-M197 HydrophobicContact CD1-CB 3.92Å; F163-M197 HydrophobicContact CE1-CB 3.78Å; F163-M197 HydrophobicContact CE1-CE 3.65Å; F163-M197 HydrophobicContact CE1-CG 4.43Å; F163-M197 HydrophobicContact CZ-CE 3.86Å; V165-M197 HydrophobicContact CG2-CB 3.88Å; V165-M197 HydrophobicContact CG2-CG 4.24Å; L193-M197 HydrophobicContact CD1-CG 3.58Å; L193-M197 HydrophobicContact CD1-SD 4.14Å; L193-M197 HydrophobicContact CG-CG 3.85Å; L193-M197 WeakPolarHBondContact O-CB 3.35Å; L193-M197 VanDerWaalsContact O-CG 3.25Å; L193-M197 WeakPolarHBondContact O-CG 3.21Å; L193-M197 PolarHBondContact O-N 3.07Å; Q195-M197 VanDerWaalsContact C-N 3.35Å; Q195-M197 PolarHBondContact O-N 3.04Å; M197-D199 PolarHBondContact O-N 3.02Å; M197-F201 WeakPolarHBondContact O-CA 3.37Å; M197-F201 WeakPolarHBondContact O-CB 3.41Å; M197-F201 PolarHBondContact O-N 3.15Å
198	Q	88.7	Confident	89.4	Confident	56 Å²	56	57.2 Å²	57.2	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-54.3	-51.5	178.7	168.1	63.3	32.2	0	0	111.6	C161 F163 H194 Q195 C202	C161-Q198 PolarHBondContact O-NE2 2.89Å; F163-Q198 PolarHBondContact O-OE1 3.31Å; H194-Q198 VanDerWaalsContact O-CB 3.31Å; H194-Q198 WeakPolarHBondContact O-CB 3.23Å; H194-Q198 PolarHBondContact O-N 3.22Å; Q195-Q198 PolarHBondContact O-N 3.41Å; Q198-C202 VanDerWaalsContact O-CB 3.22Å; Q198-C202 WeakPolarHBondContact O-CB 3.37Å; Q198-C202 PolarHBondContact O-N 3.25Å
199	D	86.4	Confident	89.2	Confident	96 Å²	96	56 Å²	56	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-74	-47.5	-174.6	-66.7	-20.7	0	0	0	111.9	Q195 M197 K203	Q195-D199 PolarHBondContact O-N 3.24Å; M197-D199 PolarHBondContact O-N 3.02Å; D199-K203 VanDerWaalsContact O-CB 3.27Å; D199-K203 WeakPolarHBondContact O-CB 3.42Å; D199-K203 PolarHBondContact O-N 2.98Å
200	D	85.8	Confident	89.1	Confident	40 Å²	40	58.6 Å²	58.6	21%	0.214	28%	0.275	C	S	.	.	H	α-helix	trans	-71.1	-44.6	-175.6	-169.8	65.3	0	0	0	111.9	L196 C202 K203 R204	L196-D200 WeakPolarHBondContact O-CB 3.24Å; L196-D200 PolarHBondContact O-N 3.2Å; D200-C202 PolarHBondContact O-N 3.11Å; D200-K203 PolarHBondContact O-N 2.99Å; D200-R204 VanDerWaalsContact CG-NE 3.31Å; D200-R204 WeakPolarHBondContact O-CB 3.21Å; D200-R204 VanDerWaalsContact O-CG 3.28Å; D200-R204 WeakPolarHBondContact O-CG 3.32Å; D200-R204 PolarHBondContact O-N 3.45Å; D200-R204 IonicContact OD1-CZ 2.62Å; D200-R204 IonicContact OD1-NE 3.99Å; D200-R204 PolarHBondContact OD1-NE 3.49Å; D200-R204 IonicContact OD1-NH2 3.49Å; D200-R204 PolarHBondContact OD1-NH2 2.72Å; D200-R204 IonicContact OD2-CZ 2.67Å; D200-R204 IonicContact OD2-NE 3.87Å; D200-R204 PolarHBondContact OD2-NE 3.48Å; D200-R204 IonicContact OD2-NH2 2.69Å
201	F	88.3	Confident	88.9	Confident	54 Å²	54	58.7 Å²	58.7	24%	0.237	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-49.3	176.2	179.3	-88.3	0	0	0	110.8	F140 F163 M197 K203 R204 L205	F140-F201 HydrophobicContact CB-CE1 3.74Å; F140-F201 HydrophobicContact CB-CZ 4.14Å; F140-F201 HydrophobicContact CD1-CE1 4.45Å; F140-F201 HydrophobicContact CD1-CZ 4.06Å; F140-F201 HydrophobicContact CD2-CE1 4.4Å; F140-F201 AromaticContact CG-CE1 3.98Å; F140-F201 HydrophobicContact CG-CE1 3.98Å; F140-F201 HydrophobicContact CG-CZ 4.05Å; F163-F201 HydrophobicContact CB-CB 4.34Å; F163-F201 HydrophobicContact CB-CD1 3.62Å; F163-F201 HydrophobicContact CB-CE1 4.22Å; F163-F201 HydrophobicContact CB-CG 4.17Å; F163-F201 HydrophobicContact CD1-CB 4.34Å; F163-F201 HydrophobicContact CD1-CG 4.41Å; F163-F201 HydrophobicContact CD2-CB 4.31Å; F163-F201 AromaticContact CD2-CD1 3.34Å; F163-F201 HydrophobicContact CD2-CD1 3.34Å; F163-F201 AromaticContact CD2-CD2 3.81Å; F163-F201 HydrophobicContact CD2-CD2 3.81Å; F163-F201 AromaticContact CD2-CE1 3.41Å; F163-F201 HydrophobicContact CD2-CE1 3.41Å; F163-F201 VanDerWaalsContact CD2-CE1 3.41Å; F163-F201 AromaticContact CD2-CE2 3.88Å; F163-F201 HydrophobicContact CD2-CE2 3.88Å; F163-F201 AromaticContact CD2-CG 3.55Å; F163-F201 HydrophobicContact CD2-CG 3.55Å; F163-F201 AromaticContact CD2-CZ 3.68Å; F163-F201 HydrophobicContact CD2-CZ 3.68Å; F163-F201 HydrophobicContact CE2-CD1 4.14Å; F163-F201 AromaticContact CE2-CD2 3.75Å; F163-F201 HydrophobicContact CE2-CD2 3.75Å; F163-F201 HydrophobicContact CE2-CE1 4.11Å; F163-F201 AromaticContact CE2-CE2 3.71Å; F163-F201 HydrophobicContact CE2-CE2 3.71Å; F163-F201 AromaticContact CE2-CG 3.96Å; F163-F201 HydrophobicContact CE2-CG 3.96Å; F163-F201 AromaticContact CE2-CZ 3.89Å; F163-F201 HydrophobicContact CE2-CZ 3.89Å; F163-F201 HydrophobicContact CG-CB 4.09Å; F163-F201 AromaticContact CG-CD1 3.65Å; F163-F201 HydrophobicContact CG-CD1 3.65Å; F163-F201 HydrophobicContact CG-CD2 4.43Å; F163-F201 HydrophobicContact CG-CE1 4.15Å; F163-F201 AromaticContact CG-CG 3.8Å; F163-F201 HydrophobicContact CG-CG 3.8Å; F163-F201 HydrophobicContact CZ-CD2 4.33Å; M197-F201 WeakPolarHBondContact O-CA 3.37Å; M197-F201 WeakPolarHBondContact O-CB 3.41Å; M197-F201 PolarHBondContact O-N 3.15Å; F201-K203 PolarHBondContact O-N 3.11Å; F201-R204 PolarHBondContact O-N 3.38Å; F201-L205 HydrophobicContact CD1-CB 4.49Å; F201-L205 HydrophobicContact CE1-CB 4.26Å; F201-L205 HydrophobicContact CE1-CD2 3.66Å; F201-L205 HydrophobicContact CZ-CD2 4.19Å; F201-L205 VanDerWaalsContact O-CB 3.31Å; F201-L205 WeakPolarHBondContact O-CB 3.48Å; F201-L205 PolarHBondContact O-N 3.16Å
202	C	91.9	Very high	88.6	Confident	12 Å²	12	50.1 Å²	50.1	8%	0.081	24%	0.241	C	C	.	.	H	α-helix	trans	-67.9	-37.1	-176.6	-82.3	0	0	0	0	113.1	C161 Q198 D200 S206	C161-C202 HydrophobicContact CB-CB 3.52Å; C161-C202 WeakPolarHBondContact CB-SG 3Å; C161-C202 PolarHBondContact O-SG 3.42Å; C161-C202 VanDerWaalsContact O-SG 3.35Å; C161-C202 WeakPolarHBondContact SG-CA 3.29Å; C161-C202 WeakPolarHBondContact SG-CB 3.34Å; C161-C202 CovalentContact SG-SG 2.05Å; C161-C202 PolarHBondContact SG-SG 2.94Å; Q198-C202 VanDerWaalsContact O-CB 3.22Å; Q198-C202 WeakPolarHBondContact O-CB 3.37Å; Q198-C202 PolarHBondContact O-N 3.25Å; D200-C202 PolarHBondContact O-N 3.11Å; C202-S206 VanDerWaalsContact O-CB 3.25Å; C202-S206 WeakPolarHBondContact O-CB 3.46Å; C202-S206 PolarHBondContact O-N 2.85Å; C202-S206 PolarHBondContact O-OG 3.09Å
203	K	91	Very high	88.6	Confident	138 Å²	138	48.1 Å²	48.1	60%	0.6	24%	0.236	S	C	*	.	H	α-helix	trans	-61.5	-47.3	173	-175.4	-177.8	177.5	-171.8	0	111.3	D199 D200 F201 N207	D199-K203 VanDerWaalsContact O-CB 3.27Å; D199-K203 WeakPolarHBondContact O-CB 3.42Å; D199-K203 PolarHBondContact O-N 2.98Å; D200-K203 PolarHBondContact O-N 2.99Å; F201-K203 PolarHBondContact O-N 3.11Å; K203-N207 WeakPolarHBondContact O-CB 3.3Å; K203-N207 PolarHBondContact O-N 2.97Å; K203-N207 PolarHBondContact O-ND2 3.28Å
204	R	88.7	Confident	88.5	Confident	20 Å²	20	50.7 Å²	50.7	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-44.6	178.6	-72	174.9	-171.1	-62.4	-14.2	112.2	V66 D200 F201 N207 F208 L541 R543	V66-R204 PolarHBondContact O-NH2 2.96Å; D200-R204 VanDerWaalsContact CG-NE 3.31Å; D200-R204 WeakPolarHBondContact O-CB 3.21Å; D200-R204 VanDerWaalsContact O-CG 3.28Å; D200-R204 WeakPolarHBondContact O-CG 3.32Å; D200-R204 PolarHBondContact O-N 3.45Å; D200-R204 IonicContact OD1-CZ 2.62Å; D200-R204 IonicContact OD1-NE 3.99Å; D200-R204 PolarHBondContact OD1-NE 3.49Å; D200-R204 IonicContact OD1-NH2 3.49Å; D200-R204 PolarHBondContact OD1-NH2 2.72Å; D200-R204 IonicContact OD2-CZ 2.67Å; D200-R204 IonicContact OD2-NE 3.87Å; D200-R204 PolarHBondContact OD2-NE 3.48Å; D200-R204 IonicContact OD2-NH2 2.69Å; F201-R204 PolarHBondContact O-N 3.38Å; R204-N207 PolarHBondContact O-N 3.33Å; R204-F208 WeakPolarHBondContact O-CB 3.34Å; R204-F208 PolarHBondContact O-N 2.95Å; R204-L541 HydrophobicContact CB-CD2 4.25Å; R204-L541 VanDerWaalsContact CD-O 3.29Å; R204-L541 WeakPolarHBondContact CD-O 3.46Å; R204-L541 PolarHBondContact NH1-O 3.21Å; R204-R543 PolarHBondContact NH1-O 3.02Å; R204-R543 PolarHBondContact NH1-OXT 3.33Å; R204-R543 VanDerWaalsContact NH1-OXT 3.15Å; R204-R543 PolarHBondContact NH2-O 2.9Å
205	L	89.4	Confident	88.4	Confident	23 Å²	23	49.6 Å²	49.6	12%	0.12	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-48.5	177.9	-180	60.3	0	0	0	111	F140 E142 F201 N207 F208 T209	F140-L205 HydrophobicContact CD2-CD2 3.74Å; F140-L205 HydrophobicContact CE2-CD2 3.88Å; E142-L205 HydrophobicContact CB-CD2 4.19Å; F201-L205 HydrophobicContact CD1-CB 4.49Å; F201-L205 HydrophobicContact CE1-CB 4.26Å; F201-L205 HydrophobicContact CE1-CD2 3.66Å; F201-L205 HydrophobicContact CZ-CD2 4.19Å; F201-L205 VanDerWaalsContact O-CB 3.31Å; F201-L205 WeakPolarHBondContact O-CB 3.48Å; F201-L205 PolarHBondContact O-N 3.16Å; L205-N207 PolarHBondContact O-N 3.06Å; L205-F208 WeakPolarHBondContact O-CB 3.34Å; L205-F208 PolarHBondContact O-N 2.82Å; L205-T209 WeakPolarHBondContact O-CB 3.45Å; L205-T209 PolarHBondContact O-N 2.82Å; L205-T209 PolarHBondContact O-OG1 3.48Å; L205-T209 VanDerWaalsContact O-OG1 3.13Å
206	S	91.6	Very high	88.3	Confident	24 Å²	24	46.5 Å²	46.5	17%	0.168	24%	0.238	C	C	.	.	H	α-helix	trans	-58	-48.4	178.2	-57.7	0	0	0	0	111.4	S158 C202 F208 T209 E210	S158-S206 PolarHBondContact OG-OG 3.34Å; C202-S206 VanDerWaalsContact O-CB 3.25Å; C202-S206 WeakPolarHBondContact O-CB 3.46Å; C202-S206 PolarHBondContact O-N 2.85Å; C202-S206 PolarHBondContact O-OG 3.09Å; S206-F208 VanDerWaalsContact C-N 3.34Å; S206-F208 PolarHBondContact O-N 3.02Å; S206-T209 PolarHBondContact O-N 3.2Å; S206-E210 WeakPolarHBondContact O-CG 3.42Å; S206-E210 PolarHBondContact O-N 2.79Å
207	N	90.4	Very high	88.4	Confident	60 Å²	60	45.4 Å²	45.4	32%	0.321	23%	0.232	S	C	.	.	H	α-helix	trans	-60.8	-42.6	177.7	-74.4	-14.7	0	0	0	112.2	K203 R204 L205 T211	K203-N207 WeakPolarHBondContact O-CB 3.3Å; K203-N207 PolarHBondContact O-N 2.97Å; K203-N207 PolarHBondContact O-ND2 3.28Å; R204-N207 PolarHBondContact O-N 3.33Å; L205-N207 PolarHBondContact O-N 3.06Å; N207-T211 WeakPolarHBondContact O-CB 3.1Å; N207-T211 PolarHBondContact O-N 3.22Å; N207-T211 PolarHBondContact O-OG1 2.85Å
208	F	88	Confident	88.2	Confident	14 Å²	14	48.3 Å²	48.3	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-47.8	177.2	174.1	-95.2	0	0	0	111.5	L54 R204 L205 S206 S212 F534 L541	L54-F208 HydrophobicContact CD2-CE1 3.8Å; L54-F208 HydrophobicContact CD2-CZ 3.65Å; R204-F208 WeakPolarHBondContact O-CB 3.34Å; R204-F208 PolarHBondContact O-N 2.95Å; L205-F208 WeakPolarHBondContact O-CB 3.34Å; L205-F208 PolarHBondContact O-N 2.82Å; S206-F208 VanDerWaalsContact C-N 3.34Å; S206-F208 PolarHBondContact O-N 3.02Å; F208-S212 WeakPolarHBondContact O-CB 3.31Å; F208-S212 PolarHBondContact O-N 3.1Å; F208-S212 PolarHBondContact O-OG 3.28Å; F208-F534 HydrophobicContact CE2-CB 4.38Å; F208-F534 HydrophobicContact CE2-CD1 4.29Å; F208-F534 HydrophobicContact CE2-CG 4.36Å; F208-F534 HydrophobicContact CZ-CB 4.29Å; F208-F534 AromaticContact CZ-CD1 3.7Å; F208-F534 HydrophobicContact CZ-CD1 3.7Å; F208-F534 HydrophobicContact CZ-CD2 4.22Å; F208-F534 HydrophobicContact CZ-CE1 4.02Å; F208-F534 AromaticContact CZ-CG 3.82Å; F208-F534 HydrophobicContact CZ-CG 3.82Å; F208-F534 HydrophobicContact CZ-CZ 4.43Å; F208-L541 HydrophobicContact CB-CD2 3.9Å; F208-L541 HydrophobicContact CB-CG 4.03Å; F208-L541 HydrophobicContact CD2-CD1 3.66Å; F208-L541 HydrophobicContact CD2-CD2 4.46Å; F208-L541 HydrophobicContact CD2-CG 3.81Å; F208-L541 HydrophobicContact CE2-CD1 4.02Å; F208-L541 HydrophobicContact CG-CD1 4.13Å; F208-L541 HydrophobicContact CG-CD2 4.23Å; F208-L541 HydrophobicContact CG-CG 4.08Å
209	T	88.8	Confident	87.8	Confident	11 Å²	11	48.5 Å²	48.5	7%	0.067	28%	0.276	C	S	.	.	H	α-helix	trans	-57.1	-56.6	177.3	-67.8	0	0	0	0	110.1	E142 I144 L205 S206 T211 S212 F213	E142-T209 PolarHBondContact OE1-OG1 3.26Å; E142-T209 PolarHBondContact OE2-OG1 3.35Å; E142-T209 VanDerWaalsContact OE2-OG1 3.1Å; I144-T209 HydrophobicContact CD1-CG2 3.83Å; I144-T209 HydrophobicContact CG1-CG2 4.11Å; L205-T209 WeakPolarHBondContact O-CB 3.45Å; L205-T209 PolarHBondContact O-N 2.82Å; L205-T209 PolarHBondContact O-OG1 3.48Å; L205-T209 VanDerWaalsContact O-OG1 3.13Å; S206-T209 PolarHBondContact O-N 3.2Å; T209-T211 PolarHBondContact O-N 2.97Å; T209-S212 PolarHBondContact O-N 3.38Å; T209-F213 HydrophobicContact CG2-CD2 3.85Å; T209-F213 HydrophobicContact CG2-CE2 3.97Å; T209-F213 VanDerWaalsContact O-CD2 3.24Å; T209-F213 WeakPolarHBondContact O-CD2 3.48Å; T209-F213 PolarHBondContact O-N 2.84Å
210	E	91.6	Very high	87.5	Confident	67 Å²	67	48 Å²	48	31%	0.313	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-45.5	-177.6	-68.2	-170.2	177	0	0	112.7	T157 S158 S206 S212 A214	T157-E210 VanDerWaalsContact CA-OE1 3.29Å; T157-E210 WeakPolarHBondContact CA-OE1 3.46Å; S158-E210 PolarHBondContact N-OE1 3.18Å; S206-E210 WeakPolarHBondContact O-CG 3.42Å; S206-E210 PolarHBondContact O-N 2.79Å; E210-S212 PolarHBondContact O-N 3.24Å; E210-A214 WeakPolarHBondContact O-CB 3.41Å; E210-A214 PolarHBondContact O-N 3.12Å
211	T	89.9	Confident	87.3	Confident	31 Å²	31	48.8 Å²	48.8	19%	0.19	28%	0.28	C	S	.	.	H	α-helix	trans	-66.1	-41.7	-179.1	-58.8	0	0	0	0	111.6	N207 T209 A214 K215 M540	N207-T211 WeakPolarHBondContact O-CB 3.1Å; N207-T211 PolarHBondContact O-N 3.22Å; N207-T211 PolarHBondContact O-OG1 2.85Å; T209-T211 PolarHBondContact O-N 2.97Å; T211-A214 PolarHBondContact O-N 2.8Å; T211-K215 HydrophobicContact CG2-CD 4.48Å; T211-K215 WeakPolarHBondContact O-CG 3.39Å; T211-K215 PolarHBondContact O-N 3.25Å; T211-M540 HydrophobicContact CG2-CE 4.06Å
212	S	85.6	Confident	87.3	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-67.2	-44.8	-179.7	-60.8	0	0	0	0	111.2	F208 T209 E210 K215 I216 S537	F208-S212 WeakPolarHBondContact O-CB 3.31Å; F208-S212 PolarHBondContact O-N 3.1Å; F208-S212 PolarHBondContact O-OG 3.28Å; T209-S212 PolarHBondContact O-N 3.38Å; E210-S212 PolarHBondContact O-N 3.24Å; S212-K215 PolarHBondContact O-N 3.29Å; S212-I216 WeakPolarHBondContact O-CG1 3.38Å; S212-I216 PolarHBondContact O-N 2.84Å; S212-I216 VanDerWaalsContact O-N 3.15Å; S212-S537 VanDerWaalsContact OG-CB 3.24Å; S212-S537 WeakPolarHBondContact OG-CB 3.41Å; S212-S537 PolarHBondContact OG-OG 3.14Å; S212-S537 VanDerWaalsContact OG-OG 3.05Å
213	F	88.4	Confident	87.2	Confident	75 Å²	75	54.3 Å²	54.3	33%	0.329	30%	0.301	S	S	.	.	H	α-helix	trans	-65.8	-40.2	174.3	-81.7	-69.6	0	0	0	112.3	I144 V156 T209 K215 I216 I217	I144-F213 HydrophobicContact CD1-CE2 4.45Å; V156-F213 HydrophobicContact CB-CB 3.78Å; V156-F213 HydrophobicContact CB-CD2 4.44Å; V156-F213 HydrophobicContact CB-CG 4.08Å; V156-F213 HydrophobicContact CG1-CB 4.01Å; V156-F213 HydrophobicContact CG1-CD2 3.72Å; V156-F213 HydrophobicContact CG1-CE2 4.34Å; V156-F213 HydrophobicContact CG1-CG 3.83Å; V156-F213 HydrophobicContact CG2-CB 4.05Å; V156-F213 HydrophobicContact CG2-CD1 4.3Å; V156-F213 HydrophobicContact CG2-CG 4.17Å; T209-F213 HydrophobicContact CG2-CD2 3.85Å; T209-F213 HydrophobicContact CG2-CE2 3.97Å; T209-F213 VanDerWaalsContact O-CD2 3.24Å; T209-F213 WeakPolarHBondContact O-CD2 3.48Å; T209-F213 PolarHBondContact O-N 2.84Å; F213-K215 VanDerWaalsContact C-N 3.3Å; F213-K215 PolarHBondContact O-N 3.45Å; F213-I216 PolarHBondContact O-N 2.77Å; F213-I217 HydrophobicContact CB-CD1 4.42Å; F213-I217 WeakPolarHBondContact O-CB 3.19Å; F213-I217 WeakPolarHBondContact O-CD1 3.38Å; F213-I217 VanDerWaalsContact O-CG1 3.23Å; F213-I217 WeakPolarHBondContact O-CG1 3.3Å; F213-I217 PolarHBondContact O-N 2.86Å
214	A	89.1	Confident	87.1	Confident	56 Å²	56	51.9 Å²	51.9	46%	0.463	29%	0.291	S	S	.	.	H	α-helix	trans	-58.4	-41.3	176.2	0	0	0	0	0	112	E210 T211 I217 A218	E210-A214 WeakPolarHBondContact O-CB 3.41Å; E210-A214 PolarHBondContact O-N 3.12Å; T211-A214 PolarHBondContact O-N 2.8Å; A214-I217 PolarHBondContact O-N 2.76Å; A214-A218 VanDerWaalsContact O-CB 3.23Å; A214-A218 WeakPolarHBondContact O-CB 3.48Å; A214-A218 PolarHBondContact O-N 3.35Å
215	K	86.2	Confident	87.1	Confident	66 Å²	66	53 Å²	53	29%	0.287	30%	0.301	S	S	.	.	H	α-helix	trans	-64.5	-42.2	175.1	-72.8	172.6	-176.2	170.9	0	112.8	T211 S212 F213 G219 L533 S536 S537	T211-K215 HydrophobicContact CG2-CD 4.48Å; T211-K215 WeakPolarHBondContact O-CG 3.39Å; T211-K215 PolarHBondContact O-N 3.25Å; S212-K215 PolarHBondContact O-N 3.29Å; F213-K215 VanDerWaalsContact C-N 3.3Å; F213-K215 PolarHBondContact O-N 3.45Å; K215-G219 PolarHBondContact O-N 3.05Å; K215-L533 HydrophobicContact CB-CD2 4.1Å; K215-L533 HydrophobicContact CD-CD2 4.5Å; K215-S536 PolarHBondContact NZ-O 3.08Å; K215-S536 PolarHBondContact NZ-OG 2.99Å; K215-S537 VanDerWaalsContact NZ-N 3.12Å; K215-S537 PolarHBondContact NZ-OG 3.06Å
216	I	84.3	Confident	86.7	Confident	60 Å²	60	54 Å²	54	31%	0.308	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-47.3	176.8	-66.7	169.5	0	0	0	109.9	S212 F213 G219 L533	S212-I216 WeakPolarHBondContact O-CG1 3.38Å; S212-I216 PolarHBondContact O-N 2.84Å; S212-I216 VanDerWaalsContact O-N 3.15Å; F213-I216 PolarHBondContact O-N 2.77Å; I216-G219 PolarHBondContact O-N 2.83Å; I216-L533 HydrophobicContact CG1-CD1 4.09Å
217	I	85.7	Confident	85.7	Confident	23 Å²	23	53.5 Å²	53.5	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-38.6	-178.4	-67.2	163.7	0	0	0	111.5	L154 V156 F213 A214 G219 I220	L154-I217 HydrophobicContact CB-CD1 4.17Å; L154-I217 HydrophobicContact CB-CG1 4.5Å; L154-I217 HydrophobicContact CB-CG2 4.35Å; L154-I217 HydrophobicContact CD2-CD1 3.93Å; L154-I217 HydrophobicContact CD2-CG1 4.18Å; L154-I217 HydrophobicContact CG-CD1 3.89Å; L154-I217 WeakPolarHBondContact O-CG2 3.48Å; V156-I217 HydrophobicContact CB-CD1 4.44Å; V156-I217 HydrophobicContact CG2-CD1 3.65Å; F213-I217 HydrophobicContact CB-CD1 4.42Å; F213-I217 WeakPolarHBondContact O-CB 3.19Å; F213-I217 WeakPolarHBondContact O-CD1 3.38Å; F213-I217 VanDerWaalsContact O-CG1 3.23Å; F213-I217 WeakPolarHBondContact O-CG1 3.3Å; F213-I217 PolarHBondContact O-N 2.86Å; A214-I217 PolarHBondContact O-N 2.76Å; I217-G219 PolarHBondContact O-N 3.11Å; I217-G219 VanDerWaalsContact O-N 3.13Å; I217-I220 WeakPolarHBondContact O-CB 3.48Å; I217-I220 PolarHBondContact O-N 2.82Å
218	A	82.9	Confident	84.1	Confident	82 Å²	82	54.3 Å²	54.3	68%	0.678	33%	0.325	S	S	*	.	H	α-helix	trans	-60	-23.1	175.8	0	0	0	0	0	112.8	A214 I220	A214-A218 VanDerWaalsContact O-CB 3.23Å; A214-A218 WeakPolarHBondContact O-CB 3.48Å; A214-A218 PolarHBondContact O-N 3.35Å; A218-I220 VanDerWaalsContact C-N 3.26Å; A218-I220 PolarHBondContact O-N 2.86Å
219	G	79.5	Confident	81.8	Confident	60 Å²	60	57.2 Å²	57.2	62%	0.619	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.7	172.5	0	0	0	0	0	114.8	K215 I216 I217 P221	K215-G219 PolarHBondContact O-N 3.05Å; I216-G219 PolarHBondContact O-N 2.83Å; I217-G219 PolarHBondContact O-N 3.11Å; I217-G219 VanDerWaalsContact O-N 3.13Å; G219-P221 WeakPolarHBondContact O-CD 3.45Å
220	I	80.9	Confident	79.3	Confident	86 Å²	86	60.3 Å²	60.3	44%	0.441	36%	0.359	S	S	.	.	S	Bend	trans	-104.9	104.2	-178.7	-53.4	174.1	0	0	0	108.5	I217 A218	I217-I220 WeakPolarHBondContact O-CB 3.48Å; I217-I220 PolarHBondContact O-N 2.82Å; A218-I220 VanDerWaalsContact C-N 3.26Å; A218-I220 PolarHBondContact O-N 2.86Å
221	P	81.6	Confident	76.8	Confident	56 Å²	56	59.9 Å²	59.9	36%	0.364	37%	0.367	S	S	.	.			trans	-69.6	141.4	-179.5	29.6	-34.6	0	0	0	111.1	G219 R223 Q224	G219-P221 WeakPolarHBondContact O-CD 3.45Å; P221-R223 VanDerWaalsContact C-N 3.26Å; P221-R223 PolarHBondContact O-N 2.83Å; P221-Q224 HydrophobicContact CG-CB 4.48Å
222	I	88.9	Confident	74.3	Confident	44 Å²	44	62.8 Å²	62.8	23%	0.226	39%	0.388	C	S	.	.	S	Bend	trans	-63.6	-37.6	172.3	-55.8	170.3	0	0	0	110.3	N151 Q153 M269	N151-I222 HydrophobicContact CB-CD1 4.27Å; Q153-I222 VanDerWaalsContact CD-CD1 3.49Å; Q153-I222 HydrophobicContact CG-CD1 3.4Å; Q153-I222 HydrophobicContact CG-CG1 3.4Å; Q153-I222 VanDerWaalsContact NE2-CG1 3.33Å; I222-M269 WeakPolarHBondContact O-CA 3.35Å; I222-M269 WeakPolarHBondContact O-CB 3.23Å; I222-M269 PolarHBondContact O-N 3.46Å
223	R	89.9	Confident	72	Confident	139 Å²	139	65.9 Å²	65.9	53%	0.525	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	109.1	177.5	-66	-173.2	176.8	174.6	-2.8	108.3	P221 P225 Y266 V267	P221-R223 VanDerWaalsContact C-N 3.26Å; P221-R223 PolarHBondContact O-N 2.83Å; R223-P225 WeakPolarHBondContact O-CD 3.34Å; R223-Y266 HydrophobicContact CB-CD2 3.72Å; R223-Y266 HydrophobicContact CB-CE2 4.32Å; R223-Y266 HydrophobicContact CB-CG 4.07Å; R223-Y266 HydrophobicContact CG-CD2 3.6Å; R223-Y266 HydrophobicContact CG-CE2 3.68Å; R223-Y266 HydrophobicContact CG-CG 4.29Å; R223-V267 WeakPolarHBondContact CA-O 3.34Å
224	Q	87.9	Confident	69.5	Low	87 Å²	87	69.6 Å²	69.6	41%	0.407	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.9	178.1	178.8	60.5	47.5	0	0	108.9	P221 L226 Y266 V267 M269	P221-Q224 HydrophobicContact CG-CB 4.48Å; Q224-L226 PolarHBondContact O-N 3.26Å; Q224-Y266 CarbonylContact O-C 3.31Å; Q224-Y266 WeakPolarHBondContact O-CA 3.48Å; Q224-Y266 WeakPolarHBondContact O-CB 3.41Å; Q224-V267 HydrophobicContact CB-CB 4.41Å; Q224-V267 PolarHBondContact N-O 2.85Å; Q224-V267 PolarHBondContact O-N 2.79Å; Q224-M269 HydrophobicContact CB-CG 4.11Å
225	P	87.8	Confident	66.6	Low	42 Å²	42	75.7 Å²	75.7	27%	0.273	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	137.3	173.8	-24	35.3	0	0	0	110.9	R223 T227	R223-P225 WeakPolarHBondContact O-CD 3.34Å; P225-T227 WeakPolarHBondContact CB-O 3.4Å
226	L	81.2	Confident	63.9	Low	46 Å²	46	76.2 Å²	76.2	24%	0.241	45%	0.454	C	S	.	.	S	Bend	trans	-71.5	-37.4	176.8	-80.2	-170.8	0	0	0	112.3	Q224 L262 F265 V267 I294 M332	Q224-L226 PolarHBondContact O-N 3.26Å; L226-L262 HydrophobicContact CD1-CD1 4.42Å; L226-L262 HydrophobicContact CD1-CD2 4.33Å; L226-F265 HydrophobicContact CB-CB 4.45Å; L226-F265 HydrophobicContact CD1-CB 3.84Å; L226-F265 HydrophobicContact CG-CB 4.28Å; L226-F265 PolarHBondContact N-O 3.01Å; L226-V267 HydrophobicContact CD2-CG2 3.46Å; L226-V267 VanDerWaalsContact CD2-CG2 3.46Å; L226-V267 HydrophobicContact CG-CG2 4.27Å; L226-I294 HydrophobicContact CD1-CD1 4.49Å; L226-I294 HydrophobicContact CD1-CG2 3.57Å; L226-I294 HydrophobicContact CD2-CD1 4.37Å; L226-I294 HydrophobicContact CG-CG2 4.31Å; L226-M332 HydrophobicContact CD1-SD 4.09Å
227	T	71.5	Confident	61.6	Low	13 Å²	13	82.7 Å²	82.7	8%	0.08	48%	0.481	C	S	.	.	S	Bend	trans	-89	134.2	171.2	68.4	0	0	0	0	107.7	P225 I229 D260 L262	P225-T227 WeakPolarHBondContact CB-O 3.4Å; T227-I229 PolarHBondContact O-N 3.04Å; T227-D260 WeakPolarHBondContact CG2-OD2 3.48Å; T227-L262 HydrophobicContact CG2-CB 4.09Å
228	G	55.7	Low	58.9	Low	77 Å²	77	87.2 Å²	87.2	79%	0.794	51%	0.509	S	S	*	.	S	Bend	trans	-61.9	2.3	177.8	0	0	0	0	0	114.5	T230	G228-T230 VanDerWaalsContact C-N 3.31Å; G228-T230 PolarHBondContact O-N 2.78Å
229	I	41	Very low	56.3	Low	74 Å²	74	94.2 Å²	94.2	38%	0.379	52%	0.518	S	S	.	.			trans	-81.5	79.9	177.4	-50.3	176.9	0	0	0	107.9	T227 A257	T227-I229 PolarHBondContact O-N 3.04Å; I229-A257 HydrophobicContact CD1-CB 4.39Å
230	T	36	Very low	54	Low	77 Å²	77	98 Å²	98	47%	0.472	52%	0.524	S	S	.	.			trans	-60.6	146.8	167.9	58.4	0	0	0	0	109.9	G228 S232 S233	G228-T230 VanDerWaalsContact C-N 3.31Å; G228-T230 PolarHBondContact O-N 2.78Å; T230-S232 PolarHBondContact O-N 3.05Å; T230-S233 PolarHBondContact O-N 2.9Å
231	A	38.7	Very low	51.9	Low	57 Å²	57	99.3 Å²	99.3	47%	0.471	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-10.9	177.3	0	0	0	0	0	114.4	S233 R234	A231-S233 PolarHBondContact O-N 3.43Å; A231-R234 WeakPolarHBondContact O-CA 3.35Å; A231-R234 WeakPolarHBondContact O-CB 3.29Å; A231-R234 WeakPolarHBondContact O-CG 3.34Å; A231-R234 PolarHBondContact O-N 3.3Å
232	S	38.4	Very low	49.9	Very low	92 Å²	92	105.4 Å²	105.4	64%	0.643	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-26.9	171.3	-156.9	0	0	0	0	113.1	T230 R234 K235	T230-S232 PolarHBondContact O-N 3.05Å; S232-R234 PolarHBondContact O-N 3.4Å; S232-K235 PolarHBondContact O-N 3.21Å
233	S	36.2	Very low	47.4	Very low	71 Å²	71	113.1 Å²	113.1	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-68.6	-11.2	169.3	-74.4	0	0	0	0	113.7	T230 A231 K235	T230-S233 PolarHBondContact O-N 2.9Å; A231-S233 PolarHBondContact O-N 3.43Å; S233-K235 PolarHBondContact O-N 2.93Å
234	R	36.3	Very low	44.7	Very low	154 Å²	154	109.5 Å²	109.5	58%	0.581	60%	0.6	S	S	*	*	H	α-helix	trans	-65.7	-24.2	170.8	-65.5	-177.9	178.8	163.3	3.2	112.3	A231 S232 E297	A231-R234 WeakPolarHBondContact O-CA 3.35Å; A231-R234 WeakPolarHBondContact O-CB 3.29Å; A231-R234 WeakPolarHBondContact O-CG 3.34Å; A231-R234 PolarHBondContact O-N 3.3Å; S232-R234 PolarHBondContact O-N 3.4Å; R234-E297 IonicContact NH2-OE2 3.74Å
235	K	27.7	Very low	42.1	Very low	184 Å²	184	113.8 Å²	113.8	80%	0.8	62%	0.62	S	S	*	*	H	α-helix	trans	-96.5	-21.5	-178.3	-71.2	-172.3	178.7	-178.4	0	114.5	S232 S233 F237	S232-K235 PolarHBondContact O-N 3.21Å; S233-K235 PolarHBondContact O-N 2.93Å; K235-F237 VanDerWaalsContact C-N 3.29Å; K235-F237 PolarHBondContact O-N 2.8Å
236	A	31	Very low	39.3	Very low	76 Å²	76	117.8 Å²	117.8	63%	0.628	65%	0.646	S	S	*	*	H	α-helix	trans	-74.2	-19.4	-179.6	0	0	0	0	0	113.5
237	F	34.1	Very low	37.1	Very low	197 Å²	197	123 Å²	123	86%	0.864	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-2.8	-177	-120.5	-90.4	0	0	0	115.2	K235	K235-F237 VanDerWaalsContact C-N 3.29Å; K235-F237 PolarHBondContact O-N 2.8Å
238	V	28.8	Very low	35	Very low	118 Å²	118	132.6 Å²	132.6	72%	0.715	71%	0.714	S	S	*	*			trans	-111.1	61.7	170.1	-167.1	0	0	0	0	108.7
239	R	29	Very low	33.9	Very low	228 Å²	228	140.1 Å²	140.1	86%	0.86	72%	0.718	S	S	*	*			trans	-103.6	96.8	163.2	-157.5	172.5	-177.1	166.6	-0	108	S241	R239-S241 PolarHBondContact O-N 3.46Å
240	N	30.9	Very low	33.2	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	73%	0.729	S	S	*	*			trans	-47.6	104.7	166.1	-80.3	-14.5	0	0	0	109	K242	N240-K242 PolarHBondContact O-N 2.93Å
241	S	38	Very low	32.8	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	74%	0.742	S	S	*	*			trans	-87.3	91.6	159.1	36.8	0	0	0	0	106.7	R239 F243	R239-S241 PolarHBondContact O-N 3.46Å; S241-F243 VanDerWaalsContact C-N 3.32Å; S241-F243 PolarHBondContact O-N 3.12Å
242	K	38.7	Very low	32.2	Very low	185 Å²	185	148.7 Å²	148.7	80%	0.804	76%	0.759	S	S	*	*			trans	-65.1	101.4	149.5	-72.1	-177.6	178.2	-177.4	0	104.9	N240	N240-K242 PolarHBondContact O-N 2.93Å
243	F	37.3	Very low	31.6	Very low	205 Å²	205	151.1 Å²	151.1	90%	0.899	77%	0.769	S	S	*	*	S	Bend	trans	168.5	141.1	148.2	-89.2	-66.5	0	0	0	108.3	S241	S241-F243 VanDerWaalsContact C-N 3.32Å; S241-F243 PolarHBondContact O-N 3.12Å
244	G	32.9	Very low	31.2	Very low	64 Å²	64	150 Å²	150	66%	0.66	77%	0.769	S	S	*	*			trans	-75	175	-153.5	0	0	0	0	0	116.5
245	H	32.3	Very low	30.9	Very low	177 Å²	177	146.2 Å²	146.2	82%	0.819	77%	0.766	S	S	*	*			trans	88.1	111	175.6	-62.2	-67.1	0	0	0	116.8	L247	H245-L247 VanDerWaalsContact C-N 3.3Å; H245-L247 PolarHBondContact O-N 3.43Å
246	P	30.4	Very low	31.1	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	77%	0.767	S	S	*	*			trans	-76.9	85.1	174.5	33.2	-30.5	0	0	0	108.1	K248	P246-K248 PolarHBondContact O-N 3.3Å
247	L	34.8	Very low	31.4	Very low	155 Å²	155	144.5 Å²	144.5	81%	0.812	76%	0.757	S	S	*	*			trans	-61.2	119.6	158.5	-77.9	165.7	0	0	0	106.4	H245 R249	H245-L247 VanDerWaalsContact C-N 3.3Å; H245-L247 PolarHBondContact O-N 3.43Å; L247-R249 PolarHBondContact O-N 3.09Å
248	K	27.8	Very low	31.6	Very low	216 Å²	216	141 Å²	141	94%	0.939	75%	0.747	S	S	*	*			trans	-52.8	83.8	169.3	-77.2	-177.9	177	179.3	0	108.3	P246 S250	P246-K248 PolarHBondContact O-N 3.3Å; K248-S250 PolarHBondContact O-N 2.88Å; K248-S250 VanDerWaalsContact O-N 3.14Å
249	R	31	Very low	33.1	Very low	234 Å²	234	142 Å²	142	88%	0.883	75%	0.748	S	S	*	*			trans	-77	107.7	-177	-151	174.6	-172.5	170.3	2	105.6	L247 A251	L247-R249 PolarHBondContact O-N 3.09Å; R249-A251 PolarHBondContact O-N 3.46Å
250	S	27	Very low	35.2	Very low	87 Å²	87	134 Å²	134	61%	0.608	72%	0.722	S	S	*	*			trans	-35.3	109.1	169.7	176	0	0	0	0	110.2	K248 Y252	K248-S250 PolarHBondContact O-N 2.88Å; K248-S250 VanDerWaalsContact O-N 3.14Å; S250-Y252 PolarHBondContact O-N 3.47Å
251	A	26.9	Very low	37.3	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	18	179.1	0	0	0	0	0	112.7	R249	R249-A251 PolarHBondContact O-N 3.46Å
252	Y	26.1	Very low	39.5	Very low	211 Å²	211	127 Å²	127	83%	0.827	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	5.3	-176	-87.6	-81.9	0	0	0	115.1	S250	S250-Y252 PolarHBondContact O-N 3.47Å
253	V	25.9	Very low	41.7	Very low	143 Å²	143	123.5 Å²	123.5	87%	0.867	66%	0.661	S	S	*	*	S	Bend	trans	-114.6	83.7	171.1	-170.2	0	0	0	0	109.1
254	G	28.1	Very low	44.1	Very low	48 Å²	48	116.9 Å²	116.9	50%	0.495	64%	0.635	S	S	.	*	S	Bend	trans	152.5	-10.9	162.4	0	0	0	0	0	119.6	Q256 A257	G254-Q256 VanDerWaalsContact C-N 3.25Å; G254-Q256 PolarHBondContact O-N 2.72Å; G254-A257 PolarHBondContact O-N 3.45Å
255	S	29.9	Very low	47	Very low	74 Å²	74	113.9 Å²	113.9	52%	0.517	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-66.5	-22.8	-176.8	54.5	0	0	0	0	114.3	A257 L258	S255-A257 PolarHBondContact O-N 2.84Å; S255-L258 PolarHBondContact O-N 3.28Å
256	Q	31.5	Very low	49.9	Very low	174 Å²	174	106.5 Å²	106.5	81%	0.813	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-67.4	-18.6	178.6	-66.6	-173.6	-1	0	0	114.2	G254	G254-Q256 VanDerWaalsContact C-N 3.25Å; G254-Q256 PolarHBondContact O-N 2.72Å
257	A	36.9	Very low	52.8	Low	50 Å²	50	101.4 Å²	101.4	41%	0.413	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-87.2	-16.8	179.9	0	0	0	0	0	113.6	I229 G254 S255	I229-A257 HydrophobicContact CD1-CB 4.39Å; G254-A257 PolarHBondContact O-N 3.45Å; S255-A257 PolarHBondContact O-N 2.84Å
258	L	39.7	Very low	55.7	Low	125 Å²	125	94.2 Å²	94.2	65%	0.654	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-26.7	177.2	-89.9	151.5	0	0	0	112.3	S255	S255-L258 PolarHBondContact O-N 3.28Å
259	D	60.7	Low	58.8	Low	137 Å²	137	86.7 Å²	86.7	73%	0.733	47%	0.466	S	S	*	.	S	Bend	trans	-101.8	11.6	-172.4	-64.4	-23.3	0	0	0	114.6	P261	D259-P261 WeakPolarHBondContact O-CD 3.38Å
260	D	73	Confident	61.8	Low	62 Å²	62	75.6 Å²	75.6	33%	0.332	43%	0.425	S	S	.	.			trans	-74.1	111.2	177.3	-169	-20.1	0	0	0	110.2	T227 L262 R263	T227-D260 WeakPolarHBondContact CG2-OD2 3.48Å; D260-L262 PolarHBondContact O-N 3.39Å; D260-L262 WeakPolarHBondContact OD1-CB 3.48Å; D260-L262 PolarHBondContact OD1-N 2.74Å; D260-R263 VanDerWaalsContact O-CB 3.31Å; D260-R263 WeakPolarHBondContact O-CB 3.31Å; D260-R263 PolarHBondContact O-N 2.9Å; D260-R263 VanDerWaalsContact O-N 3.08Å
261	P	75.1	Confident	65	Low	61 Å²	61	72 Å²	72	40%	0.396	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.1	-179.3	27.5	-35.4	0	0	0	112.6	D259 F265 L336	D259-P261 WeakPolarHBondContact O-CD 3.38Å; P261-F265 WeakPolarHBondContact O-CD2 3.43Å; P261-F265 WeakPolarHBondContact O-CE2 3.29Å; P261-L336 HydrophobicContact CB-CD2 4.35Å
262	L	84.2	Confident	68.2	Low	45 Å²	45	69.7 Å²	69.7	24%	0.236	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	5.2	-179.8	-59.3	177.4	0	0	0	113.7	L226 T227 D260 N264 F265 M332 L336	L226-L262 HydrophobicContact CD1-CD1 4.42Å; L226-L262 HydrophobicContact CD1-CD2 4.33Å; T227-L262 HydrophobicContact CG2-CB 4.09Å; D260-L262 PolarHBondContact O-N 3.39Å; D260-L262 WeakPolarHBondContact OD1-CB 3.48Å; D260-L262 PolarHBondContact OD1-N 2.74Å; L262-N264 VanDerWaalsContact C-N 3.27Å; L262-N264 PolarHBondContact O-N 3.45Å; L262-F265 HydrophobicContact CD2-CB 4.49Å; L262-F265 HydrophobicContact CD2-CD1 4.35Å; L262-F265 HydrophobicContact CD2-CD2 4.2Å; L262-F265 HydrophobicContact CD2-CG 4.1Å; L262-F265 WeakPolarHBondContact O-CB 3.45Å; L262-F265 PolarHBondContact O-N 3.13Å; L262-M332 HydrophobicContact CD2-CG 4.21Å; L262-M332 HydrophobicContact CD2-SD 3.95Å; L262-L336 HydrophobicContact CD2-CD1 4.18Å; L262-L336 HydrophobicContact CD2-CD2 4.04Å; L262-L336 HydrophobicContact CD2-CG 4.48Å
263	R	83.2	Confident	71.3	Confident	110 Å²	110	62.3 Å²	62.3	42%	0.415	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-39.3	-174.4	-178.3	176.9	174.6	-174	-0.7	114.1	D260	D260-R263 VanDerWaalsContact O-CB 3.31Å; D260-R263 WeakPolarHBondContact O-CB 3.31Å; D260-R263 PolarHBondContact O-N 2.9Å; D260-R263 VanDerWaalsContact O-N 3.08Å
264	N	88.7	Confident	74.5	Confident	66 Å²	66	63.1 Å²	63.1	35%	0.353	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	15.5	-178.5	-61.3	-28.1	0	0	0	112.7	L262 Q296 E297	L262-N264 VanDerWaalsContact C-N 3.27Å; L262-N264 PolarHBondContact O-N 3.45Å; N264-Q296 HydrophobicContact CB-CG 4.11Å; N264-Q296 CarbonylContact O-C 3.43Å; N264-Q296 WeakPolarHBondContact O-CA 3.43Å; N264-E297 PolarHBondContact O-N 3.38Å
265	F	92.6	Very high	77.7	Confident	2 Å²	2	61 Å²	61	1%	0.009	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	144.4	179.3	-76.9	-110.9	0	0	0	111.6	L226 P261 L262 I294 S295 Q296 M332 H335 L336 L341	L226-F265 HydrophobicContact CB-CB 4.45Å; L226-F265 HydrophobicContact CD1-CB 3.84Å; L226-F265 HydrophobicContact CG-CB 4.28Å; L226-F265 PolarHBondContact N-O 3.01Å; P261-F265 WeakPolarHBondContact O-CD2 3.43Å; P261-F265 WeakPolarHBondContact O-CE2 3.29Å; L262-F265 HydrophobicContact CD2-CB 4.49Å; L262-F265 HydrophobicContact CD2-CD1 4.35Å; L262-F265 HydrophobicContact CD2-CD2 4.2Å; L262-F265 HydrophobicContact CD2-CG 4.1Å; L262-F265 WeakPolarHBondContact O-CB 3.45Å; L262-F265 PolarHBondContact O-N 3.13Å; F265-I294 HydrophobicContact CD1-CG2 4.04Å; F265-S295 VanDerWaalsContact CA-O 3.32Å; F265-S295 WeakPolarHBondContact CA-O 3.45Å; F265-Q296 HydrophobicContact CD2-CB 4.44Å; F265-Q296 HydrophobicContact CD2-CG 4.49Å; F265-Q296 HydrophobicContact CE1-CB 4.42Å; F265-Q296 HydrophobicContact CE2-CB 4.17Å; F265-Q296 HydrophobicContact CE2-CG 4.26Å; F265-Q296 VanDerWaalsContact CE2-OE1 3.24Å; F265-Q296 HydrophobicContact CZ-CB 4.16Å; F265-M332 HydrophobicContact CD1-CG 4.31Å; F265-M332 HydrophobicContact CE1-CG 4.34Å; F265-H335 HydrophobicContact CE1-CB 3.61Å; F265-H335 HydrophobicContact CZ-CB 3.95Å; F265-L336 HydrophobicContact CE1-CD2 4.28Å; F265-L336 HydrophobicContact CE1-CG 4.09Å; F265-L336 HydrophobicContact CE2-CD2 3.93Å; F265-L336 HydrophobicContact CZ-CD2 3.59Å; F265-L336 HydrophobicContact CZ-CG 3.81Å; F265-L341 HydrophobicContact CE2-CD1 3.98Å; F265-L341 HydrophobicContact CZ-CD1 4.29Å
266	Y	93.2	Very high	80.8	Confident	21 Å²	21	59.1 Å²	59.1	8%	0.082	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	158.9	175.2	67	-91.1	0	0	0	111.3	R223 Q224 D268 I294 S295 E297	R223-Y266 HydrophobicContact CB-CD2 3.72Å; R223-Y266 HydrophobicContact CB-CE2 4.32Å; R223-Y266 HydrophobicContact CB-CG 4.07Å; R223-Y266 HydrophobicContact CG-CD2 3.6Å; R223-Y266 HydrophobicContact CG-CE2 3.68Å; R223-Y266 HydrophobicContact CG-CG 4.29Å; Q224-Y266 CarbonylContact O-C 3.31Å; Q224-Y266 WeakPolarHBondContact O-CA 3.48Å; Q224-Y266 WeakPolarHBondContact O-CB 3.41Å; Y266-D268 HydrophobicContact CE2-CB 4.25Å; Y266-I294 WeakPolarHBondContact O-CA 3.18Å; Y266-S295 VanDerWaalsContact CZ-OG 3.25Å; Y266-S295 PolarHBondContact N-O 2.67Å; Y266-S295 PolarHBondContact O-N 2.62Å; Y266-S295 VanDerWaalsContact O-N 3.1Å; Y266-S295 PolarHBondContact OH-OG 3.02Å; Y266-E297 HydrophobicContact CD1-CG 4.24Å; Y266-E297 HydrophobicContact CE1-CG 4.46Å
267	V	93	Very high	83.9	Confident	18 Å²	18	50.9 Å²	50.9	11%	0.109	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.8	168.4	-166.2	0	0	0	0	108.9	I34 R223 Q224 L226 M269 E293 I294	I34-V267 HydrophobicContact CD1-CG1 4.22Å; R223-V267 WeakPolarHBondContact CA-O 3.34Å; Q224-V267 HydrophobicContact CB-CB 4.41Å; Q224-V267 PolarHBondContact N-O 2.85Å; Q224-V267 PolarHBondContact O-N 2.79Å; L226-V267 HydrophobicContact CD2-CG2 3.46Å; L226-V267 VanDerWaalsContact CD2-CG2 3.46Å; L226-V267 HydrophobicContact CG-CG2 4.27Å; V267-M269 HydrophobicContact CB-SD 4.18Å; V267-M269 HydrophobicContact CG1-SD 3.74Å; V267-M269 PolarHBondContact O-N 2.69Å; V267-E293 CarbonylContact C-O 3.52Å; V267-E293 WeakPolarHBondContact CA-O 3.31Å; V267-I294 HydrophobicContact CG1-CG1 4.35Å; V267-I294 HydrophobicContact CG2-CD1 4.39Å; V267-I294 HydrophobicContact CG2-CG1 4.11Å
268	D	94.3	Very high	86.5	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	99.5	171.9	-167.7	-18.5	0	0	0	110	R152 Y266 G270 K291 G292 E293	R152-D268 IonicContact CZ-OD2 2.78Å; R152-D268 IonicContact NH1-OD2 3.73Å; R152-D268 IonicContact NH2-OD1 2.7Å; R152-D268 PolarHBondContact NH2-OD1 3.14Å; R152-D268 IonicContact NH2-OD2 3.91Å; R152-D268 PolarHBondContact NH2-OD2 2.93Å; Y266-D268 HydrophobicContact CE2-CB 4.25Å; D268-G270 PolarHBondContact O-N 2.96Å; D268-G270 PolarHBondContact OD1-N 2.94Å; D268-K291 HydrophobicContact CB-CD 4.3Å; D268-K291 WeakPolarHBondContact OD2-CD 3.28Å; D268-K291 IonicContact OD2-NZ 3.77Å; D268-G292 WeakPolarHBondContact O-CA 3.48Å; D268-G292 PolarHBondContact O-N 2.88Å; D268-E293 HydrophobicContact CB-CB 4.31Å; D268-E293 PolarHBondContact N-O 2.69Å
269	M	93	Very high	89	Confident	58 Å²	58	49.9 Å²	49.9	29%	0.286	25%	0.254	S	S	.	.			trans	-83.8	7.5	178	-57.4	-58.5	-68	0	0	113.1	I222 Q224 V267 I290	I222-M269 WeakPolarHBondContact O-CA 3.35Å; I222-M269 WeakPolarHBondContact O-CB 3.23Å; I222-M269 PolarHBondContact O-N 3.46Å; Q224-M269 HydrophobicContact CB-CG 4.11Å; V267-M269 HydrophobicContact CB-SD 4.18Å; V267-M269 HydrophobicContact CG1-SD 3.74Å; V267-M269 PolarHBondContact O-N 2.69Å; M269-I290 HydrophobicContact CB-CG2 4.48Å; M269-I290 HydrophobicContact CE-CD1 4.08Å; M269-I290 HydrophobicContact CE-CG2 4.44Å; M269-I290 HydrophobicContact SD-CG2 4.41Å
270	G	94.2	Very high	90.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.01	23%	0.228	C	C	.	.			trans	-63.6	143.9	177.4	0	0	0	0	0	113	R152 D268 I290 K291	R152-G270 CarbonylContact O-C 3.59Å; R152-G270 WeakPolarHBondContact O-CA 3.33Å; D268-G270 PolarHBondContact O-N 2.96Å; D268-G270 PolarHBondContact OD1-N 2.94Å; G270-I290 CarbonylContact O-C 3.48Å; G270-I290 WeakPolarHBondContact O-CA 3.37Å; G270-K291 PolarHBondContact O-N 2.83Å
271	L	94.7	Very high	91.1	Very high	11 Å²	11	46.4 Å²	46.4	6%	0.058	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-74.6	132.5	175	-64.3	175.6	0	0	0	111.2	V148 R152 L154 P275 L288 A289 I290	V148-L271 HydrophobicContact CG1-CB 3.99Å; V148-L271 HydrophobicContact CG2-CB 3.98Å; V148-L271 HydrophobicContact CG2-CD1 3.81Å; R152-L271 WeakPolarHBondContact CB-O 3.5Å; R152-L271 PolarHBondContact O-N 2.89Å; L154-L271 HydrophobicContact CB-CD1 4.02Å; L154-L271 HydrophobicContact CD1-CD1 4.05Å; L271-P275 HydrophobicContact CD1-CG 4.31Å; L271-L288 HydrophobicContact CD2-CB 4.09Å; L271-A289 CarbonylContact C-O 3.46Å; L271-A289 VanDerWaalsContact CA-O 3.25Å; L271-A289 WeakPolarHBondContact CA-O 3.21Å; L271-A289 WeakPolarHBondContact CD2-O 3.22Å; L271-I290 HydrophobicContact CD2-CG1 3.87Å
272	V	93.6	Very high	91.8	Very high	43 Å²	43	46.5 Å²	46.5	26%	0.261	24%	0.243	S	C	.	.	S	Bend	trans	-88.8	-27.2	174.3	-65.3	0	0	0	0	112.4	P32 A289 K291	P32-V272 HydrophobicContact CB-CG2 4.23Å; V272-A289 HydrophobicContact CG2-CB 3.77Å; V272-A289 WeakPolarHBondContact CG2-O 3.25Å; V272-A289 PolarHBondContact N-O 3.49Å; V272-K291 HydrophobicContact CG1-CB 3.68Å; V272-K291 HydrophobicContact CG1-CG 4.02Å
273	N	92.2	Very high	92.2	Very high	56 Å²	56	45 Å²	45	30%	0.299	24%	0.235	S	C	.	.	S	Bend	trans	-134.9	160.2	179.5	-69	-53.8	0	0	0	111.4	D30 V148 A289	D30-N273 PolarHBondContact O-ND2 2.72Å; V148-N273 WeakPolarHBondContact CG2-O 3.42Å; N273-A289 HydrophobicContact CB-CB 4.12Å
274	K	93.5	Very high	92.6	Very high	160 Å²	160	42.2 Å²	42.2	70%	0.696	23%	0.226	S	C	*	.			trans	-59.7	138.7	169	67.3	-178.6	-179.1	-179.3	0	111.6	V148 V276	V148-K274 HydrophobicContact CG2-CB 4.4Å; K274-V276 PolarHBondContact O-N 3.3Å
275	P	95.2	Very high	92.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.013	21%	0.21	C	C	.	.			trans	-55	136.9	172	-27.6	35.9	0	0	0	111.7	Q103 L146 L154 L271 L286 L287 L288	Q103-P275 PolarHBondContact NE2-O 3.16Å; L146-P275 HydrophobicContact CB-CB 3.89Å; L146-P275 HydrophobicContact CB-CG 3.95Å; L154-P275 HydrophobicContact CD1-CG 3.53Å; L271-P275 HydrophobicContact CD1-CG 4.31Å; P275-L286 HydrophobicContact CB-CD1 4.04Å; P275-L287 WeakPolarHBondContact CA-O 3.43Å; P275-L288 HydrophobicContact CB-CD2 3.85Å; P275-L288 HydrophobicContact CG-CD2 3.76Å
276	V	94.4	Very high	93	Very high	36 Å²	36	39.3 Å²	39.3	22%	0.218	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	143.2	-177.6	61	0	0	0	0	110.3	K274 I278 L287	K274-V276 PolarHBondContact O-N 3.3Å; V276-I278 HydrophobicContact CG1-CD1 4.22Å; V276-I278 HydrophobicContact CG1-CG1 4.11Å; V276-L287 HydrophobicContact CG1-CB 4.18Å; V276-L287 HydrophobicContact CG1-CD2 4.31Å; V276-L287 PolarHBondContact N-O 2.82Å; V276-L287 PolarHBondContact O-N 3.47Å
277	V	95.9	Very high	93.1	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.4	171.6	173.8	0	0	0	0	109.1	L96 R97 P98 Q99 Q103 K284 Y285 L286	L96-V277 HydrophobicContact CB-CG1 3.78Å; L96-V277 HydrophobicContact CB-CG2 4.1Å; L96-V277 HydrophobicContact CD2-CG2 4.38Å; R97-V277 WeakPolarHBondContact O-CB 3.14Å; P98-V277 WeakPolarHBondContact CA-O 3.48Å; P98-V277 HydrophobicContact CB-CG1 4.28Å; P98-V277 HydrophobicContact CG-CG1 4.06Å; Q99-V277 PolarHBondContact N-O 2.8Å; Q103-V277 HydrophobicContact CB-CG2 3.85Å; Q103-V277 HydrophobicContact CG-CG2 4.38Å; V277-K284 HydrophobicContact CG1-CD 4.24Å; V277-K284 HydrophobicContact CG1-CG 3.88Å; V277-Y285 CarbonylContact C-O 3.6Å; V277-Y285 VanDerWaalsContact CA-O 3.3Å; V277-Y285 WeakPolarHBondContact CA-O 3.47Å; V277-L286 HydrophobicContact CG2-CB 4.49Å; V277-L286 HydrophobicContact CG2-CD1 4Å
278	I	92.6	Very high	93.2	Very high	44 Å²	44	40 Å²	40	23%	0.226	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.7	-179.9	-59	179.6	0	0	0	108.8	V276 K284 Y285 L287	V276-I278 HydrophobicContact CG1-CD1 4.22Å; V276-I278 HydrophobicContact CG1-CG1 4.11Å; I278-K284 WeakPolarHBondContact O-CA 3.39Å; I278-Y285 HydrophobicContact CB-CD2 4.43Å; I278-Y285 HydrophobicContact CB-CE1 4.32Å; I278-Y285 HydrophobicContact CB-CE2 3.86Å; I278-Y285 HydrophobicContact CD1-CE2 4.05Å; I278-Y285 HydrophobicContact CG1-CE2 4.3Å; I278-Y285 HydrophobicContact CG2-CE1 4.33Å; I278-Y285 HydrophobicContact CG2-CE2 4.49Å; I278-Y285 PolarHBondContact N-O 3.42Å; I278-Y285 PolarHBondContact O-N 2.94Å; I278-L287 HydrophobicContact CD1-CB 4.18Å; I278-L287 HydrophobicContact CD1-CD2 3.63Å
279	L	92.3	Very high	93.2	Very high	109 Å²	109	40.1 Å²	40.1	57%	0.571	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.1	166.8	-179.6	61.7	0	0	0	108.3	P98 K284	P98-L279 HydrophobicContact CG-CB 4.35Å; L279-K284 HydrophobicContact CD1-CB 4.15Å
280	S	89.2	Confident	93.3	Very high	26 Å²	26	38 Å²	38	18%	0.182	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	86.6	177.7	-176.3	0	0	0	0	107.6	I283	S280-I283 CarbonylContact C-O 3.5Å; S280-I283 PolarHBondContact N-O 2.82Å; S280-I283 CarbonylContact O-C 3.2Å; S280-I283 VanDerWaalsContact O-CG1 3.3Å; S280-I283 WeakPolarHBondContact O-CG1 3.43Å; S280-I283 PolarHBondContact O-N 2.8Å
281	P	88.1	Confident	93.3	Very high	101 Å²	101	38.9 Å²	38.9	66%	0.656	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.8	135.9	-175.1	-28.8	36	0	0	0	111.6
282	P	90.2	Very high	93.3	Very high	62 Å²	62	38.3 Å²	38.3	40%	0.403	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.9	7.8	11.3	36.4	-37.1	0	0	0	115	G314 R316	P282-G314 WeakPolarHBondContact CD-O 3.36Å; P282-G314 WeakPolarHBondContact CG-O 3.36Å; P282-R316 HydrophobicContact CB-CG 3.75Å; P282-R316 HydrophobicContact CG-CG 3.94Å
283	I	91.4	Very high	93.4	Very high	14 Å²	14	36.4 Å²	36.4	7%	0.072	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	158.9	-174.3	64.1	163.1	0	0	0	113.3	T39 S280 Y285 K315 Y321	T39-I283 HydrophobicContact CG2-CD1 4.16Å; S280-I283 CarbonylContact C-O 3.5Å; S280-I283 PolarHBondContact N-O 2.82Å; S280-I283 CarbonylContact O-C 3.2Å; S280-I283 VanDerWaalsContact O-CG1 3.3Å; S280-I283 WeakPolarHBondContact O-CG1 3.43Å; S280-I283 PolarHBondContact O-N 2.8Å; I283-Y285 HydrophobicContact CD1-CD1 3.55Å; I283-Y285 HydrophobicContact CD1-CE1 4.01Å; I283-Y285 HydrophobicContact CG1-CD1 3.94Å; I283-Y285 HydrophobicContact CG1-CE1 4.34Å; I283-K315 WeakPolarHBondContact CG2-O 3.33Å; I283-Y321 HydrophobicContact CD1-CE2 4.17Å
284	K	93	Very high	93.6	Very high	52 Å²	52	34.3 Å²	34.3	23%	0.226	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.3	167.4	178.2	173.2	60.2	168.7	0	107	T39 N40 L96 P98 V277 I278 L279	T39-K284 CarbonylContact C-O 3.57Å; T39-K284 WeakPolarHBondContact CA-O 3.3Å; N40-K284 PolarHBondContact N-O 2.98Å; L96-K284 HydrophobicContact CB-CD 4.1Å; L96-K284 HydrophobicContact CB-CG 4.24Å; L96-K284 WeakPolarHBondContact O-CD 3.09Å; L96-K284 WeakPolarHBondContact O-CE 3.49Å; L96-K284 PolarHBondContact O-NZ 2.82Å; P98-K284 HydrophobicContact CG-CD 3.89Å; V277-K284 HydrophobicContact CG1-CD 4.24Å; V277-K284 HydrophobicContact CG1-CG 3.88Å; I278-K284 WeakPolarHBondContact O-CA 3.39Å; L279-K284 HydrophobicContact CD1-CB 4.15Å
285	Y	94.4	Very high	93.7	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.008	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	152.3	-174.1	60.6	-94.8	0	0	0	113.2	R37 I38 V277 I278 I283 L287	R37-Y285 HydrophobicContact CB-CD2 3.61Å; R37-Y285 HydrophobicContact CB-CE2 4.13Å; R37-Y285 HydrophobicContact CB-CG 3.92Å; R37-Y285 HydrophobicContact CG-CD2 3.76Å; R37-Y285 HydrophobicContact CG-CE2 3.74Å; R37-Y285 HydrophobicContact CG-CG 4.41Å; R37-Y285 PolarHBondContact NH1-OH 2.9Å; I38-Y285 CarbonylContact O-C 3.58Å; I38-Y285 WeakPolarHBondContact O-CA 3Å; I38-Y285 VanDerWaalsContact O-CB 3.3Å; I38-Y285 WeakPolarHBondContact O-CB 2.92Å; V277-Y285 CarbonylContact C-O 3.6Å; V277-Y285 VanDerWaalsContact CA-O 3.3Å; V277-Y285 WeakPolarHBondContact CA-O 3.47Å; I278-Y285 HydrophobicContact CB-CD2 4.43Å; I278-Y285 HydrophobicContact CB-CE1 4.32Å; I278-Y285 HydrophobicContact CB-CE2 3.86Å; I278-Y285 HydrophobicContact CD1-CE2 4.05Å; I278-Y285 HydrophobicContact CG1-CE2 4.3Å; I278-Y285 HydrophobicContact CG2-CE1 4.33Å; I278-Y285 HydrophobicContact CG2-CE2 4.49Å; I278-Y285 PolarHBondContact N-O 3.42Å; I278-Y285 PolarHBondContact O-N 2.94Å; I283-Y285 HydrophobicContact CD1-CD1 3.55Å; I283-Y285 HydrophobicContact CD1-CE1 4.01Å; I283-Y285 HydrophobicContact CG1-CD1 3.94Å; I283-Y285 HydrophobicContact CG1-CE1 4.34Å; Y285-L287 HydrophobicContact CD2-CB 4.25Å; Y285-L287 HydrophobicContact CE2-CB 4.03Å; Y285-L287 HydrophobicContact CE2-CD1 4.43Å
286	L	95.4	Very high	93.5	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	124.2	164.5	178.8	69.3	0	0	0	108.9	R37 I38 F43 Q103 L146 P275 V277 L288	R37-L286 WeakPolarHBondContact CA-O 3.29Å; I38-L286 PolarHBondContact N-O 3.1Å; I38-L286 PolarHBondContact O-N 3.41Å; F43-L286 HydrophobicContact CE2-CB 3.86Å; F43-L286 HydrophobicContact CE2-CD2 4.33Å; F43-L286 HydrophobicContact CZ-CB 4.19Å; F43-L286 HydrophobicContact CZ-CD2 3.84Å; Q103-L286 HydrophobicContact CB-CD1 4.34Å; Q103-L286 HydrophobicContact CG-CD1 4.45Å; L146-L286 HydrophobicContact CD2-CD2 3.79Å; P275-L286 HydrophobicContact CB-CD1 4.04Å; V277-L286 HydrophobicContact CG2-CB 4.49Å; V277-L286 HydrophobicContact CG2-CD1 4Å; L286-L288 HydrophobicContact CD2-CD2 4.45Å
287	L	94.4	Very high	93.2	Very high	29 Å²	29	30.7 Å²	30.7	15%	0.152	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124.2	176.4	179	63.5	0	0	0	110.6	A35 R37 P275 V276 I278 Y285	A35-L287 HydrophobicContact CB-CD1 3.89Å; R37-L287 HydrophobicContact CG-CD1 4.13Å; P275-L287 WeakPolarHBondContact CA-O 3.43Å; V276-L287 HydrophobicContact CG1-CB 4.18Å; V276-L287 HydrophobicContact CG1-CD2 4.31Å; V276-L287 PolarHBondContact N-O 2.82Å; V276-L287 PolarHBondContact O-N 3.47Å; I278-L287 HydrophobicContact CD1-CB 4.18Å; I278-L287 HydrophobicContact CD1-CD2 3.63Å; Y285-L287 HydrophobicContact CD2-CB 4.25Å; Y285-L287 HydrophobicContact CE2-CB 4.03Å; Y285-L287 HydrophobicContact CE2-CD1 4.43Å
288	L	94.6	Very high	92.8	Very high	26 Å²	26	38.2 Å²	38.2	14%	0.136	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	114.3	163.2	-52	176.9	0	0	0	108.2	V36 L154 L271 P275 L286	V36-L288 HydrophobicContact CB-CB 4.2Å; V36-L288 PolarHBondContact N-O 3.35Å; V36-L288 PolarHBondContact O-N 3.27Å; L154-L288 HydrophobicContact CD1-CD2 4.33Å; L271-L288 HydrophobicContact CD2-CB 4.09Å; P275-L288 HydrophobicContact CB-CD2 3.85Å; P275-L288 HydrophobicContact CG-CD2 3.76Å; L286-L288 HydrophobicContact CD2-CD2 4.45Å
289	A	94.9	Very high	92.7	Very high	5 Å²	5	37.9 Å²	37.9	4%	0.041	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	102.4	-179.6	0	0	0	0	0	109.2	P32 L271 V272 N273	P32-A289 HydrophobicContact CB-CB 3.87Å; P32-A289 HydrophobicContact CG-CB 4.08Å; L271-A289 CarbonylContact C-O 3.46Å; L271-A289 VanDerWaalsContact CA-O 3.25Å; L271-A289 WeakPolarHBondContact CA-O 3.21Å; L271-A289 WeakPolarHBondContact CD2-O 3.22Å; V272-A289 HydrophobicContact CG2-CB 3.77Å; V272-A289 WeakPolarHBondContact CG2-O 3.25Å; V272-A289 PolarHBondContact N-O 3.49Å; N273-A289 HydrophobicContact CB-CB 4.12Å
290	I	94.6	Very high	92.7	Very high	14 Å²	14	36.6 Å²	36.6	7%	0.072	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.6	-176.2	-63.1	168.7	0	0	0	109.6	P32 G33 I34 V36 M269 G270 L271	P32-I290 CarbonylContact C-O 3.58Å; P32-I290 WeakPolarHBondContact CA-O 3.43Å; P32-I290 WeakPolarHBondContact CB-O 3.38Å; G33-I290 PolarHBondContact N-O 2.94Å; I34-I290 HydrophobicContact CB-CB 4.08Å; I34-I290 HydrophobicContact CB-CG2 4.25Å; I34-I290 HydrophobicContact CG2-CD1 4.48Å; I34-I290 PolarHBondContact N-O 3.2Å; I34-I290 WeakPolarHBondContact O-CA 3.19Å; I34-I290 VanDerWaalsContact O-CB 3.29Å; I34-I290 WeakPolarHBondContact O-CB 3.22Å; I34-I290 PolarHBondContact O-N 3.3Å; I34-I290 VanDerWaalsContact O-O 3.05Å; V36-I290 HydrophobicContact CG2-CD1 3.82Å; M269-I290 HydrophobicContact CB-CG2 4.48Å; M269-I290 HydrophobicContact CE-CD1 4.08Å; M269-I290 HydrophobicContact CE-CG2 4.44Å; M269-I290 HydrophobicContact SD-CG2 4.41Å; G270-I290 CarbonylContact O-C 3.48Å; G270-I290 WeakPolarHBondContact O-CA 3.37Å; L271-I290 HydrophobicContact CD2-CG1 3.87Å
291	K	94.7	Very high	92.8	Very high	19 Å²	19	40.7 Å²	40.7	8%	0.083	23%	0.23	C	C	.	.			trans	-58.6	-50.3	-179.7	-168.6	-178.5	179.7	-158.7	0	111.6	G33 D268 G270 V272 E293 E301	G33-K291 WeakPolarHBondContact CA-O 3.46Å; G33-K291 PolarHBondContact N-O 3.35Å; D268-K291 HydrophobicContact CB-CD 4.3Å; D268-K291 WeakPolarHBondContact OD2-CD 3.28Å; D268-K291 IonicContact OD2-NZ 3.77Å; G270-K291 PolarHBondContact O-N 2.83Å; V272-K291 HydrophobicContact CG1-CB 3.68Å; V272-K291 HydrophobicContact CG1-CG 4.02Å; K291-E293 HydrophobicContact CD-CB 4.34Å; K291-E293 WeakPolarHBondContact CE-OE2 3.43Å; K291-E293 HydrophobicContact CG-CB 4.32Å; K291-E293 IonicContact NZ-OE2 3.12Å; K291-E293 PolarHBondContact NZ-OE2 2.95Å; K291-E293 PolarHBondContact O-N 2.8Å; K291-E301 IonicContact NZ-OE1 2.71Å; K291-E301 PolarHBondContact NZ-OE1 3.3Å; K291-E301 IonicContact NZ-OE2 2.78Å
292	G	94.5	Very high	93.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.201	C	C	.	.			trans	68.3	16.5	173.8	0	0	0	0	0	114.5	D268 P328	D268-G292 WeakPolarHBondContact O-CA 3.48Å; D268-G292 PolarHBondContact O-N 2.88Å; G292-P328 VanDerWaalsContact O-CA 3.3Å; G292-P328 WeakPolarHBondContact O-CA 3.49Å; G292-P328 WeakPolarHBondContact O-CB 3.45Å; G292-P328 WeakPolarHBondContact O-CG 3.39Å
293	E	96.1	Very high	93.3	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.009	20%	0.204	C	C	.	.			trans	-67.3	134.9	174.6	-172.3	174.9	172.5	0	0	109.8	V267 D268 K291 E301 A302 Y327 H335	V267-E293 CarbonylContact C-O 3.52Å; V267-E293 WeakPolarHBondContact CA-O 3.31Å; D268-E293 HydrophobicContact CB-CB 4.31Å; D268-E293 PolarHBondContact N-O 2.69Å; K291-E293 HydrophobicContact CD-CB 4.34Å; K291-E293 WeakPolarHBondContact CE-OE2 3.43Å; K291-E293 HydrophobicContact CG-CB 4.32Å; K291-E293 IonicContact NZ-OE2 3.12Å; K291-E293 PolarHBondContact NZ-OE2 2.95Å; K291-E293 PolarHBondContact O-N 2.8Å; E293-E301 WeakPolarHBondContact OE1-CA 3.36Å; E293-A302 PolarHBondContact OE1-N 3.19Å; E293-Y327 HydrophobicContact CB-CE1 3.77Å; E293-Y327 HydrophobicContact CG-CE1 4.24Å; E293-Y327 PolarHBondContact OE2-OH 2.65Å; E293-H335 IonicContact OE1-NE2 2.67Å
294	I	96.1	Very high	93.5	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.062	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.2	169.6	-59.6	-175.2	0	0	0	107.4	L226 F265 Y266 V267 P328 S331 M332 H335	L226-I294 HydrophobicContact CD1-CD1 4.49Å; L226-I294 HydrophobicContact CD1-CG2 3.57Å; L226-I294 HydrophobicContact CD2-CD1 4.37Å; L226-I294 HydrophobicContact CG-CG2 4.31Å; F265-I294 HydrophobicContact CD1-CG2 4.04Å; Y266-I294 WeakPolarHBondContact O-CA 3.18Å; V267-I294 HydrophobicContact CG1-CG1 4.35Å; V267-I294 HydrophobicContact CG2-CD1 4.39Å; V267-I294 HydrophobicContact CG2-CG1 4.11Å; I294-P328 WeakPolarHBondContact CB-O 3.23Å; I294-P328 HydrophobicContact CD1-CB 3.98Å; I294-P328 WeakPolarHBondContact CD1-O 3.36Å; I294-P328 HydrophobicContact CG1-CB 4.04Å; I294-P328 WeakPolarHBondContact CG1-O 3.34Å; I294-S331 PolarHBondContact N-OG 3.31Å; I294-S331 CarbonylContact O-C 3.57Å; I294-M332 HydrophobicContact CB-CB 3.81Å; I294-M332 HydrophobicContact CB-CG 4.48Å; I294-M332 HydrophobicContact CD1-CB 4.39Å; I294-M332 HydrophobicContact CG2-CB 3.57Å; I294-M332 HydrophobicContact CG2-CG 3.69Å; I294-M332 HydrophobicContact CG2-SD 4.26Å; I294-M332 PolarHBondContact O-N 2.9Å; I294-H335 PolarHBondContact O-CD2 3.45Å
295	S	94.9	Very high	93.4	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.028	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	166.3	-177.5	68.8	0	0	0	0	112.2	F265 Y266 H335	F265-S295 VanDerWaalsContact CA-O 3.32Å; F265-S295 WeakPolarHBondContact CA-O 3.45Å; Y266-S295 VanDerWaalsContact CZ-OG 3.25Å; Y266-S295 PolarHBondContact N-O 2.67Å; Y266-S295 PolarHBondContact O-N 2.62Å; Y266-S295 VanDerWaalsContact O-N 3.1Å; Y266-S295 PolarHBondContact OH-OG 3.02Å; S295-H335 VanDerWaalsContact CA-CD2 3.48Å; S295-H335 WeakPolarHBondContact CA-CD2 3.34Å; S295-H335 WeakPolarHBondContact CB-NE2 3.29Å
296	Q	91.3	Very high	93.4	Very high	35 Å²	35	38.1 Å²	38.1	16%	0.164	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	151	175.8	-171.8	164.2	-41.6	0	0	110.4	N264 F265 N298 S299 D339	N264-Q296 HydrophobicContact CB-CG 4.11Å; N264-Q296 CarbonylContact O-C 3.43Å; N264-Q296 WeakPolarHBondContact O-CA 3.43Å; F265-Q296 HydrophobicContact CD2-CB 4.44Å; F265-Q296 HydrophobicContact CD2-CG 4.49Å; F265-Q296 HydrophobicContact CE1-CB 4.42Å; F265-Q296 HydrophobicContact CE2-CB 4.17Å; F265-Q296 HydrophobicContact CE2-CG 4.26Å; F265-Q296 VanDerWaalsContact CE2-OE1 3.24Å; F265-Q296 HydrophobicContact CZ-CB 4.16Å; Q296-N298 PolarHBondContact O-N 3.03Å; Q296-S299 PolarHBondContact N-OG 3.01Å; Q296-S299 PolarHBondContact O-N 2.9Å; Q296-S299 PolarHBondContact O-OG 2.95Å; Q296-D339 PolarHBondContact NE2-OD2 2.96Å; Q296-D339 PolarHBondContact OE1-OD2 3.46Å
297	E	88.6	Confident	93.1	Very high	84 Å²	84	42.7 Å²	42.7	39%	0.393	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	128.5	170.9	-73.1	-175.1	176	0	0	110.9	R234 N264 Y266 S299	R234-E297 IonicContact NH2-OE2 3.74Å; N264-E297 PolarHBondContact O-N 3.38Å; Y266-E297 HydrophobicContact CD1-CG 4.24Å; Y266-E297 HydrophobicContact CE1-CG 4.46Å; E297-S299 VanDerWaalsContact C-N 3.26Å; E297-S299 PolarHBondContact O-N 3.01Å
298	N	87.3	Confident	92.7	Very high	159 Å²	159	51 Å²	51	85%	0.85	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	13.2	178.3	-43.9	-55	0	0	0	116	Q296	Q296-N298 PolarHBondContact O-N 3.03Å
299	S	90.5	Very high	91.9	Very high	36 Å²	36	51.4 Å²	51.4	25%	0.252	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-79.9	152.2	169	69.6	0	0	0	0	111.5	Q296 E297 H335	Q296-S299 PolarHBondContact N-OG 3.01Å; Q296-S299 PolarHBondContact O-N 2.9Å; Q296-S299 PolarHBondContact O-OG 2.95Å; E297-S299 VanDerWaalsContact C-N 3.26Å; E297-S299 PolarHBondContact O-N 3.01Å; S299-H335 PolarHBondContact OG-CE1 3.05Å; S299-H335 PolarHBondContact OG-ND1 2.77Å
300	A	92.4	Very high	90.8	Very high	83 Å²	83	53.7 Å²	53.7	69%	0.686	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-62.1	160.8	164.6	0	0	0	0	0	110.5	H335	A300-H335 PolarHBondContact O-CE1 3Å
301	E	91.7	Very high	89.6	Confident	111 Å²	111	58.4 Å²	58.4	52%	0.519	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-65.7	151.3	174.8	-60.6	-170.8	159	0	0	111	K291 E293	K291-E301 IonicContact NZ-OE1 2.71Å; K291-E301 PolarHBondContact NZ-OE1 3.3Å; K291-E301 IonicContact NZ-OE2 2.78Å; E293-E301 WeakPolarHBondContact OE1-CA 3.36Å
302	A	94	Very high	88.4	Confident	5 Å²	5	60.2 Å²	60.2	4%	0.041	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-57.6	137.3	172.2	0	0	0	0	0	110.8	E293 F304 Y334	E293-A302 PolarHBondContact OE1-N 3.19Å; A302-F304 HydrophobicContact CB-CD1 4.3Å; A302-F304 HydrophobicContact CB-CE1 3.9Å; A302-F304 HydrophobicContact CB-CE2 4.17Å; A302-F304 HydrophobicContact CB-CZ 3.83Å; A302-F304 PolarHBondContact O-N 2.72Å; A302-Y334 HydrophobicContact CB-CD1 4.11Å
303	P	94.7	Very high	87.3	Confident	71 Å²	71	64.9 Å²	64.9	46%	0.461	35%	0.348	S	S	.	.	S	Bend	trans	-77.8	22.8	-173.2	33.7	-38.1	0	0	0	113.5	Y334	P303-Y334 HydrophobicContact CG-CE1 4.48Å; P303-Y334 HydrophobicContact CG-CE2 3.83Å
304	F	94.4	Very high	86.6	Confident	19 Å²	19	65.1 Å²	65.1	8%	0.083	35%	0.351	C	S	.	.	S	Bend	trans	-144.1	167.5	-178.9	54.4	-96.6	0	0	0	110	F23 A302 Y327 N330 Y334	F23-F304 HydrophobicContact CB-CB 4.33Å; F23-F304 HydrophobicContact CD1-CB 3.6Å; F23-F304 AromaticContact CD1-CD1 3.66Å; F23-F304 HydrophobicContact CD1-CD1 3.66Å; F23-F304 AromaticContact CD1-CG 3.81Å; F23-F304 HydrophobicContact CD1-CG 3.81Å; F23-F304 HydrophobicContact CE1-CB 4.33Å; F23-F304 AromaticContact CE1-CD1 3.71Å; F23-F304 HydrophobicContact CE1-CD1 3.71Å; F23-F304 HydrophobicContact CE1-CE1 4.21Å; F23-F304 HydrophobicContact CE1-CG 4.06Å; F23-F304 HydrophobicContact CG-CB 4.32Å; F23-F304 HydrophobicContact CG-CD1 4.34Å; F23-F304 HydrophobicContact CZ-CD1 4.45Å; A302-F304 HydrophobicContact CB-CD1 4.3Å; A302-F304 HydrophobicContact CB-CE1 3.9Å; A302-F304 HydrophobicContact CB-CE2 4.17Å; A302-F304 HydrophobicContact CB-CZ 3.83Å; A302-F304 PolarHBondContact O-N 2.72Å; F304-Y327 AromaticContact CD2-CD2 3.7Å; F304-Y327 HydrophobicContact CD2-CD2 3.7Å; F304-Y327 AromaticContact CD2-CE2 3.67Å; F304-Y327 HydrophobicContact CD2-CE2 3.67Å; F304-Y327 AromaticContact CE2-CD2 3.7Å; F304-Y327 HydrophobicContact CE2-CD2 3.7Å; F304-Y327 AromaticContact CE2-CE2 3.74Å; F304-Y327 HydrophobicContact CE2-CE2 3.74Å; F304-Y327 VanDerWaalsContact O-CE2 3.3Å; F304-Y327 WeakPolarHBondContact O-CE2 3.47Å; F304-N330 HydrophobicContact CE2-CB 3.91Å; F304-N330 HydrophobicContact CZ-CB 4.1Å; F304-Y334 HydrophobicContact CE1-CD2 4.09Å; F304-Y334 AromaticContact CE1-CG 3.96Å; F304-Y334 HydrophobicContact CE1-CG 3.96Å; F304-Y334 HydrophobicContact CZ-CG 4.47Å
305	H	92.2	Very high	86.1	Confident	73 Å²	73	68.2 Å²	68.2	34%	0.338	36%	0.364	S	S	.	.			trans	-128.4	162.2	-174.3	-59.2	-60.2	0	0	0	112.1	K307	H305-K307 PolarHBondContact O-N 3.11Å
306	P	93.2	Very high	85.7	Confident	9 Å²	9	77.9 Å²	77.9	6%	0.058	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-57.6	134.5	174.3	-21.7	31.2	0	0	0	112.3	N31 Y327	N31-P306 HydrophobicContact CB-CB 3.98Å; N31-P306 VanDerWaalsContact CB-O 3.3Å; N31-P306 WeakPolarHBondContact CB-O 3.46Å; N31-P306 PolarHBondContact ND2-O 3.35Å; N31-P306 WeakPolarHBondContact O-CG 3.41Å; P306-Y327 HydrophobicContact CB-CD1 4.48Å; P306-Y327 HydrophobicContact CB-CG 4.13Å; P306-Y327 HydrophobicContact CG-CD1 3.55Å; P306-Y327 HydrophobicContact CG-CD2 4.01Å; P306-Y327 HydrophobicContact CG-CE1 3.91Å; P306-Y327 HydrophobicContact CG-CE2 4.39Å; P306-Y327 HydrophobicContact CG-CG 3.56Å
307	K	90.7	Very high	85.7	Confident	101 Å²	101	78 Å²	78	44%	0.439	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-71.8	157.2	171.1	-66.9	173.7	-175.7	164.7	0	110.1	H305 I309	H305-K307 PolarHBondContact O-N 3.11Å; K307-I309 PolarHBondContact O-N 3.4Å
308	R	84.3	Confident	85.9	Confident	202 Å²	202	74.9 Å²	74.9	76%	0.762	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-61.4	135.8	171.3	-72.4	-172.6	178.7	-164.9	1.7	110.2	N31 N515	N31-R308 WeakPolarHBondContact ND2-CG 3.33Å; N31-R308 PolarHBondContact ND2-N 3.35Å; R308-N515 PolarHBondContact O-ND2 2.88Å; R308-N515 VanDerWaalsContact O-ND2 3.16Å
309	I	79.1	Confident	86.3	Confident	35 Å²	35	68.2 Å²	68.2	18%	0.179	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-92.9	135.5	175.4	-42.7	176.4	0	0	0	108.2	K307 N311 V323 T325 A516 W518	K307-I309 PolarHBondContact O-N 3.4Å; I309-N311 PolarHBondContact O-N 2.78Å; I309-V323 HydrophobicContact CD1-CG1 3.72Å; I309-V323 HydrophobicContact CG2-CG1 4.12Å; I309-T325 HydrophobicContact CD1-CG2 3.21Å; I309-T325 HydrophobicContact CG1-CG2 3.47Å; I309-T325 VanDerWaalsContact CG1-CG2 3.47Å; I309-A516 HydrophobicContact CD1-CB 4.44Å; I309-A516 HydrophobicContact CG2-CB 3.6Å; I309-W518 HydrophobicContact CG2-CZ2 4.09Å
310	A	70.7	Confident	86.4	Confident	54 Å²	54	67.2 Å²	67.2	45%	0.446	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-62.8	132.1	167.9	0	0	0	0	0	109.3	L312 W518	A310-L312 PolarHBondContact O-N 3.46Å; A310-L312 VanDerWaalsContact O-N 3.08Å; A310-W518 WeakPolarHBondContact O-CZ2 3.41Å
311	N	70.1	Confident	86.5	Confident	112 Å²	112	63.4 Å²	63.4	60%	0.599	32%	0.321	S	S	*	.			trans	-70.5	107.7	172.8	-83.6	-35.5	0	0	0	109	R37 I309	R37-N311 PolarHBondContact NH2-OD1 3.34Å; I309-N311 PolarHBondContact O-N 2.78Å
312	L	69.7	Low	86.6	Confident	58 Å²	58	59.3 Å²	59.3	30%	0.304	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-72.7	136.4	163.9	-65.3	-174.4	0	0	0	109.1	A310 G314 A513 W518	A310-L312 PolarHBondContact O-N 3.46Å; A310-L312 VanDerWaalsContact O-N 3.08Å; L312-G314 PolarHBondContact O-N 2.86Å; L312-A513 HydrophobicContact CD1-CB 4.07Å; L312-A513 HydrophobicContact CG-CB 4.47Å; L312-W518 HydrophobicContact CB-CD2 4.26Å; L312-W518 HydrophobicContact CB-CE3 4.22Å; L312-W518 HydrophobicContact CB-CH2 3.76Å; L312-W518 HydrophobicContact CB-CZ2 3.8Å; L312-W518 HydrophobicContact CB-CZ3 3.98Å; L312-W518 HydrophobicContact CD1-CB 4.44Å; L312-W518 HydrophobicContact CD1-CD2 3.6Å; L312-W518 HydrophobicContact CD1-CE3 4.22Å; L312-W518 HydrophobicContact CD1-CG 3.66Å; L312-W518 HydrophobicContact CD1-CZ2 4.21Å; L312-W518 HydrophobicContact CG-CD2 4.09Å; L312-W518 HydrophobicContact CG-CH2 4.25Å; L312-W518 HydrophobicContact CG-CZ2 3.76Å
313	P	71.8	Confident	86.6	Confident	98 Å²	98	59 Å²	59	64%	0.636	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-61.1	128.8	170.7	25.3	-31.2	0	0	0	108.7
314	G	80.1	Confident	86.5	Confident	6 Å²	6	57.9 Å²	57.9	6%	0.062	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-66	150.2	174.3	0	0	0	0	0	111.4	P282 L312	P282-G314 WeakPolarHBondContact CD-O 3.36Å; P282-G314 WeakPolarHBondContact CG-O 3.36Å; L312-G314 PolarHBondContact O-N 2.86Å
315	K	86.8	Confident	86.6	Confident	77 Å²	77	57 Å²	57	34%	0.335	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-84.3	140.9	166.9	-58.6	-178.6	-171.5	175.5	0	109.8	I283 V318 Y321 E509 M520	I283-K315 WeakPolarHBondContact CG2-O 3.33Å; K315-V318 HydrophobicContact CB-CG2 3.95Å; K315-Y321 PolarHBondContact N-OH 2.81Å; K315-Y321 PolarHBondContact O-OH 2.85Å; K315-Y321 VanDerWaalsContact O-OH 3.08Å; K315-E509 VanDerWaalsContact NZ-CD 3.26Å; K315-E509 IonicContact NZ-OE1 2.72Å; K315-E509 PolarHBondContact NZ-OE1 3.44Å; K315-E509 IonicContact NZ-OE2 2.72Å; K315-E509 PolarHBondContact NZ-OE2 2.82Å; K315-M520 HydrophobicContact CD-SD 4.44Å
316	R	85.8	Confident	86.7	Confident	207 Å²	207	53.7 Å²	53.7	78%	0.781	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	147.7	168.1	-69.2	-175.4	177.4	174.6	1.6	109.6	P282 V318	P282-R316 HydrophobicContact CB-CG 3.75Å; P282-R316 HydrophobicContact CG-CG 3.94Å; R316-V318 VanDerWaalsContact C-N 3.3Å; R316-V318 PolarHBondContact O-N 3.18Å
317	G	90.5	Very high	86.9	Confident	37 Å²	37	53.6 Å²	53.6	38%	0.381	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-24.2	177.9	0	0	0	0	0	115.7	H41 M319	H41-G317 PolarHBondContact CE1-O 3.34Å; H41-G317 VanDerWaalsContact CE1-O 3.25Å; H41-G317 PolarHBondContact ND1-O 3.15Å; G317-M319 PolarHBondContact O-N 3.18Å
318	V	93.8	Very high	87.1	Confident	20 Å²	20	49 Å²	49	12%	0.121	25%	0.249	C	C	.	.			trans	-71.1	127.1	177.7	177.8	0	0	0	0	110.4	T39 K315 R316 L320 Y321 M520	T39-V318 WeakPolarHBondContact CB-O 3.3Å; T39-V318 VanDerWaalsContact CG2-O 3.23Å; T39-V318 WeakPolarHBondContact CG2-O 3.48Å; T39-V318 PolarHBondContact OG1-O 2.8Å; K315-V318 HydrophobicContact CB-CG2 3.95Å; R316-V318 VanDerWaalsContact C-N 3.3Å; R316-V318 PolarHBondContact O-N 3.18Å; V318-L320 WeakPolarHBondContact CG1-O 3.28Å; V318-Y321 HydrophobicContact CB-CE2 3.75Å; V318-Y321 WeakPolarHBondContact CB-OH 3.25Å; V318-Y321 HydrophobicContact CG1-CD2 4.03Å; V318-Y321 HydrophobicContact CG1-CE1 4.31Å; V318-Y321 HydrophobicContact CG1-CE2 3.44Å; V318-Y321 VanDerWaalsContact CG1-CE2 3.44Å; V318-M520 HydrophobicContact CG1-CB 4.03Å
319	M	95	Very high	87.6	Confident	19 Å²	19	42.1 Å²	42.1	9%	0.094	23%	0.227	C	C	.	.			trans	-79.8	-34.9	-178.4	-62.1	-178	-179.1	0	0	114	T39 H41 Y45 G317 A521 D522 I523	T39-M319 PolarHBondContact N-O 2.8Å; T39-M319 WeakPolarHBondContact OG1-CA 3.35Å; T39-M319 PolarHBondContact OG1-O 2.98Å; H41-M319 VanDerWaalsContact CE1-CE 3.49Å; H41-M319 WeakPolarHBondContact CE1-CE 3.46Å; H41-M319 VanDerWaalsContact ND1-CG 3.34Å; H41-M319 WeakPolarHBondContact ND1-CG 3.05Å; Y45-M319 HydrophobicContact CD1-SD 3.98Å; Y45-M319 HydrophobicContact CD2-CE 3.98Å; Y45-M319 HydrophobicContact CD2-SD 4.47Å; Y45-M319 HydrophobicContact CG-CE 3.74Å; Y45-M319 HydrophobicContact CG-SD 3.79Å; G317-M319 PolarHBondContact O-N 3.18Å; M319-A521 PolarHBondContact N-O 3.28Å; M319-D522 HydrophobicContact CG-CB 4.37Å; M319-D522 WeakPolarHBondContact CG-OD1 3.35Å; M319-D522 PolarHBondContact N-OD1 3.27Å; M319-D522 HydrophobicContact SD-CB 4.09Å; M319-I523 HydrophobicContact CB-CG1 4.12Å; M319-I523 HydrophobicContact SD-CG1 3.65Å
320	L	93.9	Very high	88.5	Confident	15 Å²	15	41.3 Å²	41.3	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.6	-169.3	-177.7	62.6	0	0	0	111.9	V36 R37 I38 V318 I322 F505 M520 A521 I523	V36-L320 HydrophobicContact CG1-CD1 3.64Å; R37-L320 WeakPolarHBondContact O-CA 3.48Å; I38-L320 HydrophobicContact CG1-CD1 3.98Å; V318-L320 WeakPolarHBondContact CG1-O 3.28Å; L320-I322 HydrophobicContact CG-CG1 4.42Å; L320-F505 HydrophobicContact CD2-CD1 4.13Å; L320-F505 HydrophobicContact CD2-CE1 3.52Å; L320-M520 WeakPolarHBondContact O-CA 3.33Å; L320-A521 PolarHBondContact N-O 3.28Å; L320-A521 PolarHBondContact O-N 2.87Å; L320-I523 HydrophobicContact CB-CG2 3.89Å; L320-I523 HydrophobicContact CD2-CG2 3.66Å; L320-I523 HydrophobicContact CG-CG2 4.43Å
321	Y	94.1	Very high	89.8	Confident	3 Å²	3	38.7 Å²	38.7	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.7	167.5	-59	-110.3	0	0	0	109.9	V36 R37 T39 I283 K315 V318 W518 L519 M520	V36-Y321 CarbonylContact C-O 3.58Å; V36-Y321 WeakPolarHBondContact CA-O 3.46Å; R37-Y321 HydrophobicContact CB-CD2 4.41Å; R37-Y321 PolarHBondContact N-O 2.74Å; R37-Y321 PolarHBondContact O-N 2.92Å; T39-Y321 HydrophobicContact CG2-CD2 3.8Å; T39-Y321 HydrophobicContact CG2-CE2 3.57Å; I283-Y321 HydrophobicContact CD1-CE2 4.17Å; K315-Y321 PolarHBondContact N-OH 2.81Å; K315-Y321 PolarHBondContact O-OH 2.85Å; K315-Y321 VanDerWaalsContact O-OH 3.08Å; V318-Y321 HydrophobicContact CB-CE2 3.75Å; V318-Y321 WeakPolarHBondContact CB-OH 3.25Å; V318-Y321 HydrophobicContact CG1-CD2 4.03Å; V318-Y321 HydrophobicContact CG1-CE1 4.31Å; V318-Y321 HydrophobicContact CG1-CE2 3.44Å; V318-Y321 VanDerWaalsContact CG1-CE2 3.44Å; Y321-W518 HydrophobicContact CD1-CE3 4.03Å; Y321-W518 HydrophobicContact CD1-CZ3 4.27Å; Y321-L519 CarbonylContact C-O 3.42Å; Y321-L519 VanDerWaalsContact CA-O 3.25Å; Y321-L519 WeakPolarHBondContact CA-O 3.31Å; Y321-M520 HydrophobicContact CD1-CB 4.49Å; Y321-M520 HydrophobicContact CD1-CG 3.51Å; Y321-M520 HydrophobicContact CD1-SD 4.33Å; Y321-M520 HydrophobicContact CE1-CB 4.43Å; Y321-M520 HydrophobicContact CE1-CG 3.46Å; Y321-M520 VanDerWaalsContact CE1-CG 3.46Å; Y321-M520 HydrophobicContact CE1-SD 3.77Å; Y321-M520 HydrophobicContact CG-CG 4.46Å
322	I	93.2	Very high	91.1	Very high	24 Å²	24	34.9 Å²	34.9	12%	0.123	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	111.8	167.8	-56.1	174.8	0	0	0	106.7	I34 V36 L320 I324 F505 L519	I34-I322 HydrophobicContact CG2-CG2 4.09Å; V36-I322 HydrophobicContact CG2-CG1 4.48Å; L320-I322 HydrophobicContact CG-CG1 4.42Å; I322-I324 HydrophobicContact CG2-CD1 4.35Å; I322-I324 HydrophobicContact CG2-CG1 3.98Å; I322-F505 HydrophobicContact CD1-CE1 3.73Å; I322-F505 HydrophobicContact CD1-CZ 3.66Å; I322-L519 HydrophobicContact CB-CB 4.18Å; I322-L519 HydrophobicContact CB-CD1 4.45Å; I322-L519 PolarHBondContact N-O 3.32Å; I322-L519 WeakPolarHBondContact O-CB 3.48Å; I322-L519 PolarHBondContact O-N 2.89Å
323	V	93.7	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.9	179.6	-169.1	0	0	0	0	107.9	I34 A35 I309 A516 V517 W518	I34-V323 CarbonylContact C-O 3.5Å; I34-V323 VanDerWaalsContact CA-O 3.28Å; I34-V323 WeakPolarHBondContact CA-O 3.37Å; A35-V323 HydrophobicContact CB-CB 4.21Å; A35-V323 PolarHBondContact N-O 3.01Å; A35-V323 PolarHBondContact O-N 3.27Å; I309-V323 HydrophobicContact CD1-CG1 3.72Å; I309-V323 HydrophobicContact CG2-CG1 4.12Å; V323-A516 HydrophobicContact CG1-CB 3.78Å; V323-V517 WeakPolarHBondContact CA-O 3.36Å; V323-W518 HydrophobicContact CB-CD2 4.46Å; V323-W518 HydrophobicContact CG1-CD2 3.99Å; V323-W518 HydrophobicContact CG1-CG 4.28Å; V323-W518 HydrophobicContact CG1-CZ2 4.03Å; V323-W518 HydrophobicContact CG2-CD2 3.72Å; V323-W518 HydrophobicContact CG2-CE3 3.51Å; V323-W518 HydrophobicContact CG2-CG 4.46Å; V323-W518 HydrophobicContact CG2-CH2 3.96Å; V323-W518 HydrophobicContact CG2-CZ2 4.13Å; V323-W518 HydrophobicContact CG2-CZ3 3.65Å
324	I	93.9	Very high	93.6	Very high	47 Å²	47	30.2 Å²	30.2	24%	0.241	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115.7	-178.5	-54.6	177.4	0	0	0	107	I34 I322 P328 A516 V517 L519	I34-I324 HydrophobicContact CG1-CG2 4.41Å; I322-I324 HydrophobicContact CG2-CD1 4.35Å; I322-I324 HydrophobicContact CG2-CG1 3.98Å; I324-P328 HydrophobicContact CG2-CG 3.95Å; I324-A516 CarbonylContact O-C 3.5Å; I324-A516 VanDerWaalsContact O-CA 3.29Å; I324-A516 WeakPolarHBondContact O-CA 3.12Å; I324-V517 PolarHBondContact N-O 2.88Å; I324-V517 PolarHBondContact O-N 3.14Å; I324-L519 HydrophobicContact CD1-CD1 3.94Å
325	T	95.3	Very high	94.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	175.8	177.2	59.6	0	0	0	0	112.1	G33 I309 Y327 P328 F398 N515	G33-T325 WeakPolarHBondContact CA-OG1 3.46Å; G33-T325 PolarHBondContact O-N 3.07Å; G33-T325 PolarHBondContact O-OG1 3.17Å; I309-T325 HydrophobicContact CD1-CG2 3.21Å; I309-T325 HydrophobicContact CG1-CG2 3.47Å; I309-T325 VanDerWaalsContact CG1-CG2 3.47Å; T325-Y327 PolarHBondContact O-N 2.87Å; T325-Y327 WeakPolarHBondContact OG1-CB 3.41Å; T325-Y327 PolarHBondContact OG1-N 3.36Å; T325-P328 WeakPolarHBondContact O-CD 3.23Å; T325-P328 VanDerWaalsContact OG1-CD 3.23Å; T325-P328 WeakPolarHBondContact OG1-CD 3.43Å; T325-F398 WeakPolarHBondContact O-CE2 3.27Å; T325-N515 CarbonylContact C-O 3.57Å; T325-N515 WeakPolarHBondContact CA-O 3.44Å; T325-N515 WeakPolarHBondContact CB-O 3.43Å
326	D	95.4	Very high	94.8	Very high	4 Å²	4	27 Å²	27	2%	0.021	13%	0.133	C	C	.	.	S	Bend	trans	-70.4	-13.8	167.1	58.5	10.7	0	0	0	113.1	I329 N330 F398 N515	D326-I329 PolarHBondContact O-N 3.3Å; D326-N330 WeakPolarHBondContact O-CB 3.43Å; D326-N330 PolarHBondContact O-N 3.33Å; D326-N330 PolarHBondContact O-ND2 3.25Å; D326-F398 HydrophobicContact CB-CD2 3.82Å; D326-F398 HydrophobicContact CB-CE2 4.13Å; D326-F398 HydrophobicContact CB-CG 4.14Å; D326-N515 PolarHBondContact N-O 2.88Å
327	Y	96.8	Very high	95.2	Very high	6 Å²	6	19.6 Å²	19.6	2%	0.024	11%	0.105	C	C	.	.	H	α-helix	trans	-61.6	-46.8	-177.9	172	-98	0	0	0	115.5	E293 F304 P306 T325 I329 N330 S331	E293-Y327 HydrophobicContact CB-CE1 3.77Å; E293-Y327 HydrophobicContact CG-CE1 4.24Å; E293-Y327 PolarHBondContact OE2-OH 2.65Å; F304-Y327 AromaticContact CD2-CD2 3.7Å; F304-Y327 HydrophobicContact CD2-CD2 3.7Å; F304-Y327 AromaticContact CD2-CE2 3.67Å; F304-Y327 HydrophobicContact CD2-CE2 3.67Å; F304-Y327 AromaticContact CE2-CD2 3.7Å; F304-Y327 HydrophobicContact CE2-CD2 3.7Å; F304-Y327 AromaticContact CE2-CE2 3.74Å; F304-Y327 HydrophobicContact CE2-CE2 3.74Å; F304-Y327 VanDerWaalsContact O-CE2 3.3Å; F304-Y327 WeakPolarHBondContact O-CE2 3.47Å; P306-Y327 HydrophobicContact CB-CD1 4.48Å; P306-Y327 HydrophobicContact CB-CG 4.13Å; P306-Y327 HydrophobicContact CG-CD1 3.55Å; P306-Y327 HydrophobicContact CG-CD2 4.01Å; P306-Y327 HydrophobicContact CG-CE1 3.91Å; P306-Y327 HydrophobicContact CG-CE2 4.39Å; P306-Y327 HydrophobicContact CG-CG 3.56Å; T325-Y327 PolarHBondContact O-N 2.87Å; T325-Y327 WeakPolarHBondContact OG1-CB 3.41Å; T325-Y327 PolarHBondContact OG1-N 3.36Å; Y327-I329 VanDerWaalsContact C-N 3.26Å; Y327-I329 PolarHBondContact O-N 3.38Å; Y327-N330 PolarHBondContact O-N 3.08Å; Y327-S331 WeakPolarHBondContact O-CB 3.43Å; Y327-S331 PolarHBondContact O-N 2.78Å; Y327-S331 PolarHBondContact O-OG 3.08Å
328	P	95.9	Very high	95.4	Very high	5 Å²	5	23 Å²	23	3%	0.032	11%	0.111	C	C	.	.	H	α-helix	trans	-51.2	-44.4	173.8	-26.3	28.4	0	0	0	113.1	I34 G292 I294 I324 T325 S331 M332	I34-P328 HydrophobicContact CG1-CG 4.12Å; G292-P328 VanDerWaalsContact O-CA 3.3Å; G292-P328 WeakPolarHBondContact O-CA 3.49Å; G292-P328 WeakPolarHBondContact O-CB 3.45Å; G292-P328 WeakPolarHBondContact O-CG 3.39Å; I294-P328 WeakPolarHBondContact CB-O 3.23Å; I294-P328 HydrophobicContact CD1-CB 3.98Å; I294-P328 WeakPolarHBondContact CD1-O 3.36Å; I294-P328 HydrophobicContact CG1-CB 4.04Å; I294-P328 WeakPolarHBondContact CG1-O 3.34Å; I324-P328 HydrophobicContact CG2-CG 3.95Å; T325-P328 WeakPolarHBondContact O-CD 3.23Å; T325-P328 VanDerWaalsContact OG1-CD 3.23Å; T325-P328 WeakPolarHBondContact OG1-CD 3.43Å; P328-S331 WeakPolarHBondContact CA-OG 3.49Å; P328-S331 PolarHBondContact O-OG 2.78Å; P328-M332 PolarHBondContact O-N 3.22Å; P328-M332 VanDerWaalsContact O-N 3.16Å
329	I	95	Very high	95.3	Very high	57 Å²	57	25.8 Å²	25.8	29%	0.292	13%	0.126	S	C	.	.	H	α-helix	trans	-73.2	-40.4	-179.8	-56.9	-56.5	0	0	0	111	D326 Y327 M332 L333 A396 F398	D326-I329 PolarHBondContact O-N 3.3Å; Y327-I329 VanDerWaalsContact C-N 3.26Å; Y327-I329 PolarHBondContact O-N 3.38Å; I329-M332 HydrophobicContact CD1-CE 4.44Å; I329-M332 HydrophobicContact CG2-CE 4.39Å; I329-M332 WeakPolarHBondContact O-CB 3.42Å; I329-M332 PolarHBondContact O-N 2.95Å; I329-L333 HydrophobicContact CG2-CD1 3.99Å; I329-L333 HydrophobicContact CG2-CG 4.35Å; I329-L333 VanDerWaalsContact O-CG 3.29Å; I329-L333 WeakPolarHBondContact O-CG 3.46Å; I329-L333 PolarHBondContact O-N 3.41Å; I329-A396 HydrophobicContact CB-CB 4.22Å; I329-A396 HydrophobicContact CG2-CB 3.66Å; I329-F398 HydrophobicContact CG1-CZ 4.34Å
330	N	97.9	Very high	95.2	Very high	18 Å²	18	26.1 Å²	26.1	10%	0.096	13%	0.133	C	C	.	.	H	α-helix	trans	-65.3	-40.2	177.8	-77.1	-43.6	0	0	0	112.9	F304 D326 Y327 L333 Y334 A396	F304-N330 HydrophobicContact CE2-CB 3.91Å; F304-N330 HydrophobicContact CZ-CB 4.1Å; D326-N330 WeakPolarHBondContact O-CB 3.43Å; D326-N330 PolarHBondContact O-N 3.33Å; D326-N330 PolarHBondContact O-ND2 3.25Å; Y327-N330 PolarHBondContact O-N 3.08Å; N330-L333 PolarHBondContact O-N 2.96Å; N330-Y334 WeakPolarHBondContact O-CB 3.48Å; N330-Y334 PolarHBondContact O-N 2.98Å; N330-A396 PolarHBondContact ND2-O 3.18Å; N330-A396 PolarHBondContact OD1-N 3.15Å; N330-A396 PolarHBondContact OD1-O 2.82Å
331	S	97.9	Very high	95.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.9	-42.8	174.1	46.8	0	0	0	0	111.3	I294 Y327 P328 L333 Y334 H335	I294-S331 PolarHBondContact N-OG 3.31Å; I294-S331 CarbonylContact O-C 3.57Å; Y327-S331 WeakPolarHBondContact O-CB 3.43Å; Y327-S331 PolarHBondContact O-N 2.78Å; Y327-S331 PolarHBondContact O-OG 3.08Å; P328-S331 WeakPolarHBondContact CA-OG 3.49Å; P328-S331 PolarHBondContact O-OG 2.78Å; S331-L333 PolarHBondContact O-N 3.42Å; S331-Y334 WeakPolarHBondContact O-CB 3.43Å; S331-Y334 PolarHBondContact O-N 2.85Å; S331-H335 PolarHBondContact O-CD2 2.89Å; S331-H335 PolarHBondContact O-N 3.17Å
332	M	96.3	Very high	94.9	Very high	31 Å²	31	29.6 Å²	29.6	15%	0.153	15%	0.152	C	C	.	.	H	α-helix	trans	-57.2	-51.1	172.3	-171.2	-178.2	65.4	0	0	112.1	L226 L262 F265 I294 P328 I329 Y334 H335 L336	L226-M332 HydrophobicContact CD1-SD 4.09Å; L262-M332 HydrophobicContact CD2-CG 4.21Å; L262-M332 HydrophobicContact CD2-SD 3.95Å; F265-M332 HydrophobicContact CD1-CG 4.31Å; F265-M332 HydrophobicContact CE1-CG 4.34Å; I294-M332 HydrophobicContact CB-CB 3.81Å; I294-M332 HydrophobicContact CB-CG 4.48Å; I294-M332 HydrophobicContact CD1-CB 4.39Å; I294-M332 HydrophobicContact CG2-CB 3.57Å; I294-M332 HydrophobicContact CG2-CG 3.69Å; I294-M332 HydrophobicContact CG2-SD 4.26Å; I294-M332 PolarHBondContact O-N 2.9Å; P328-M332 PolarHBondContact O-N 3.22Å; P328-M332 VanDerWaalsContact O-N 3.16Å; I329-M332 HydrophobicContact CD1-CE 4.44Å; I329-M332 HydrophobicContact CG2-CE 4.39Å; I329-M332 WeakPolarHBondContact O-CB 3.42Å; I329-M332 PolarHBondContact O-N 2.95Å; M332-Y334 VanDerWaalsContact C-N 3.29Å; M332-Y334 PolarHBondContact O-N 2.71Å; M332-H335 PolarHBondContact O-N 2.82Å; M332-L336 HydrophobicContact CG-CD1 3.91Å; M332-L336 HydrophobicContact CG-CG 4.43Å; M332-L336 WeakPolarHBondContact O-CB 3.49Å; M332-L336 VanDerWaalsContact O-CG 3.3Å; M332-L336 WeakPolarHBondContact O-CG 3.35Å; M332-L336 PolarHBondContact O-N 3.38Å
333	L	96.4	Very high	94.9	Very high	20 Å²	20	31.8 Å²	31.8	11%	0.105	16%	0.164	C	C	.	.	H	α-helix	trans	-62.9	-36.5	-179.3	-70.5	171.5	0	0	0	112.1	I329 N330 S331 Y337 L342 P394 A396 V405	I329-L333 HydrophobicContact CG2-CD1 3.99Å; I329-L333 HydrophobicContact CG2-CG 4.35Å; I329-L333 VanDerWaalsContact O-CG 3.29Å; I329-L333 WeakPolarHBondContact O-CG 3.46Å; I329-L333 PolarHBondContact O-N 3.41Å; N330-L333 PolarHBondContact O-N 2.96Å; S331-L333 PolarHBondContact O-N 3.42Å; L333-Y337 VanDerWaalsContact O-CB 3.28Å; L333-Y337 WeakPolarHBondContact O-CB 3.45Å; L333-Y337 PolarHBondContact O-N 3.31Å; L333-L342 HydrophobicContact CD2-CD1 4.42Å; L333-P394 HydrophobicContact CB-CB 4.48Å; L333-P394 HydrophobicContact CD1-CB 4.25Å; L333-P394 HydrophobicContact CD2-CB 4.39Å; L333-A396 HydrophobicContact CD1-CB 4.05Å; L333-V405 HydrophobicContact CD1-CG1 4.37Å
334	Y	97.8	Very high	94.7	Very high	38 Å²	38	37 Å²	37	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-48.9	174	172.2	-98.4	0	0	0	111.9	A302 P303 F304 N330 S331 M332 Y337 Q338 V393	A302-Y334 HydrophobicContact CB-CD1 4.11Å; P303-Y334 HydrophobicContact CG-CE1 4.48Å; P303-Y334 HydrophobicContact CG-CE2 3.83Å; F304-Y334 HydrophobicContact CE1-CD2 4.09Å; F304-Y334 AromaticContact CE1-CG 3.96Å; F304-Y334 HydrophobicContact CE1-CG 3.96Å; F304-Y334 HydrophobicContact CZ-CG 4.47Å; N330-Y334 WeakPolarHBondContact O-CB 3.48Å; N330-Y334 PolarHBondContact O-N 2.98Å; S331-Y334 WeakPolarHBondContact O-CB 3.43Å; S331-Y334 PolarHBondContact O-N 2.85Å; M332-Y334 VanDerWaalsContact C-N 3.29Å; M332-Y334 PolarHBondContact O-N 2.71Å; Y334-Y337 PolarHBondContact O-N 2.86Å; Y334-Q338 HydrophobicContact CD1-CG 4.27Å; Y334-Q338 HydrophobicContact CD2-CG 4.34Å; Y334-Q338 HydrophobicContact CE1-CG 3.82Å; Y334-Q338 HydrophobicContact CE2-CG 3.91Å; Y334-Q338 VanDerWaalsContact O-CG 3.3Å; Y334-Q338 WeakPolarHBondContact O-CG 3.37Å; Y334-Q338 PolarHBondContact O-N 3.43Å; Y334-Q338 PolarHBondContact OH-NE2 3.22Å; Y334-V393 HydrophobicContact CD2-CG1 4.3Å; Y334-V393 HydrophobicContact CD2-CG2 4.1Å
335	H	96.7	Very high	94.6	Very high	4 Å²	4	41 Å²	41	2%	0.019	21%	0.206	C	C	.	.	H	α-helix	trans	-67.1	-41.7	178.6	-76.4	-60.4	0	0	0	112.7	F265 E293 I294 S295 S299 A300 S331 M332 Y337 Q338 D339	F265-H335 HydrophobicContact CE1-CB 3.61Å; F265-H335 HydrophobicContact CZ-CB 3.95Å; E293-H335 IonicContact OE1-NE2 2.67Å; I294-H335 PolarHBondContact O-CD2 3.45Å; S295-H335 VanDerWaalsContact CA-CD2 3.48Å; S295-H335 WeakPolarHBondContact CA-CD2 3.34Å; S295-H335 WeakPolarHBondContact CB-NE2 3.29Å; S299-H335 PolarHBondContact OG-CE1 3.05Å; S299-H335 PolarHBondContact OG-ND1 2.77Å; A300-H335 PolarHBondContact O-CE1 3Å; S331-H335 PolarHBondContact O-CD2 2.89Å; S331-H335 PolarHBondContact O-N 3.17Å; M332-H335 PolarHBondContact O-N 2.82Å; H335-Y337 PolarHBondContact O-N 3.45Å; H335-Q338 PolarHBondContact O-N 2.64Å; H335-D339 PolarHBondContact O-N 3.17Å; H335-D339 VanDerWaalsContact O-N 3.11Å
336	L	94.9	Very high	94.4	Very high	13 Å²	13	43.4 Å²	43.4	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-35.4	174.1	-70.4	169.6	0	0	0	112.2	P261 L262 F265 M332 G340 L341 L342	P261-L336 HydrophobicContact CB-CD2 4.35Å; L262-L336 HydrophobicContact CD2-CD1 4.18Å; L262-L336 HydrophobicContact CD2-CD2 4.04Å; L262-L336 HydrophobicContact CD2-CG 4.48Å; F265-L336 HydrophobicContact CE1-CD2 4.28Å; F265-L336 HydrophobicContact CE1-CG 4.09Å; F265-L336 HydrophobicContact CE2-CD2 3.93Å; F265-L336 HydrophobicContact CZ-CD2 3.59Å; F265-L336 HydrophobicContact CZ-CG 3.81Å; M332-L336 HydrophobicContact CG-CD1 3.91Å; M332-L336 HydrophobicContact CG-CG 4.43Å; M332-L336 WeakPolarHBondContact O-CB 3.49Å; M332-L336 VanDerWaalsContact O-CG 3.3Å; M332-L336 WeakPolarHBondContact O-CG 3.35Å; M332-L336 PolarHBondContact O-N 3.38Å; L336-G340 PolarHBondContact O-N 3.35Å; L336-L341 HydrophobicContact CB-CB 4.46Å; L336-L341 HydrophobicContact CD2-CB 3.85Å; L336-L341 HydrophobicContact CD2-CD1 3.85Å; L336-L341 WeakPolarHBondContact O-CB 3.24Å; L336-L341 PolarHBondContact O-N 3.36Å; L336-L342 HydrophobicContact CB-CD1 3.92Å; L336-L342 HydrophobicContact CB-CD2 4.02Å; L336-L342 HydrophobicContact CB-CG 3.71Å; L336-L342 HydrophobicContact CD1-CD2 4.17Å; L336-L342 PolarHBondContact O-N 2.92Å
337	Y	95.5	Very high	94.2	Very high	50 Å²	50	44.5 Å²	44.5	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-70.7	-48.4	174.9	169.8	-94.3	0	0	0	112.4	L333 Y334 H335 D339 G340 L390 V393	L333-Y337 VanDerWaalsContact O-CB 3.28Å; L333-Y337 WeakPolarHBondContact O-CB 3.45Å; L333-Y337 PolarHBondContact O-N 3.31Å; Y334-Y337 PolarHBondContact O-N 2.86Å; H335-Y337 PolarHBondContact O-N 3.45Å; Y337-D339 VanDerWaalsContact C-N 3.26Å; Y337-D339 PolarHBondContact O-N 3.47Å; Y337-G340 PolarHBondContact O-N 3.01Å; Y337-L390 HydrophobicContact CD2-CB 3.72Å; Y337-L390 HydrophobicContact CD2-CD1 3.9Å; Y337-L390 HydrophobicContact CE2-CB 3.73Å; Y337-V393 HydrophobicContact CD1-CB 4.35Å; Y337-V393 HydrophobicContact CD1-CG2 3.44Å; Y337-V393 VanDerWaalsContact CD1-CG2 3.44Å; Y337-V393 HydrophobicContact CE1-CG2 3.65Å; Y337-V393 HydrophobicContact CG-CB 4.45Å; Y337-V393 HydrophobicContact CG-CG2 4Å
338	Q	94.5	Very high	94	Very high	108 Å²	108	44.8 Å²	44.8	51%	0.505	23%	0.227	S	C	.	.	H	α-helix	trans	-55.8	-41.6	-179.5	-77.4	-84.1	-37.6	0	0	112	Y334 H335 G340	Y334-Q338 HydrophobicContact CD1-CG 4.27Å; Y334-Q338 HydrophobicContact CD2-CG 4.34Å; Y334-Q338 HydrophobicContact CE1-CG 3.82Å; Y334-Q338 HydrophobicContact CE2-CG 3.91Å; Y334-Q338 VanDerWaalsContact O-CG 3.3Å; Y334-Q338 WeakPolarHBondContact O-CG 3.37Å; Y334-Q338 PolarHBondContact O-N 3.43Å; Y334-Q338 PolarHBondContact OH-NE2 3.22Å; H335-Q338 PolarHBondContact O-N 2.64Å; Q338-G340 VanDerWaalsContact C-N 3.26Å; Q338-G340 PolarHBondContact O-N 2.96Å
339	D	91.7	Very high	93.7	Very high	80 Å²	80	51.3 Å²	51.3	43%	0.428	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	5.1	-178.7	-73.8	18.9	0	0	0	112.7	Q296 H335 Y337 L341	Q296-D339 PolarHBondContact NE2-OD2 2.96Å; Q296-D339 PolarHBondContact OE1-OD2 3.46Å; H335-D339 PolarHBondContact O-N 3.17Å; H335-D339 VanDerWaalsContact O-N 3.11Å; Y337-D339 VanDerWaalsContact C-N 3.26Å; Y337-D339 PolarHBondContact O-N 3.47Å; D339-L341 HydrophobicContact CB-CD1 4.05Å; D339-L341 HydrophobicContact CB-CG 3.89Å; D339-L341 PolarHBondContact O-N 3.23Å
340	G	92.4	Very high	93.2	Very high	25 Å²	25	50.2 Å²	50.2	26%	0.258	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	13.9	179.6	0	0	0	0	0	114.5	L336 Y337 Q338 L342 N343	L336-G340 PolarHBondContact O-N 3.35Å; Y337-G340 PolarHBondContact O-N 3.01Å; Q338-G340 VanDerWaalsContact C-N 3.26Å; Q338-G340 PolarHBondContact O-N 2.96Å; G340-L342 PolarHBondContact O-N 2.94Å; G340-N343 VanDerWaalsContact O-CB 3.31Å; G340-N343 WeakPolarHBondContact O-CB 3.17Å; G340-N343 PolarHBondContact O-N 3.5Å
341	L	91.2	Very high	92.5	Very high	62 Å²	62	56.4 Å²	56.4	33%	0.325	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-8.2	-177	-61	176.2	0	0	0	113.7	F265 L336 D339	F265-L341 HydrophobicContact CE2-CD1 3.98Å; F265-L341 HydrophobicContact CZ-CD1 4.29Å; L336-L341 HydrophobicContact CB-CB 4.46Å; L336-L341 HydrophobicContact CD2-CB 3.85Å; L336-L341 HydrophobicContact CD2-CD1 3.85Å; L336-L341 WeakPolarHBondContact O-CB 3.24Å; L336-L341 PolarHBondContact O-N 3.36Å; D339-L341 HydrophobicContact CB-CD1 4.05Å; D339-L341 HydrophobicContact CB-CG 3.89Å; D339-L341 PolarHBondContact O-N 3.23Å
342	L	91.2	Very high	91.9	Very high	30 Å²	30	60.1 Å²	60.1	16%	0.157	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-0.5	171.1	-60.2	178.5	0	0	0	113.1	L333 L336 G340 Y344 L390 P394	L333-L342 HydrophobicContact CD2-CD1 4.42Å; L336-L342 HydrophobicContact CB-CD1 3.92Å; L336-L342 HydrophobicContact CB-CD2 4.02Å; L336-L342 HydrophobicContact CB-CG 3.71Å; L336-L342 HydrophobicContact CD1-CD2 4.17Å; L336-L342 PolarHBondContact O-N 2.92Å; G340-L342 PolarHBondContact O-N 2.94Å; L342-Y344 WeakPolarHBondContact O-CD2 3.4Å; L342-Y344 WeakPolarHBondContact O-CE2 3.23Å; L342-L390 HydrophobicContact CB-CD1 3.43Å; L342-L390 VanDerWaalsContact CB-CD1 3.43Å; L342-L390 HydrophobicContact CB-CG 4.27Å; L342-L390 HydrophobicContact CD1-CD1 3.53Å; L342-L390 HydrophobicContact CG-CD1 4.11Å; L342-P394 HydrophobicContact CD1-CG 3.79Å
343	N	92.8	Very high	91.2	Very high	69 Å²	69	64.4 Å²	64.4	37%	0.369	33%	0.326	S	S	.	.			trans	-84.8	137.6	171.3	-59	-23.4	0	0	0	108.6	G340 F388 A389 L390	G340-N343 VanDerWaalsContact O-CB 3.31Å; G340-N343 WeakPolarHBondContact O-CB 3.17Å; G340-N343 PolarHBondContact O-N 3.5Å; N343-F388 CarbonylContact C-O 3.12Å; N343-F388 VanDerWaalsContact CA-O 3.27Å; N343-F388 WeakPolarHBondContact CA-O 3.47Å; N343-A389 VanDerWaalsContact OD1-CA 3.29Å; N343-A389 WeakPolarHBondContact OD1-CA 3.48Å; N343-L390 PolarHBondContact OD1-N 3.23Å
344	Y	90	Very high	90.7	Very high	109 Å²	109	64.1 Å²	64.1	43%	0.427	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.2	-175.7	-70.8	-89.6	0	0	0	110.8	L342 F346 T387 F388	L342-Y344 WeakPolarHBondContact O-CD2 3.4Å; L342-Y344 WeakPolarHBondContact O-CE2 3.23Å; Y344-F346 HydrophobicContact CD1-CE1 4.36Å; Y344-F346 HydrophobicContact CD1-CZ 4.22Å; Y344-F346 HydrophobicContact CG-CE1 4.47Å; Y344-F346 HydrophobicContact CG-CE2 4.48Å; Y344-F346 AromaticContact CG-CZ 3.91Å; Y344-F346 HydrophobicContact CG-CZ 3.91Å; Y344-T387 CarbonylContact O-C 3.59Å; Y344-T387 WeakPolarHBondContact O-CA 3.38Å; Y344-F388 HydrophobicContact CD2-CD1 4.5Å; Y344-F388 PolarHBondContact N-O 3.07Å; Y344-F388 PolarHBondContact O-N 3.37Å
345	N	90.9	Very high	90.3	Very high	133 Å²	133	62.3 Å²	62.3	71%	0.711	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.1	170.3	-66.6	-25.6	0	0	0	108.3	T387	N345-T387 WeakPolarHBondContact OD1-CB 3.42Å; N345-T387 VanDerWaalsContact OD1-CG2 3.24Å; N345-T387 WeakPolarHBondContact OD1-CG2 3.47Å
346	F	91	Very high	90	Very high	49 Å²	49	66.5 Å²	66.5	22%	0.215	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145.9	177.4	-52.6	-74.5	0	0	0	109.3	Y344 M354 L358 E385 A386 F388	Y344-F346 HydrophobicContact CD1-CE1 4.36Å; Y344-F346 HydrophobicContact CD1-CZ 4.22Å; Y344-F346 HydrophobicContact CG-CE1 4.47Å; Y344-F346 HydrophobicContact CG-CE2 4.48Å; Y344-F346 AromaticContact CG-CZ 3.91Å; Y344-F346 HydrophobicContact CG-CZ 3.91Å; F346-M354 HydrophobicContact CB-CG 3.53Å; F346-M354 HydrophobicContact CD1-CB 3.94Å; F346-M354 HydrophobicContact CD1-CG 3.49Å; F346-M354 VanDerWaalsContact CD1-CG 3.49Å; F346-M354 HydrophobicContact CD2-CG 4.2Å; F346-M354 HydrophobicContact CE1-CB 4.48Å; F346-M354 HydrophobicContact CE1-CE 4.5Å; F346-M354 HydrophobicContact CE1-CG 4.18Å; F346-M354 HydrophobicContact CG-CB 4.4Å; F346-M354 HydrophobicContact CG-CG 3.48Å; F346-M354 VanDerWaalsContact CG-CG 3.48Å; F346-M354 HydrophobicContact CZ-CE 4.44Å; F346-L358 HydrophobicContact CB-CD1 3.63Å; F346-E385 CarbonylContact O-C 3.57Å; F346-E385 WeakPolarHBondContact O-CA 3.47Å; F346-A386 HydrophobicContact CB-CB 4.33Å; F346-A386 HydrophobicContact CD2-CB 4.36Å; F346-A386 WeakPolarHBondContact CD2-O 3.47Å; F346-A386 PolarHBondContact N-O 3.04Å; F346-A386 PolarHBondContact O-N 3.37Å; F346-F388 HydrophobicContact CE2-CB 4.46Å
347	S	91.5	Very high	89.9	Confident	28 Å²	28	66.4 Å²	66.4	20%	0.196	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	142.1	-179.7	177.8	0	0	0	0	109.4	K349 S350 G355	S347-K349 PolarHBondContact O-N 2.89Å; S347-K349 PolarHBondContact OG-N 2.88Å; S347-S350 PolarHBondContact O-N 2.89Å; S347-S350 PolarHBondContact O-OG 3.11Å; S347-G355 VanDerWaalsContact O-CA 3.23Å; S347-G355 WeakPolarHBondContact O-CA 3.33Å
348	S	92.2	Very high	89.7	Confident	11 Å²	11	64 Å²	64	8%	0.077	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-17.4	171.9	54.3	0	0	0	0	114.7	G355 L358 D383 I384	S348-G355 WeakPolarHBondContact CA-O 3.31Å; S348-L358 WeakPolarHBondContact CB-O 3.43Å; S348-D383 WeakPolarHBondContact OG-CA 3.44Å; S348-D383 WeakPolarHBondContact OG-CB 3.18Å; S348-I384 PolarHBondContact N-O 3.44Å; S348-I384 PolarHBondContact OG-N 3.36Å; S348-I384 VanDerWaalsContact OG-N 3.11Å; S348-I384 PolarHBondContact OG-O 2.84Å
349	K	89.2	Confident	89.7	Confident	142 Å²	142	63.6 Å²	63.6	62%	0.617	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.5	173.4	-70.2	177.8	172.9	146	0	114.6	S347 D383	S347-K349 PolarHBondContact O-N 2.89Å; S347-K349 PolarHBondContact OG-N 2.88Å; K349-D383 VanDerWaalsContact CE-OD1 3.29Å; K349-D383 WeakPolarHBondContact CE-OD1 3.17Å; K349-D383 WeakPolarHBondContact CE-OD2 3.5Å; K349-D383 IonicContact NZ-OD1 2.74Å; K349-D383 IonicContact NZ-OD2 3.61Å; K349-D383 PolarHBondContact NZ-OD2 3.32Å
350	S	85.6	Confident	89.7	Confident	35 Å²	35	60.2 Å²	60.2	25%	0.245	30%	0.301	C	S	.	.	S	Bend	trans	-71.2	145.2	177.6	61.8	0	0	0	0	110.7	S347 D352 G355	S347-S350 PolarHBondContact O-N 2.89Å; S347-S350 PolarHBondContact O-OG 3.11Å; S350-D352 WeakPolarHBondContact CB-OD1 3.31Å; S350-D352 PolarHBondContact O-N 3.44Å; S350-D352 PolarHBondContact OG-OD1 3.31Å; S350-G355 WeakPolarHBondContact O-CA 3.45Å; S350-G355 WeakPolarHBondContact OG-CA 3.27Å; S350-G355 PolarHBondContact OG-N 3.47Å
351	N	83.1	Confident	89.5	Confident	147 Å²	147	63.4 Å²	63.4	79%	0.786	31%	0.312	S	S	*	.	S	Bend	trans	-88.1	13.2	-179.9	-75.6	-21.5	0	0	0	113.2
352	D	84.2	Confident	89.3	Confident	79 Å²	79	62.7 Å²	62.7	42%	0.422	31%	0.311	S	S	.	.	S	Bend	trans	-93.7	175.3	176.3	65.7	-1	0	0	0	111.6	S350 M354 G355 K356	S350-D352 WeakPolarHBondContact CB-OD1 3.31Å; S350-D352 PolarHBondContact O-N 3.44Å; S350-D352 PolarHBondContact OG-OD1 3.31Å; D352-M354 PolarHBondContact O-N 3.06Å; D352-M354 PolarHBondContact OD1-N 3.24Å; D352-G355 PolarHBondContact O-N 3.49Å; D352-G355 PolarHBondContact OD1-N 3.06Å; D352-K356 WeakPolarHBondContact O-CG 3.3Å; D352-K356 PolarHBondContact O-N 2.94Å; D352-K356 VanDerWaalsContact O-N 3.07Å
353	E	83.4	Confident	88.8	Confident	121 Å²	121	68.9 Å²	68.9	57%	0.565	35%	0.345	S	S	*	.	H	α-helix	trans	-56.8	-34.8	180	-64.3	-57.9	119.6	0	0	112	K356 F357 M482	E353-K356 IonicContact OE1-NZ 3.84Å; E353-K356 PolarHBondContact OE1-NZ 3.3Å; E353-F357 WeakPolarHBondContact O-CB 3.18Å; E353-F357 PolarHBondContact O-N 3.47Å; E353-M482 HydrophobicContact CB-CE 3.77Å; E353-M482 WeakPolarHBondContact O-CE 3.21Å
354	M	85.1	Confident	87.8	Confident	13 Å²	13	72 Å²	72	6%	0.064	36%	0.361	C	S	.	.	H	α-helix	trans	-69.2	-42.9	178.3	-167.5	63.8	71.7	0	0	112.3	F346 D352 K356 F357 L358 L479 M482	F346-M354 HydrophobicContact CB-CG 3.53Å; F346-M354 HydrophobicContact CD1-CB 3.94Å; F346-M354 HydrophobicContact CD1-CG 3.49Å; F346-M354 VanDerWaalsContact CD1-CG 3.49Å; F346-M354 HydrophobicContact CD2-CG 4.2Å; F346-M354 HydrophobicContact CE1-CB 4.48Å; F346-M354 HydrophobicContact CE1-CE 4.5Å; F346-M354 HydrophobicContact CE1-CG 4.18Å; F346-M354 HydrophobicContact CG-CB 4.4Å; F346-M354 HydrophobicContact CG-CG 3.48Å; F346-M354 VanDerWaalsContact CG-CG 3.48Å; F346-M354 HydrophobicContact CZ-CE 4.44Å; D352-M354 PolarHBondContact O-N 3.06Å; D352-M354 PolarHBondContact OD1-N 3.24Å; M354-K356 VanDerWaalsContact C-N 3.34Å; M354-K356 PolarHBondContact O-N 2.94Å; M354-F357 PolarHBondContact O-N 3.22Å; M354-F357 HydrophobicContact SD-CD1 4.14Å; M354-L358 HydrophobicContact CG-CD1 4.13Å; M354-L358 HydrophobicContact CG-CG 4.45Å; M354-L358 VanDerWaalsContact O-CG 3.29Å; M354-L358 WeakPolarHBondContact O-CG 3.3Å; M354-L358 PolarHBondContact O-N 3.03Å; M354-L479 HydrophobicContact CE-CD2 3.71Å; M354-L479 HydrophobicContact SD-CD2 3.99Å; M354-M482 HydrophobicContact CB-CE 3.93Å; M354-M482 HydrophobicContact CE-CB 4.16Å; M354-M482 HydrophobicContact CE-CE 3.96Å; M354-M482 HydrophobicContact CE-SD 3.6Å; M354-M482 HydrophobicContact CG-CE 4.48Å; M354-M482 HydrophobicContact SD-CE 3.87Å; M354-M482 HydrophobicContact SD-SD 3.83Å
355	G	90.2	Very high	87	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-41	176	0	0	0	0	0	112.5	S347 S348 S350 D352 F357 L358	S347-G355 VanDerWaalsContact O-CA 3.23Å; S347-G355 WeakPolarHBondContact O-CA 3.33Å; S348-G355 WeakPolarHBondContact CA-O 3.31Å; S350-G355 WeakPolarHBondContact O-CA 3.45Å; S350-G355 WeakPolarHBondContact OG-CA 3.27Å; S350-G355 PolarHBondContact OG-N 3.47Å; D352-G355 PolarHBondContact O-N 3.49Å; D352-G355 PolarHBondContact OD1-N 3.06Å; G355-F357 PolarHBondContact O-N 3.3Å; G355-L358 PolarHBondContact O-N 3.33Å
356	K	90.4	Very high	86.4	Confident	92 Å²	92	72 Å²	72	40%	0.4	37%	0.366	S	S	.	.	H	α-helix	trans	-60.4	-45.8	173.7	-65.6	175.3	-168.7	167.3	0	112	D352 E353 M354 L358 R359	D352-K356 WeakPolarHBondContact O-CG 3.3Å; D352-K356 PolarHBondContact O-N 2.94Å; D352-K356 VanDerWaalsContact O-N 3.07Å; E353-K356 IonicContact OE1-NZ 3.84Å; E353-K356 PolarHBondContact OE1-NZ 3.3Å; M354-K356 VanDerWaalsContact C-N 3.34Å; M354-K356 PolarHBondContact O-N 2.94Å; K356-L358 VanDerWaalsContact C-N 3.3Å; K356-L358 PolarHBondContact O-N 3.28Å; K356-R359 WeakPolarHBondContact O-CB 3.4Å; K356-R359 PolarHBondContact O-N 2.98Å
357	F	91.1	Very high	86.4	Confident	11 Å²	11	69.9 Å²	69.9	5%	0.048	36%	0.357	C	S	.	.	H	α-helix	trans	-60.2	-40.3	177.1	172.4	-111.1	0	0	0	111.9	E353 M354 G355 R359 C367 I368 L475 I478 M482	E353-F357 WeakPolarHBondContact O-CB 3.18Å; E353-F357 PolarHBondContact O-N 3.47Å; M354-F357 PolarHBondContact O-N 3.22Å; M354-F357 HydrophobicContact SD-CD1 4.14Å; G355-F357 PolarHBondContact O-N 3.3Å; F357-R359 PolarHBondContact O-N 2.82Å; F357-R359 VanDerWaalsContact O-N 3.15Å; F357-C367 CarbonylContact O-C 3.2Å; F357-C367 WeakPolarHBondContact O-CA 3.42Å; F357-I368 HydrophobicContact CE1-CB 4.35Å; F357-I368 HydrophobicContact CE1-CD1 4.27Å; F357-I368 HydrophobicContact CE1-CG1 4.44Å; F357-I368 HydrophobicContact CE2-CB 4.23Å; F357-I368 HydrophobicContact CZ-CB 4.02Å; F357-I368 HydrophobicContact CZ-CD1 4.33Å; F357-I368 HydrophobicContact CZ-CG1 4.06Å; F357-I368 WeakPolarHBondContact O-CB 3.42Å; F357-I368 PolarHBondContact O-N 2.97Å; F357-L475 HydrophobicContact CE1-CD2 4.06Å; F357-L475 HydrophobicContact CZ-CD2 3.68Å; F357-I478 HydrophobicContact CD1-CG2 4.23Å; F357-I478 HydrophobicContact CD2-CD1 4.05Å; F357-I478 HydrophobicContact CD2-CG2 3.72Å; F357-I478 HydrophobicContact CE1-CG2 4.29Å; F357-I478 HydrophobicContact CE2-CB 4.33Å; F357-I478 HydrophobicContact CE2-CD1 3.39Å; F357-I478 HydrophobicContact CE2-CG1 4.42Å; F357-I478 HydrophobicContact CE2-CG2 3.8Å; F357-I478 HydrophobicContact CG-CG2 3.95Å; F357-I478 HydrophobicContact CZ-CB 4.45Å; F357-I478 HydrophobicContact CZ-CD1 4.04Å; F357-I478 HydrophobicContact CZ-CG2 4.08Å; F357-M482 HydrophobicContact CB-CE 3.97Å; F357-M482 HydrophobicContact CB-SD 4.45Å
358	L	93.3	Very high	86.4	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	1.3	-178.1	-67.7	176	0	0	0	114.4	F346 S348 M354 G355 K356 I368 I384 A386 F413	F346-L358 HydrophobicContact CB-CD1 3.63Å; S348-L358 WeakPolarHBondContact CB-O 3.43Å; M354-L358 HydrophobicContact CG-CD1 4.13Å; M354-L358 HydrophobicContact CG-CG 4.45Å; M354-L358 VanDerWaalsContact O-CG 3.29Å; M354-L358 WeakPolarHBondContact O-CG 3.3Å; M354-L358 PolarHBondContact O-N 3.03Å; G355-L358 PolarHBondContact O-N 3.33Å; K356-L358 VanDerWaalsContact C-N 3.3Å; K356-L358 PolarHBondContact O-N 3.28Å; L358-I368 HydrophobicContact CD2-CD1 4.3Å; L358-I384 HydrophobicContact CB-CB 4.36Å; L358-I384 HydrophobicContact CD2-CG2 4.18Å; L358-I384 VanDerWaalsContact O-CB 3.25Å; L358-I384 WeakPolarHBondContact O-CB 3.36Å; L358-I384 WeakPolarHBondContact O-CG1 3.49Å; L358-A386 HydrophobicContact CD1-CB 4.07Å; L358-A386 HydrophobicContact CD2-CB 4.1Å; L358-F413 HydrophobicContact CD2-CD1 4.15Å; L358-F413 HydrophobicContact CD2-CE1 3.76Å
359	R	93.1	Very high	86.3	Confident	99 Å²	99	68.1 Å²	68.1	37%	0.374	34%	0.344	S	S	.	.			trans	-70.7	142.6	176.9	-66.5	176.9	-176.7	169.8	-0.8	111.5	K356 F357 C367 I368 G369	K356-R359 WeakPolarHBondContact O-CB 3.4Å; K356-R359 PolarHBondContact O-N 2.98Å; F357-R359 PolarHBondContact O-N 2.82Å; F357-R359 VanDerWaalsContact O-N 3.15Å; R359-C367 HydrophobicContact CB-CB 4.22Å; R359-C367 WeakPolarHBondContact O-CB 3.16Å; R359-C367 PolarHBondContact O-SG 3.47Å; R359-I368 WeakPolarHBondContact O-CG2 3.19Å; R359-I368 PolarHBondContact O-N 3.39Å; R359-G369 PolarHBondContact O-N 2.93Å
360	V	92.1	Very high	86.2	Confident	9 Å²	9	66.9 Å²	66.9	6%	0.055	34%	0.339	C	S	.	.	S	Bend	trans	-75.9	-45.7	172.6	-176.1	0	0	0	0	109.9	G369 L375 E376 I384	V360-G369 WeakPolarHBondContact O-CA 3.3Å; V360-L375 HydrophobicContact CG1-CB 4.25Å; V360-E376 HydrophobicContact CG1-CB 4.25Å; V360-I384 HydrophobicContact CG2-CD1 3.81Å; V360-I384 HydrophobicContact CG2-CG1 3.58Å
361	N	88.4	Confident	86.2	Confident	92 Å²	92	66 Å²	66	49%	0.492	34%	0.335	S	S	.	.	S	Bend	trans	-105.4	131.1	179.3	-53.7	-39	0	0	0	110.2	A380	N361-A380 PolarHBondContact ND2-O 3.45Å
362	C	85.8	Confident	86.6	Confident	47 Å²	47	59 Å²	59	32%	0.318	30%	0.298	S	S	.	.			trans	-154.2	151.7	174.3	62.9	0	0	0	0	111.1	C367	C362-C367 HydrophobicContact CB-CB 3.56Å; C362-C367 WeakPolarHBondContact CB-SG 3.23Å; C362-C367 WeakPolarHBondContact SG-CB 3.41Å; C362-C367 PolarHBondContact SG-N 3.41Å; C362-C367 VanDerWaalsContact SG-N 3.4Å; C362-C367 CovalentContact SG-SG 2.02Å; C362-C367 PolarHBondContact SG-SG 3.45Å
363	D	81.8	Confident	86.7	Confident	160 Å²	160	58.2 Å²	58.2	86%	0.856	30%	0.297	S	S	*	.	S	Bend	trans	-80	-28.9	176.4	-56.6	-39.9	0	0	0	112	L365	D363-L365 PolarHBondContact O-N 3.49Å
364	D	70.9	Confident	87.1	Confident	135 Å²	135	55.5 Å²	55.5	72%	0.722	28%	0.284	S	S	*	.	S	Bend	trans	-90.3	13.9	-166.5	-66.5	-32.3	0	0	0	115.6	M366	D364-M366 WeakPolarHBondContact O-CG 3.22Å; D364-M366 PolarHBondContact O-N 3.3Å
365	L	74.7	Confident	87.4	Confident	106 Å²	106	54.9 Å²	54.9	56%	0.555	28%	0.281	S	S	*	.	S	Bend	trans	52.7	7.3	-176.2	-49.5	-178.7	0	0	0	115.9	D363 F370	D363-L365 PolarHBondContact O-N 3.49Å; L365-F370 HydrophobicContact CB-CD1 4.03Å; L365-F370 HydrophobicContact CB-CD2 4.32Å; L365-F370 HydrophobicContact CB-CE1 4.05Å; L365-F370 HydrophobicContact CB-CE2 4.35Å; L365-F370 HydrophobicContact CB-CG 4.15Å; L365-F370 HydrophobicContact CB-CZ 4.21Å; L365-F370 HydrophobicContact CD1-CE2 4.43Å; L365-F370 HydrophobicContact CD1-CZ 4.25Å; L365-F370 HydrophobicContact CD2-CD2 3.65Å; L365-F370 HydrophobicContact CD2-CE2 3.59Å; L365-F370 HydrophobicContact CD2-CG 4.3Å; L365-F370 HydrophobicContact CD2-CZ 4.17Å; L365-F370 HydrophobicContact CG-CE2 4.34Å; L365-F370 HydrophobicContact CG-CZ 4.45Å; L365-F370 WeakPolarHBondContact O-CD1 3.33Å
366	M	78.3	Confident	87.4	Confident	136 Å²	136	60.1 Å²	60.1	67%	0.67	31%	0.306	S	S	*	.			trans	-106.8	24.2	-173.3	-72.2	-65.2	-65.6	0	0	112.8	D364	D364-M366 WeakPolarHBondContact O-CG 3.22Å; D364-M366 PolarHBondContact O-N 3.3Å
367	C	89.9	Confident	87.4	Confident	5 Å²	5	62.7 Å²	62.7	3%	0.034	32%	0.323	C	S	.	.	S	Bend	trans	-113.9	164.5	175.7	67.9	0	0	0	0	112.4	F357 R359 C362 G369 F370 G371	F357-C367 CarbonylContact O-C 3.2Å; F357-C367 WeakPolarHBondContact O-CA 3.42Å; R359-C367 HydrophobicContact CB-CB 4.22Å; R359-C367 WeakPolarHBondContact O-CB 3.16Å; R359-C367 PolarHBondContact O-SG 3.47Å; C362-C367 HydrophobicContact CB-CB 3.56Å; C362-C367 WeakPolarHBondContact CB-SG 3.23Å; C362-C367 WeakPolarHBondContact SG-CB 3.41Å; C362-C367 PolarHBondContact SG-N 3.41Å; C362-C367 VanDerWaalsContact SG-N 3.4Å; C362-C367 CovalentContact SG-SG 2.02Å; C362-C367 PolarHBondContact SG-SG 3.45Å; C367-G369 VanDerWaalsContact C-N 3.29Å; C367-G369 PolarHBondContact O-N 3.15Å; C367-F370 PolarHBondContact O-N 2.86Å; C367-G371 PolarHBondContact O-N 2.89Å
368	I	90.9	Very high	87.5	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-67.5	-30.1	-172	-164.2	170.9	0	0	0	112	F357 L358 R359 F370 G371 I372 L375 I384 F413 F425 L475	F357-I368 HydrophobicContact CE1-CB 4.35Å; F357-I368 HydrophobicContact CE1-CD1 4.27Å; F357-I368 HydrophobicContact CE1-CG1 4.44Å; F357-I368 HydrophobicContact CE2-CB 4.23Å; F357-I368 HydrophobicContact CZ-CB 4.02Å; F357-I368 HydrophobicContact CZ-CD1 4.33Å; F357-I368 HydrophobicContact CZ-CG1 4.06Å; F357-I368 WeakPolarHBondContact O-CB 3.42Å; F357-I368 PolarHBondContact O-N 2.97Å; L358-I368 HydrophobicContact CD2-CD1 4.3Å; R359-I368 WeakPolarHBondContact O-CG2 3.19Å; R359-I368 PolarHBondContact O-N 3.39Å; I368-F370 VanDerWaalsContact C-N 3.33Å; I368-F370 PolarHBondContact O-N 3.35Å; I368-G371 PolarHBondContact O-N 3.46Å; I368-I372 HydrophobicContact CD1-CD1 4.1Å; I368-I372 HydrophobicContact CG1-CD1 3.73Å; I368-I372 HydrophobicContact CG1-CG1 4.3Å; I368-I372 WeakPolarHBondContact O-CB 3.36Å; I368-I372 PolarHBondContact O-N 3.48Å; I368-L375 HydrophobicContact CB-CD1 4.36Å; I368-L375 HydrophobicContact CD1-CD1 4.18Å; I368-L375 HydrophobicContact CG1-CD1 3.83Å; I368-L375 HydrophobicContact CG2-CD1 3.86Å; I368-I384 HydrophobicContact CG2-CG1 4.34Å; I368-F413 HydrophobicContact CD1-CD1 3.99Å; I368-F413 HydrophobicContact CD1-CE1 3.81Å; I368-F425 HydrophobicContact CD1-CZ 4.32Å; I368-L475 HydrophobicContact CD1-CD2 3.88Å; I368-L475 HydrophobicContact CG1-CD2 4.16Å
369	G	90.1	Very high	87.5	Confident	0 Å²	0	71 Å²	71	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65.7	-34.9	176	0	0	0	0	0	113.1	R359 V360 C367 I372	R359-G369 PolarHBondContact O-N 2.93Å; V360-G369 WeakPolarHBondContact O-CA 3.3Å; C367-G369 VanDerWaalsContact C-N 3.29Å; C367-G369 PolarHBondContact O-N 3.15Å; G369-I372 CarbonylContact O-C 3.11Å; G369-I372 PolarHBondContact O-N 3.42Å; G369-I372 VanDerWaalsContact O-O 3.08Å
370	F	87.5	Confident	87.4	Confident	117 Å²	117	68.2 Å²	68.2	51%	0.513	35%	0.353	S	S	.	.	H	α-helix	trans	-65.9	-43.3	172.2	179.5	-102.2	0	0	0	111.9	L365 C367 I368 I372	L365-F370 HydrophobicContact CB-CD1 4.03Å; L365-F370 HydrophobicContact CB-CD2 4.32Å; L365-F370 HydrophobicContact CB-CE1 4.05Å; L365-F370 HydrophobicContact CB-CE2 4.35Å; L365-F370 HydrophobicContact CB-CG 4.15Å; L365-F370 HydrophobicContact CB-CZ 4.21Å; L365-F370 HydrophobicContact CD1-CE2 4.43Å; L365-F370 HydrophobicContact CD1-CZ 4.25Å; L365-F370 HydrophobicContact CD2-CD2 3.65Å; L365-F370 HydrophobicContact CD2-CE2 3.59Å; L365-F370 HydrophobicContact CD2-CG 4.3Å; L365-F370 HydrophobicContact CD2-CZ 4.17Å; L365-F370 HydrophobicContact CG-CE2 4.34Å; L365-F370 HydrophobicContact CG-CZ 4.45Å; L365-F370 WeakPolarHBondContact O-CD1 3.33Å; C367-F370 PolarHBondContact O-N 2.86Å; I368-F370 VanDerWaalsContact C-N 3.33Å; I368-F370 PolarHBondContact O-N 3.35Å; F370-I372 VanDerWaalsContact C-N 3.27Å; F370-I372 PolarHBondContact O-N 2.86Å
371	G	86.1	Confident	87.4	Confident	16 Å²	16	73.5 Å²	73.5	17%	0.165	38%	0.381	C	S	.	.	H	α-helix	trans	-70.9	-20.8	177.6	0	0	0	0	0	114.1	C367 I368 Q471	C367-G371 PolarHBondContact O-N 2.89Å; I368-G371 PolarHBondContact O-N 3.46Å; G371-Q471 WeakPolarHBondContact O-CG 3.44Å
372	I	90.7	Very high	87.7	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	37%	0.367	C	S	.	.			trans	-139.2	81.8	-176.5	-49.1	176.1	0	0	0	108.5	I368 G369 F370 E374 L375 F425 L467 L475	I368-I372 HydrophobicContact CD1-CD1 4.1Å; I368-I372 HydrophobicContact CG1-CD1 3.73Å; I368-I372 HydrophobicContact CG1-CG1 4.3Å; I368-I372 WeakPolarHBondContact O-CB 3.36Å; I368-I372 PolarHBondContact O-N 3.48Å; G369-I372 CarbonylContact O-C 3.11Å; G369-I372 PolarHBondContact O-N 3.42Å; G369-I372 VanDerWaalsContact O-O 3.08Å; F370-I372 VanDerWaalsContact C-N 3.27Å; F370-I372 PolarHBondContact O-N 2.86Å; I372-E374 HydrophobicContact CG2-CB 4.42Å; I372-E374 WeakPolarHBondContact CG2-OE2 3.31Å; I372-E374 PolarHBondContact O-N 3.41Å; I372-L375 HydrophobicContact CB-CD1 3.95Å; I372-L375 HydrophobicContact CB-CG 4.05Å; I372-L375 HydrophobicContact CD1-CD1 4.17Å; I372-L375 HydrophobicContact CG2-CD1 4.26Å; I372-L375 HydrophobicContact CG2-CG 3.89Å; I372-L375 WeakPolarHBondContact O-CB 3.38Å; I372-L375 PolarHBondContact O-N 2.82Å; I372-F425 HydrophobicContact CD1-CE1 4.03Å; I372-F425 HydrophobicContact CD1-CZ 3.7Å; I372-L467 HydrophobicContact CB-CD2 4.42Å; I372-L467 HydrophobicContact CD1-CD1 4.02Å; I372-L467 HydrophobicContact CD1-CD2 3.9Å; I372-L467 HydrophobicContact CG1-CD2 4.16Å; I372-L467 HydrophobicContact CG2-CD2 3.41Å; I372-L467 VanDerWaalsContact CG2-CD2 3.41Å; I372-L475 HydrophobicContact CD1-CD1 3.94Å; I372-L475 HydrophobicContact CD1-CD2 4.43Å; I372-L475 HydrophobicContact CD1-CG 4.44Å
373	P	87.8	Confident	88.1	Confident	62 Å²	62	71.4 Å²	71.4	40%	0.403	36%	0.363	S	S	.	.	H	α-helix	trans	-57.3	-24.7	-175.6	-26.6	35.8	0	0	0	113.9	L375 E376 L377	P373-L375 PolarHBondContact O-N 2.88Å; P373-E376 WeakPolarHBondContact O-CB 3.24Å; P373-E376 PolarHBondContact O-N 2.9Å; P373-E376 VanDerWaalsContact O-N 3.07Å; P373-L377 WeakPolarHBondContact O-CG 3.49Å; P373-L377 PolarHBondContact O-N 3.36Å; P373-L377 VanDerWaalsContact O-N 3.08Å
374	E	90.3	Very high	88.8	Confident	63 Å²	63	63.8 Å²	63.8	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-24.4	175	-61.6	83.5	175.3	0	0	113.3	I372 R378 L465 Q471	I372-E374 HydrophobicContact CG2-CB 4.42Å; I372-E374 WeakPolarHBondContact CG2-OE2 3.31Å; I372-E374 PolarHBondContact O-N 3.41Å; E374-R378 WeakPolarHBondContact O-CB 3.37Å; E374-R378 PolarHBondContact O-N 2.87Å; E374-L465 HydrophobicContact CB-CD1 4.4Å; E374-L465 HydrophobicContact CB-CD2 4.22Å; E374-Q471 PolarHBondContact OE2-NE2 3.21Å
375	L	92.4	Very high	89.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-70.4	-41.6	173.1	-65.7	178.5	0	0	0	111.4	V360 I368 I372 P373 L377 Y379 A380 I384 L424 L465	V360-L375 HydrophobicContact CG1-CB 4.25Å; I368-L375 HydrophobicContact CB-CD1 4.36Å; I368-L375 HydrophobicContact CD1-CD1 4.18Å; I368-L375 HydrophobicContact CG1-CD1 3.83Å; I368-L375 HydrophobicContact CG2-CD1 3.86Å; I372-L375 HydrophobicContact CB-CD1 3.95Å; I372-L375 HydrophobicContact CB-CG 4.05Å; I372-L375 HydrophobicContact CD1-CD1 4.17Å; I372-L375 HydrophobicContact CG2-CD1 4.26Å; I372-L375 HydrophobicContact CG2-CG 3.89Å; I372-L375 WeakPolarHBondContact O-CB 3.38Å; I372-L375 PolarHBondContact O-N 2.82Å; P373-L375 PolarHBondContact O-N 2.88Å; L375-L377 VanDerWaalsContact C-N 3.34Å; L375-Y379 HydrophobicContact CD2-CD2 4.06Å; L375-Y379 CarbonylContact O-C 3.53Å; L375-Y379 WeakPolarHBondContact O-CA 3.42Å; L375-Y379 WeakPolarHBondContact O-CB 3.49Å; L375-Y379 PolarHBondContact O-N 3.47Å; L375-A380 PolarHBondContact O-N 3.37Å; L375-I384 HydrophobicContact CD2-CD1 4.34Å; L375-L424 HydrophobicContact CD2-CD1 3.74Å; L375-L424 HydrophobicContact CD2-CD2 4.29Å; L375-L465 HydrophobicContact CD2-CD1 3.56Å; L375-L465 HydrophobicContact CG-CD1 4.31Å
376	E	90.4	Very high	90.9	Very high	110 Å²	110	54.7 Å²	54.7	51%	0.514	27%	0.273	S	S	.	.	H	α-helix	trans	-64.3	-42.9	175.8	-168.2	178	177.7	0	0	110.6	V360 P373 R378 A380	V360-E376 HydrophobicContact CG1-CB 4.25Å; P373-E376 WeakPolarHBondContact O-CB 3.24Å; P373-E376 PolarHBondContact O-N 2.9Å; P373-E376 VanDerWaalsContact O-N 3.07Å; E376-R378 PolarHBondContact O-N 3.03Å; E376-A380 WeakPolarHBondContact O-CB 3.41Å
377	L	90.9	Very high	91.6	Very high	147 Å²	147	49.2 Å²	49.2	77%	0.77	25%	0.247	S	C	*	.	H	α-helix	trans	-67.5	-32.6	-178.3	-66.3	174.2	0	0	0	114.4	P373 L375	P373-L377 WeakPolarHBondContact O-CG 3.49Å; P373-L377 PolarHBondContact O-N 3.36Å; P373-L377 VanDerWaalsContact O-N 3.08Å; L375-L377 VanDerWaalsContact C-N 3.34Å
378	R	92.3	Very high	91.9	Very high	170 Å²	170	50.3 Å²	50.3	64%	0.642	25%	0.251	S	S	*	.	H	α-helix	trans	-115.8	-22	-171.1	-65.3	-179.8	173.4	-169.9	-1.2	114.6	E374 E376	E374-R378 WeakPolarHBondContact O-CB 3.37Å; E374-R378 PolarHBondContact O-N 2.87Å; E376-R378 PolarHBondContact O-N 3.03Å
379	Y	93.7	Very high	92.1	Very high	14 Å²	14	52.2 Å²	52.2	6%	0.055	27%	0.267	C	S	.	.	H	α-helix	trans	-135.1	22	-167.1	-60.2	-74.9	0	0	0	112.5	L375 D381 Y382 A415 Q422 L424 L465	L375-Y379 HydrophobicContact CD2-CD2 4.06Å; L375-Y379 CarbonylContact O-C 3.53Å; L375-Y379 WeakPolarHBondContact O-CA 3.42Å; L375-Y379 WeakPolarHBondContact O-CB 3.49Å; L375-Y379 PolarHBondContact O-N 3.47Å; Y379-D381 PolarHBondContact O-N 3.09Å; Y379-D381 VanDerWaalsContact O-N 3.07Å; Y379-Y382 HydrophobicContact CD1-CD1 4.21Å; Y379-Y382 AromaticContact CD1-CD2 3.95Å; Y379-Y382 HydrophobicContact CD1-CD2 3.95Å; Y379-Y382 HydrophobicContact CD1-CE1 4.45Å; Y379-Y382 HydrophobicContact CD1-CE2 4.21Å; Y379-Y382 AromaticContact CD1-CG 3.96Å; Y379-Y382 HydrophobicContact CD1-CG 3.96Å; Y379-Y382 WeakPolarHBondContact O-CB 3.14Å; Y379-Y382 PolarHBondContact O-N 3.21Å; Y379-A415 HydrophobicContact CD1-CB 3.5Å; Y379-A415 VanDerWaalsContact CD1-CB 3.5Å; Y379-A415 HydrophobicContact CE1-CB 3.86Å; Y379-A415 HydrophobicContact CG-CB 4.06Å; Y379-Q422 PolarHBondContact OH-NE2 3.35Å; Y379-Q422 VanDerWaalsContact OH-NE2 3.09Å; Y379-Q422 PolarHBondContact OH-OE1 2.56Å; Y379-L424 HydrophobicContact CD1-CD2 4.44Å; Y379-L424 HydrophobicContact CD2-CD2 3.87Å; Y379-L424 HydrophobicContact CE1-CD2 4.07Å; Y379-L424 HydrophobicContact CE2-CD2 3.43Å; Y379-L424 VanDerWaalsContact CE2-CD2 3.43Å; Y379-L424 HydrophobicContact CG-CD2 4.35Å; Y379-L465 HydrophobicContact CE2-CD1 4.29Å; Y379-L465 HydrophobicContact CE2-CD2 4.35Å
380	A	90.9	Very high	92.4	Very high	41 Å²	41	53 Å²	53	34%	0.339	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-37.9	179.5	0	0	0	0	0	114.7	N361 L375 E376	N361-A380 PolarHBondContact ND2-O 3.45Å; L375-A380 PolarHBondContact O-N 3.37Å; E376-A380 WeakPolarHBondContact O-CB 3.41Å
381	D	91.3	Very high	92.9	Very high	121 Å²	121	50 Å²	50	65%	0.647	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	10.8	-178.7	-65	-20.4	0	0	0	114.3	Y379 K417	Y379-D381 PolarHBondContact O-N 3.09Å; Y379-D381 VanDerWaalsContact O-N 3.07Å; D381-K417 HydrophobicContact CB-CD 4.29Å; D381-K417 IonicContact OD2-NZ 3.01Å; D381-K417 PolarHBondContact OD2-NZ 3.13Å
382	Y	94.9	Very high	93.4	Very high	51 Å²	51	52.1 Å²	52.1	20%	0.2	27%	0.268	C	S	.	.	S	Bend	trans	-102.3	147.3	-178.4	-75.3	-111.9	0	0	0	110.7	Y379 A415 K417 I420	Y379-Y382 HydrophobicContact CD1-CD1 4.21Å; Y379-Y382 AromaticContact CD1-CD2 3.95Å; Y379-Y382 HydrophobicContact CD1-CD2 3.95Å; Y379-Y382 HydrophobicContact CD1-CE1 4.45Å; Y379-Y382 HydrophobicContact CD1-CE2 4.21Å; Y379-Y382 AromaticContact CD1-CG 3.96Å; Y379-Y382 HydrophobicContact CD1-CG 3.96Å; Y379-Y382 WeakPolarHBondContact O-CB 3.14Å; Y379-Y382 PolarHBondContact O-N 3.21Å; Y382-A415 HydrophobicContact CD1-CB 3.71Å; Y382-A415 HydrophobicContact CG-CB 4.07Å; Y382-K417 HydrophobicContact CD1-CB 3.41Å; Y382-K417 VanDerWaalsContact CD1-CB 3.41Å; Y382-K417 HydrophobicContact CD2-CB 4.31Å; Y382-K417 HydrophobicContact CD2-CD 4Å; Y382-K417 HydrophobicContact CE1-CB 3.43Å; Y382-K417 VanDerWaalsContact CE1-CB 3.43Å; Y382-K417 HydrophobicContact CE1-CD 4.39Å; Y382-K417 HydrophobicContact CE2-CB 4.33Å; Y382-K417 HydrophobicContact CE2-CD 3.78Å; Y382-K417 HydrophobicContact CG-CB 3.87Å; Y382-K417 HydrophobicContact CG-CD 4.38Å; Y382-I420 HydrophobicContact CE1-CG2 4.23Å
383	D	94.6	Very high	93.7	Very high	43 Å²	43	52.9 Å²	52.9	23%	0.23	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	132.9	164.8	-60.8	-63	0	0	0	108.6	S348 K349 A415 T416	S348-D383 WeakPolarHBondContact OG-CA 3.44Å; S348-D383 WeakPolarHBondContact OG-CB 3.18Å; K349-D383 VanDerWaalsContact CE-OD1 3.29Å; K349-D383 WeakPolarHBondContact CE-OD1 3.17Å; K349-D383 WeakPolarHBondContact CE-OD2 3.5Å; K349-D383 IonicContact NZ-OD1 2.74Å; K349-D383 IonicContact NZ-OD2 3.61Å; K349-D383 PolarHBondContact NZ-OD2 3.32Å; D383-A415 CarbonylContact O-C 3.48Å; D383-A415 WeakPolarHBondContact O-CA 3.39Å; D383-T416 PolarHBondContact N-O 3.04Å; D383-T416 PolarHBondContact O-N 3.47Å; D383-T416 PolarHBondContact O-OG1 2.81Å
384	I	95.5	Very high	94.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.3	170.7	-47.7	-59	0	0	0	109.2	S348 L358 V360 I368 L375 F413 F414 A415 L424	S348-I384 PolarHBondContact N-O 3.44Å; S348-I384 PolarHBondContact OG-N 3.36Å; S348-I384 VanDerWaalsContact OG-N 3.11Å; S348-I384 PolarHBondContact OG-O 2.84Å; L358-I384 HydrophobicContact CB-CB 4.36Å; L358-I384 HydrophobicContact CD2-CG2 4.18Å; L358-I384 VanDerWaalsContact O-CB 3.25Å; L358-I384 WeakPolarHBondContact O-CB 3.36Å; L358-I384 WeakPolarHBondContact O-CG1 3.49Å; V360-I384 HydrophobicContact CG2-CD1 3.81Å; V360-I384 HydrophobicContact CG2-CG1 3.58Å; I368-I384 HydrophobicContact CG2-CG1 4.34Å; L375-I384 HydrophobicContact CD2-CD1 4.34Å; I384-F413 HydrophobicContact CG2-CD1 4.34Å; I384-F414 WeakPolarHBondContact CA-O 3.33Å; I384-A415 HydrophobicContact CD1-CB 4.23Å; I384-L424 HydrophobicContact CD1-CD1 3.96Å; I384-L424 HydrophobicContact CG2-CD1 4.4Å
385	E	95.2	Very high	94.5	Very high	50 Å²	50	50.1 Å²	50.1	23%	0.234	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	143.9	173.4	-69.7	171.5	-164.7	0	0	109.8	F346 F413 F414 T416 R421	F346-E385 CarbonylContact O-C 3.57Å; F346-E385 WeakPolarHBondContact O-CA 3.47Å; E385-F413 CarbonylContact O-C 3.54Å; E385-F413 WeakPolarHBondContact O-CA 3.29Å; E385-F414 HydrophobicContact CB-CB 4.44Å; E385-F414 PolarHBondContact N-O 3.31Å; E385-F414 PolarHBondContact O-N 2.83Å; E385-T416 HydrophobicContact CG-CG2 4.35Å; E385-T416 WeakPolarHBondContact OE1-CG2 3.4Å; E385-T416 PolarHBondContact OE1-OG1 3.36Å; E385-R421 IonicContact OE2-NE 3.6Å
386	A	94.4	Very high	94.8	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124	172.4	0	0	0	0	0	109.4	F346 L358 L411 E412 F413	F346-A386 HydrophobicContact CB-CB 4.33Å; F346-A386 HydrophobicContact CD2-CB 4.36Å; F346-A386 WeakPolarHBondContact CD2-O 3.47Å; F346-A386 PolarHBondContact N-O 3.04Å; F346-A386 PolarHBondContact O-N 3.37Å; L358-A386 HydrophobicContact CD1-CB 4.07Å; L358-A386 HydrophobicContact CD2-CB 4.1Å; A386-L411 HydrophobicContact CB-CD1 4.26Å; A386-E412 CarbonylContact C-O 3.57Å; A386-E412 WeakPolarHBondContact CA-O 3.36Å; A386-F413 HydrophobicContact CB-CD1 3.83Å; A386-F413 HydrophobicContact CB-CE1 3.71Å; A386-F413 HydrophobicContact CB-CG 4.42Å; A386-F413 HydrophobicContact CB-CZ 4.22Å
387	T	94.5	Very high	95	Very high	21 Å²	21	48.9 Å²	48.9	13%	0.129	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.4	178.7	65	0	0	0	0	109.3	Y344 N345 L411 E412 F414	Y344-T387 CarbonylContact O-C 3.59Å; Y344-T387 WeakPolarHBondContact O-CA 3.38Å; N345-T387 WeakPolarHBondContact OD1-CB 3.42Å; N345-T387 VanDerWaalsContact OD1-CG2 3.24Å; N345-T387 WeakPolarHBondContact OD1-CG2 3.47Å; T387-L411 WeakPolarHBondContact O-CA 3.36Å; T387-E412 PolarHBondContact N-O 3.44Å; T387-E412 PolarHBondContact O-N 2.79Å; T387-F414 HydrophobicContact CG2-CD2 4.33Å; T387-F414 HydrophobicContact CG2-CE2 4.14Å; T387-F414 WeakPolarHBondContact OG1-CE2 3.41Å
388	F	94.5	Very high	95.1	Very high	28 Å²	28	42.9 Å²	42.9	12%	0.123	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.2	172	179.6	-103.5	0	0	0	109.7	N343 Y344 F346 L390 F407 K410 L411 V429	N343-F388 CarbonylContact C-O 3.12Å; N343-F388 VanDerWaalsContact CA-O 3.27Å; N343-F388 WeakPolarHBondContact CA-O 3.47Å; Y344-F388 HydrophobicContact CD2-CD1 4.5Å; Y344-F388 PolarHBondContact N-O 3.07Å; Y344-F388 PolarHBondContact O-N 3.37Å; F346-F388 HydrophobicContact CE2-CB 4.46Å; F388-L390 HydrophobicContact CE1-CD2 3.75Å; F388-L390 HydrophobicContact CE1-CG 4.08Å; F388-L390 HydrophobicContact CZ-CD2 3.73Å; F388-L390 HydrophobicContact CZ-CG 4.46Å; F388-F407 HydrophobicContact CE2-CE2 4.46Å; F388-F407 AromaticContact CZ-CD2 3.91Å; F388-F407 HydrophobicContact CZ-CD2 3.91Å; F388-F407 AromaticContact CZ-CE2 3.83Å; F388-F407 HydrophobicContact CZ-CE2 3.83Å; F388-K410 CarbonylContact C-O 3.59Å; F388-K410 WeakPolarHBondContact CA-O 3.44Å; F388-L411 HydrophobicContact CB-CD1 4.01Å; F388-L411 HydrophobicContact CD2-CB 4.33Å; F388-V429 HydrophobicContact CD2-CG2 4.47Å; F388-V429 HydrophobicContact CE2-CB 4.07Å; F388-V429 HydrophobicContact CE2-CG1 4.4Å; F388-V429 HydrophobicContact CE2-CG2 4.12Å
389	A	96.1	Very high	95.1	Very high	40 Å²	40	36.9 Å²	36.9	33%	0.331	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135	173.4	0	0	0	0	0	110.3	N343 G409 K410	N343-A389 VanDerWaalsContact OD1-CA 3.29Å; N343-A389 WeakPolarHBondContact OD1-CA 3.48Å; A389-G409 CarbonylContact O-C 3.56Å; A389-G409 WeakPolarHBondContact O-CA 3.29Å; A389-K410 PolarHBondContact N-O 2.93Å; A389-K410 PolarHBondContact O-N 3.43Å
390	L	97.3	Very high	94.9	Very high	18 Å²	18	39 Å²	39	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	142.9	173.7	-70.5	175.9	0	0	0	110.8	Y337 L342 N343 F388 P394 F407 E408	Y337-L390 HydrophobicContact CD2-CB 3.72Å; Y337-L390 HydrophobicContact CD2-CD1 3.9Å; Y337-L390 HydrophobicContact CE2-CB 3.73Å; L342-L390 HydrophobicContact CB-CD1 3.43Å; L342-L390 VanDerWaalsContact CB-CD1 3.43Å; L342-L390 HydrophobicContact CB-CG 4.27Å; L342-L390 HydrophobicContact CD1-CD1 3.53Å; L342-L390 HydrophobicContact CG-CD1 4.11Å; N343-L390 PolarHBondContact OD1-N 3.23Å; F388-L390 HydrophobicContact CE1-CD2 3.75Å; F388-L390 HydrophobicContact CE1-CG 4.08Å; F388-L390 HydrophobicContact CZ-CD2 3.73Å; F388-L390 HydrophobicContact CZ-CG 4.46Å; L390-P394 HydrophobicContact CD1-CG 3.38Å; L390-P394 HydrophobicContact CD2-CG 4.31Å; L390-P394 HydrophobicContact CG-CG 4.49Å; L390-F407 HydrophobicContact CD2-CB 3.91Å; L390-F407 HydrophobicContact CD2-CD2 4.02Å; L390-F407 HydrophobicContact CD2-CG 4.35Å; L390-E408 WeakPolarHBondContact CA-O 3.31Å; L390-E408 VanDerWaalsContact CD2-O 3.31Å; L390-E408 WeakPolarHBondContact CD2-O 3.25Å
391	T	97.3	Very high	94.7	Very high	54 Å²	54	44.5 Å²	44.5	33%	0.331	25%	0.245	S	C	.	.	S	Bend	trans	-101.4	-20.3	175.2	50.4	0	0	0	0	112.6	E408 G409 K410	T391-E408 PolarHBondContact N-O 3.42Å; T391-E408 PolarHBondContact OG1-O 2.75Å; T391-G409 PolarHBondContact OG1-N 2.95Å; T391-K410 HydrophobicContact CG2-CD 3.95Å; T391-K410 HydrophobicContact CG2-CG 3.72Å
392	E	96.6	Very high	94.8	Very high	59 Å²	59	42 Å²	42	28%	0.276	23%	0.228	S	C	.	.	S	Bend	trans	-140.4	159.2	176	-61.9	-164.7	167	0	0	110.2	W19 R22 P394	W19-E392 HydrophobicContact CZ2-CG 4.29Å; R22-E392 IonicContact NH1-OE2 3.8Å; R22-E392 PolarHBondContact NH1-OE2 3.31Å; R22-E392 VanDerWaalsContact NH1-OE2 3.12Å; E392-P394 WeakPolarHBondContact O-CD 3.45Å
393	V	97.2	Very high	94.7	Very high	17 Å²	17	39.6 Å²	39.6	10%	0.103	22%	0.219	C	C	.	.			trans	-62.3	127	174.8	-178.2	0	0	0	0	109.3	W19 Y334 Y337	W19-V393 HydrophobicContact CH2-CG2 4.26Å; Y334-V393 HydrophobicContact CD2-CG1 4.3Å; Y334-V393 HydrophobicContact CD2-CG2 4.1Å; Y337-V393 HydrophobicContact CD1-CB 4.35Å; Y337-V393 HydrophobicContact CD1-CG2 3.44Å; Y337-V393 VanDerWaalsContact CD1-CG2 3.44Å; Y337-V393 HydrophobicContact CE1-CG2 3.65Å; Y337-V393 HydrophobicContact CG-CB 4.45Å; Y337-V393 HydrophobicContact CG-CG2 4Å
394	P	97.7	Very high	94.9	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.032	21%	0.213	C	C	.	.			trans	-65.3	142.3	174.4	-23.1	36.3	0	0	0	111.4	L333 L342 L390 E392 T406 F407	L333-P394 HydrophobicContact CB-CB 4.48Å; L333-P394 HydrophobicContact CD1-CB 4.25Å; L333-P394 HydrophobicContact CD2-CB 4.39Å; L342-P394 HydrophobicContact CD1-CG 3.79Å; L390-P394 HydrophobicContact CD1-CG 3.38Å; L390-P394 HydrophobicContact CD2-CG 4.31Å; L390-P394 HydrophobicContact CG-CG 4.49Å; E392-P394 WeakPolarHBondContact O-CD 3.45Å; P394-T406 CarbonylContact C-O 3.55Å; P394-T406 VanDerWaalsContact CA-O 3.25Å; P394-T406 WeakPolarHBondContact CA-O 3.42Å; P394-F407 HydrophobicContact CB-CB 4.06Å; P394-F407 HydrophobicContact CG-CB 4.11Å
395	V	97.8	Very high	94.9	Very high	62 Å²	62	39.9 Å²	39.9	38%	0.376	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.7	-177.5	-178.3	0	0	0	0	109.9	V405 T406	V395-V405 WeakPolarHBondContact O-CA 3.38Å; V395-T406 PolarHBondContact N-O 2.92Å; V395-T406 PolarHBondContact O-N 3.2Å
396	A	96.9	Very high	95.1	Very high	2 Å²	2	39.8 Å²	39.8	2%	0.017	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	137.9	166.1	0	0	0	0	0	110.3	I329 N330 L333 T404 V405	I329-A396 HydrophobicContact CB-CB 4.22Å; I329-A396 HydrophobicContact CG2-CB 3.66Å; N330-A396 PolarHBondContact ND2-O 3.18Å; N330-A396 PolarHBondContact OD1-N 3.15Å; N330-A396 PolarHBondContact OD1-O 2.82Å; L333-A396 HydrophobicContact CD1-CB 4.05Å; A396-T404 CarbonylContact C-O 3.56Å; A396-T404 VanDerWaalsContact CA-O 3.24Å; A396-T404 WeakPolarHBondContact CA-O 3.33Å; A396-V405 HydrophobicContact CB-CG2 4.11Å
397	K	95.8	Very high	95.2	Very high	83 Å²	83	40.8 Å²	40.8	36%	0.361	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.7	176.6	-172	-178.3	178.6	-128.7	0	110	D399 A403 T404	K397-D399 WeakPolarHBondContact CE-OD1 3.47Å; K397-D399 WeakPolarHBondContact CE-OD2 3.44Å; K397-D399 IonicContact NZ-OD1 2.61Å; K397-D399 PolarHBondContact NZ-OD1 2.9Å; K397-D399 IonicContact NZ-OD2 2.88Å; K397-D399 PolarHBondContact NZ-OD2 3.14Å; K397-A403 CarbonylContact O-C 3.59Å; K397-A403 VanDerWaalsContact O-CA 3.31Å; K397-A403 WeakPolarHBondContact O-CA 3.41Å; K397-T404 PolarHBondContact N-O 3.32Å; K397-T404 PolarHBondContact O-N 2.86Å
398	F	93.8	Very high	95.4	Very high	21 Å²	21	42.2 Å²	42.2	9%	0.092	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.5	171.5	-60.1	-27.5	0	0	0	110	T325 D326 I329 A403 L512 N515 V517	T325-F398 WeakPolarHBondContact O-CE2 3.27Å; D326-F398 HydrophobicContact CB-CD2 3.82Å; D326-F398 HydrophobicContact CB-CE2 4.13Å; D326-F398 HydrophobicContact CB-CG 4.14Å; I329-F398 HydrophobicContact CG1-CZ 4.34Å; F398-A403 HydrophobicContact CD1-CB 3.54Å; F398-A403 HydrophobicContact CE1-CB 3.78Å; F398-L512 HydrophobicContact CB-CD2 4.35Å; F398-L512 HydrophobicContact CD1-CD2 4.34Å; F398-L512 HydrophobicContact CG-CD2 4.35Å; F398-N515 PolarHBondContact O-N 2.96Å; F398-V517 HydrophobicContact CD2-CG2 3.99Å; F398-V517 HydrophobicContact CE2-CG2 3.82Å; F398-V517 HydrophobicContact CG-CG2 4.38Å; F398-V517 HydrophobicContact CZ-CG2 4.11Å
399	D	91.9	Very high	95.5	Very high	43 Å²	43	41 Å²	41	23%	0.23	23%	0.229	C	C	.	.			trans	-119	178.7	169.3	-71.7	-59.9	0	0	0	109	K397 D401 K402 L512	K397-D399 WeakPolarHBondContact CE-OD1 3.47Å; K397-D399 WeakPolarHBondContact CE-OD2 3.44Å; K397-D399 IonicContact NZ-OD1 2.61Å; K397-D399 PolarHBondContact NZ-OD1 2.9Å; K397-D399 IonicContact NZ-OD2 2.88Å; K397-D399 PolarHBondContact NZ-OD2 3.14Å; D399-D401 VanDerWaalsContact C-N 3.3Å; D399-D401 PolarHBondContact O-N 3Å; D399-K402 PolarHBondContact N-O 2.88Å; D399-L512 WeakPolarHBondContact O-CB 3.13Å
400	A	88.5	Confident	95.5	Very high	60 Å²	60	43.5 Å²	43.5	50%	0.496	23%	0.233	S	C	.	.	S	Bend	trans	-61	-37.9	-174.8	0	0	0	0	0	113.4	L512	A400-L512 WeakPolarHBondContact O-CB 3.15Å
401	D	87.5	Confident	95.5	Very high	155 Å²	155	42.9 Å²	42.9	83%	0.829	23%	0.23	S	C	*	.	S	Bend	trans	-105.4	-23.2	-170.3	-53.7	-48.8	0	0	0	113.3	D399	D399-D401 VanDerWaalsContact C-N 3.3Å; D399-D401 PolarHBondContact O-N 3Å
402	K	92.4	Very high	95.4	Very high	68 Å²	68	42.9 Å²	42.9	30%	0.296	23%	0.226	S	C	.	.			trans	-150.9	156.2	-175.8	64.6	177.3	-179.8	176.6	0	112.8	D399 T404 E451	D399-K402 PolarHBondContact N-O 2.88Å; K402-T404 HydrophobicContact CD-CG2 4.02Å; K402-T404 HydrophobicContact CG-CG2 4.29Å; K402-E451 IonicContact NZ-OE1 3.18Å; K402-E451 PolarHBondContact NZ-OE1 2.86Å; K402-E451 IonicContact NZ-OE2 2.74Å; K402-E451 PolarHBondContact NZ-OE2 2.88Å
403	A	94.3	Very high	95.4	Very high	2 Å²	2	40 Å²	40	2%	0.017	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	149.3	162.1	0	0	0	0	0	108.1	K397 F398 P435 L512	K397-A403 CarbonylContact O-C 3.59Å; K397-A403 VanDerWaalsContact O-CA 3.31Å; K397-A403 WeakPolarHBondContact O-CA 3.41Å; F398-A403 HydrophobicContact CD1-CB 3.54Å; F398-A403 HydrophobicContact CE1-CB 3.78Å; A403-P435 HydrophobicContact CB-CG 3.88Å; A403-P435 WeakPolarHBondContact O-CD 3.5Å; A403-L512 HydrophobicContact CB-CD2 4.46Å
404	T	97	Very high	95.3	Very high	16 Å²	16	39.8 Å²	39.8	10%	0.098	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.5	172.4	55.8	0	0	0	0	110.8	A396 K397 K402 V432 I433	A396-T404 CarbonylContact C-O 3.56Å; A396-T404 VanDerWaalsContact CA-O 3.24Å; A396-T404 WeakPolarHBondContact CA-O 3.33Å; K397-T404 PolarHBondContact N-O 3.32Å; K397-T404 PolarHBondContact O-N 2.86Å; K402-T404 HydrophobicContact CD-CG2 4.02Å; K402-T404 HydrophobicContact CG-CG2 4.29Å; T404-V432 HydrophobicContact CG2-CG1 4.34Å; T404-I433 CarbonylContact C-O 3.6Å; T404-I433 WeakPolarHBondContact CA-O 3.4Å
405	V	97.3	Very high	95.3	Very high	32 Å²	32	39.6 Å²	39.6	19%	0.194	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	118.1	169.9	-178.5	0	0	0	0	108.1	L333 V395 A396 I433 P435	L333-V405 HydrophobicContact CD1-CG1 4.37Å; V395-V405 WeakPolarHBondContact O-CA 3.38Å; A396-V405 HydrophobicContact CB-CG2 4.11Å; V405-I433 HydrophobicContact CB-CB 4.37Å; V405-I433 PolarHBondContact N-O 2.82Å; V405-I433 PolarHBondContact O-N 2.92Å; V405-P435 HydrophobicContact CG2-CG 4.39Å
406	T	98.1	Very high	95.2	Very high	48 Å²	48	37.2 Å²	37.2	29%	0.294	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.4	178.5	-55.7	0	0	0	0	109.7	P394 V395 A431 V432	P394-T406 CarbonylContact C-O 3.55Å; P394-T406 VanDerWaalsContact CA-O 3.25Å; P394-T406 WeakPolarHBondContact CA-O 3.42Å; V395-T406 PolarHBondContact N-O 2.92Å; V395-T406 PolarHBondContact O-N 3.2Å; T406-A431 WeakPolarHBondContact CA-O 3.41Å; T406-V432 HydrophobicContact CG2-CG2 4.27Å
407	F	97.2	Very high	95	Very high	23 Å²	23	40.2 Å²	40.2	10%	0.101	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	151.7	172.7	68.8	-94.3	0	0	0	111.6	F388 L390 P394 V429 A431 I433 F450	F388-F407 HydrophobicContact CE2-CE2 4.46Å; F388-F407 AromaticContact CZ-CD2 3.91Å; F388-F407 HydrophobicContact CZ-CD2 3.91Å; F388-F407 AromaticContact CZ-CE2 3.83Å; F388-F407 HydrophobicContact CZ-CE2 3.83Å; L390-F407 HydrophobicContact CD2-CB 3.91Å; L390-F407 HydrophobicContact CD2-CD2 4.02Å; L390-F407 HydrophobicContact CD2-CG 4.35Å; P394-F407 HydrophobicContact CB-CB 4.06Å; P394-F407 HydrophobicContact CG-CB 4.11Å; F407-V429 HydrophobicContact CE2-CG1 4.17Å; F407-A431 HydrophobicContact CD1-CB 4.15Å; F407-A431 HydrophobicContact CD2-CB 4.37Å; F407-A431 HydrophobicContact CE1-CB 3.58Å; F407-A431 HydrophobicContact CE2-CB 3.83Å; F407-A431 HydrophobicContact CZ-CB 3.41Å; F407-A431 VanDerWaalsContact CZ-CB 3.41Å; F407-A431 PolarHBondContact N-O 3.03Å; F407-A431 PolarHBondContact O-N 3.46Å; F407-I433 HydrophobicContact CD1-CD1 4.15Å; F407-I433 HydrophobicContact CE1-CD1 3.62Å; F407-I433 HydrophobicContact CE1-CG1 4.13Å; F407-F450 AromaticContact CE1-CE1 3.83Å; F407-F450 HydrophobicContact CE1-CE1 3.83Å; F407-F450 HydrophobicContact CE1-CZ 4.39Å; F407-F450 AromaticContact CZ-CE1 3.93Å; F407-F450 HydrophobicContact CZ-CE1 3.93Å; F407-F450 HydrophobicContact CZ-CZ 4.27Å
408	E	97.7	Very high	94.7	Very high	51 Å²	51	47.9 Å²	47.9	24%	0.238	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.8	176.3	-59.9	-167.1	-168.2	0	0	109.5	L390 T391 V429 K430	L390-E408 WeakPolarHBondContact CA-O 3.31Å; L390-E408 VanDerWaalsContact CD2-O 3.31Å; L390-E408 WeakPolarHBondContact CD2-O 3.25Å; T391-E408 PolarHBondContact N-O 3.42Å; T391-E408 PolarHBondContact OG1-O 2.75Å; E408-V429 CarbonylContact C-O 3.53Å; E408-V429 VanDerWaalsContact CA-O 3.27Å; E408-V429 WeakPolarHBondContact CA-O 3.29Å; E408-K430 HydrophobicContact CG-CB 4.16Å; E408-K430 HydrophobicContact CG-CD 4.3Å; E408-K430 HydrophobicContact CG-CG 3.96Å; E408-K430 VanDerWaalsContact OE1-CD 3.29Å; E408-K430 WeakPolarHBondContact OE1-CD 3.38Å; E408-K430 WeakPolarHBondContact OE1-CE 3.47Å; E408-K430 IonicContact OE1-NZ 2.83Å; E408-K430 PolarHBondContact OE1-NZ 3.42Å
409	G	97.1	Very high	94.5	Very high	1 Å²	1	55 Å²	55	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	178.1	-175.5	0	0	0	0	0	114	A389 T391 V429	A389-G409 CarbonylContact O-C 3.56Å; A389-G409 WeakPolarHBondContact O-CA 3.29Å; T391-G409 PolarHBondContact OG1-N 2.95Å; G409-V429 PolarHBondContact N-O 2.85Å; G409-V429 PolarHBondContact O-N 2.74Å
410	K	97.2	Very high	94.5	Very high	93 Å²	93	57.4 Å²	57.4	40%	0.404	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	133.1	172.7	-72.3	172.4	-177	176.5	0	108.8	F388 A389 T391 Y427	F388-K410 CarbonylContact C-O 3.59Å; F388-K410 WeakPolarHBondContact CA-O 3.44Å; A389-K410 PolarHBondContact N-O 2.93Å; A389-K410 PolarHBondContact O-N 3.43Å; T391-K410 HydrophobicContact CG2-CD 3.95Å; T391-K410 HydrophobicContact CG2-CG 3.72Å; K410-Y427 WeakPolarHBondContact CA-O 2.91Å
411	L	96.1	Very high	94.8	Very high	6 Å²	6	60.9 Å²	60.9	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.3	172.8	-179.7	66.4	0	0	0	108.5	A386 T387 F388 F413 A426 Y427 V429 M455 L479	A386-L411 HydrophobicContact CB-CD1 4.26Å; T387-L411 WeakPolarHBondContact O-CA 3.36Å; F388-L411 HydrophobicContact CB-CD1 4.01Å; F388-L411 HydrophobicContact CD2-CB 4.33Å; L411-F413 HydrophobicContact CD1-CE2 4.37Å; L411-F413 HydrophobicContact CD2-CE2 3.49Å; L411-F413 VanDerWaalsContact CD2-CE2 3.49Å; L411-F413 HydrophobicContact CD2-CZ 3.83Å; L411-F413 HydrophobicContact CG-CD2 4.26Å; L411-F413 HydrophobicContact CG-CE2 3.6Å; L411-F413 HydrophobicContact CG-CZ 4.2Å; L411-A426 CarbonylContact O-C 3.59Å; L411-A426 VanDerWaalsContact O-CA 3.25Å; L411-A426 WeakPolarHBondContact O-CA 3.48Å; L411-Y427 PolarHBondContact N-O 2.88Å; L411-Y427 PolarHBondContact O-N 3.43Å; L411-V429 HydrophobicContact CB-CG2 3.85Å; L411-M455 HydrophobicContact CD2-CE 3.82Å; L411-L479 HydrophobicContact CD2-CD1 3.32Å
412	E	95.9	Very high	95.1	Very high	53 Å²	53	56.7 Å²	56.7	25%	0.248	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	132.5	-176.7	-55.7	-172.4	127.1	0	0	110	A386 T387 F414 K423 A426	A386-E412 CarbonylContact C-O 3.57Å; A386-E412 WeakPolarHBondContact CA-O 3.36Å; T387-E412 PolarHBondContact N-O 3.44Å; T387-E412 PolarHBondContact O-N 2.79Å; E412-F414 HydrophobicContact CB-CD2 4.41Å; E412-F414 HydrophobicContact CB-CE2 3.47Å; E412-F414 VanDerWaalsContact CB-CE2 3.47Å; E412-F414 HydrophobicContact CB-CZ 3.85Å; E412-K423 WeakPolarHBondContact OE1-CE 3.17Å; E412-K423 IonicContact OE1-NZ 2.62Å; E412-K423 PolarHBondContact OE1-NZ 2.85Å; E412-A426 HydrophobicContact CB-CB 4.41Å; E412-A426 HydrophobicContact CG-CB 3.95Å
413	F	96.1	Very high	95.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	139.1	178.5	-70.2	-101.2	0	0	0	110.2	L358 I368 I384 E385 A386 L411 L424 F425 Y427 L475 L479	L358-F413 HydrophobicContact CD2-CD1 4.15Å; L358-F413 HydrophobicContact CD2-CE1 3.76Å; I368-F413 HydrophobicContact CD1-CD1 3.99Å; I368-F413 HydrophobicContact CD1-CE1 3.81Å; I384-F413 HydrophobicContact CG2-CD1 4.34Å; E385-F413 CarbonylContact O-C 3.54Å; E385-F413 WeakPolarHBondContact O-CA 3.29Å; A386-F413 HydrophobicContact CB-CD1 3.83Å; A386-F413 HydrophobicContact CB-CE1 3.71Å; A386-F413 HydrophobicContact CB-CG 4.42Å; A386-F413 HydrophobicContact CB-CZ 4.22Å; L411-F413 HydrophobicContact CD1-CE2 4.37Å; L411-F413 HydrophobicContact CD2-CE2 3.49Å; L411-F413 VanDerWaalsContact CD2-CE2 3.49Å; L411-F413 HydrophobicContact CD2-CZ 3.83Å; L411-F413 HydrophobicContact CG-CD2 4.26Å; L411-F413 HydrophobicContact CG-CE2 3.6Å; L411-F413 HydrophobicContact CG-CZ 4.2Å; F413-L424 HydrophobicContact CB-CB 4.39Å; F413-L424 PolarHBondContact O-N 3.38Å; F413-F425 HydrophobicContact CB-CD2 4.02Å; F413-F425 HydrophobicContact CB-CE1 4.29Å; F413-F425 HydrophobicContact CB-CE2 3.71Å; F413-F425 HydrophobicContact CB-CG 4.47Å; F413-F425 HydrophobicContact CB-CZ 3.85Å; F413-F425 HydrophobicContact CD1-CE2 4.05Å; F413-F425 HydrophobicContact CD1-CZ 4.11Å; F413-F425 AromaticContact CD2-CD2 3.62Å; F413-F425 HydrophobicContact CD2-CD2 3.62Å; F413-F425 AromaticContact CD2-CE2 3.19Å; F413-F425 HydrophobicContact CD2-CE2 3.19Å; F413-F425 HydrophobicContact CD2-CZ 4.04Å; F413-F425 HydrophobicContact CE1-CE2 4.47Å; F413-F425 HydrophobicContact CE2-CD2 4.33Å; F413-F425 AromaticContact CE2-CE2 3.7Å; F413-F425 HydrophobicContact CE2-CE2 3.7Å; F413-F425 HydrophobicContact CG-CD2 4.02Å; F413-F425 AromaticContact CG-CE2 3.38Å; F413-F425 HydrophobicContact CG-CE2 3.38Å; F413-F425 AromaticContact CG-CZ 3.75Å; F413-F425 HydrophobicContact CG-CZ 3.75Å; F413-F425 HydrophobicContact CZ-CE2 4.31Å; F413-F425 PolarHBondContact N-O 3.23Å; F413-Y427 HydrophobicContact CE2-CD2 4.32Å; F413-Y427 HydrophobicContact CE2-CE2 4.5Å; F413-L475 HydrophobicContact CZ-CD2 4.29Å; F413-L479 HydrophobicContact CZ-CD1 4.4Å
414	F	96.2	Very high	95.3	Very high	12 Å²	12	56.1 Å²	56.1	5%	0.053	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	145.2	-178.5	-59.1	-95.6	0	0	0	110.5	I384 E385 T387 E412 T416 R421 Q422 K423	I384-F414 WeakPolarHBondContact CA-O 3.33Å; E385-F414 HydrophobicContact CB-CB 4.44Å; E385-F414 PolarHBondContact N-O 3.31Å; E385-F414 PolarHBondContact O-N 2.83Å; T387-F414 HydrophobicContact CG2-CD2 4.33Å; T387-F414 HydrophobicContact CG2-CE2 4.14Å; T387-F414 WeakPolarHBondContact OG1-CE2 3.41Å; E412-F414 HydrophobicContact CB-CD2 4.41Å; E412-F414 HydrophobicContact CB-CE2 3.47Å; E412-F414 VanDerWaalsContact CB-CE2 3.47Å; E412-F414 HydrophobicContact CB-CZ 3.85Å; F414-T416 HydrophobicContact CB-CG2 4.49Å; F414-R421 HydrophobicContact CB-CG 4.33Å; F414-R421 HydrophobicContact CD1-CG 3.98Å; F414-R421 VanDerWaalsContact CE1-NH1 3.3Å; F414-R421 HydrophobicContact CG-CG 4.4Å; F414-Q422 CarbonylContact C-O 3.52Å; F414-Q422 VanDerWaalsContact CA-O 3.22Å; F414-Q422 WeakPolarHBondContact CA-O 3.48Å; F414-K423 HydrophobicContact CD1-CB 3.79Å; F414-K423 HydrophobicContact CD1-CG 4.27Å; F414-K423 HydrophobicContact CE1-CB 3.61Å; F414-K423 HydrophobicContact CE1-CD 4.18Å; F414-K423 HydrophobicContact CE1-CG 3.87Å; F414-K423 HydrophobicContact CZ-CB 4.48Å; F414-K423 HydrophobicContact CZ-CD 4.33Å; F414-K423 HydrophobicContact CZ-CG 4.27Å
415	A	96.4	Very high	95.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125	162.1	0	0	0	0	0	108.4	Y379 Y382 D383 I384 Q422 L424	Y379-A415 HydrophobicContact CD1-CB 3.5Å; Y379-A415 VanDerWaalsContact CD1-CB 3.5Å; Y379-A415 HydrophobicContact CE1-CB 3.86Å; Y379-A415 HydrophobicContact CG-CB 4.06Å; Y382-A415 HydrophobicContact CD1-CB 3.71Å; Y382-A415 HydrophobicContact CG-CB 4.07Å; D383-A415 CarbonylContact O-C 3.48Å; D383-A415 WeakPolarHBondContact O-CA 3.39Å; I384-A415 HydrophobicContact CD1-CB 4.23Å; A415-Q422 PolarHBondContact N-O 2.61Å; A415-Q422 PolarHBondContact O-N 2.91Å; A415-L424 HydrophobicContact CB-CD1 4.03Å; A415-L424 HydrophobicContact CB-CD2 3.88Å; A415-L424 HydrophobicContact CB-CG 4.1Å
416	T	94.9	Very high	95.1	Very high	13 Å²	13	54 Å²	54	8%	0.08	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.9	178.5	56.7	0	0	0	0	111.4	D383 E385 F414 I420 R421	D383-T416 PolarHBondContact N-O 3.04Å; D383-T416 PolarHBondContact O-N 3.47Å; D383-T416 PolarHBondContact O-OG1 2.81Å; E385-T416 HydrophobicContact CG-CG2 4.35Å; E385-T416 WeakPolarHBondContact OE1-CG2 3.4Å; E385-T416 PolarHBondContact OE1-OG1 3.36Å; F414-T416 HydrophobicContact CB-CG2 4.49Å; T416-I420 VanDerWaalsContact CA-O 3.28Å; T416-I420 WeakPolarHBondContact CA-O 3.28Å; T416-R421 HydrophobicContact CG2-CB 4Å; T416-R421 HydrophobicContact CG2-CG 3.71Å
417	K	93.8	Very high	95.1	Very high	65 Å²	65	51.7 Å²	51.7	28%	0.283	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	117.4	173.4	-172.8	176.5	-170.9	177.3	0	108.5	D381 Y382 N419 I420	D381-K417 HydrophobicContact CB-CD 4.29Å; D381-K417 IonicContact OD2-NZ 3.01Å; D381-K417 PolarHBondContact OD2-NZ 3.13Å; Y382-K417 HydrophobicContact CD1-CB 3.41Å; Y382-K417 VanDerWaalsContact CD1-CB 3.41Å; Y382-K417 HydrophobicContact CD2-CB 4.31Å; Y382-K417 HydrophobicContact CD2-CD 4Å; Y382-K417 HydrophobicContact CE1-CB 3.43Å; Y382-K417 VanDerWaalsContact CE1-CB 3.43Å; Y382-K417 HydrophobicContact CE1-CD 4.39Å; Y382-K417 HydrophobicContact CE2-CB 4.33Å; Y382-K417 HydrophobicContact CE2-CD 3.78Å; Y382-K417 HydrophobicContact CG-CB 3.87Å; Y382-K417 HydrophobicContact CG-CD 4.38Å; K417-N419 PolarHBondContact O-N 3.25Å; K417-N419 VanDerWaalsContact O-N 3.13Å; K417-I420 PolarHBondContact N-O 3.47Å; K417-I420 WeakPolarHBondContact O-CB 3.12Å; K417-I420 PolarHBondContact O-N 3.44Å
418	R	88.7	Confident	95.1	Very high	244 Å²	244	53.2 Å²	53.2	92%	0.921	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	-115.5	-174.2	-57.4	177.1	177.5	175.2	-1.5	110.4
419	N	89.3	Confident	95	Very high	169 Å²	169	51.1 Å²	51.1	90%	0.904	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	1.8	179.2	-65.3	-19.1	0	0	0	113.5	K417	K417-N419 PolarHBondContact O-N 3.25Å; K417-N419 VanDerWaalsContact O-N 3.13Å
420	I	92.8	Very high	95	Very high	94 Å²	94	55.2 Å²	55.2	48%	0.482	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.1	179.8	-57.9	174	0	0	0	108.2	Y382 T416 K417	Y382-I420 HydrophobicContact CE1-CG2 4.23Å; T416-I420 VanDerWaalsContact CA-O 3.28Å; T416-I420 WeakPolarHBondContact CA-O 3.28Å; K417-I420 PolarHBondContact N-O 3.47Å; K417-I420 WeakPolarHBondContact O-CB 3.12Å; K417-I420 PolarHBondContact O-N 3.44Å
421	R	93.8	Very high	95	Very high	134 Å²	134	50.8 Å²	50.8	51%	0.506	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	105.2	171.8	-179.1	164.8	-168.7	-89.6	0.2	109.1	E385 F414 T416	E385-R421 IonicContact OE2-NE 3.6Å; F414-R421 HydrophobicContact CB-CG 4.33Å; F414-R421 HydrophobicContact CD1-CG 3.98Å; F414-R421 VanDerWaalsContact CE1-NH1 3.3Å; F414-R421 HydrophobicContact CG-CG 4.4Å; T416-R421 HydrophobicContact CG2-CB 4Å; T416-R421 HydrophobicContact CG2-CG 3.71Å
422	Q	94.1	Very high	95.1	Very high	66 Å²	66	51.8 Å²	51.8	31%	0.308	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.8	-178.7	-175.9	175.8	3.9	0	0	110.3	Y379 F414 A415 L424 G463	Y379-Q422 PolarHBondContact OH-NE2 3.35Å; Y379-Q422 VanDerWaalsContact OH-NE2 3.09Å; Y379-Q422 PolarHBondContact OH-OE1 2.56Å; F414-Q422 CarbonylContact C-O 3.52Å; F414-Q422 VanDerWaalsContact CA-O 3.22Å; F414-Q422 WeakPolarHBondContact CA-O 3.48Å; A415-Q422 PolarHBondContact N-O 2.61Å; A415-Q422 PolarHBondContact O-N 2.91Å; Q422-L424 PolarHBondContact O-N 3.1Å; Q422-G463 PolarHBondContact NE2-O 3.32Å
423	K	95.6	Very high	95.1	Very high	58 Å²	58	49.9 Å²	49.9	25%	0.252	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	126.6	172.2	-172.7	171	173.4	175.8	0	109.8	E412 F414	E412-K423 WeakPolarHBondContact OE1-CE 3.17Å; E412-K423 IonicContact OE1-NZ 2.62Å; E412-K423 PolarHBondContact OE1-NZ 2.85Å; F414-K423 HydrophobicContact CD1-CB 3.79Å; F414-K423 HydrophobicContact CD1-CG 4.27Å; F414-K423 HydrophobicContact CE1-CB 3.61Å; F414-K423 HydrophobicContact CE1-CD 4.18Å; F414-K423 HydrophobicContact CE1-CG 3.87Å; F414-K423 HydrophobicContact CZ-CB 4.48Å; F414-K423 HydrophobicContact CZ-CD 4.33Å; F414-K423 HydrophobicContact CZ-CG 4.27Å
424	L	95.8	Very high	95.1	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-53.8	-177.4	-63	169.8	0	0	0	111.3	L375 Y379 I384 F413 A415 Q422 Q464 L465	L375-L424 HydrophobicContact CD2-CD1 3.74Å; L375-L424 HydrophobicContact CD2-CD2 4.29Å; Y379-L424 HydrophobicContact CD1-CD2 4.44Å; Y379-L424 HydrophobicContact CD2-CD2 3.87Å; Y379-L424 HydrophobicContact CE1-CD2 4.07Å; Y379-L424 HydrophobicContact CE2-CD2 3.43Å; Y379-L424 VanDerWaalsContact CE2-CD2 3.43Å; Y379-L424 HydrophobicContact CG-CD2 4.35Å; I384-L424 HydrophobicContact CD1-CD1 3.96Å; I384-L424 HydrophobicContact CG2-CD1 4.4Å; F413-L424 HydrophobicContact CB-CB 4.39Å; F413-L424 PolarHBondContact O-N 3.38Å; A415-L424 HydrophobicContact CB-CD1 4.03Å; A415-L424 HydrophobicContact CB-CD2 3.88Å; A415-L424 HydrophobicContact CB-CG 4.1Å; Q422-L424 PolarHBondContact O-N 3.1Å; L424-Q464 CarbonylContact O-C 3.52Å; L424-Q464 WeakPolarHBondContact O-CA 2.99Å; L424-Q464 WeakPolarHBondContact O-CB 3.44Å; L424-L465 HydrophobicContact CD2-CD1 4.17Å; L424-L465 HydrophobicContact CD2-CG 4.49Å; L424-L465 PolarHBondContact O-N 3.39Å
425	F	95.4	Very high	94.9	Very high	1 Å²	1	52 Å²	52	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	166.8	-179.9	48.3	-93.7	0	0	0	109.9	I368 I372 F413 Y427 L465 L467 L475	I368-F425 HydrophobicContact CD1-CZ 4.32Å; I372-F425 HydrophobicContact CD1-CE1 4.03Å; I372-F425 HydrophobicContact CD1-CZ 3.7Å; F413-F425 HydrophobicContact CB-CD2 4.02Å; F413-F425 HydrophobicContact CB-CE1 4.29Å; F413-F425 HydrophobicContact CB-CE2 3.71Å; F413-F425 HydrophobicContact CB-CG 4.47Å; F413-F425 HydrophobicContact CB-CZ 3.85Å; F413-F425 HydrophobicContact CD1-CE2 4.05Å; F413-F425 HydrophobicContact CD1-CZ 4.11Å; F413-F425 AromaticContact CD2-CD2 3.62Å; F413-F425 HydrophobicContact CD2-CD2 3.62Å; F413-F425 AromaticContact CD2-CE2 3.19Å; F413-F425 HydrophobicContact CD2-CE2 3.19Å; F413-F425 HydrophobicContact CD2-CZ 4.04Å; F413-F425 HydrophobicContact CE1-CE2 4.47Å; F413-F425 HydrophobicContact CE2-CD2 4.33Å; F413-F425 AromaticContact CE2-CE2 3.7Å; F413-F425 HydrophobicContact CE2-CE2 3.7Å; F413-F425 HydrophobicContact CG-CD2 4.02Å; F413-F425 AromaticContact CG-CE2 3.38Å; F413-F425 HydrophobicContact CG-CE2 3.38Å; F413-F425 AromaticContact CG-CZ 3.75Å; F413-F425 HydrophobicContact CG-CZ 3.75Å; F413-F425 HydrophobicContact CZ-CE2 4.31Å; F413-F425 PolarHBondContact N-O 3.23Å; F425-Y427 HydrophobicContact CD2-CD2 4.21Å; F425-Y427 AromaticContact CD2-CE2 3.55Å; F425-Y427 HydrophobicContact CD2-CE2 3.55Å; F425-Y427 AromaticContact CE2-CE2 3.86Å; F425-Y427 HydrophobicContact CE2-CE2 3.86Å; F425-L465 HydrophobicContact CD1-CB 4.27Å; F425-L465 HydrophobicContact CD1-CD1 4.49Å; F425-L467 HydrophobicContact CD1-CD1 3.79Å; F425-L467 HydrophobicContact CD1-CD2 4.46Å; F425-L467 HydrophobicContact CD1-CG 4.2Å; F425-L467 HydrophobicContact CD2-CD1 3.7Å; F425-L467 HydrophobicContact CE1-CD1 3.82Å; F425-L467 HydrophobicContact CE1-CD2 4.39Å; F425-L467 HydrophobicContact CE1-CG 4.45Å; F425-L467 HydrophobicContact CE2-CD1 3.69Å; F425-L467 HydrophobicContact CG-CD1 3.74Å; F425-L467 HydrophobicContact CG-CG 4.38Å; F425-L467 HydrophobicContact CZ-CD1 3.77Å; F425-L475 HydrophobicContact CE2-CD1 4.06Å; F425-L475 HydrophobicContact CZ-CD1 4.39Å
426	A	95.8	Very high	94.7	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	154.6	-180	0	0	0	0	0	112.7	L411 E412 M458	L411-A426 CarbonylContact O-C 3.59Å; L411-A426 VanDerWaalsContact O-CA 3.25Å; L411-A426 WeakPolarHBondContact O-CA 3.48Å; E412-A426 HydrophobicContact CB-CB 4.41Å; E412-A426 HydrophobicContact CG-CB 3.95Å; A426-M458 HydrophobicContact CB-CB 4.31Å; A426-M458 HydrophobicContact CB-CG 4.28Å; A426-M458 HydrophobicContact CB-SD 3.78Å; A426-M458 PolarHBondContact O-N 3.01Å
427	Y	96.3	Very high	94.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.1	179.1	-66.8	-90.7	0	0	0	110.9	K410 L411 F413 F425 M455 N456 R457 L467 S472 L475	K410-Y427 WeakPolarHBondContact CA-O 2.91Å; L411-Y427 PolarHBondContact N-O 2.88Å; L411-Y427 PolarHBondContact O-N 3.43Å; F413-Y427 HydrophobicContact CE2-CD2 4.32Å; F413-Y427 HydrophobicContact CE2-CE2 4.5Å; F425-Y427 HydrophobicContact CD2-CD2 4.21Å; F425-Y427 AromaticContact CD2-CE2 3.55Å; F425-Y427 HydrophobicContact CD2-CE2 3.55Å; F425-Y427 AromaticContact CE2-CE2 3.86Å; F425-Y427 HydrophobicContact CE2-CE2 3.86Å; Y427-M455 HydrophobicContact CD1-CB 4Å; Y427-M455 HydrophobicContact CD1-CE 3.83Å; Y427-M455 HydrophobicContact CD2-CE 3.58Å; Y427-M455 HydrophobicContact CE1-CE 4.32Å; Y427-M455 HydrophobicContact CE2-CE 4.07Å; Y427-M455 HydrophobicContact CG-CB 4.46Å; Y427-M455 HydrophobicContact CG-CE 3.45Å; Y427-M455 VanDerWaalsContact CG-CE 3.45Å; Y427-N456 CarbonylContact C-O 3.51Å; Y427-N456 VanDerWaalsContact CA-O 3.3Å; Y427-N456 WeakPolarHBondContact CA-O 3.47Å; Y427-R457 HydrophobicContact CD1-CB 3.99Å; Y427-R457 HydrophobicContact CE1-CB 3.71Å; Y427-R457 HydrophobicContact CE1-CG 4.11Å; Y427-L467 VanDerWaalsContact OH-CD1 3.27Å; Y427-L467 WeakPolarHBondContact OH-CD1 3.31Å; Y427-S472 WeakPolarHBondContact OH-CB 3.41Å; Y427-S472 PolarHBondContact OH-OG 2.97Å; Y427-L475 HydrophobicContact CE2-CD1 4.17Å
428	T	97.2	Very high	94.3	Very high	55 Å²	55	62.2 Å²	62.2	34%	0.337	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130.2	157.2	58.3	0	0	0	0	108.4	M455 N456 M458	T428-M455 WeakPolarHBondContact O-CA 2.93Å; T428-N456 PolarHBondContact N-O 2.83Å; T428-N456 PolarHBondContact O-N 3.12Å; T428-N456 PolarHBondContact OG1-O 2.98Å; T428-M458 HydrophobicContact CG2-CG 4.04Å; T428-M458 HydrophobicContact CG2-SD 4.23Å
429	V	96.7	Very high	94.2	Very high	7 Å²	7	52.7 Å²	52.7	4%	0.042	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.3	-179.1	-175.2	0	0	0	0	107.8	F388 F407 E408 G409 L411 F453 T454 M455	F388-V429 HydrophobicContact CD2-CG2 4.47Å; F388-V429 HydrophobicContact CE2-CB 4.07Å; F388-V429 HydrophobicContact CE2-CG1 4.4Å; F388-V429 HydrophobicContact CE2-CG2 4.12Å; F407-V429 HydrophobicContact CE2-CG1 4.17Å; E408-V429 CarbonylContact C-O 3.53Å; E408-V429 VanDerWaalsContact CA-O 3.27Å; E408-V429 WeakPolarHBondContact CA-O 3.29Å; G409-V429 PolarHBondContact N-O 2.85Å; G409-V429 PolarHBondContact O-N 2.74Å; L411-V429 HydrophobicContact CB-CG2 3.85Å; V429-F453 HydrophobicContact CG1-CE2 3.94Å; V429-F453 HydrophobicContact CG1-CZ 4.15Å; V429-T454 WeakPolarHBondContact CA-O 3.23Å; V429-M455 HydrophobicContact CG2-CG 4.17Å
430	K	97.5	Very high	94	Very high	87 Å²	87	49.3 Å²	49.3	38%	0.378	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	125.5	168.8	173.5	168.3	-172.2	144.6	0	108.8	E408 T454	E408-K430 HydrophobicContact CG-CB 4.16Å; E408-K430 HydrophobicContact CG-CD 4.3Å; E408-K430 HydrophobicContact CG-CG 3.96Å; E408-K430 VanDerWaalsContact OE1-CD 3.29Å; E408-K430 WeakPolarHBondContact OE1-CD 3.38Å; E408-K430 WeakPolarHBondContact OE1-CE 3.47Å; E408-K430 IonicContact OE1-NZ 2.83Å; E408-K430 PolarHBondContact OE1-NZ 3.42Å; K430-T454 PolarHBondContact N-O 2.81Å; K430-T454 PolarHBondContact O-N 2.88Å; K430-T454 PolarHBondContact O-OG1 2.84Å
431	A	97.2	Very high	93.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	149.1	-174.5	0	0	0	0	0	113.1	T406 F407 F450 K452 F453	T406-A431 WeakPolarHBondContact CA-O 3.41Å; F407-A431 HydrophobicContact CD1-CB 4.15Å; F407-A431 HydrophobicContact CD2-CB 4.37Å; F407-A431 HydrophobicContact CE1-CB 3.58Å; F407-A431 HydrophobicContact CE2-CB 3.83Å; F407-A431 HydrophobicContact CZ-CB 3.41Å; F407-A431 VanDerWaalsContact CZ-CB 3.41Å; F407-A431 PolarHBondContact N-O 3.03Å; F407-A431 PolarHBondContact O-N 3.46Å; A431-F450 HydrophobicContact CB-CD1 3.9Å; A431-F450 HydrophobicContact CB-CE1 3.61Å; A431-K452 CarbonylContact C-O 3.55Å; A431-K452 VanDerWaalsContact CA-O 3.23Å; A431-K452 WeakPolarHBondContact CA-O 3.26Å; A431-F453 HydrophobicContact CB-CD2 3.78Å; A431-F453 HydrophobicContact CB-CE2 4.41Å
432	V	97.6	Very high	92.8	Very high	27 Å²	27	46.3 Å²	46.3	16%	0.164	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	116.3	175.7	-176.4	0	0	0	0	107.2	T404 T406 F450 E451 K452	T404-V432 HydrophobicContact CG2-CG1 4.34Å; T406-V432 HydrophobicContact CG2-CG2 4.27Å; V432-F450 CarbonylContact O-C 3.54Å; V432-F450 WeakPolarHBondContact O-CA 3.4Å; V432-E451 HydrophobicContact CB-CB 4.39Å; V432-E451 HydrophobicContact CG1-CB 4.21Å; V432-E451 PolarHBondContact O-N 2.98Å; V432-K452 HydrophobicContact CB-CB 4.15Å; V432-K452 HydrophobicContact CG2-CB 4.2Å; V432-K452 PolarHBondContact N-O 2.96Å; V432-K452 PolarHBondContact O-N 2.84Å
433	I	96.4	Very high	92.4	Very high	14 Å²	14	47.2 Å²	47.2	7%	0.072	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	135.7	176.8	-60.6	164.3	0	0	0	108.9	T404 V405 F407 P435 A448 R449 F450 L487	T404-I433 CarbonylContact C-O 3.6Å; T404-I433 WeakPolarHBondContact CA-O 3.4Å; V405-I433 HydrophobicContact CB-CB 4.37Å; V405-I433 PolarHBondContact N-O 2.82Å; V405-I433 PolarHBondContact O-N 2.92Å; F407-I433 HydrophobicContact CD1-CD1 4.15Å; F407-I433 HydrophobicContact CE1-CD1 3.62Å; F407-I433 HydrophobicContact CE1-CG1 4.13Å; I433-P435 VanDerWaalsContact O-CD 3.24Å; I433-P435 WeakPolarHBondContact O-CD 3.45Å; I433-A448 HydrophobicContact CG2-CB 3.72Å; I433-R449 CarbonylContact C-O 3.54Å; I433-R449 WeakPolarHBondContact CA-O 3.28Å; I433-F450 HydrophobicContact CD1-CE1 3.95Å; I433-F450 HydrophobicContact CD1-CZ 4.32Å; I433-F450 HydrophobicContact CG1-CD1 3.61Å; I433-F450 HydrophobicContact CG1-CE1 3.39Å; I433-F450 HydrophobicContact CG1-CG 4.45Å; I433-F450 HydrophobicContact CG1-CZ 4.09Å; I433-L487 HydrophobicContact CD1-CD1 3.58Å; I433-L487 HydrophobicContact CG1-CD1 4.46Å
434	D	95	Very high	92	Very high	35 Å²	35	46.4 Å²	46.4	19%	0.187	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	96.3	165.8	173.7	25.1	0	0	0	109.3	Q436 R449	D434-Q436 PolarHBondContact O-N 3.19Å; D434-R449 PolarHBondContact N-O 2.82Å; D434-R449 PolarHBondContact O-N 2.7Å; D434-R449 VanDerWaalsContact O-N 3.12Å
435	P	93.4	Very high	91.7	Very high	22 Å²	22	50.1 Å²	50.1	14%	0.143	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	106.7	170.1	28.9	-33.8	0	0	0	111.3	A403 V405 I433 I437 K447	A403-P435 HydrophobicContact CB-CG 3.88Å; A403-P435 WeakPolarHBondContact O-CD 3.5Å; V405-P435 HydrophobicContact CG2-CG 4.39Å; I433-P435 VanDerWaalsContact O-CD 3.24Å; I433-P435 WeakPolarHBondContact O-CD 3.45Å; P435-I437 PolarHBondContact O-N 2.84Å; P435-K447 CarbonylContact C-O 3.59Å
436	Q	91.6	Very high	91.5	Very high	70 Å²	70	50.5 Å²	50.5	33%	0.327	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	83.4	174.4	-54.2	-169.8	-47.2	0	0	110.5	D434 G446 K447	D434-Q436 PolarHBondContact O-N 3.19Å; Q436-G446 CarbonylContact O-C 3.59Å; Q436-G446 WeakPolarHBondContact O-CA 3.24Å; Q436-K447 WeakPolarHBondContact CA-O 3.45Å; Q436-K447 WeakPolarHBondContact CB-O 3.17Å; Q436-K447 PolarHBondContact N-O 3.21Å; Q436-K447 PolarHBondContact O-N 2.88Å
437	I	89.7	Confident	91.4	Very high	42 Å²	42	56.6 Å²	56.6	22%	0.215	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	141	179.2	56.8	169.9	0	0	0	112.4	P435 I444 R445 M510 V517	P435-I437 PolarHBondContact O-N 2.84Å; I437-I444 HydrophobicContact CB-CG2 4.42Å; I437-R445 CarbonylContact C-O 3.52Å; I437-R445 WeakPolarHBondContact CA-O 3.41Å; I437-M510 HydrophobicContact CB-CE 4.1Å; I437-M510 HydrophobicContact CD1-CE 3.82Å; I437-M510 HydrophobicContact CD1-SD 4.03Å; I437-M510 HydrophobicContact CG1-CE 3.7Å; I437-V517 HydrophobicContact CD1-CG2 4.12Å
438	R	89.9	Confident	91.3	Very high	179 Å²	179	56.7 Å²	56.7	68%	0.675	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.2	147.3	179.1	-62	-176.2	-175.9	172.9	-0	110.2	R445	R438-R445 PolarHBondContact N-O 2.92Å; R438-R445 PolarHBondContact O-N 3.32Å
439	L	87.8	Confident	91.2	Very high	44 Å²	44	60.9 Å²	60.9	23%	0.23	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.7	173.6	-175.4	60.4	0	0	0	109.4	I444 L497 P508 M510	L439-I444 HydrophobicContact CD1-CG1 4.2Å; L439-L497 HydrophobicContact CD1-CD1 4.2Å; L439-L497 HydrophobicContact CD1-CG 4.42Å; L439-P508 VanDerWaalsContact CD2-C 3.4Å; L439-P508 HydrophobicContact CD2-CB 3.65Å; L439-P508 HydrophobicContact CD2-CG 3.81Å; L439-P508 WeakPolarHBondContact CD2-O 3.33Å; L439-P508 HydrophobicContact CG-CG 4.48Å; L439-M510 HydrophobicContact CB-CB 4.41Å
440	Q	84.6	Confident	91.1	Very high	98 Å²	98	61.2 Å²	61.2	46%	0.458	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	124.2	-178.4	-170.2	-174.2	32.5	0	0	109.7	G442 R443	Q440-G442 VanDerWaalsContact C-N 3.33Å; Q440-G442 PolarHBondContact O-N 3.14Å; Q440-R443 PolarHBondContact N-O 2.8Å; Q440-R443 PolarHBondContact O-N 3.01Å; Q440-R443 VanDerWaalsContact O-O 3.07Å
441	N	81.5	Confident	91	Very high	140 Å²	140	62.5 Å²	62.5	75%	0.749	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	44.5	177.5	-56.1	-12.7	0	0	0	113.6	R443	N441-R443 PolarHBondContact O-N 2.84Å
442	G	79.3	Confident	90.9	Very high	26 Å²	26	67.7 Å²	67.7	27%	0.268	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	7.9	-178.3	0	0	0	0	0	114.9	Q440 L497	Q440-G442 VanDerWaalsContact C-N 3.33Å; Q440-G442 PolarHBondContact O-N 3.14Å; G442-L497 PolarHBondContact O-N 3.21Å; G442-L497 VanDerWaalsContact O-N 3.16Å
443	R	86.4	Confident	90.9	Very high	85 Å²	85	68 Å²	68	32%	0.321	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138.2	176.7	-56.4	-177.7	74.5	83	2	110.9	Q440 N441 R445 K493 G494 M495	Q440-R443 PolarHBondContact N-O 2.8Å; Q440-R443 PolarHBondContact O-N 3.01Å; Q440-R443 VanDerWaalsContact O-O 3.07Å; N441-R443 PolarHBondContact O-N 2.84Å; R443-R445 HydrophobicContact CB-CG 4.33Å; R443-R445 PolarHBondContact O-N 3.32Å; R443-K493 PolarHBondContact NE-O 3.18Å; R443-K493 PolarHBondContact NH2-O 3.42Å; R443-G494 PolarHBondContact NH2-O 3.46Å; R443-M495 CarbonylContact C-O 3.51Å; R443-M495 VanDerWaalsContact CA-O 3.23Å; R443-M495 WeakPolarHBondContact CA-O 3.28Å
444	I	87.5	Confident	90.8	Very high	40 Å²	40	69.2 Å²	69.2	21%	0.205	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	105.9	167.1	-56.2	174.2	0	0	0	106.7	I437 L439 G494 M495 L497 M510 L519	I437-I444 HydrophobicContact CB-CG2 4.42Å; L439-I444 HydrophobicContact CD1-CG1 4.2Å; I444-G494 CarbonylContact O-C 3.59Å; I444-G494 WeakPolarHBondContact O-CA 3.32Å; I444-M495 PolarHBondContact N-O 3.01Å; I444-M495 PolarHBondContact O-N 2.86Å; I444-L497 HydrophobicContact CD1-CD2 3.91Å; I444-L497 HydrophobicContact CG1-CD2 4.09Å; I444-M510 HydrophobicContact CG2-SD 4.42Å; I444-L519 HydrophobicContact CD1-CD1 4.29Å; I444-L519 HydrophobicContact CD1-CD2 4.35Å
445	R	90.1	Very high	90.8	Very high	79 Å²	79	68.7 Å²	68.7	30%	0.298	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	166.6	175.9	-73.1	179.8	168.6	163	-0.8	109.5	I437 R438 R443 L491 S492	I437-R445 CarbonylContact C-O 3.52Å; I437-R445 WeakPolarHBondContact CA-O 3.41Å; R438-R445 PolarHBondContact N-O 2.92Å; R438-R445 PolarHBondContact O-N 3.32Å; R443-R445 HydrophobicContact CB-CG 4.33Å; R443-R445 PolarHBondContact O-N 3.32Å; R445-L491 CarbonylContact C-O 3.53Å; R445-L491 WeakPolarHBondContact CA-O 3.39Å; R445-S492 WeakPolarHBondContact CD-O 3.47Å; R445-S492 PolarHBondContact NE-O 3.15Å
446	G	90.4	Very high	90.8	Very high	9 Å²	9	72.4 Å²	72.4	9%	0.093	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	178.4	171.5	0	0	0	0	0	114.2	Q436 L491	Q436-G446 CarbonylContact O-C 3.59Å; Q436-G446 WeakPolarHBondContact O-CA 3.24Å; G446-L491 PolarHBondContact N-O 3.4Å; G446-L491 CarbonylContact O-C 3.52Å; G446-L491 VanDerWaalsContact O-C 3.31Å; G446-L491 VanDerWaalsContact O-CB 3.23Å; G446-L491 WeakPolarHBondContact O-CB 3.15Å
447	K	93.8	Very high	90.9	Very high	130 Å²	130	72.5 Å²	72.5	57%	0.565	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130	140.1	166.6	-66.3	-174.6	178.6	-175.4	0	108.7	P435 Q436 N488	P435-K447 CarbonylContact C-O 3.59Å; Q436-K447 WeakPolarHBondContact CA-O 3.45Å; Q436-K447 WeakPolarHBondContact CB-O 3.17Å; Q436-K447 PolarHBondContact N-O 3.21Å; Q436-K447 PolarHBondContact O-N 2.88Å; K447-N488 WeakPolarHBondContact CA-OD1 3.43Å; K447-N488 WeakPolarHBondContact CB-OD1 3.24Å
448	A	93.8	Very high	91.1	Very high	2 Å²	2	73.5 Å²	73.5	2%	0.017	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	138.7	171.6	0	0	0	0	0	109.7	I433 L487 N488 L491	I433-A448 HydrophobicContact CG2-CB 3.72Å; A448-L487 HydrophobicContact CB-CB 3.79Å; A448-L487 HydrophobicContact CB-CD1 3.96Å; A448-N488 PolarHBondContact N-OD1 3.47Å; A448-N488 PolarHBondContact O-ND2 2.88Å; A448-N488 PolarHBondContact O-OD1 2.94Å; A448-L491 HydrophobicContact CB-CD1 3.65Å
449	R	94.7	Very high	91.1	Very high	142 Å²	142	72.6 Å²	72.6	54%	0.536	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.7	167.6	-66.8	-178.5	176.6	-93.4	4.3	108.7	I433 D434	I433-R449 CarbonylContact C-O 3.54Å; I433-R449 WeakPolarHBondContact CA-O 3.28Å; D434-R449 PolarHBondContact N-O 2.82Å; D434-R449 PolarHBondContact O-N 2.7Å; D434-R449 VanDerWaalsContact O-N 3.12Å
450	F	95.1	Very high	91	Very high	15 Å²	15	72.9 Å²	72.9	7%	0.066	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	122.5	169.3	-74.8	-77.2	0	0	0	110.6	F407 A431 V432 I433 F453 K480 I483 E484	F407-F450 AromaticContact CE1-CE1 3.83Å; F407-F450 HydrophobicContact CE1-CE1 3.83Å; F407-F450 HydrophobicContact CE1-CZ 4.39Å; F407-F450 AromaticContact CZ-CE1 3.93Å; F407-F450 HydrophobicContact CZ-CE1 3.93Å; F407-F450 HydrophobicContact CZ-CZ 4.27Å; A431-F450 HydrophobicContact CB-CD1 3.9Å; A431-F450 HydrophobicContact CB-CE1 3.61Å; V432-F450 CarbonylContact O-C 3.54Å; V432-F450 WeakPolarHBondContact O-CA 3.4Å; I433-F450 HydrophobicContact CD1-CE1 3.95Å; I433-F450 HydrophobicContact CD1-CZ 4.32Å; I433-F450 HydrophobicContact CG1-CD1 3.61Å; I433-F450 HydrophobicContact CG1-CE1 3.39Å; I433-F450 HydrophobicContact CG1-CG 4.45Å; I433-F450 HydrophobicContact CG1-CZ 4.09Å; F450-F453 HydrophobicContact CB-CB 4.26Å; F450-F453 HydrophobicContact CD1-CB 4.21Å; F450-F453 AromaticContact CD1-CD2 3.96Å; F450-F453 HydrophobicContact CD1-CD2 3.96Å; F450-F453 HydrophobicContact CD2-CD2 4.47Å; F450-F453 AromaticContact CE1-CD2 3.72Å; F450-F453 HydrophobicContact CE1-CD2 3.72Å; F450-F453 HydrophobicContact CE1-CE2 4.37Å; F450-F453 HydrophobicContact CE2-CD2 4.27Å; F450-F453 HydrophobicContact CG-CB 4.17Å; F450-F453 HydrophobicContact CG-CD2 4.33Å; F450-F453 AromaticContact CZ-CD2 3.89Å; F450-F453 HydrophobicContact CZ-CD2 3.89Å; F450-F453 HydrophobicContact CZ-CE2 4.22Å; F450-K480 VanDerWaalsContact CB-CE 3.45Å; F450-K480 HydrophobicContact CB-CG 4.37Å; F450-K480 HydrophobicContact CD2-CB 4.44Å; F450-K480 HydrophobicContact CD2-CD 4.31Å; F450-K480 HydrophobicContact CD2-CG 3.35Å; F450-K480 HydrophobicContact CE2-CG 3.86Å; F450-K480 HydrophobicContact CG-CG 4.08Å; F450-I483 HydrophobicContact CE2-CB 4.07Å; F450-I483 HydrophobicContact CE2-CG2 4.05Å; F450-I483 HydrophobicContact CZ-CB 4.08Å; F450-I483 HydrophobicContact CZ-CD1 4.49Å; F450-I483 HydrophobicContact CZ-CG2 3.68Å; F450-E484 HydrophobicContact CD2-CG 3.37Å; F450-E484 VanDerWaalsContact CD2-OE1 3.27Å; F450-E484 WeakPolarHBondContact CD2-OE1 3.37Å; F450-E484 HydrophobicContact CE2-CG 3.6Å; F450-E484 PolarHBondContact N-OE1 3.22Å
451	E	95.1	Very high	91.2	Very high	113 Å²	113	72.5 Å²	72.5	53%	0.528	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-39.9	164.6	178.7	172.5	-178.6	0	0	110.2	K402 V432	K402-E451 IonicContact NZ-OE1 3.18Å; K402-E451 PolarHBondContact NZ-OE1 2.86Å; K402-E451 IonicContact NZ-OE2 2.74Å; K402-E451 PolarHBondContact NZ-OE2 2.88Å; V432-E451 HydrophobicContact CB-CB 4.39Å; V432-E451 HydrophobicContact CG1-CB 4.21Å; V432-E451 PolarHBondContact O-N 2.98Å
452	K	95.9	Very high	91.3	Very high	109 Å²	109	73 Å²	73	47%	0.474	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	134.9	175.4	-173.3	171.1	-179.8	171.9	0	109.7	A431 V432 T454	A431-K452 CarbonylContact C-O 3.55Å; A431-K452 VanDerWaalsContact CA-O 3.23Å; A431-K452 WeakPolarHBondContact CA-O 3.26Å; V432-K452 HydrophobicContact CB-CB 4.15Å; V432-K452 HydrophobicContact CG2-CB 4.2Å; V432-K452 PolarHBondContact N-O 2.96Å; V432-K452 PolarHBondContact O-N 2.84Å; K452-T454 HydrophobicContact CD-CG2 4.44Å; K452-T454 HydrophobicContact CG-CG2 4.07Å
453	F	96.3	Very high	91.5	Very high	33 Å²	33	74 Å²	74	15%	0.145	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	111.6	170.7	-174.3	-93.3	0	0	0	107.5	V429 A431 F450 M455 A476 L479 K480 I483	V429-F453 HydrophobicContact CG1-CE2 3.94Å; V429-F453 HydrophobicContact CG1-CZ 4.15Å; A431-F453 HydrophobicContact CB-CD2 3.78Å; A431-F453 HydrophobicContact CB-CE2 4.41Å; F450-F453 HydrophobicContact CB-CB 4.26Å; F450-F453 HydrophobicContact CD1-CB 4.21Å; F450-F453 AromaticContact CD1-CD2 3.96Å; F450-F453 HydrophobicContact CD1-CD2 3.96Å; F450-F453 HydrophobicContact CD2-CD2 4.47Å; F450-F453 AromaticContact CE1-CD2 3.72Å; F450-F453 HydrophobicContact CE1-CD2 3.72Å; F450-F453 HydrophobicContact CE1-CE2 4.37Å; F450-F453 HydrophobicContact CE2-CD2 4.27Å; F450-F453 HydrophobicContact CG-CB 4.17Å; F450-F453 HydrophobicContact CG-CD2 4.33Å; F450-F453 AromaticContact CZ-CD2 3.89Å; F450-F453 HydrophobicContact CZ-CD2 3.89Å; F450-F453 HydrophobicContact CZ-CE2 4.22Å; F453-M455 HydrophobicContact CD1-CG 4.41Å; F453-M455 HydrophobicContact CE1-CG 3.63Å; F453-M455 HydrophobicContact CE1-SD 3.54Å; F453-M455 VanDerWaalsContact CE1-SD 3.54Å; F453-M455 HydrophobicContact CZ-CG 4.03Å; F453-M455 HydrophobicContact CZ-SD 3.85Å; F453-A476 HydrophobicContact CD1-CB 4.36Å; F453-A476 HydrophobicContact CE1-CB 4.04Å; F453-A476 WeakPolarHBondContact CE1-O 3.4Å; F453-L479 HydrophobicContact CZ-CB 4.35Å; F453-K480 HydrophobicContact CB-CD 4.21Å; F453-K480 HydrophobicContact CB-CG 4.18Å; F453-K480 HydrophobicContact CD1-CB 3.96Å; F453-K480 HydrophobicContact CD1-CG 4.36Å; F453-K480 HydrophobicContact CD2-CB 4.48Å; F453-K480 HydrophobicContact CD2-CG 4.48Å; F453-K480 HydrophobicContact CE1-CB 4.14Å; F453-K480 HydrophobicContact CG-CB 4.13Å; F453-K480 HydrophobicContact CG-CG 4.1Å; F453-I483 HydrophobicContact CE2-CD1 4.21Å
454	T	94.9	Very high	91.7	Very high	40 Å²	40	71.4 Å²	71.4	25%	0.245	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128	-176.9	44.6	0	0	0	0	109.8	V429 K430 K452	V429-T454 WeakPolarHBondContact CA-O 3.23Å; K430-T454 PolarHBondContact N-O 2.81Å; K430-T454 PolarHBondContact O-N 2.88Å; K430-T454 PolarHBondContact O-OG1 2.84Å; K452-T454 HydrophobicContact CD-CG2 4.44Å; K452-T454 HydrophobicContact CG-CG2 4.07Å
455	M	94.8	Very high	91.8	Very high	25 Å²	25	69.9 Å²	69.9	12%	0.123	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	113.4	173.6	-74.5	-175.9	54.1	0	0	108.7	L411 Y427 T428 V429 F453 A476 L479	L411-M455 HydrophobicContact CD2-CE 3.82Å; Y427-M455 HydrophobicContact CD1-CB 4Å; Y427-M455 HydrophobicContact CD1-CE 3.83Å; Y427-M455 HydrophobicContact CD2-CE 3.58Å; Y427-M455 HydrophobicContact CE1-CE 4.32Å; Y427-M455 HydrophobicContact CE2-CE 4.07Å; Y427-M455 HydrophobicContact CG-CB 4.46Å; Y427-M455 HydrophobicContact CG-CE 3.45Å; Y427-M455 VanDerWaalsContact CG-CE 3.45Å; T428-M455 WeakPolarHBondContact O-CA 2.93Å; V429-M455 HydrophobicContact CG2-CG 4.17Å; F453-M455 HydrophobicContact CD1-CG 4.41Å; F453-M455 HydrophobicContact CE1-CG 3.63Å; F453-M455 HydrophobicContact CE1-SD 3.54Å; F453-M455 VanDerWaalsContact CE1-SD 3.54Å; F453-M455 HydrophobicContact CZ-CG 4.03Å; F453-M455 HydrophobicContact CZ-SD 3.85Å; M455-A476 HydrophobicContact CB-CB 4.22Å; M455-A476 HydrophobicContact CG-CB 4.17Å; M455-A476 VanDerWaalsContact SD-CA 3.55Å; M455-A476 HydrophobicContact SD-CB 3.7Å; M455-L479 HydrophobicContact CE-CD1 3.74Å; M455-L479 HydrophobicContact SD-CD1 3.66Å
456	N	94.1	Very high	91.7	Very high	100 Å²	100	75.9 Å²	75.9	54%	0.535	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.6	177.4	-61.8	-45	0	0	0	109	Y427 T428 M458	Y427-N456 CarbonylContact C-O 3.51Å; Y427-N456 VanDerWaalsContact CA-O 3.3Å; Y427-N456 WeakPolarHBondContact CA-O 3.47Å; T428-N456 PolarHBondContact N-O 2.83Å; T428-N456 PolarHBondContact O-N 3.12Å; T428-N456 PolarHBondContact OG1-O 2.98Å; N456-M458 PolarHBondContact O-N 3.43Å
457	R	93.4	Very high	91.6	Very high	72 Å²	72	76.3 Å²	76.3	27%	0.272	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	132.8	-178.8	-170.7	168	172	-81.8	-7.9	110.1	Y427 L465	Y427-R457 HydrophobicContact CD1-CB 3.99Å; Y427-R457 HydrophobicContact CE1-CB 3.71Å; Y427-R457 HydrophobicContact CE1-CG 4.11Å; R457-L465 PolarHBondContact NH2-O 3.5Å
458	M	93.2	Very high	91.4	Very high	62 Å²	62	76.1 Å²	76.1	31%	0.305	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-75.6	150.7	172.6	-61.9	-176.3	72.2	0	0	110	A426 T428 N456	A426-M458 HydrophobicContact CB-CB 4.31Å; A426-M458 HydrophobicContact CB-CG 4.28Å; A426-M458 HydrophobicContact CB-SD 3.78Å; A426-M458 PolarHBondContact O-N 3.01Å; T428-M458 HydrophobicContact CG2-CG 4.04Å; T428-M458 HydrophobicContact CG2-SD 4.23Å; N456-M458 PolarHBondContact O-N 3.43Å
459	L	89.8	Confident	91.2	Very high	160 Å²	160	83.5 Å²	83.5	84%	0.838	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-57.3	128.3	176.7	-87.6	77.3	0	0	0	109.7
460	P	86	Confident	91	Very high	50 Å²	50	82.4 Å²	82.4	33%	0.325	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-69.7	135.4	179	25.5	-29	0	0	0	110.3	Q464 R466	P460-Q464 HydrophobicContact CB-CB 3.95Å; P460-R466 HydrophobicContact CG-CG 4.44Å
461	T	88.6	Confident	90.7	Very high	91 Å²	91	82.5 Å²	82.5	56%	0.558	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-84.3	168.3	164.3	61.5	0	0	0	0	110.3	G463 Q464	T461-G463 PolarHBondContact O-N 2.81Å; T461-Q464 WeakPolarHBondContact O-CB 3.22Å; T461-Q464 PolarHBondContact O-N 2.83Å; T461-Q464 VanDerWaalsContact O-N 3.1Å; T461-Q464 VanDerWaalsContact OG1-CD 3.25Å; T461-Q464 PolarHBondContact OG1-NE2 2.81Å
462	T	85	Confident	90.5	Very high	150 Å²	150	78 Å²	78	92%	0.92	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	130.8	176	-50	0	0	0	0	111.5
463	G	83.6	Confident	90.3	Very high	48 Å²	48	77.4 Å²	77.4	50%	0.495	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	-4.4	179.3	0	0	0	0	0	116.1	Q422 T461	Q422-G463 PolarHBondContact NE2-O 3.32Å; T461-G463 PolarHBondContact O-N 2.81Å
464	Q	90.7	Very high	89.9	Confident	30 Å²	30	79.6 Å²	79.6	14%	0.14	41%	0.411	C	S	.	.			trans	-83.7	147.4	175.2	-72.5	-179.3	2.5	0	0	112.3	L424 P460 T461	L424-Q464 CarbonylContact O-C 3.52Å; L424-Q464 WeakPolarHBondContact O-CA 2.99Å; L424-Q464 WeakPolarHBondContact O-CB 3.44Å; P460-Q464 HydrophobicContact CB-CB 3.95Å; T461-Q464 WeakPolarHBondContact O-CB 3.22Å; T461-Q464 PolarHBondContact O-N 2.83Å; T461-Q464 VanDerWaalsContact O-N 3.1Å; T461-Q464 VanDerWaalsContact OG1-CD 3.25Å; T461-Q464 PolarHBondContact OG1-NE2 2.81Å
465	L	89.3	Confident	89.7	Confident	7 Å²	7	78 Å²	78	4%	0.037	40%	0.4	C	S	.	.			trans	-70.4	136.2	179.1	-63.3	179.3	0	0	0	110.7	E374 L375 Y379 L424 F425 R457	E374-L465 HydrophobicContact CB-CD1 4.4Å; E374-L465 HydrophobicContact CB-CD2 4.22Å; L375-L465 HydrophobicContact CD2-CD1 3.56Å; L375-L465 HydrophobicContact CG-CD1 4.31Å; Y379-L465 HydrophobicContact CE2-CD1 4.29Å; Y379-L465 HydrophobicContact CE2-CD2 4.35Å; L424-L465 HydrophobicContact CD2-CD1 4.17Å; L424-L465 HydrophobicContact CD2-CG 4.49Å; L424-L465 PolarHBondContact O-N 3.39Å; F425-L465 HydrophobicContact CD1-CB 4.27Å; F425-L465 HydrophobicContact CD1-CD1 4.49Å; R457-L465 PolarHBondContact NH2-O 3.5Å
466	R	87.4	Confident	89.6	Confident	206 Å²	206	77.6 Å²	77.6	78%	0.777	40%	0.401	S	S	*	.			trans	-93.2	102.6	173.1	-65.4	-177.8	74.5	159.6	2.3	108.4	P460	P460-R466 HydrophobicContact CG-CG 4.44Å
467	L	87.9	Confident	89.4	Confident	17 Å²	17	77.2 Å²	77.2	9%	0.089	40%	0.402	C	S	.	.			trans	-84.1	142.6	176.8	-59.2	-179.6	0	0	0	110.7	I372 F425 Y427 Q471 L475	I372-L467 HydrophobicContact CB-CD2 4.42Å; I372-L467 HydrophobicContact CD1-CD1 4.02Å; I372-L467 HydrophobicContact CD1-CD2 3.9Å; I372-L467 HydrophobicContact CG1-CD2 4.16Å; I372-L467 HydrophobicContact CG2-CD2 3.41Å; I372-L467 VanDerWaalsContact CG2-CD2 3.41Å; F425-L467 HydrophobicContact CD1-CD1 3.79Å; F425-L467 HydrophobicContact CD1-CD2 4.46Å; F425-L467 HydrophobicContact CD1-CG 4.2Å; F425-L467 HydrophobicContact CD2-CD1 3.7Å; F425-L467 HydrophobicContact CE1-CD1 3.82Å; F425-L467 HydrophobicContact CE1-CD2 4.39Å; F425-L467 HydrophobicContact CE1-CG 4.45Å; F425-L467 HydrophobicContact CE2-CD1 3.69Å; F425-L467 HydrophobicContact CG-CD1 3.74Å; F425-L467 HydrophobicContact CG-CG 4.38Å; F425-L467 HydrophobicContact CZ-CD1 3.77Å; Y427-L467 VanDerWaalsContact OH-CD1 3.27Å; Y427-L467 WeakPolarHBondContact OH-CD1 3.31Å; L467-Q471 VanDerWaalsContact CA-OE1 3.25Å; L467-Q471 HydrophobicContact CB-CB 4.35Å; L467-L475 HydrophobicContact CD1-CD1 3.8Å
468	E	90.2	Very high	89.1	Confident	127 Å²	127	75.2 Å²	75.2	59%	0.593	40%	0.397	S	S	*	.			trans	-70.9	164.9	170.2	-62.9	-168.8	166.7	0	0	111.4	I470 Q471 S472	E468-I470 VanDerWaalsContact C-N 3.3Å; E468-I470 HydrophobicContact CB-CG2 4.26Å; E468-I470 PolarHBondContact O-N 2.8Å; E468-Q471 HydrophobicContact CB-CG 4.3Å; E468-Q471 PolarHBondContact O-N 3.26Å; E468-S472 PolarHBondContact O-N 2.98Å; E468-S472 VanDerWaalsContact O-N 3.11Å; E468-S472 PolarHBondContact O-OG 2.91Å; E468-S472 VanDerWaalsContact O-OG 3.11Å
469	K	89.6	Confident	88.9	Confident	157 Å²	157	72.7 Å²	72.7	68%	0.683	38%	0.384	S	S	*	.	H	α-helix	trans	-60.1	-43.1	177.7	-166.6	-172.1	-177.3	-127.4	0	111.2	Q471 S472 E473	K469-Q471 PolarHBondContact O-N 2.78Å; K469-S472 WeakPolarHBondContact O-CB 3.04Å; K469-S472 PolarHBondContact O-N 2.72Å; K469-E473 WeakPolarHBondContact CE-OE1 3.27Å; K469-E473 HydrophobicContact CG-CG 4.49Å; K469-E473 IonicContact NZ-OE1 3.59Å; K469-E473 PolarHBondContact NZ-OE1 3.46Å; K469-E473 WeakPolarHBondContact O-CG 3.17Å; K469-E473 PolarHBondContact O-N 3.46Å
470	I	89.6	Confident	89	Confident	118 Å²	118	68.5 Å²	68.5	61%	0.605	36%	0.36	S	S	*	.	H	α-helix	trans	-64.6	-40.1	-178.4	-163.3	162.8	0	0	0	112.2	E468 S472 E473 L474	E468-I470 VanDerWaalsContact C-N 3.3Å; E468-I470 HydrophobicContact CB-CG2 4.26Å; E468-I470 PolarHBondContact O-N 2.8Å; I470-S472 VanDerWaalsContact C-N 3.33Å; I470-S472 PolarHBondContact O-N 2.86Å; I470-E473 PolarHBondContact O-N 2.78Å; I470-L474 WeakPolarHBondContact O-CB 3.41Å; I470-L474 PolarHBondContact O-N 2.75Å
471	Q	90.2	Very high	89.2	Confident	17 Å²	17	69.5 Å²	69.5	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-63	-41	174.6	-62.6	177.1	-42.1	0	0	111	G371 E374 L467 E468 K469 L474 L475	G371-Q471 WeakPolarHBondContact O-CG 3.44Å; E374-Q471 PolarHBondContact OE2-NE2 3.21Å; L467-Q471 VanDerWaalsContact CA-OE1 3.25Å; L467-Q471 HydrophobicContact CB-CB 4.35Å; E468-Q471 HydrophobicContact CB-CG 4.3Å; E468-Q471 PolarHBondContact O-N 3.26Å; K469-Q471 PolarHBondContact O-N 2.78Å; Q471-L474 PolarHBondContact O-N 2.84Å; Q471-L475 WeakPolarHBondContact O-CB 3.46Å; Q471-L475 WeakPolarHBondContact O-CG 3.48Å; Q471-L475 PolarHBondContact O-N 3.02Å
472	S	90.8	Very high	89.1	Confident	20 Å²	20	66.9 Å²	66.9	14%	0.14	35%	0.35	C	S	.	.	H	α-helix	trans	-66.7	-39.5	176.5	-59.9	0	0	0	0	112.8	Y427 E468 K469 I470 A476	Y427-S472 WeakPolarHBondContact OH-CB 3.41Å; Y427-S472 PolarHBondContact OH-OG 2.97Å; E468-S472 PolarHBondContact O-N 2.98Å; E468-S472 VanDerWaalsContact O-N 3.11Å; E468-S472 PolarHBondContact O-OG 2.91Å; E468-S472 VanDerWaalsContact O-OG 3.11Å; K469-S472 WeakPolarHBondContact O-CB 3.04Å; K469-S472 PolarHBondContact O-N 2.72Å; I470-S472 VanDerWaalsContact C-N 3.33Å; I470-S472 PolarHBondContact O-N 2.86Å; S472-A476 WeakPolarHBondContact O-CB 3.48Å; S472-A476 PolarHBondContact O-N 3.48Å
473	E	91.2	Very high	89.3	Confident	95 Å²	95	62.4 Å²	62.4	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-68.1	-39	176.6	-73.6	174	-179.6	0	0	111.7	K469 I470 A476 T477	K469-E473 WeakPolarHBondContact CE-OE1 3.27Å; K469-E473 HydrophobicContact CG-CG 4.49Å; K469-E473 IonicContact NZ-OE1 3.59Å; K469-E473 PolarHBondContact NZ-OE1 3.46Å; K469-E473 WeakPolarHBondContact O-CG 3.17Å; K469-E473 PolarHBondContact O-N 3.46Å; I470-E473 PolarHBondContact O-N 2.78Å; E473-A476 PolarHBondContact O-N 2.9Å; E473-T477 WeakPolarHBondContact O-CB 3.47Å; E473-T477 PolarHBondContact O-N 2.68Å; E473-T477 PolarHBondContact O-OG1 2.68Å
474	L	88.2	Confident	89.7	Confident	80 Å²	80	61.9 Å²	61.9	42%	0.419	30%	0.304	S	S	.	.	H	α-helix	trans	-62.8	-50.5	174	-179.8	62.3	0	0	0	111.4	I470 Q471 A476 T477 I478	I470-L474 WeakPolarHBondContact O-CB 3.41Å; I470-L474 PolarHBondContact O-N 2.75Å; Q471-L474 PolarHBondContact O-N 2.84Å; L474-A476 VanDerWaalsContact C-N 3.3Å; L474-A476 PolarHBondContact O-N 3.3Å; L474-T477 PolarHBondContact O-N 3.29Å; L474-T477 VanDerWaalsContact O-N 3.14Å; L474-I478 HydrophobicContact CD1-CD1 3.96Å; L474-I478 HydrophobicContact CD1-CG1 4.35Å; L474-I478 HydrophobicContact CG-CD1 3.96Å; L474-I478 WeakPolarHBondContact O-CG1 3.36Å; L474-I478 PolarHBondContact O-N 2.8Å
475	L	89.9	Confident	89.6	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-53.2	-48	174.7	-80.4	165.1	0	0	0	111.6	F357 I368 I372 F413 F425 Y427 L467 Q471 T477 I478 L479	F357-L475 HydrophobicContact CE1-CD2 4.06Å; F357-L475 HydrophobicContact CZ-CD2 3.68Å; I368-L475 HydrophobicContact CD1-CD2 3.88Å; I368-L475 HydrophobicContact CG1-CD2 4.16Å; I372-L475 HydrophobicContact CD1-CD1 3.94Å; I372-L475 HydrophobicContact CD1-CD2 4.43Å; I372-L475 HydrophobicContact CD1-CG 4.44Å; F413-L475 HydrophobicContact CZ-CD2 4.29Å; F425-L475 HydrophobicContact CE2-CD1 4.06Å; F425-L475 HydrophobicContact CZ-CD1 4.39Å; Y427-L475 HydrophobicContact CE2-CD1 4.17Å; L467-L475 HydrophobicContact CD1-CD1 3.8Å; Q471-L475 WeakPolarHBondContact O-CB 3.46Å; Q471-L475 WeakPolarHBondContact O-CG 3.48Å; Q471-L475 PolarHBondContact O-N 3.02Å; L475-T477 VanDerWaalsContact C-N 3.33Å; L475-T477 PolarHBondContact O-N 3.47Å; L475-I478 PolarHBondContact O-N 3.35Å; L475-L479 WeakPolarHBondContact O-CB 3.42Å; L475-L479 VanDerWaalsContact O-CG 3.25Å; L475-L479 WeakPolarHBondContact O-CG 3.48Å; L475-L479 PolarHBondContact O-N 3.44Å
476	A	92.2	Very high	89.5	Confident	17 Å²	17	70.6 Å²	70.6	14%	0.14	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-41.2	179.6	0	0	0	0	0	112.3	F453 M455 S472 E473 L474 K480	F453-A476 HydrophobicContact CD1-CB 4.36Å; F453-A476 HydrophobicContact CE1-CB 4.04Å; F453-A476 WeakPolarHBondContact CE1-O 3.4Å; M455-A476 HydrophobicContact CB-CB 4.22Å; M455-A476 HydrophobicContact CG-CB 4.17Å; M455-A476 VanDerWaalsContact SD-CA 3.55Å; M455-A476 HydrophobicContact SD-CB 3.7Å; S472-A476 WeakPolarHBondContact O-CB 3.48Å; S472-A476 PolarHBondContact O-N 3.48Å; E473-A476 PolarHBondContact O-N 2.9Å; L474-A476 VanDerWaalsContact C-N 3.3Å; L474-A476 PolarHBondContact O-N 3.3Å; A476-K480 WeakPolarHBondContact O-CB 3.49Å; A476-K480 PolarHBondContact O-N 3.03Å
477	T	91	Very high	89.5	Confident	92 Å²	92	63 Å²	63	56%	0.564	33%	0.326	S	S	*	.	H	α-helix	trans	-64.5	-44.4	179.2	-59.4	0	0	0	0	111.8	E473 L474 L475 S481	E473-T477 WeakPolarHBondContact O-CB 3.47Å; E473-T477 PolarHBondContact O-N 2.68Å; E473-T477 PolarHBondContact O-OG1 2.68Å; L474-T477 PolarHBondContact O-N 3.29Å; L474-T477 VanDerWaalsContact O-N 3.14Å; L475-T477 VanDerWaalsContact C-N 3.33Å; L475-T477 PolarHBondContact O-N 3.47Å; T477-S481 PolarHBondContact O-N 2.05Å
478	I	87.7	Confident	89.8	Confident	31 Å²	31	64.3 Å²	64.3	16%	0.159	33%	0.333	C	S	.	.	H	α-helix	trans	-65.1	-52.3	179.3	-66.4	171	0	0	0	110.2	F357 L474 L475 K480 S481 M482	F357-I478 HydrophobicContact CD1-CG2 4.23Å; F357-I478 HydrophobicContact CD2-CD1 4.05Å; F357-I478 HydrophobicContact CD2-CG2 3.72Å; F357-I478 HydrophobicContact CE1-CG2 4.29Å; F357-I478 HydrophobicContact CE2-CB 4.33Å; F357-I478 HydrophobicContact CE2-CD1 3.39Å; F357-I478 HydrophobicContact CE2-CG1 4.42Å; F357-I478 HydrophobicContact CE2-CG2 3.8Å; F357-I478 HydrophobicContact CG-CG2 3.95Å; F357-I478 HydrophobicContact CZ-CB 4.45Å; F357-I478 HydrophobicContact CZ-CD1 4.04Å; F357-I478 HydrophobicContact CZ-CG2 4.08Å; L474-I478 HydrophobicContact CD1-CD1 3.96Å; L474-I478 HydrophobicContact CD1-CG1 4.35Å; L474-I478 HydrophobicContact CG-CD1 3.96Å; L474-I478 WeakPolarHBondContact O-CG1 3.36Å; L474-I478 PolarHBondContact O-N 2.8Å; L475-I478 PolarHBondContact O-N 3.35Å; I478-K480 VanDerWaalsContact C-N 3.32Å; I478-K480 PolarHBondContact O-N 2.76Å; I478-S481 WeakPolarHBondContact O-CB 3.37Å; I478-S481 PolarHBondContact O-N 3.27Å; I478-S481 VanDerWaalsContact O-N 3.1Å; I478-M482 HydrophobicContact CG2-CG 4.35Å; I478-M482 HydrophobicContact CG2-SD 3.59Å; I478-M482 VanDerWaalsContact CG2-SD 3.59Å; I478-M482 VanDerWaalsContact O-CG 3.23Å; I478-M482 WeakPolarHBondContact O-CG 3.27Å; I478-M482 PolarHBondContact O-N 2.99Å
479	L	88.4	Confident	89.7	Confident	8 Å²	8	61.2 Å²	61.2	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-58.5	-43.7	179.5	-69.8	168.7	0	0	0	112.2	M354 L411 F413 F453 M455 L475 S481 M482 I483	M354-L479 HydrophobicContact CE-CD2 3.71Å; M354-L479 HydrophobicContact SD-CD2 3.99Å; L411-L479 HydrophobicContact CD2-CD1 3.32Å; F413-L479 HydrophobicContact CZ-CD1 4.4Å; F453-L479 HydrophobicContact CZ-CB 4.35Å; M455-L479 HydrophobicContact CE-CD1 3.74Å; M455-L479 HydrophobicContact SD-CD1 3.66Å; L475-L479 WeakPolarHBondContact O-CB 3.42Å; L475-L479 VanDerWaalsContact O-CG 3.25Å; L475-L479 WeakPolarHBondContact O-CG 3.48Å; L475-L479 PolarHBondContact O-N 3.44Å; L479-S481 PolarHBondContact O-N 3.33Å; L479-M482 PolarHBondContact O-N 3.33Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.1Å; L479-I483 PolarHBondContact O-N 3.24Å
480	K	92.2	Very high	89.5	Confident	72 Å²	72	58.5 Å²	58.5	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-54.8	-51.5	174.3	-176.1	-165.3	-177.8	-171.8	0	111	F450 F453 A476 I478 M482 I483 E484	F450-K480 VanDerWaalsContact CB-CE 3.45Å; F450-K480 HydrophobicContact CB-CG 4.37Å; F450-K480 HydrophobicContact CD2-CB 4.44Å; F450-K480 HydrophobicContact CD2-CD 4.31Å; F450-K480 HydrophobicContact CD2-CG 3.35Å; F450-K480 HydrophobicContact CE2-CG 3.86Å; F450-K480 HydrophobicContact CG-CG 4.08Å; F453-K480 HydrophobicContact CB-CD 4.21Å; F453-K480 HydrophobicContact CB-CG 4.18Å; F453-K480 HydrophobicContact CD1-CB 3.96Å; F453-K480 HydrophobicContact CD1-CG 4.36Å; F453-K480 HydrophobicContact CD2-CB 4.48Å; F453-K480 HydrophobicContact CD2-CG 4.48Å; F453-K480 HydrophobicContact CE1-CB 4.14Å; F453-K480 HydrophobicContact CG-CB 4.13Å; F453-K480 HydrophobicContact CG-CG 4.1Å; A476-K480 WeakPolarHBondContact O-CB 3.49Å; A476-K480 PolarHBondContact O-N 3.03Å; I478-K480 VanDerWaalsContact C-N 3.32Å; I478-K480 PolarHBondContact O-N 2.76Å; K480-M482 VanDerWaalsContact C-N 3.33Å; K480-M482 PolarHBondContact O-N 3.15Å; K480-I483 PolarHBondContact O-N 2.81Å; K480-E484 WeakPolarHBondContact O-CG 3.28Å; K480-E484 PolarHBondContact O-N 2.92Å
481	S	90.4	Very high	89.4	Confident	72 Å²	72	55.2 Å²	55.2	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-41.5	-179.5	-174.5	0	0	0	0	112.6	T477 I478 L479 E484 S485	T477-S481 PolarHBondContact O-N 2.05Å; I478-S481 WeakPolarHBondContact O-CB 3.37Å; I478-S481 PolarHBondContact O-N 3.27Å; I478-S481 VanDerWaalsContact O-N 3.1Å; L479-S481 PolarHBondContact O-N 3.33Å; S481-E484 PolarHBondContact O-N 2.75Å; S481-S485 WeakPolarHBondContact O-CB 3.49Å; S481-S485 PolarHBondContact O-N 3.16Å
482	M	86.6	Confident	89.4	Confident	35 Å²	35	57.3 Å²	57.3	17%	0.172	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-43.2	-179.8	-63.4	170.5	100.2	0	0	112.3	E353 M354 F357 I478 L479 K480 S485 K486	E353-M482 HydrophobicContact CB-CE 3.77Å; E353-M482 WeakPolarHBondContact O-CE 3.21Å; M354-M482 HydrophobicContact CB-CE 3.93Å; M354-M482 HydrophobicContact CE-CB 4.16Å; M354-M482 HydrophobicContact CE-CE 3.96Å; M354-M482 HydrophobicContact CE-SD 3.6Å; M354-M482 HydrophobicContact CG-CE 4.48Å; M354-M482 HydrophobicContact SD-CE 3.87Å; M354-M482 HydrophobicContact SD-SD 3.83Å; F357-M482 HydrophobicContact CB-CE 3.97Å; F357-M482 HydrophobicContact CB-SD 4.45Å; I478-M482 HydrophobicContact CG2-CG 4.35Å; I478-M482 HydrophobicContact CG2-SD 3.59Å; I478-M482 VanDerWaalsContact CG2-SD 3.59Å; I478-M482 VanDerWaalsContact O-CG 3.23Å; I478-M482 WeakPolarHBondContact O-CG 3.27Å; I478-M482 PolarHBondContact O-N 2.99Å; L479-M482 PolarHBondContact O-N 3.33Å; K480-M482 VanDerWaalsContact C-N 3.33Å; K480-M482 PolarHBondContact O-N 3.15Å; M482-S485 PolarHBondContact O-N 2.79Å; M482-K486 PolarHBondContact O-N 3.05Å
483	I	88.3	Confident	89.1	Confident	56 Å²	56	62.9 Å²	62.9	29%	0.287	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-45.2	175.6	-62.7	163.5	0	0	0	109.9	F450 F453 L479 K480 S485 K486 L487	F450-I483 HydrophobicContact CE2-CB 4.07Å; F450-I483 HydrophobicContact CE2-CG2 4.05Å; F450-I483 HydrophobicContact CZ-CB 4.08Å; F450-I483 HydrophobicContact CZ-CD1 4.49Å; F450-I483 HydrophobicContact CZ-CG2 3.68Å; F453-I483 HydrophobicContact CE2-CD1 4.21Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.1Å; L479-I483 PolarHBondContact O-N 3.24Å; K480-I483 PolarHBondContact O-N 2.81Å; I483-S485 VanDerWaalsContact C-N 3.32Å; I483-S485 PolarHBondContact O-N 2.81Å; I483-K486 PolarHBondContact O-N 2.95Å; I483-L487 HydrophobicContact CG2-CD1 3.85Å; I483-L487 HydrophobicContact CG2-CG 4.23Å; I483-L487 WeakPolarHBondContact O-CB 3.17Å; I483-L487 VanDerWaalsContact O-CG 3.3Å; I483-L487 WeakPolarHBondContact O-CG 3.3Å; I483-L487 PolarHBondContact O-N 2.68Å
484	E	91.1	Very high	88.6	Confident	38 Å²	38	59.2 Å²	59.2	18%	0.178	33%	0.327	C	S	.	.	H	α-helix	trans	-57.1	-45.7	174.7	-75.5	-177.2	168.4	0	0	111.4	F450 K480 S481 K486 L487 N488	F450-E484 HydrophobicContact CD2-CG 3.37Å; F450-E484 VanDerWaalsContact CD2-OE1 3.27Å; F450-E484 WeakPolarHBondContact CD2-OE1 3.37Å; F450-E484 HydrophobicContact CE2-CG 3.6Å; F450-E484 PolarHBondContact N-OE1 3.22Å; K480-E484 WeakPolarHBondContact O-CG 3.28Å; K480-E484 PolarHBondContact O-N 2.92Å; S481-E484 PolarHBondContact O-N 2.75Å; E484-K486 PolarHBondContact O-N 2.92Å; E484-L487 PolarHBondContact O-N 2.66Å; E484-N488 WeakPolarHBondContact O-CB 3.15Å; E484-N488 PolarHBondContact O-N 3.42Å; E484-N488 PolarHBondContact O-ND2 2.77Å
485	S	89.9	Confident	88.2	Confident	79 Å²	79	61.2 Å²	61.2	55%	0.552	34%	0.336	S	S	*	.	H	α-helix	trans	-59.1	-47.2	177.8	-177	0	0	0	0	111.9	S481 M482 I483 N488 S489	S481-S485 WeakPolarHBondContact O-CB 3.49Å; S481-S485 PolarHBondContact O-N 3.16Å; M482-S485 PolarHBondContact O-N 2.79Å; I483-S485 VanDerWaalsContact C-N 3.32Å; I483-S485 PolarHBondContact O-N 2.81Å; S485-N488 PolarHBondContact O-N 2.82Å; S485-S489 PolarHBondContact O-N 3.42Å
486	K	85.9	Confident	87.8	Confident	140 Å²	140	64 Å²	64	61%	0.609	36%	0.356	S	S	*	.	H	α-helix	trans	-62.8	-46.7	177.9	-175.5	66.7	175	-162.9	0	111.9	M482 I483 E484 N488 S489 I490	M482-K486 PolarHBondContact O-N 3.05Å; I483-K486 PolarHBondContact O-N 2.95Å; E484-K486 PolarHBondContact O-N 2.92Å; K486-N488 VanDerWaalsContact C-N 3.33Å; K486-N488 PolarHBondContact O-N 2.66Å; K486-S489 WeakPolarHBondContact O-CB 3.41Å; K486-S489 PolarHBondContact O-N 2.88Å; K486-I490 PolarHBondContact O-N 2.82Å
487	L	89.1	Confident	87.1	Confident	48 Å²	48	63.7 Å²	63.7	25%	0.251	35%	0.352	S	S	.	.	H	α-helix	trans	-61.1	-43	176.8	-70.6	173	0	0	0	111.3	I433 A448 I483 E484 S489 I490 L491	I433-L487 HydrophobicContact CD1-CD1 3.58Å; I433-L487 HydrophobicContact CG1-CD1 4.46Å; A448-L487 HydrophobicContact CB-CB 3.79Å; A448-L487 HydrophobicContact CB-CD1 3.96Å; I483-L487 HydrophobicContact CG2-CD1 3.85Å; I483-L487 HydrophobicContact CG2-CG 4.23Å; I483-L487 WeakPolarHBondContact O-CB 3.17Å; I483-L487 VanDerWaalsContact O-CG 3.3Å; I483-L487 WeakPolarHBondContact O-CG 3.3Å; I483-L487 PolarHBondContact O-N 2.68Å; E484-L487 PolarHBondContact O-N 2.66Å; L487-S489 VanDerWaalsContact C-N 3.34Å; L487-S489 PolarHBondContact O-N 2.99Å; L487-I490 PolarHBondContact O-N 2.89Å; L487-I490 VanDerWaalsContact O-N 3.14Å; L487-L491 WeakPolarHBondContact O-CB 3.42Å; L487-L491 WeakPolarHBondContact O-CG 3.24Å; L487-L491 PolarHBondContact O-N 2.95Å
488	N	92.8	Very high	86	Confident	43 Å²	43	63.9 Å²	63.9	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-65.6	-35.2	178.1	-74.9	-37.6	0	0	0	112.4	K447 A448 E484 S485 K486 I490 S492	K447-N488 WeakPolarHBondContact CA-OD1 3.43Å; K447-N488 WeakPolarHBondContact CB-OD1 3.24Å; A448-N488 PolarHBondContact N-OD1 3.47Å; A448-N488 PolarHBondContact O-ND2 2.88Å; A448-N488 PolarHBondContact O-OD1 2.94Å; E484-N488 WeakPolarHBondContact O-CB 3.15Å; E484-N488 PolarHBondContact O-N 3.42Å; E484-N488 PolarHBondContact O-ND2 2.77Å; S485-N488 PolarHBondContact O-N 2.82Å; K486-N488 VanDerWaalsContact C-N 3.33Å; K486-N488 PolarHBondContact O-N 2.66Å; N488-I490 VanDerWaalsContact C-N 3.26Å; N488-I490 PolarHBondContact O-N 2.82Å; N488-S492 WeakPolarHBondContact O-CB 3.36Å; N488-S492 PolarHBondContact O-N 2.96Å; N488-S492 PolarHBondContact O-OG 2.85Å
489	S	88.4	Confident	85	Confident	63 Å²	63	67.7 Å²	67.7	44%	0.441	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-34.2	172.7	-172.9	0	0	0	0	112.4	S485 K486 L487 S492 K493	S485-S489 PolarHBondContact O-N 3.42Å; K486-S489 WeakPolarHBondContact O-CB 3.41Å; K486-S489 PolarHBondContact O-N 2.88Å; L487-S489 VanDerWaalsContact C-N 3.34Å; L487-S489 PolarHBondContact O-N 2.99Å; S489-S492 PolarHBondContact O-OG 3.32Å; S489-K493 WeakPolarHBondContact O-CG 3.25Å
490	I	85.9	Confident	84.1	Confident	100 Å²	100	70.8 Å²	70.8	51%	0.513	39%	0.391	S	S	.	.	H	α-helix	trans	-77.6	-52.9	175.9	-62.3	168.3	0	0	0	110.5	K486 L487 N488 S492 K493	K486-I490 PolarHBondContact O-N 2.82Å; L487-I490 PolarHBondContact O-N 2.89Å; L487-I490 VanDerWaalsContact O-N 3.14Å; N488-I490 VanDerWaalsContact C-N 3.26Å; N488-I490 PolarHBondContact O-N 2.82Å; I490-S492 VanDerWaalsContact C-N 3.3Å; I490-S492 PolarHBondContact O-N 2.78Å; I490-K493 WeakPolarHBondContact O-CB 3.31Å; I490-K493 PolarHBondContact O-N 2.82Å
491	L	87.5	Confident	83.1	Confident	48 Å²	48	76.6 Å²	76.6	25%	0.251	42%	0.416	S	S	.	.	H	α-helix	trans	-67.8	-27.5	-174.3	-66.1	174.1	0	0	0	113.2	R445 G446 A448 L487 G494	R445-L491 CarbonylContact C-O 3.53Å; R445-L491 WeakPolarHBondContact CA-O 3.39Å; G446-L491 PolarHBondContact N-O 3.4Å; G446-L491 CarbonylContact O-C 3.52Å; G446-L491 VanDerWaalsContact O-C 3.31Å; G446-L491 VanDerWaalsContact O-CB 3.23Å; G446-L491 WeakPolarHBondContact O-CB 3.15Å; A448-L491 HydrophobicContact CB-CD1 3.65Å; L487-L491 WeakPolarHBondContact O-CB 3.42Å; L487-L491 WeakPolarHBondContact O-CG 3.24Å; L487-L491 PolarHBondContact O-N 2.95Å; L491-G494 PolarHBondContact O-N 2.9Å
492	S	89.2	Confident	82.2	Confident	62 Å²	62	74.4 Å²	74.4	43%	0.434	40%	0.4	S	S	.	.	H	α-helix	trans	-71.2	-32.4	176.7	59.8	0	0	0	0	113.4	R445 N488 S489 I490 G494	R445-S492 WeakPolarHBondContact CD-O 3.47Å; R445-S492 PolarHBondContact NE-O 3.15Å; N488-S492 WeakPolarHBondContact O-CB 3.36Å; N488-S492 PolarHBondContact O-N 2.96Å; N488-S492 PolarHBondContact O-OG 2.85Å; S489-S492 PolarHBondContact O-OG 3.32Å; I490-S492 VanDerWaalsContact C-N 3.3Å; I490-S492 PolarHBondContact O-N 2.78Å; S492-G494 PolarHBondContact O-N 2.9Å
493	K	85.6	Confident	82	Confident	136 Å²	136	74.7 Å²	74.7	59%	0.591	40%	0.402	S	S	*	.	H	α-helix	trans	-60.4	-41.3	170.4	-67.3	175.8	-176	-177.9	0	110.2	R443 S489 I490	R443-K493 PolarHBondContact NE-O 3.18Å; R443-K493 PolarHBondContact NH2-O 3.42Å; S489-K493 WeakPolarHBondContact O-CG 3.25Å; I490-K493 WeakPolarHBondContact O-CB 3.31Å; I490-K493 PolarHBondContact O-N 2.82Å
494	G	80.4	Confident	81.9	Confident	19 Å²	19	77 Å²	77	20%	0.196	41%	0.41	C	S	.	.			trans	64.9	173.4	179.5	0	0	0	0	0	113.7	R443 I444 L491 S492	R443-G494 PolarHBondContact NH2-O 3.46Å; I444-G494 CarbonylContact O-C 3.59Å; I444-G494 WeakPolarHBondContact O-CA 3.32Å; L491-G494 PolarHBondContact O-N 2.9Å; S492-G494 PolarHBondContact O-N 2.9Å
495	M	80.6	Confident	81.7	Confident	121 Å²	121	76.7 Å²	76.7	60%	0.596	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.7	177.5	-173.8	-178.6	-71.3	0	0	109.6	R443 I444	R443-M495 CarbonylContact C-O 3.51Å; R443-M495 VanDerWaalsContact CA-O 3.23Å; R443-M495 WeakPolarHBondContact CA-O 3.28Å; I444-M495 PolarHBondContact N-O 3.01Å; I444-M495 PolarHBondContact O-N 2.86Å
496	S	80.9	Confident	81.7	Confident	64 Å²	64	75.3 Å²	75.3	45%	0.448	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	143.6	170	44	0	0	0	0	110.2
497	L	76.8	Confident	81.8	Confident	10 Å²	10	74.7 Å²	74.7	5%	0.052	40%	0.399	C	S	.	.			trans	-57	145.2	166.1	-65.4	175.9	0	0	0	109.5	L439 G442 I444 E499 F505 P508 L519	L439-L497 HydrophobicContact CD1-CD1 4.2Å; L439-L497 HydrophobicContact CD1-CG 4.42Å; G442-L497 PolarHBondContact O-N 3.21Å; G442-L497 VanDerWaalsContact O-N 3.16Å; I444-L497 HydrophobicContact CD1-CD2 3.91Å; I444-L497 HydrophobicContact CG1-CD2 4.09Å; L497-E499 VanDerWaalsContact C-N 3.34Å; L497-E499 PolarHBondContact O-N 3.45Å; L497-F505 HydrophobicContact CB-CD2 3.77Å; L497-F505 HydrophobicContact CB-CE2 3.8Å; L497-F505 HydrophobicContact CD1-CB 4.35Å; L497-F505 HydrophobicContact CD1-CD2 3.98Å; L497-F505 HydrophobicContact CD1-CG 4.21Å; L497-P508 HydrophobicContact CD1-CB 3.94Å; L497-P508 HydrophobicContact CD1-CG 4.11Å; L497-L519 HydrophobicContact CD2-CD1 3.95Å; L497-L519 HydrophobicContact CD2-CD2 4.44Å
498	P	68.5	Low	82	Confident	96 Å²	96	74.5 Å²	74.5	62%	0.623	40%	0.401	S	S	*	.			trans	-69.1	90.1	179	27.7	-33.7	0	0	0	110	F505	P498-F505 VanDerWaalsContact O-CE2 3.31Å; P498-F505 WeakPolarHBondContact O-CE2 3.31Å
499	E	67.3	Low	81.9	Confident	112 Å²	112	75.9 Å²	75.9	52%	0.523	41%	0.406	S	S	.	.			trans	-79.2	137.6	171.8	-67.4	-177.4	-172	0	0	109.9	L497 F505	L497-E499 VanDerWaalsContact C-N 3.34Å; L497-E499 PolarHBondContact O-N 3.45Å; E499-F505 HydrophobicContact CG-CD2 4.31Å
500	T	69.5	Low	82	Confident	72 Å²	72	74.6 Å²	74.6	44%	0.442	39%	0.393	S	S	.	.			trans	-97.2	164.6	169.8	69.3	0	0	0	0	109.2	V502 L503	T500-V502 PolarHBondContact O-N 3.41Å; T500-V502 VanDerWaalsContact O-N 3.12Å; T500-V502 PolarHBondContact OG1-N 3.46Å; T500-L503 PolarHBondContact N-O 3.35Å; T500-L503 WeakPolarHBondContact OG1-CB 3.38Å; T500-L503 PolarHBondContact OG1-N 2.83Å; T500-L503 PolarHBondContact OG1-O 3.4Å
501	K	69.8	Low	82.2	Confident	194 Å²	194	74.2 Å²	74.2	84%	0.843	39%	0.388	S	S	*	.	S	Bend	trans	-58.8	-24.8	174.9	-68.3	-175.3	179.1	-179.3	0	113.3
502	V	73	Confident	82.4	Confident	26 Å²	26	74 Å²	74	16%	0.158	39%	0.387	C	S	.	.	S	Bend	trans	-103.7	-30.1	-172.3	-173.2	0	0	0	0	111.7	T500 L525 D526 A529 L533	T500-V502 PolarHBondContact O-N 3.41Å; T500-V502 VanDerWaalsContact O-N 3.12Å; T500-V502 PolarHBondContact OG1-N 3.46Å; V502-L525 HydrophobicContact CG1-CD2 4.26Å; V502-L525 CarbonylContact O-C 3.48Å; V502-L525 VanDerWaalsContact O-CA 3.22Å; V502-L525 WeakPolarHBondContact O-CA 3.28Å; V502-D526 PolarHBondContact O-N 3.06Å; V502-A529 HydrophobicContact CG2-CB 4.24Å; V502-L533 HydrophobicContact CG2-CD1 3.75Å
503	L	81.4	Confident	82.5	Confident	41 Å²	41	71.3 Å²	71.3	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.2	-172	-174.9	156.7	0	0	0	111	T500 I523 L525	T500-L503 PolarHBondContact N-O 3.35Å; T500-L503 WeakPolarHBondContact OG1-CB 3.38Å; T500-L503 PolarHBondContact OG1-N 2.83Å; T500-L503 PolarHBondContact OG1-O 3.4Å; L503-I523 HydrophobicContact CD1-CB 4.09Å; L503-I523 HydrophobicContact CD1-CD1 4.1Å; L503-I523 HydrophobicContact CD1-CG2 4.01Å; L503-I523 HydrophobicContact CD2-CB 4.26Å; L503-I523 HydrophobicContact CD2-CG2 3.91Å; L503-I523 HydrophobicContact CG-CB 4.07Å; L503-I523 HydrophobicContact CG-CG2 4.16Å; L503-L525 HydrophobicContact CB-CD2 4.26Å; L503-L525 HydrophobicContact CD1-CD2 4.41Å; L503-L525 HydrophobicContact CG-CD2 4.46Å
504	K	85.7	Confident	82.8	Confident	105 Å²	105	71 Å²	71	46%	0.457	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.2	173	-64.8	-176.7	177.6	178.6	0	110.9	I523 K524	K504-I523 CarbonylContact O-C 3.56Å; K504-I523 WeakPolarHBondContact O-CA 3.41Å; K504-K524 PolarHBondContact N-O 2.8Å; K504-K524 PolarHBondContact O-N 2.75Å
505	F	87.8	Confident	83.4	Confident	31 Å²	31	71.1 Å²	71.1	14%	0.136	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	138.3	173.7	-60.3	-77.3	0	0	0	110.9	L320 I322 L497 P498 E499 P508 A521	L320-F505 HydrophobicContact CD2-CD1 4.13Å; L320-F505 HydrophobicContact CD2-CE1 3.52Å; I322-F505 HydrophobicContact CD1-CE1 3.73Å; I322-F505 HydrophobicContact CD1-CZ 3.66Å; L497-F505 HydrophobicContact CB-CD2 3.77Å; L497-F505 HydrophobicContact CB-CE2 3.8Å; L497-F505 HydrophobicContact CD1-CB 4.35Å; L497-F505 HydrophobicContact CD1-CD2 3.98Å; L497-F505 HydrophobicContact CD1-CG 4.21Å; P498-F505 VanDerWaalsContact O-CE2 3.31Å; P498-F505 WeakPolarHBondContact O-CE2 3.31Å; E499-F505 HydrophobicContact CG-CD2 4.31Å; F505-P508 HydrophobicContact CB-CB 4.49Å; F505-A521 HydrophobicContact CB-CB 4.25Å; F505-A521 HydrophobicContact CD1-CB 3.75Å; F505-A521 HydrophobicContact CG-CB 4.45Å
506	V	89.4	Confident	84	Confident	50 Å²	50	65.3 Å²	65.3	30%	0.303	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.9	174.5	178.7	0	0	0	0	108.4	P508 D522 K524	V506-P508 VanDerWaalsContact C-CD 3.46Å; V506-D522 HydrophobicContact CB-CB 4.04Å; V506-D522 HydrophobicContact CG1-CB 4.47Å; V506-D522 PolarHBondContact N-O 3.05Å; V506-D522 PolarHBondContact O-N 3.34Å; V506-K524 HydrophobicContact CG2-CB 3.62Å
507	N	89.3	Confident	84.6	Confident	128 Å²	128	62.8 Å²	62.8	68%	0.684	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	46.5	50.2	-179.6	-57.9	-30.8	0	0	0	114.3	E509	N507-E509 PolarHBondContact O-N 3.2Å
508	P	91.7	Very high	85.3	Confident	43 Å²	43	62.4 Å²	62.4	28%	0.279	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	136.5	-177	32.9	-37	0	0	0	110.6	L439 L497 F505 V506 M520 A521	L439-P508 VanDerWaalsContact CD2-C 3.4Å; L439-P508 HydrophobicContact CD2-CB 3.65Å; L439-P508 HydrophobicContact CD2-CG 3.81Å; L439-P508 WeakPolarHBondContact CD2-O 3.33Å; L439-P508 HydrophobicContact CG-CG 4.48Å; L497-P508 HydrophobicContact CD1-CB 3.94Å; L497-P508 HydrophobicContact CD1-CG 4.11Å; F505-P508 HydrophobicContact CB-CB 4.49Å; V506-P508 VanDerWaalsContact C-CD 3.46Å; P508-M520 CarbonylContact C-O 3.58Å; P508-M520 VanDerWaalsContact CA-O 3.29Å; P508-M520 WeakPolarHBondContact CA-O 3.43Å; P508-A521 HydrophobicContact CB-CB 4.05Å
509	E	91.3	Very high	86.4	Confident	72 Å²	72	58.4 Å²	58.4	34%	0.336	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.8	176	-177.1	-171.1	169.8	0	0	108.5	K315 N507 K511 L519 M520	K315-E509 VanDerWaalsContact NZ-CD 3.26Å; K315-E509 IonicContact NZ-OE1 2.72Å; K315-E509 PolarHBondContact NZ-OE1 3.44Å; K315-E509 IonicContact NZ-OE2 2.72Å; K315-E509 PolarHBondContact NZ-OE2 2.82Å; N507-E509 PolarHBondContact O-N 3.2Å; E509-K511 WeakPolarHBondContact OE1-CE 3.45Å; E509-K511 IonicContact OE1-NZ 2.9Å; E509-L519 CarbonylContact O-C 3.57Å; E509-L519 WeakPolarHBondContact O-CA 3.34Å; E509-M520 HydrophobicContact CB-CB 4.43Å; E509-M520 HydrophobicContact CB-CE 4.13Å; E509-M520 VanDerWaalsContact CD-CE 3.46Å; E509-M520 HydrophobicContact CG-CE 3.78Å; E509-M520 PolarHBondContact N-O 2.85Å; E509-M520 PolarHBondContact O-N 2.84Å
510	M	90.3	Very high	87.6	Confident	37 Å²	37	53.7 Å²	53.7	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.9	177.6	-172.9	178.3	70.6	0	0	110.5	I437 L439 I444 V517 W518 L519	I437-M510 HydrophobicContact CB-CE 4.1Å; I437-M510 HydrophobicContact CD1-CE 3.82Å; I437-M510 HydrophobicContact CD1-SD 4.03Å; I437-M510 HydrophobicContact CG1-CE 3.7Å; L439-M510 HydrophobicContact CB-CB 4.41Å; I444-M510 HydrophobicContact CG2-SD 4.42Å; M510-V517 HydrophobicContact CG-CG1 3.47Å; M510-V517 VanDerWaalsContact CG-CG1 3.47Å; M510-V517 HydrophobicContact SD-CG1 3.71Å; M510-W518 CarbonylContact C-O 3.59Å; M510-W518 VanDerWaalsContact CA-O 3.31Å; M510-W518 WeakPolarHBondContact CA-O 3.39Å; M510-L519 HydrophobicContact CB-CD2 3.8Å; M510-L519 HydrophobicContact CG-CD2 3.69Å; M510-L519 HydrophobicContact SD-CD2 4.09Å
511	K	91	Very high	88.8	Confident	92 Å²	92	50.6 Å²	50.6	40%	0.4	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.2	172.4	-69.7	-166.9	179.2	-160	0	111.6	E509 W518 M520	E509-K511 WeakPolarHBondContact OE1-CE 3.45Å; E509-K511 IonicContact OE1-NZ 2.9Å; K511-W518 HydrophobicContact CB-CB 4.48Å; K511-W518 PolarHBondContact N-O 2.85Å; K511-W518 PolarHBondContact O-N 2.97Å; K511-M520 HydrophobicContact CB-CE 4.31Å; K511-M520 HydrophobicContact CD-CE 3.85Å; K511-M520 HydrophobicContact CG-CE 3.7Å
512	L	91	Very high	89.9	Confident	42 Å²	42	43.5 Å²	43.5	22%	0.22	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	147.2	169.4	-82.3	166	0	0	0	110.3	F398 D399 A400 A403 V517	F398-L512 HydrophobicContact CB-CD2 4.35Å; F398-L512 HydrophobicContact CD1-CD2 4.34Å; F398-L512 HydrophobicContact CG-CD2 4.35Å; D399-L512 WeakPolarHBondContact O-CB 3.13Å; A400-L512 WeakPolarHBondContact O-CB 3.15Å; A403-L512 HydrophobicContact CB-CD2 4.46Å; L512-V517 HydrophobicContact CD2-CG2 3.53Å
513	A	90.9	Very high	90.7	Very high	7 Å²	7	42.7 Å²	42.7	6%	0.058	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	165.5	176.3	0	0	0	0	0	109.1	L312 N515 A516	L312-A513 HydrophobicContact CD1-CB 4.07Å; L312-A513 HydrophobicContact CG-CB 4.47Å; A513-N515 PolarHBondContact O-N 3.26Å; A513-N515 VanDerWaalsContact O-N 3.11Å; A513-A516 CarbonylContact C-O 3.58Å; A513-A516 WeakPolarHBondContact CA-O 3.45Å; A513-A516 PolarHBondContact N-O 2.88Å; A513-A516 PolarHBondContact O-N 2.89Å
514	K	92	Very high	91.2	Very high	129 Å²	129	46.9 Å²	46.9	56%	0.561	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	122.4	174.7	-170.3	175.3	-178.1	177.9	0	110.6	A516	K514-A516 PolarHBondContact O-N 3.39Å
515	N	93.5	Very high	91.2	Very high	21 Å²	21	42.6 Å²	42.6	11%	0.112	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	4.7	-177.7	-48.2	-32.4	0	0	0	116.1	R308 T325 D326 F398 A513	R308-N515 PolarHBondContact O-ND2 2.88Å; R308-N515 VanDerWaalsContact O-ND2 3.16Å; T325-N515 CarbonylContact C-O 3.57Å; T325-N515 WeakPolarHBondContact CA-O 3.44Å; T325-N515 WeakPolarHBondContact CB-O 3.43Å; D326-N515 PolarHBondContact N-O 2.88Å; F398-N515 PolarHBondContact O-N 2.96Å; A513-N515 PolarHBondContact O-N 3.26Å; A513-N515 VanDerWaalsContact O-N 3.11Å
516	A	93.5	Very high	91.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	151.4	-175.2	0	0	0	0	0	115.4	I309 V323 I324 A513 K514	I309-A516 HydrophobicContact CD1-CB 4.44Å; I309-A516 HydrophobicContact CG2-CB 3.6Å; V323-A516 HydrophobicContact CG1-CB 3.78Å; I324-A516 CarbonylContact O-C 3.5Å; I324-A516 VanDerWaalsContact O-CA 3.29Å; I324-A516 WeakPolarHBondContact O-CA 3.12Å; A513-A516 CarbonylContact C-O 3.58Å; A513-A516 WeakPolarHBondContact CA-O 3.45Å; A513-A516 PolarHBondContact N-O 2.88Å; A513-A516 PolarHBondContact O-N 2.89Å; K514-A516 PolarHBondContact O-N 3.39Å
517	V	92.3	Very high	91.1	Very high	10 Å²	10	44.3 Å²	44.3	6%	0.061	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.1	162.2	175.6	0	0	0	0	108.9	V323 I324 F398 I437 M510 L512	V323-V517 WeakPolarHBondContact CA-O 3.36Å; I324-V517 PolarHBondContact N-O 2.88Å; I324-V517 PolarHBondContact O-N 3.14Å; F398-V517 HydrophobicContact CD2-CG2 3.99Å; F398-V517 HydrophobicContact CE2-CG2 3.82Å; F398-V517 HydrophobicContact CG-CG2 4.38Å; F398-V517 HydrophobicContact CZ-CG2 4.11Å; I437-V517 HydrophobicContact CD1-CG2 4.12Å; M510-V517 HydrophobicContact CG-CG1 3.47Å; M510-V517 VanDerWaalsContact CG-CG1 3.47Å; M510-V517 HydrophobicContact SD-CG1 3.71Å; L512-V517 HydrophobicContact CD2-CG2 3.53Å
518	W	92.4	Very high	91	Very high	3 Å²	3	48.1 Å²	48.1	1%	0.011	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	113.8	177.6	-70.6	70.1	0	0	0	109.8	R37 I309 A310 L312 Y321 V323 M510 K511	R37-W518 VanDerWaalsContact CZ-CH2 3.49Å; I309-W518 HydrophobicContact CG2-CZ2 4.09Å; A310-W518 WeakPolarHBondContact O-CZ2 3.41Å; L312-W518 HydrophobicContact CB-CD2 4.26Å; L312-W518 HydrophobicContact CB-CE3 4.22Å; L312-W518 HydrophobicContact CB-CH2 3.76Å; L312-W518 HydrophobicContact CB-CZ2 3.8Å; L312-W518 HydrophobicContact CB-CZ3 3.98Å; L312-W518 HydrophobicContact CD1-CB 4.44Å; L312-W518 HydrophobicContact CD1-CD2 3.6Å; L312-W518 HydrophobicContact CD1-CE3 4.22Å; L312-W518 HydrophobicContact CD1-CG 3.66Å; L312-W518 HydrophobicContact CD1-CZ2 4.21Å; L312-W518 HydrophobicContact CG-CD2 4.09Å; L312-W518 HydrophobicContact CG-CH2 4.25Å; L312-W518 HydrophobicContact CG-CZ2 3.76Å; Y321-W518 HydrophobicContact CD1-CE3 4.03Å; Y321-W518 HydrophobicContact CD1-CZ3 4.27Å; V323-W518 HydrophobicContact CB-CD2 4.46Å; V323-W518 HydrophobicContact CG1-CD2 3.99Å; V323-W518 HydrophobicContact CG1-CG 4.28Å; V323-W518 HydrophobicContact CG1-CZ2 4.03Å; V323-W518 HydrophobicContact CG2-CD2 3.72Å; V323-W518 HydrophobicContact CG2-CE3 3.51Å; V323-W518 HydrophobicContact CG2-CG 4.46Å; V323-W518 HydrophobicContact CG2-CH2 3.96Å; V323-W518 HydrophobicContact CG2-CZ2 4.13Å; V323-W518 HydrophobicContact CG2-CZ3 3.65Å; M510-W518 CarbonylContact C-O 3.59Å; M510-W518 VanDerWaalsContact CA-O 3.31Å; M510-W518 WeakPolarHBondContact CA-O 3.39Å; K511-W518 HydrophobicContact CB-CB 4.48Å; K511-W518 PolarHBondContact N-O 2.85Å; K511-W518 PolarHBondContact O-N 2.97Å
519	L	92.2	Very high	90.6	Very high	12 Å²	12	47 Å²	47	6%	0.063	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.7	168.2	-62.6	166.4	0	0	0	108.5	Y321 I322 I324 I444 L497 E509 M510	Y321-L519 CarbonylContact C-O 3.42Å; Y321-L519 VanDerWaalsContact CA-O 3.25Å; Y321-L519 WeakPolarHBondContact CA-O 3.31Å; I322-L519 HydrophobicContact CB-CB 4.18Å; I322-L519 HydrophobicContact CB-CD1 4.45Å; I322-L519 PolarHBondContact N-O 3.32Å; I322-L519 WeakPolarHBondContact O-CB 3.48Å; I322-L519 PolarHBondContact O-N 2.89Å; I324-L519 HydrophobicContact CD1-CD1 3.94Å; I444-L519 HydrophobicContact CD1-CD1 4.29Å; I444-L519 HydrophobicContact CD1-CD2 4.35Å; L497-L519 HydrophobicContact CD2-CD1 3.95Å; L497-L519 HydrophobicContact CD2-CD2 4.44Å; E509-L519 CarbonylContact O-C 3.57Å; E509-L519 WeakPolarHBondContact O-CA 3.34Å; M510-L519 HydrophobicContact CB-CD2 3.8Å; M510-L519 HydrophobicContact CG-CD2 3.69Å; M510-L519 HydrophobicContact SD-CD2 4.09Å
520	M	92.7	Very high	90.1	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.059	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.9	179.4	-63.3	171.5	-75.2	0	0	107.5	K315 V318 L320 Y321 P508 E509 K511	K315-M520 HydrophobicContact CD-SD 4.44Å; V318-M520 HydrophobicContact CG1-CB 4.03Å; L320-M520 WeakPolarHBondContact O-CA 3.33Å; Y321-M520 HydrophobicContact CD1-CB 4.49Å; Y321-M520 HydrophobicContact CD1-CG 3.51Å; Y321-M520 HydrophobicContact CD1-SD 4.33Å; Y321-M520 HydrophobicContact CE1-CB 4.43Å; Y321-M520 HydrophobicContact CE1-CG 3.46Å; Y321-M520 VanDerWaalsContact CE1-CG 3.46Å; Y321-M520 HydrophobicContact CE1-SD 3.77Å; Y321-M520 HydrophobicContact CG-CG 4.46Å; P508-M520 CarbonylContact C-O 3.58Å; P508-M520 VanDerWaalsContact CA-O 3.29Å; P508-M520 WeakPolarHBondContact CA-O 3.43Å; E509-M520 HydrophobicContact CB-CB 4.43Å; E509-M520 HydrophobicContact CB-CE 4.13Å; E509-M520 VanDerWaalsContact CD-CE 3.46Å; E509-M520 HydrophobicContact CG-CE 3.78Å; E509-M520 PolarHBondContact N-O 2.85Å; E509-M520 PolarHBondContact O-N 2.84Å; K511-M520 HydrophobicContact CB-CE 4.31Å; K511-M520 HydrophobicContact CD-CE 3.85Å; K511-M520 HydrophobicContact CG-CE 3.7Å
521	A	92.9	Very high	89.9	Confident	8 Å²	8	44.2 Å²	44.2	7%	0.066	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	157.8	-179.9	0	0	0	0	0	111.6	M319 L320 F505 P508	M319-A521 PolarHBondContact N-O 3.28Å; L320-A521 PolarHBondContact N-O 3.28Å; L320-A521 PolarHBondContact O-N 2.87Å; F505-A521 HydrophobicContact CB-CB 4.25Å; F505-A521 HydrophobicContact CD1-CB 3.75Å; F505-A521 HydrophobicContact CG-CB 4.45Å; P508-A521 HydrophobicContact CB-CB 4.05Å
522	D	93	Very high	89.5	Confident	44 Å²	44	43.3 Å²	43.3	24%	0.235	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	164.3	158.1	-64.3	-33.7	0	0	0	109.7	M319 V506	M319-D522 HydrophobicContact CG-CB 4.37Å; M319-D522 WeakPolarHBondContact CG-OD1 3.35Å; M319-D522 PolarHBondContact N-OD1 3.27Å; M319-D522 HydrophobicContact SD-CB 4.09Å; V506-D522 HydrophobicContact CB-CB 4.04Å; V506-D522 HydrophobicContact CG1-CB 4.47Å; V506-D522 PolarHBondContact N-O 3.05Å; V506-D522 PolarHBondContact O-N 3.34Å
523	I	91.2	Very high	88.9	Confident	10 Å²	10	42.9 Å²	42.9	5%	0.051	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.2	-178.6	59.9	171	0	0	0	109.8	Y45 L46 M319 L320 L503 K504	Y45-I523 HydrophobicContact CD1-CD1 4Å; Y45-I523 HydrophobicContact CD1-CG1 3.68Å; Y45-I523 HydrophobicContact CE1-CD1 4.41Å; Y45-I523 HydrophobicContact CE1-CG1 3.94Å; Y45-I523 WeakPolarHBondContact CE1-O 3.32Å; L46-I523 HydrophobicContact CD1-CD1 4.43Å; L46-I523 HydrophobicContact CD2-CD1 3.76Å; L46-I523 HydrophobicContact CG-CD1 4Å; M319-I523 HydrophobicContact CB-CG1 4.12Å; M319-I523 HydrophobicContact SD-CG1 3.65Å; L320-I523 HydrophobicContact CB-CG2 3.89Å; L320-I523 HydrophobicContact CD2-CG2 3.66Å; L320-I523 HydrophobicContact CG-CG2 4.43Å; L503-I523 HydrophobicContact CD1-CB 4.09Å; L503-I523 HydrophobicContact CD1-CD1 4.1Å; L503-I523 HydrophobicContact CD1-CG2 4.01Å; L503-I523 HydrophobicContact CD2-CB 4.26Å; L503-I523 HydrophobicContact CD2-CG2 3.91Å; L503-I523 HydrophobicContact CG-CB 4.07Å; L503-I523 HydrophobicContact CG-CG2 4.16Å; K504-I523 CarbonylContact O-C 3.56Å; K504-I523 WeakPolarHBondContact O-CA 3.41Å
524	K	91.2	Very high	88.2	Confident	128 Å²	128	43.1 Å²	43.1	56%	0.557	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	126	170	-176.3	170.7	-176.1	173	0	109.6	Y45 K504 V506	Y45-K524 WeakPolarHBondContact OH-CA 3.36Å; K504-K524 PolarHBondContact N-O 2.8Å; K504-K524 PolarHBondContact O-N 2.75Å; V506-K524 HydrophobicContact CG2-CB 3.62Å
525	L	86.7	Confident	87.5	Confident	15 Å²	15	39.1 Å²	39.1	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	141.3	174.5	-61.9	-177.4	0	0	0	111.3	Y45 L46 T49 V502 L503 V527 L530	Y45-L525 HydrophobicContact CE1-CG 4.12Å; Y45-L525 PolarHBondContact OH-N 3Å; Y45-L525 VanDerWaalsContact OH-N 3.14Å; L46-L525 HydrophobicContact CD2-CD1 3.62Å; L46-L525 HydrophobicContact CD2-CD2 3.89Å; L46-L525 HydrophobicContact CD2-CG 3.98Å; T49-L525 HydrophobicContact CG2-CB 4.16Å; T49-L525 HydrophobicContact CG2-CD1 3.89Å; V502-L525 HydrophobicContact CG1-CD2 4.26Å; V502-L525 CarbonylContact O-C 3.48Å; V502-L525 VanDerWaalsContact O-CA 3.22Å; V502-L525 WeakPolarHBondContact O-CA 3.28Å; L503-L525 HydrophobicContact CB-CD2 4.26Å; L503-L525 HydrophobicContact CD1-CD2 4.41Å; L503-L525 HydrophobicContact CG-CD2 4.46Å; L525-V527 PolarHBondContact O-N 3.15Å; L525-L530 HydrophobicContact CD1-CD2 4.14Å
526	D	87.7	Confident	86.5	Confident	59 Å²	59	40.8 Å²	40.8	32%	0.316	22%	0.216	S	C	.	.			trans	-78.5	101.2	164.3	-170.7	-42.6	0	0	0	108.7	V502 R528 A529 L530	V502-D526 PolarHBondContact O-N 3.06Å; D526-R528 VanDerWaalsContact C-N 3.25Å; D526-R528 PolarHBondContact O-N 3.19Å; D526-R528 PolarHBondContact OD1-N 2.81Å; D526-A529 HydrophobicContact CB-CB 3.87Å; D526-A529 PolarHBondContact O-N 2.6Å; D526-A529 PolarHBondContact OD1-N 3.06Å; D526-L530 PolarHBondContact O-N 3.05Å
527	V	86.4	Confident	85.2	Confident	58 Å²	58	40.8 Å²	40.8	35%	0.352	22%	0.216	S	C	.	.	H	α-helix	trans	-58.4	-36.9	-176.8	178.3	0	0	0	0	111.7	T49 V53 L525 L530 E531	T49-V527 HydrophobicContact CG2-CG2 4.39Å; V53-V527 HydrophobicContact CG2-CG1 3.84Å; L525-V527 PolarHBondContact O-N 3.15Å; V527-L530 PolarHBondContact O-N 3.05Å; V527-E531 HydrophobicContact CG1-CG 4.38Å; V527-E531 WeakPolarHBondContact O-CB 3.32Å; V527-E531 WeakPolarHBondContact O-CG 3.31Å; V527-E531 PolarHBondContact O-N 3.01Å
528	R	86.7	Confident	83.6	Confident	208 Å²	208	41.2 Å²	41.2	79%	0.785	22%	0.222	S	C	*	.	H	α-helix	trans	-70.7	-40.7	179.8	-64.7	-179.6	-177.8	172.3	0.3	111.2	D526 L530 E531 S532	D526-R528 VanDerWaalsContact C-N 3.25Å; D526-R528 PolarHBondContact O-N 3.19Å; D526-R528 PolarHBondContact OD1-N 2.81Å; R528-L530 VanDerWaalsContact C-N 3.29Å; R528-L530 PolarHBondContact O-N 2.84Å; R528-E531 PolarHBondContact O-N 3.13Å; R528-S532 WeakPolarHBondContact O-CB 3.23Å; R528-S532 PolarHBondContact O-N 2.95Å
529	A	83.2	Confident	82	Confident	20 Å²	20	46.9 Å²	46.9	17%	0.165	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-41.6	173.4	0	0	0	0	0	110.6	V502 D526 S532 L533	V502-A529 HydrophobicContact CG2-CB 4.24Å; D526-A529 HydrophobicContact CB-CB 3.87Å; D526-A529 PolarHBondContact O-N 2.6Å; D526-A529 PolarHBondContact OD1-N 3.06Å; A529-S532 PolarHBondContact O-N 3.44Å; A529-S532 PolarHBondContact O-OG 2.99Å; A529-L533 WeakPolarHBondContact O-CG 3.49Å; A529-L533 PolarHBondContact O-N 3.43Å
530	L	81.8	Confident	80.1	Confident	4 Å²	4	50 Å²	50	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-46.7	176.7	-170.8	63.3	0	0	0	112.4	T49 I50 V53 L525 D526 V527 R528 S532 L533 F534	T49-L530 HydrophobicContact CG2-CD2 4.45Å; I50-L530 HydrophobicContact CG1-CD2 4.09Å; V53-L530 HydrophobicContact CB-CD2 4.35Å; V53-L530 HydrophobicContact CG1-CG 4.47Å; V53-L530 HydrophobicContact CG2-CD2 3.96Å; V53-L530 HydrophobicContact CG2-CG 4.5Å; L525-L530 HydrophobicContact CD1-CD2 4.14Å; D526-L530 PolarHBondContact O-N 3.05Å; V527-L530 PolarHBondContact O-N 3.05Å; R528-L530 VanDerWaalsContact C-N 3.29Å; R528-L530 PolarHBondContact O-N 2.84Å; L530-S532 VanDerWaalsContact C-N 3.31Å; L530-S532 PolarHBondContact O-N 3.05Å; L530-L533 WeakPolarHBondContact O-CB 3.32Å; L530-L533 PolarHBondContact O-N 3.32Å; L530-F534 HydrophobicContact CD1-CD1 4.28Å; L530-F534 HydrophobicContact CD1-CE1 3.71Å; L530-F534 HydrophobicContact CD1-CE2 3.93Å; L530-F534 HydrophobicContact CD1-CZ 3.5Å; L530-F534 HydrophobicContact CD2-CE2 4.16Å; L530-F534 HydrophobicContact CD2-CZ 4.38Å; L530-F534 HydrophobicContact CG-CD2 4.24Å; L530-F534 HydrophobicContact CG-CE1 4.44Å; L530-F534 HydrophobicContact CG-CE2 3.85Å; L530-F534 HydrophobicContact CG-CZ 3.97Å; L530-F534 PolarHBondContact O-N 3.34Å
531	E	85	Confident	78.3	Confident	47 Å²	47	50.7 Å²	50.7	22%	0.22	27%	0.272	C	S	.	.	H	α-helix	trans	-56	-44.4	173.2	-78.6	178	156.1	0	0	111.2	V53 K56 H57 V527 R528 L533 F534 A535	V53-E531 HydrophobicContact CG1-CB 4.47Å; V53-E531 HydrophobicContact CG1-CG 3.71Å; V53-E531 HydrophobicContact CG2-CG 4.39Å; K56-E531 IonicContact NZ-OE1 3.77Å; K56-E531 PolarHBondContact NZ-OE1 3.02Å; K56-E531 IonicContact NZ-OE2 2.68Å; H57-E531 PolarHBondContact NE2-O 3.45Å; V527-E531 HydrophobicContact CG1-CG 4.38Å; V527-E531 WeakPolarHBondContact O-CB 3.32Å; V527-E531 WeakPolarHBondContact O-CG 3.31Å; V527-E531 PolarHBondContact O-N 3.01Å; R528-E531 PolarHBondContact O-N 3.13Å; E531-L533 PolarHBondContact O-N 3.44Å; E531-F534 PolarHBondContact O-N 2.85Å; E531-A535 VanDerWaalsContact O-CB 3.28Å; E531-A535 WeakPolarHBondContact O-CB 3.33Å; E531-A535 PolarHBondContact O-N 3.49Å
532	S	83.8	Confident	76	Confident	73 Å²	73	51.4 Å²	51.4	51%	0.51	28%	0.28	S	S	.	.	H	α-helix	trans	-64.9	-38.8	178.3	76.4	0	0	0	0	112.7	R528 A529 L530 S536	R528-S532 WeakPolarHBondContact O-CB 3.23Å; R528-S532 PolarHBondContact O-N 2.95Å; A529-S532 PolarHBondContact O-N 3.44Å; A529-S532 PolarHBondContact O-OG 2.99Å; L530-S532 VanDerWaalsContact C-N 3.31Å; L530-S532 PolarHBondContact O-N 3.05Å; S532-S536 WeakPolarHBondContact O-CB 3.36Å; S532-S536 PolarHBondContact O-N 3.44Å; S532-S536 VanDerWaalsContact O-N 3.11Å; S532-S536 PolarHBondContact O-OG 3.18Å
533	L	77.9	Confident	73.4	Confident	33 Å²	33	60 Å²	60	17%	0.173	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-47.1	175.4	-75.2	169.4	0	0	0	110.5	K215 I216 V502 A529 L530 E531 S536 S537	K215-L533 HydrophobicContact CB-CD2 4.1Å; K215-L533 HydrophobicContact CD-CD2 4.5Å; I216-L533 HydrophobicContact CG1-CD1 4.09Å; V502-L533 HydrophobicContact CG2-CD1 3.75Å; A529-L533 WeakPolarHBondContact O-CG 3.49Å; A529-L533 PolarHBondContact O-N 3.43Å; L530-L533 WeakPolarHBondContact O-CB 3.32Å; L530-L533 PolarHBondContact O-N 3.32Å; E531-L533 PolarHBondContact O-N 3.44Å; L533-S536 PolarHBondContact O-N 2.79Å; L533-S536 PolarHBondContact O-OG 3.27Å; L533-S537 PolarHBondContact O-N 3.39Å; L533-S537 PolarHBondContact O-OG 2.89Å
534	F	76.8	Confident	72.5	Confident	12 Å²	12	62.5 Å²	62.5	5%	0.053	32%	0.322	C	S	.	.	H	α-helix	trans	-70.9	-36.2	-179.8	-70.7	-4.9	0	0	0	112.9	I50 V53 L54 F208 L530 E531 S536 S537 G538	I50-F534 HydrophobicContact CG1-CZ 4.28Å; I50-F534 HydrophobicContact CG2-CE2 3.98Å; I50-F534 HydrophobicContact CG2-CZ 4.03Å; V53-F534 HydrophobicContact CB-CD2 4.31Å; V53-F534 HydrophobicContact CB-CE2 4.38Å; V53-F534 HydrophobicContact CG1-CD2 3.59Å; V53-F534 HydrophobicContact CG1-CE2 4.11Å; L54-F534 HydrophobicContact CD2-CD2 4.02Å; L54-F534 HydrophobicContact CD2-CE2 4.11Å; L54-F534 HydrophobicContact CG-CD2 4.43Å; L54-F534 HydrophobicContact CG-CE2 4.16Å; F208-F534 HydrophobicContact CE2-CB 4.38Å; F208-F534 HydrophobicContact CE2-CD1 4.29Å; F208-F534 HydrophobicContact CE2-CG 4.36Å; F208-F534 HydrophobicContact CZ-CB 4.29Å; F208-F534 AromaticContact CZ-CD1 3.7Å; F208-F534 HydrophobicContact CZ-CD1 3.7Å; F208-F534 HydrophobicContact CZ-CD2 4.22Å; F208-F534 HydrophobicContact CZ-CE1 4.02Å; F208-F534 AromaticContact CZ-CG 3.82Å; F208-F534 HydrophobicContact CZ-CG 3.82Å; F208-F534 HydrophobicContact CZ-CZ 4.43Å; L530-F534 HydrophobicContact CD1-CD1 4.28Å; L530-F534 HydrophobicContact CD1-CE1 3.71Å; L530-F534 HydrophobicContact CD1-CE2 3.93Å; L530-F534 HydrophobicContact CD1-CZ 3.5Å; L530-F534 HydrophobicContact CD2-CE2 4.16Å; L530-F534 HydrophobicContact CD2-CZ 4.38Å; L530-F534 HydrophobicContact CG-CD2 4.24Å; L530-F534 HydrophobicContact CG-CE1 4.44Å; L530-F534 HydrophobicContact CG-CE2 3.85Å; L530-F534 HydrophobicContact CG-CZ 3.97Å; L530-F534 PolarHBondContact O-N 3.34Å; E531-F534 PolarHBondContact O-N 2.85Å; F534-S536 VanDerWaalsContact C-N 3.33Å; F534-S536 PolarHBondContact O-N 3.16Å; F534-S537 CarbonylContact O-C 3.51Å; F534-S537 PolarHBondContact O-N 3.18Å; F534-G538 WeakPolarHBondContact O-CA 3.44Å; F534-G538 PolarHBondContact O-N 2.89Å
535	A	76.7	Confident	71.5	Confident	44 Å²	44	59 Å²	59	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-58.9	-46.2	171.6	0	0	0	0	0	111.1	E531 S537 G538 N539	E531-A535 VanDerWaalsContact O-CB 3.28Å; E531-A535 WeakPolarHBondContact O-CB 3.33Å; E531-A535 PolarHBondContact O-N 3.49Å; A535-S537 VanDerWaalsContact C-N 3.27Å; A535-S537 PolarHBondContact O-N 3.47Å; A535-G538 PolarHBondContact O-N 3.44Å; A535-N539 PolarHBondContact O-N 2.82Å
536	S	73.3	Confident	70.7	Confident	56 Å²	56	61.4 Å²	61.4	39%	0.392	32%	0.322	S	S	.	.	H	α-helix	trans	-68.3	-24.7	178	75.1	0	0	0	0	113.4	K215 S532 L533 F534	K215-S536 PolarHBondContact NZ-O 3.08Å; K215-S536 PolarHBondContact NZ-OG 2.99Å; S532-S536 WeakPolarHBondContact O-CB 3.36Å; S532-S536 PolarHBondContact O-N 3.44Å; S532-S536 VanDerWaalsContact O-N 3.11Å; S532-S536 PolarHBondContact O-OG 3.18Å; L533-S536 PolarHBondContact O-N 2.79Å; L533-S536 PolarHBondContact O-OG 3.27Å; F534-S536 VanDerWaalsContact C-N 3.33Å; F534-S536 PolarHBondContact O-N 3.16Å
537	S	65.9	Low	69.7	Low	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-88.7	-24.9	173.3	-64.7	0	0	0	0	112.3	S212 K215 L533 F534 A535 N539 M540	S212-S537 VanDerWaalsContact OG-CB 3.24Å; S212-S537 WeakPolarHBondContact OG-CB 3.41Å; S212-S537 PolarHBondContact OG-OG 3.14Å; S212-S537 VanDerWaalsContact OG-OG 3.05Å; K215-S537 VanDerWaalsContact NZ-N 3.12Å; K215-S537 PolarHBondContact NZ-OG 3.06Å; L533-S537 PolarHBondContact O-N 3.39Å; L533-S537 PolarHBondContact O-OG 2.89Å; F534-S537 CarbonylContact O-C 3.51Å; F534-S537 PolarHBondContact O-N 3.18Å; A535-S537 VanDerWaalsContact C-N 3.27Å; A535-S537 PolarHBondContact O-N 3.47Å; S537-N539 VanDerWaalsContact C-N 3.3Å; S537-N539 PolarHBondContact O-N 2.9Å; S537-M540 WeakPolarHBondContact O-CA 3.28Å; S537-M540 WeakPolarHBondContact O-CB 3.4Å; S537-M540 WeakPolarHBondContact O-CG 3.4Å; S537-M540 PolarHBondContact O-N 3.08Å
538	G	57.4	Low	68.7	Low	19 Å²	19	61.8 Å²	61.8	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-71.6	-24.1	-176.4	0	0	0	0	0	112.8	F534 A535 M540 L541 G542	F534-G538 WeakPolarHBondContact O-CA 3.44Å; F534-G538 PolarHBondContact O-N 2.89Å; A535-G538 PolarHBondContact O-N 3.44Å; G538-M540 PolarHBondContact O-N 3.08Å; G538-L541 WeakPolarHBondContact O-CA 3.39Å; G538-L541 WeakPolarHBondContact O-CB 3.42Å; G538-L541 PolarHBondContact O-N 3.05Å; G538-G542 PolarHBondContact O-N 2.96Å; G538-G542 VanDerWaalsContact O-N 3.14Å
539	N	58.7	Low	67.5	Low	123 Å²	123	52.1 Å²	52.1	66%	0.658	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-17.1	162.8	-72	-8.8	0	0	0	112.8	A535 S537 R543	A535-N539 PolarHBondContact O-N 2.82Å; S537-N539 VanDerWaalsContact C-N 3.3Å; S537-N539 PolarHBondContact O-N 2.9Å; N539-R543 WeakPolarHBondContact O-CG 3.47Å; N539-R543 PolarHBondContact O-N 2.85Å
540	M	53	Low	66.3	Low	76 Å²	76	54.4 Å²	54.4	37%	0.374	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-12.2	174.2	-49.9	-96.1	-104.8	0	0	113.2	T211 S537 G538 G542	T211-M540 HydrophobicContact CG2-CE 4.06Å; S537-M540 WeakPolarHBondContact O-CA 3.28Å; S537-M540 WeakPolarHBondContact O-CB 3.4Å; S537-M540 WeakPolarHBondContact O-CG 3.4Å; S537-M540 PolarHBondContact O-N 3.08Å; G538-M540 PolarHBondContact O-N 3.08Å; M540-G542 VanDerWaalsContact C-N 3.28Å
541	L	54.1	Low	65.1	Low	28 Å²	28	58.2 Å²	58.2	15%	0.147	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-33.2	161	-77.1	163.7	0	0	0	109.3	L61 I63 R204 F208 G538	L61-L541 HydrophobicContact CD1-CB 4.22Å; I63-L541 WeakPolarHBondContact CD1-O 3.22Å; R204-L541 HydrophobicContact CB-CD2 4.25Å; R204-L541 VanDerWaalsContact CD-O 3.29Å; R204-L541 WeakPolarHBondContact CD-O 3.46Å; R204-L541 PolarHBondContact NH1-O 3.21Å; F208-L541 HydrophobicContact CB-CD2 3.9Å; F208-L541 HydrophobicContact CB-CG 4.03Å; F208-L541 HydrophobicContact CD2-CD1 3.66Å; F208-L541 HydrophobicContact CD2-CD2 4.46Å; F208-L541 HydrophobicContact CD2-CG 3.81Å; F208-L541 HydrophobicContact CE2-CD1 4.02Å; F208-L541 HydrophobicContact CG-CD1 4.13Å; F208-L541 HydrophobicContact CG-CD2 4.23Å; F208-L541 HydrophobicContact CG-CG 4.08Å; G538-L541 WeakPolarHBondContact O-CA 3.39Å; G538-L541 WeakPolarHBondContact O-CB 3.42Å; G538-L541 PolarHBondContact O-N 3.05Å
542	G	45.9	Very low	63.5	Low	23 Å²	23	59.2 Å²	59.2	24%	0.237	33%	0.329	C	S	.	.			trans	-92.5	-1.7	177.8	0	0	0	0	0	117	I63 G538 M540	I63-G542 WeakPolarHBondContact CG2-O 3.41Å; G538-G542 PolarHBondContact O-N 2.96Å; G538-G542 VanDerWaalsContact O-N 3.14Å; M540-G542 VanDerWaalsContact C-N 3.28Å
543	R	38.2	Very low	61.6	Low	223 Å²	223	57.9 Å²	57.9	84%	0.842	31%	0.312	S	S	*	.			trans	-108.6	0	164.4	-78.3	-178.1	173.2	-177.6	-1.8	107.5	R204 N539	R204-R543 PolarHBondContact NH1-O 3.02Å; R204-R543 PolarHBondContact NH1-OXT 3.33Å; R204-R543 VanDerWaalsContact NH1-OXT 3.15Å; R204-R543 PolarHBondContact NH2-O 2.9Å; N539-R543 WeakPolarHBondContact O-CG 3.47Å; N539-R543 PolarHBondContact O-N 2.85Å

Retrieved 543 of 543 residues in 395 ms (Link to these results)

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