RND3_RAT Loading...

Rho-related GTP-binding protein RhoE

Binds GTP but lacks intrinsic GTPase activity and is resistant to Rho-specific GTPase-activating proteins.

AlphaFold DB , UniProt , Accession Q6SA80, Species RAT (Rattus norvegicus, Rat), Gene Rnd3, Length 244 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.1	Very low	44.1	Very low	252 Å²	252	180.1 Å²	180.1	100%	1.241	88%	0.884	S	S	*	*				0	155.9	0	-101	162.3	165.4	0	0	109.2
2	K	46.4	Very low	43.9	Very low	206 Å²	206	174.8 Å²	174.8	90%	0.896	88%	0.878	S	S	*	*			trans	-92.1	119.3	-179.4	-74.4	-179.9	176.1	175.4	0	111
3	E	40.2	Very low	44	Very low	179 Å²	179	176.5 Å²	176.5	84%	0.836	88%	0.876	S	S	*	*			trans	-68.6	150.9	162.2	-66.6	-173.7	108.4	0	0	110.9
4	R	48	Very low	44.4	Very low	247 Å²	247	169.2 Å²	169.2	93%	0.932	85%	0.851	S	S	*	*			trans	-125.1	105	166.4	-83.8	-177.5	165.7	179.4	-3.7	109.1
5	R	44.5	Very low	45	Very low	229 Å²	229	168.9 Å²	168.9	86%	0.864	85%	0.85	S	S	*	*			trans	-75.9	133.4	164.4	-72.5	-177	173.8	-170.8	-3.4	109.5
6	A	49.2	Very low	45.6	Very low	99 Å²	99	163.4 Å²	163.4	82%	0.818	82%	0.822	S	S	*	*			trans	-110.8	111.8	168.2	0	0	0	0	0	108.9	Q8	A6-Q8 PolarHBondContact O-N 3.5Å
7	S	44.7	Very low	46.3	Very low	113 Å²	113	159.1 Å²	159.1	79%	0.79	80%	0.802	S	S	*	*			trans	-86	111.9	-177.5	-57	0	0	0	0	111.4
8	Q	41.6	Very low	46.9	Very low	179 Å²	179	156.4 Å²	156.4	84%	0.836	80%	0.798	S	S	*	*			trans	-71.8	127.2	161	-71.1	-177.7	-12.9	0	0	109.3	A6	A6-Q8 PolarHBondContact O-N 3.5Å
9	K	40.5	Very low	47.4	Very low	208 Å²	208	155.8 Å²	155.8	90%	0.904	80%	0.796	S	S	*	*			trans	-87.8	107.3	170.3	-73.7	179.3	176.1	176.4	0	108.9
10	L	43.3	Very low	48.3	Very low	160 Å²	160	154.6 Å²	154.6	84%	0.838	79%	0.787	S	S	*	*			trans	-67.1	136.9	158.3	-74.5	83.2	0	0	0	108.1
11	S	42.5	Very low	49.6	Very low	109 Å²	109	152.4 Å²	152.4	76%	0.762	78%	0.777	S	S	*	*			trans	-78.5	137.1	171.9	62.6	0	0	0	0	109.9	K13	S11-K13 PolarHBondContact O-N 3.11Å; S11-K13 VanDerWaalsContact O-N 3.11Å
12	S	42	Very low	51.8	Low	117 Å²	117	141.7 Å²	141.7	82%	0.818	73%	0.726	S	S	*	*			trans	-76.1	97.4	177	54.1	0	0	0	0	110.1	S14	S12-S14 PolarHBondContact O-N 3.36Å
13	K	45.3	Very low	54	Low	197 Å²	197	138.3 Å²	138.3	86%	0.857	71%	0.712	S	S	*	*			trans	-60.4	124.7	154.7	-77.6	-167.3	173.6	-167.9	0	107.5	S11 I15	S11-K13 PolarHBondContact O-N 3.11Å; S11-K13 VanDerWaalsContact O-N 3.11Å; K13-I15 PolarHBondContact O-N 3.25Å
14	S	49.9	Very low	56.6	Low	74 Å²	74	130 Å²	130	52%	0.517	67%	0.673	S	S	.	*			trans	-73.3	108.1	175	49.1	0	0	0	0	109.5	S12 M16	S12-S14 PolarHBondContact O-N 3.36Å; S14-M16 PolarHBondContact O-N 3.32Å
15	I	52.6	Low	58.9	Low	164 Å²	164	119.9 Å²	119.9	84%	0.841	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-68	118.7	166.6	-58.8	172.8	0	0	0	106.6	K13	K13-I15 PolarHBondContact O-N 3.25Å
16	M	55.5	Low	61.5	Low	82 Å²	82	109 Å²	109	40%	0.404	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-79.5	149	172.5	-61.8	-173.6	-68.8	0	0	109.1	S14 P18	S14-M16 PolarHBondContact O-N 3.32Å; M16-P18 VanDerWaalsContact O-CD 3.31Å; M16-P18 WeakPolarHBondContact O-CD 3.48Å
17	D	56.7	Low	63.8	Low	90 Å²	90	104.3 Å²	104.3	48%	0.481	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-68.1	118.9	179.6	-170.6	-27.4	0	0	0	109.9	N19 Q20 Q69	D17-N19 PolarHBondContact O-N 3.22Å; D17-N19 VanDerWaalsContact O-N 3.12Å; D17-N19 WeakPolarHBondContact OD1-CB 3.31Å; D17-N19 PolarHBondContact OD1-N 3.12Å; D17-Q20 HydrophobicContact CB-CB 4.35Å; D17-Q20 PolarHBondContact O-N 3.45Å; D17-Q69 PolarHBondContact O-NE2 3.17Å
18	P	56.7	Low	66.4	Low	111 Å²	111	98.9 Å²	98.9	72%	0.721	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.4	179.8	-24.3	35.2	0	0	0	113.9	M16	M16-P18 VanDerWaalsContact O-CD 3.31Å; M16-P18 WeakPolarHBondContact O-CD 3.48Å
19	N	56.6	Low	69.1	Low	144 Å²	144	90.4 Å²	90.4	77%	0.77	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-2.3	-177.4	-65.5	-40.6	0	0	0	113.9	D17 N21	D17-N19 PolarHBondContact O-N 3.22Å; D17-N19 VanDerWaalsContact O-N 3.12Å; D17-N19 WeakPolarHBondContact OD1-CB 3.31Å; D17-N19 PolarHBondContact OD1-N 3.12Å; N19-N21 PolarHBondContact O-N 2.91Å
20	Q	65.7	Low	71.9	Confident	131 Å²	131	80.5 Å²	80.5	61%	0.612	44%	0.435	S	S	*	.			trans	-91.1	104.1	177.8	-169	167.5	25.6	0	0	110.9	D17 V22 Q69	D17-Q20 HydrophobicContact CB-CB 4.35Å; D17-Q20 PolarHBondContact O-N 3.45Å; Q20-V22 PolarHBondContact O-N 2.93Å; Q20-Q69 PolarHBondContact O-NE2 2.91Å
21	N	76.1	Confident	74.6	Confident	109 Å²	109	74.1 Å²	74.1	58%	0.583	40%	0.402	S	S	*	.			trans	-60.1	98.5	168	-75.9	37.3	0	0	0	109.8	N19 E72	N19-N21 PolarHBondContact O-N 2.91Å; N21-E72 PolarHBondContact ND2-OE1 3.16Å
22	V	89.5	Confident	77.2	Confident	28 Å²	28	71 Å²	71	17%	0.17	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.2	171.6	-177.2	0	0	0	0	108.1	Q20 I71 E72 V198	Q20-V22 PolarHBondContact O-N 2.93Å; V22-I71 HydrophobicContact CB-CG1 4.18Å; V22-I71 HydrophobicContact CB-CG2 4.34Å; V22-I71 HydrophobicContact CG1-CG1 4.43Å; V22-I71 HydrophobicContact CG1-CG2 4.17Å; V22-I71 WeakPolarHBondContact O-CA 3.5Å; V22-I71 WeakPolarHBondContact O-CG2 3.23Å; V22-E72 PolarHBondContact O-N 3.3Å; V22-V198 HydrophobicContact CG1-CG1 4.11Å
23	K	93.1	Very high	79.9	Confident	135 Å²	135	71.1 Å²	71.1	59%	0.587	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	144.3	172	-48.1	-156	-177.9	-145.2	0	108.9	E72	K23-E72 CarbonylContact C-O 3.6Å; K23-E72 VanDerWaalsContact CA-O 3.31Å; K23-E72 WeakPolarHBondContact CA-O 3.47Å; K23-E72 HydrophobicContact CD-CB 4.49Å; K23-E72 VanDerWaalsContact CE-OE2 3.23Å; K23-E72 WeakPolarHBondContact CE-OE2 3.49Å; K23-E72 HydrophobicContact CG-CB 4.2Å; K23-E72 IonicContact NZ-OE1 3.57Å; K23-E72 PolarHBondContact NZ-OE1 3.27Å; K23-E72 IonicContact NZ-OE2 3.61Å; K23-E72 PolarHBondContact NZ-OE2 2.84Å
24	C	95.2	Very high	82.4	Confident	5 Å²	5	61.8 Å²	61.8	3%	0.034	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128.2	174.5	-62.2	0	0	0	0	110.3	I71 E72 L73 S74 D96 C197	C24-I71 HydrophobicContact CB-CG2 4.25Å; C24-E72 PolarHBondContact N-O 3.32Å; C24-L73 HydrophobicContact CB-CD2 3.86Å; C24-L73 WeakPolarHBondContact O-CA 3.5Å; C24-S74 PolarHBondContact O-N 3.41Å; C24-D96 WeakPolarHBondContact CA-OD2 3.24Å; C24-D96 HydrophobicContact CB-CB 4.47Å; C24-C197 HydrophobicContact CB-CB 3.77Å; C24-C197 WeakPolarHBondContact SG-CB 3.43Å
25	K	97	Very high	84.8	Confident	34 Å²	34	59 Å²	59	15%	0.148	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125.4	174	179.3	171.7	171.8	177	0	110.4	S74 S91 P93 D96 A97	K25-S74 WeakPolarHBondContact CA-O 3.39Å; K25-S91 WeakPolarHBondContact CE-O 3.33Å; K25-S91 PolarHBondContact NZ-O 2.99Å; K25-P93 WeakPolarHBondContact CE-O 3.36Å; K25-P93 PolarHBondContact NZ-O 3.17Å; K25-D96 PolarHBondContact N-OD2 3.36Å; K25-D96 VanDerWaalsContact N-OD2 3.11Å; K25-D96 WeakPolarHBondContact O-CA 3.17Å; K25-D96 WeakPolarHBondContact O-CB 3.16Å; K25-D96 PolarHBondContact O-N 2.98Å; K25-A97 PolarHBondContact O-N 3.38Å
26	I	98	Very high	87	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.3	178.2	-55.1	176.6	0	0	0	108.6	L73 S74 L75 W76 A97 L99 F190 A193	I26-L73 HydrophobicContact CD1-CD2 4.22Å; I26-S74 PolarHBondContact N-O 2.87Å; I26-L75 HydrophobicContact CB-CD2 3.91Å; I26-L75 HydrophobicContact CD1-CD2 4.03Å; I26-L75 HydrophobicContact CG1-CD2 4.32Å; I26-L75 CarbonylContact O-C 3.51Å; I26-L75 WeakPolarHBondContact O-CA 3.45Å; I26-W76 PolarHBondContact O-N 3.28Å; I26-A97 WeakPolarHBondContact CA-O 3.28Å; I26-L99 HydrophobicContact CG2-CD1 4.09Å; I26-L99 HydrophobicContact CG2-CD2 4.44Å; I26-L99 HydrophobicContact CG2-CG 3.8Å; I26-F190 HydrophobicContact CD1-CD1 4.32Å; I26-A193 HydrophobicContact CD1-CB 3.94Å
27	V	98.5	Very high	89	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.8	174.6	-173.7	0	0	0	0	109.5	V29 W76 T78 S91 Y92 S95 A97 V98 L99	V27-V29 HydrophobicContact CG1-CG1 4.08Å; V27-W76 HydrophobicContact CB-CB 4.36Å; V27-W76 HydrophobicContact CG1-CB 4.16Å; V27-W76 HydrophobicContact CG2-CB 4.08Å; V27-W76 HydrophobicContact CG2-CG 4.29Å; V27-T78 HydrophobicContact CG1-CG2 3.85Å; V27-S91 WeakPolarHBondContact CG2-O 3.26Å; V27-Y92 HydrophobicContact CG1-CD1 4.01Å; V27-Y92 HydrophobicContact CG1-CE1 3.91Å; V27-S95 VanDerWaalsContact CG2-OG 3.23Å; V27-S95 WeakPolarHBondContact CG2-OG 3.3Å; V27-A97 PolarHBondContact N-O 3.06Å; V27-A97 VanDerWaalsContact N-O 3.16Å; V27-V98 HydrophobicContact CB-CG2 4.45Å; V27-V98 CarbonylContact O-C 3.56Å; V27-V98 VanDerWaalsContact O-CA 3.3Å; V27-V98 WeakPolarHBondContact O-CA 3.38Å; V27-L99 PolarHBondContact O-N 2.99Å
28	V	98.8	Very high	91	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.8	-178.9	-167.5	0	0	0	0	109.3	K36 L40 W76 T78 L99 C101	V28-K36 HydrophobicContact CG1-CB 3.77Å; V28-K36 HydrophobicContact CG1-CD 3.97Å; V28-K36 HydrophobicContact CG1-CG 3.84Å; V28-L40 HydrophobicContact CB-CD1 4.02Å; V28-L40 HydrophobicContact CG2-CD1 3.74Å; V28-L40 HydrophobicContact CG2-CD2 3.93Å; V28-L40 HydrophobicContact CG2-CG 4.02Å; V28-W76 PolarHBondContact N-O 2.97Å; V28-T78 PolarHBondContact O-OG1 3.25Å; V28-L99 WeakPolarHBondContact CA-O 3.38Å; V28-L99 HydrophobicContact CG1-CB 4.17Å; V28-L99 HydrophobicContact CG2-CB 4.25Å; V28-L99 HydrophobicContact CG2-CD1 4.07Å; V28-L99 HydrophobicContact CG2-CG 4.38Å; V28-C101 VanDerWaalsContact CG1-SG 3.54Å
29	V	98.8	Very high	93	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	168.9	-176.2	-53.7	0	0	0	0	110.8	V27 K36 Y92 V98 L99 I100 C101 W117 I121	V27-V29 HydrophobicContact CG1-CG1 4.08Å; V29-K36 WeakPolarHBondContact O-CD 3.36Å; V29-Y92 HydrophobicContact CG1-CE1 3.69Å; V29-Y92 WeakPolarHBondContact CG1-OH 3.33Å; V29-V98 HydrophobicContact CG1-CG1 4.31Å; V29-V98 HydrophobicContact CG2-CG1 3.77Å; V29-L99 PolarHBondContact N-O 3.34Å; V29-I100 HydrophobicContact CG2-CB 4.3Å; V29-I100 HydrophobicContact CG2-CG1 3.84Å; V29-I100 HydrophobicContact CG2-CG2 4.35Å; V29-C101 PolarHBondContact O-N 3.3Å; V29-W117 HydrophobicContact CB-CE3 3.88Å; V29-W117 HydrophobicContact CB-CZ3 4.05Å; V29-W117 HydrophobicContact CG2-CE3 4.04Å; V29-I121 HydrophobicContact CG1-CD1 4.24Å; V29-I121 HydrophobicContact CG2-CD1 4.17Å; V29-I121 HydrophobicContact CG2-CG1 4.12Å
30	G	98.8	Very high	95	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	130.9	168.6	-170.5	0	0	0	0	0	112.3	K36 G80 C101 W117	G30-K36 PolarHBondContact O-NZ 3.18Å; G30-G80 WeakPolarHBondContact O-CA 3.49Å; G30-C101 VanDerWaalsContact CA-O 3.3Å; G30-C101 WeakPolarHBondContact CA-O 3.48Å; G30-W117 VanDerWaalsContact C-CE2 3.48Å; G30-W117 VanDerWaalsContact CA-CE2 3.4Å; G30-W117 WeakPolarHBondContact O-CZ2 3.5Å
31	D	98.8	Very high	96.4	Very high	26 Å²	26	29.1 Å²	29.1	14%	0.139	15%	0.154	C	C	.	.	S	Bend	trans	-58.7	161.7	-170.6	-74.5	11.4	0	0	0	114.1	C34 K36 T109 S112 W117	D31-C34 PolarHBondContact O-N 3.09Å; D31-C34 PolarHBondContact O-SG 2.79Å; D31-K36 PolarHBondContact O-NZ 3.49Å; D31-K36 VanDerWaalsContact O-NZ 3.14Å; D31-T109 HydrophobicContact CB-CG2 3.92Å; D31-T109 WeakPolarHBondContact OD2-CA 3.15Å; D31-S112 WeakPolarHBondContact OD1-CB 3.49Å; D31-S112 PolarHBondContact OD1-OG 2.9Å; D31-S112 VanDerWaalsContact OD2-CB 3.24Å; D31-S112 WeakPolarHBondContact OD2-CB 3.36Å; D31-S112 PolarHBondContact OD2-OG 3.45Å; D31-W117 PolarHBondContact OD1-NE1 3.43Å
32	S	98.4	Very high	97.4	Very high	43 Å²	43	24.2 Å²	24.2	30%	0.301	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	141.8	169.7	-67.4	0	0	0	0	110.6	C34 G80 S81 R106	S32-C34 PolarHBondContact O-N 3.23Å; S32-G80 VanDerWaalsContact OG-C 3.31Å; S32-S81 PolarHBondContact OG-N 3.44Å; S32-R106 PolarHBondContact O-NH2 3.47Å; S32-R106 VanDerWaalsContact O-NH2 3.08Å
33	Q	98.2	Very high	97.8	Very high	120 Å²	120	24.3 Å²	24.3	56%	0.561	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	10.1	178.9	-59.5	-179.4	81.1	0	0	116.3	G35 Y52 K136	Q33-G35 VanDerWaalsContact C-N 3.27Å; Q33-G35 PolarHBondContact O-N 2.99Å; Q33-Y52 HydrophobicContact CG-CD1 4.37Å; Q33-Y52 HydrophobicContact CG-CE1 3.71Å; Q33-Y52 HydrophobicContact CG-CE2 3.89Å; Q33-Y52 VanDerWaalsContact CG-CZ 3.44Å; Q33-K136 WeakPolarHBondContact O-CE 3.47Å; Q33-K136 PolarHBondContact O-NZ 3.21Å
34	C	98.6	Very high	98	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.007	11%	0.109	C	C	.	.	S	Bend	trans	-71.4	-16.4	179.7	75.1	0	0	0	0	114.6	D31 S32 C101 D103 C135	D31-C34 PolarHBondContact O-N 3.09Å; D31-C34 PolarHBondContact O-SG 2.79Å; S32-C34 PolarHBondContact O-N 3.23Å; C34-C101 PolarHBondContact SG-O 2.94Å; C34-C101 VanDerWaalsContact SG-O 3.37Å; C34-D103 HydrophobicContact CB-CB 3.84Å; C34-C135 WeakPolarHBondContact O-CB 3.38Å
35	G	98.5	Very high	97.9	Very high	17 Å²	17	24.4 Å²	24.4	18%	0.175	13%	0.131	C	C	.	.	S	Bend	trans	120.5	0.8	172.7	0	0	0	0	0	116.5	Q33 T37 A38 L39	Q33-G35 VanDerWaalsContact C-N 3.27Å; Q33-G35 PolarHBondContact O-N 2.99Å; G35-T37 VanDerWaalsContact C-N 3.33Å; G35-T37 PolarHBondContact O-N 3.47Å; G35-A38 PolarHBondContact O-N 3.15Å; G35-L39 PolarHBondContact O-N 3.17Å
36	K	98.7	Very high	97.8	Very high	10 Å²	10	29 Å²	29	4%	0.043	16%	0.157	C	C	.	.	H	α-helix	trans	-45.1	-51.9	-179.3	-53.3	-169.4	-60	-76.8	0	113.8	V28 V29 G30 D31 L39 L40 D77 T78 C101	V28-K36 HydrophobicContact CG1-CB 3.77Å; V28-K36 HydrophobicContact CG1-CD 3.97Å; V28-K36 HydrophobicContact CG1-CG 3.84Å; V29-K36 WeakPolarHBondContact O-CD 3.36Å; G30-K36 PolarHBondContact O-NZ 3.18Å; D31-K36 PolarHBondContact O-NZ 3.49Å; D31-K36 VanDerWaalsContact O-NZ 3.14Å; K36-L39 WeakPolarHBondContact O-CB 3.5Å; K36-L39 PolarHBondContact O-N 2.77Å; K36-L40 WeakPolarHBondContact O-CB 3.22Å; K36-L40 WeakPolarHBondContact O-CG 3.39Å; K36-L40 PolarHBondContact O-N 2.82Å; K36-D77 VanDerWaalsContact CB-OD1 3.32Å; K36-D77 WeakPolarHBondContact CB-OD1 3.5Å; K36-T78 WeakPolarHBondContact CE-O 3.41Å; K36-T78 PolarHBondContact NZ-O 3.25Å; K36-C101 HydrophobicContact CG-CB 3.89Å
37	T	98.3	Very high	97.6	Very high	36 Å²	36	31.6 Å²	31.6	22%	0.221	18%	0.175	C	C	.	.	H	α-helix	trans	-64.8	-41.6	-178.5	-37.6	0	0	0	0	111.5	G35 L40 H41 T55 D77	G35-T37 VanDerWaalsContact C-N 3.33Å; G35-T37 PolarHBondContact O-N 3.47Å; T37-L40 PolarHBondContact O-N 2.97Å; T37-H41 WeakPolarHBondContact O-CB 3.46Å; T37-H41 PolarHBondContact O-N 2.88Å; T37-T55 PolarHBondContact OG1-OG1 3.3Å; T37-T55 VanDerWaalsContact OG1-OG1 3.05Å; T37-D77 WeakPolarHBondContact CA-OD2 3.4Å; T37-D77 VanDerWaalsContact CB-OD2 3.29Å; T37-D77 WeakPolarHBondContact CB-OD2 3.39Å; T37-D77 WeakPolarHBondContact CG2-OD2 3.36Å; T37-D77 PolarHBondContact OG1-OD2 3.21Å
38	A	98.4	Very high	97.5	Very high	13 Å²	13	36 Å²	36	11%	0.107	19%	0.194	C	C	.	.	H	α-helix	trans	-66.3	-43.4	176.9	0	0	0	0	0	111.9	G35 L40 H41 V42 F48 P49 A179	G35-A38 PolarHBondContact O-N 3.15Å; A38-L40 VanDerWaalsContact C-N 3.33Å; A38-L40 PolarHBondContact O-N 2.9Å; A38-H41 PolarHBondContact O-N 2.99Å; A38-V42 WeakPolarHBondContact O-CB 3.35Å; A38-V42 VanDerWaalsContact O-CG2 3.27Å; A38-V42 WeakPolarHBondContact O-CG2 3.5Å; A38-V42 PolarHBondContact O-N 3.48Å; A38-F48 HydrophobicContact CB-CD2 4.31Å; A38-F48 HydrophobicContact CB-CE2 3.76Å; A38-F48 HydrophobicContact CB-CZ 4.15Å; A38-P49 HydrophobicContact CB-CG 3.96Å; A38-A179 HydrophobicContact CB-CB 4.17Å
39	L	98.5	Very high	97.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56	-46.1	173.3	168.4	64.4	0	0	0	111.8	G35 K36 F43 V133 V186 I189 F190	G35-L39 PolarHBondContact O-N 3.17Å; K36-L39 WeakPolarHBondContact O-CB 3.5Å; K36-L39 PolarHBondContact O-N 2.77Å; L39-F43 WeakPolarHBondContact O-CB 3.44Å; L39-F43 PolarHBondContact O-N 2.94Å; L39-V133 HydrophobicContact CD2-CG1 4.23Å; L39-V186 HydrophobicContact CD1-CB 4.19Å; L39-V186 HydrophobicContact CD1-CG1 3.88Å; L39-V186 HydrophobicContact CD1-CG2 3.87Å; L39-I189 HydrophobicContact CD1-CB 4.35Å; L39-I189 HydrophobicContact CD1-CG1 3.92Å; L39-F190 HydrophobicContact CD1-CE2 3.72Å; L39-F190 HydrophobicContact CD1-CZ 4.36Å; L39-F190 HydrophobicContact CG-CE2 3.93Å; L39-F190 HydrophobicContact CG-CZ 4.09Å
40	L	98.3	Very high	97	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-72.1	-40.2	179.2	-77.5	169.4	0	0	0	113.4	V28 K36 T37 A38 F43 A44 Y60 L75 D77 F190	V28-L40 HydrophobicContact CB-CD1 4.02Å; V28-L40 HydrophobicContact CG2-CD1 3.74Å; V28-L40 HydrophobicContact CG2-CD2 3.93Å; V28-L40 HydrophobicContact CG2-CG 4.02Å; K36-L40 WeakPolarHBondContact O-CB 3.22Å; K36-L40 WeakPolarHBondContact O-CG 3.39Å; K36-L40 PolarHBondContact O-N 2.82Å; T37-L40 PolarHBondContact O-N 2.97Å; A38-L40 VanDerWaalsContact C-N 3.33Å; A38-L40 PolarHBondContact O-N 2.9Å; L40-F43 PolarHBondContact O-N 3.44Å; L40-A44 WeakPolarHBondContact O-CB 3.42Å; L40-A44 PolarHBondContact O-N 2.92Å; L40-Y60 HydrophobicContact CB-CD2 4.1Å; L40-Y60 HydrophobicContact CB-CE2 4.01Å; L40-Y60 HydrophobicContact CD1-CD2 4.38Å; L40-Y60 HydrophobicContact CD1-CE2 4.31Å; L40-L75 HydrophobicContact CD2-CB 3.64Å; L40-L75 HydrophobicContact CD2-CD1 3.75Å; L40-L75 HydrophobicContact CD2-CG 4.22Å; L40-D77 HydrophobicContact CD1-CB 3.45Å; L40-D77 VanDerWaalsContact CD1-CB 3.45Å; L40-F190 HydrophobicContact CD2-CE1 4.06Å; L40-F190 HydrophobicContact CD2-CZ 3.74Å; L40-F190 HydrophobicContact CG-CZ 4.47Å
41	H	96.6	Very high	96.8	Very high	34 Å²	34	52.3 Å²	52.3	16%	0.157	28%	0.277	C	S	.	.	H	α-helix	trans	-71.2	-41.8	-176.3	-160.2	-114.8	0	0	0	111.5	T37 A38 A44 K45 C47	T37-H41 WeakPolarHBondContact O-CB 3.46Å; T37-H41 PolarHBondContact O-N 2.88Å; A38-H41 PolarHBondContact O-N 2.99Å; H41-A44 PolarHBondContact O-N 3.16Å; H41-K45 WeakPolarHBondContact NE2-CD 3.41Å; H41-K45 PolarHBondContact NE2-NZ 3.01Å; H41-K45 WeakPolarHBondContact O-CB 3.32Å; H41-K45 PolarHBondContact O-N 2.82Å; H41-C47 CarbonylContact C-O 3.56Å; H41-C47 VanDerWaalsContact CE1-SG 3.52Å; H41-C47 PolarHBondContact ND1-O 2.88Å; H41-C47 VanDerWaalsContact ND1-O 3.14Å
42	V	97.5	Very high	96.6	Very high	6 Å²	6	57 Å²	57	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-60.7	-47.1	171.2	171.6	0	0	0	0	110.4	A38 A44 D46 C47 F48 A179 E183 V186	A38-V42 WeakPolarHBondContact O-CB 3.35Å; A38-V42 VanDerWaalsContact O-CG2 3.27Å; A38-V42 WeakPolarHBondContact O-CG2 3.5Å; A38-V42 PolarHBondContact O-N 3.48Å; V42-A44 PolarHBondContact O-N 3Å; V42-D46 VanDerWaalsContact O-CA 3.27Å; V42-D46 WeakPolarHBondContact O-CA 3.38Å; V42-D46 PolarHBondContact O-N 3.41Å; V42-C47 PolarHBondContact N-O 3.06Å; V42-F48 HydrophobicContact CG2-CB 4.16Å; V42-F48 HydrophobicContact CG2-CD2 4.03Å; V42-A179 HydrophobicContact CG2-CB 4.28Å; V42-E183 HydrophobicContact CG1-CB 4.49Å; V42-E183 HydrophobicContact CG1-CG 4.03Å; V42-V186 HydrophobicContact CB-CG1 4.4Å; V42-V186 HydrophobicContact CG1-CB 4.3Å; V42-V186 HydrophobicContact CG1-CG1 4.07Å; V42-V186 HydrophobicContact CG1-CG2 4.24Å
43	F	97.5	Very high	96.4	Very high	31 Å²	31	60.1 Å²	60.1	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-67.5	-34.3	-179.6	178.5	-110.9	0	0	0	114.7	L39 L40 A62 F64 L73 L75 V186 F190	L39-F43 WeakPolarHBondContact O-CB 3.44Å; L39-F43 PolarHBondContact O-N 2.94Å; L40-F43 PolarHBondContact O-N 3.44Å; F43-A62 HydrophobicContact CD1-CB 4.37Å; F43-A62 HydrophobicContact CE1-CB 3.7Å; F43-A62 HydrophobicContact CZ-CB 4.33Å; F43-F64 AromaticContact CE2-CD2 3.88Å; F43-F64 HydrophobicContact CE2-CD2 3.88Å; F43-F64 HydrophobicContact CE2-CE2 4.26Å; F43-F64 AromaticContact CZ-CD2 3.87Å; F43-F64 HydrophobicContact CZ-CD2 3.87Å; F43-L73 HydrophobicContact CE1-CD1 3.8Å; F43-L73 HydrophobicContact CZ-CD1 3.83Å; F43-L75 HydrophobicContact CD1-CD1 3.59Å; F43-L75 HydrophobicContact CE1-CD1 3.79Å; F43-V186 HydrophobicContact CB-CG1 3.64Å; F43-F190 HydrophobicContact CB-CD2 3.6Å; F43-F190 HydrophobicContact CB-CE2 3.45Å; F43-F190 VanDerWaalsContact CB-CE2 3.45Å; F43-F190 HydrophobicContact CB-CZ 4.26Å; F43-F190 HydrophobicContact CD1-CB 4.24Å; F43-F190 AromaticContact CD1-CD1 3.85Å; F43-F190 HydrophobicContact CD1-CD1 3.85Å; F43-F190 AromaticContact CD1-CD2 3.52Å; F43-F190 HydrophobicContact CD1-CD2 3.52Å; F43-F190 HydrophobicContact CD1-CE1 4.09Å; F43-F190 AromaticContact CD1-CE2 3.77Å; F43-F190 HydrophobicContact CD1-CE2 3.77Å; F43-F190 AromaticContact CD1-CG 3.57Å; F43-F190 HydrophobicContact CD1-CG 3.57Å; F43-F190 HydrophobicContact CD1-CZ 4.06Å; F43-F190 HydrophobicContact CD2-CB 3.93Å; F43-F190 AromaticContact CD2-CD2 3.44Å; F43-F190 HydrophobicContact CD2-CD2 3.44Å; F43-F190 VanDerWaalsContact CD2-CD2 3.44Å; F43-F190 HydrophobicContact CD2-CE2 4.21Å; F43-F190 AromaticContact CD2-CG 3.83Å; F43-F190 HydrophobicContact CD2-CG 3.83Å; F43-F190 HydrophobicContact CE1-CB 3.89Å; F43-F190 AromaticContact CE1-CD1 3.85Å; F43-F190 HydrophobicContact CE1-CD1 3.85Å; F43-F190 HydrophobicContact CE1-CD2 4.06Å; F43-F190 HydrophobicContact CE1-CE1 4.46Å; F43-F190 AromaticContact CE1-CG 3.64Å; F43-F190 HydrophobicContact CE1-CG 3.64Å; F43-F190 HydrophobicContact CE2-CB 3.55Å; F43-F190 HydrophobicContact CE2-CD2 4Å; F43-F190 AromaticContact CE2-CG 3.9Å; F43-F190 HydrophobicContact CE2-CG 3.9Å; F43-F190 HydrophobicContact CG-CB 4.27Å; F43-F190 HydrophobicContact CG-CD1 4.37Å; F43-F190 AromaticContact CG-CD2 3.18Å; F43-F190 HydrophobicContact CG-CD2 3.18Å; F43-F190 AromaticContact CG-CE2 3.52Å; F43-F190 HydrophobicContact CG-CE2 3.52Å; F43-F190 AromaticContact CG-CG 3.67Å; F43-F190 HydrophobicContact CG-CG 3.67Å; F43-F190 HydrophobicContact CG-CZ 4.26Å; F43-F190 HydrophobicContact CZ-CB 3.54Å; F43-F190 HydrophobicContact CZ-CD1 4.4Å; F43-F190 HydrophobicContact CZ-CD2 4.29Å; F43-F190 AromaticContact CZ-CG 3.82Å; F43-F190 HydrophobicContact CZ-CG 3.82Å
44	A	95.9	Very high	96.2	Very high	28 Å²	28	58.3 Å²	58.3	23%	0.231	31%	0.31	C	S	.	.	H	α-helix	trans	-97.5	-11.7	-172.7	0	0	0	0	0	114.4	L40 H41 V42 Y60	L40-A44 WeakPolarHBondContact O-CB 3.42Å; L40-A44 PolarHBondContact O-N 2.92Å; H41-A44 PolarHBondContact O-N 3.16Å; V42-A44 PolarHBondContact O-N 3Å; A44-Y60 HydrophobicContact CB-CD1 4.32Å; A44-Y60 HydrophobicContact CB-CG 4.24Å
45	K	94.6	Very high	96	Very high	113 Å²	113	59.1 Å²	59.1	49%	0.491	32%	0.315	S	S	.	.	H	α-helix	trans	-142.6	5.4	-176.2	-54.3	-170	-165.3	166.2	0	114.8	H41 C47	H41-K45 WeakPolarHBondContact NE2-CD 3.41Å; H41-K45 PolarHBondContact NE2-NZ 3.01Å; H41-K45 WeakPolarHBondContact O-CB 3.32Å; H41-K45 PolarHBondContact O-N 2.82Å; K45-C47 PolarHBondContact O-N 3.47Å
46	D	94	Very high	95.8	Very high	131 Å²	131	61.5 Å²	61.5	70%	0.701	33%	0.326	S	S	*	.	S	Bend	trans	52.6	36.3	-178.2	-52.9	-48.4	0	0	0	113.1	V42	V42-D46 VanDerWaalsContact O-CA 3.27Å; V42-D46 WeakPolarHBondContact O-CA 3.38Å; V42-D46 PolarHBondContact O-N 3.41Å
47	C	94.8	Very high	95.5	Very high	54 Å²	54	63.9 Å²	63.9	37%	0.365	34%	0.336	S	S	.	.			trans	-149.4	140.4	178.7	70	0	0	0	0	114.5	H41 V42 K45	H41-C47 CarbonylContact C-O 3.56Å; H41-C47 VanDerWaalsContact CE1-SG 3.52Å; H41-C47 PolarHBondContact ND1-O 2.88Å; H41-C47 VanDerWaalsContact ND1-O 3.14Å; V42-C47 PolarHBondContact N-O 3.06Å; K45-C47 PolarHBondContact O-N 3.47Å
48	F	95.5	Very high	95.3	Very high	92 Å²	92	67.2 Å²	67.2	40%	0.404	35%	0.349	S	S	.	.			trans	-80.3	137.7	174.4	-167.3	-89.2	0	0	0	110.9	A38 V42 E50 A179 L180	A38-F48 HydrophobicContact CB-CD2 4.31Å; A38-F48 HydrophobicContact CB-CE2 3.76Å; A38-F48 HydrophobicContact CB-CZ 4.15Å; V42-F48 HydrophobicContact CG2-CB 4.16Å; V42-F48 HydrophobicContact CG2-CD2 4.03Å; F48-E50 PolarHBondContact O-N 3.15Å; F48-A179 HydrophobicContact CD2-CB 4.36Å; F48-A179 WeakPolarHBondContact CD2-O 3.14Å; F48-A179 HydrophobicContact CE2-CB 4.16Å; F48-L180 HydrophobicContact CD1-CD1 4.34Å; F48-L180 HydrophobicContact CD2-CB 4.39Å; F48-L180 HydrophobicContact CD2-CD1 4.32Å; F48-L180 HydrophobicContact CE1-CD1 4.25Å; F48-L180 HydrophobicContact CE2-CB 3.92Å; F48-L180 HydrophobicContact CE2-CD1 4.21Å; F48-L180 HydrophobicContact CG-CD1 4.37Å; F48-L180 HydrophobicContact CZ-CB 4.38Å; F48-L180 HydrophobicContact CZ-CD1 4.18Å
49	P	94.5	Very high	95.2	Very high	33 Å²	33	70.1 Å²	70.1	21%	0.214	36%	0.363	C	S	.	.			trans	-71.6	114.5	178	28.5	-33.7	0	0	0	111.6	A38 N51	A38-P49 HydrophobicContact CB-CG 3.96Å; P49-N51 PolarHBondContact O-N 3.03Å
50	E	93.5	Very high	95	Very high	185 Å²	185	71.3 Å²	71.3	86%	0.864	37%	0.368	S	S	*	.	S	Bend	trans	-60.5	-28.1	179.4	-61.2	-179.7	163.2	0	0	114	F48	F48-E50 PolarHBondContact O-N 3.15Å
51	N	94.7	Very high	94.9	Very high	125 Å²	125	76.8 Å²	76.8	67%	0.668	40%	0.401	S	S	*	.	S	Bend	trans	-130.2	136.3	-174.3	-71.7	-88	0	0	0	110.4	P49 V53	P49-N51 PolarHBondContact O-N 3.03Å; N51-V53 PolarHBondContact O-N 3.01Å
52	Y	93.3	Very high	94.8	Very high	124 Å²	124	76.3 Å²	76.3	49%	0.486	40%	0.403	S	S	.	.			trans	-80.5	119.5	173.8	173.7	-111.2	0	0	0	111.2	Q33 P54	Q33-Y52 HydrophobicContact CG-CD1 4.37Å; Q33-Y52 HydrophobicContact CG-CE1 3.71Å; Q33-Y52 HydrophobicContact CG-CE2 3.89Å; Q33-Y52 VanDerWaalsContact CG-CZ 3.44Å; Y52-P54 HydrophobicContact CE1-CG 3.82Å
53	V	94.5	Very high	94.5	Very high	109 Å²	109	78.4 Å²	78.4	66%	0.661	42%	0.418	S	S	*	.			trans	-117.6	129.4	168	-178.2	0	0	0	0	107.8	N51 T55	N51-V53 PolarHBondContact O-N 3.01Å; V53-T55 PolarHBondContact O-N 3.41Å; V53-T55 VanDerWaalsContact O-N 3.13Å
54	P	95	Very high	94.2	Very high	83 Å²	83	77.6 Å²	77.6	54%	0.539	41%	0.414	S	S	.	.			trans	-65.2	111.2	178	-21.2	32.3	0	0	0	112.3	Y52 V56	Y52-P54 HydrophobicContact CE1-CG 3.82Å; P54-V56 PolarHBondContact O-N 3.41Å
55	T	94	Very high	93.9	Very high	18 Å²	18	82 Å²	82	11%	0.11	43%	0.431	C	S	.	.			trans	-57.5	137.8	173.9	-54.3	0	0	0	0	111.5	T37 V53 E58 D77 S79	T37-T55 PolarHBondContact OG1-OG1 3.3Å; T37-T55 VanDerWaalsContact OG1-OG1 3.05Å; V53-T55 PolarHBondContact O-N 3.41Å; V53-T55 VanDerWaalsContact O-N 3.13Å; T55-E58 HydrophobicContact CG2-CG 4.36Å; T55-D77 WeakPolarHBondContact CB-OD2 3.39Å; T55-D77 HydrophobicContact CG2-CB 3.99Å; T55-D77 WeakPolarHBondContact CG2-OD2 3.47Å; T55-D77 PolarHBondContact OG1-OD2 3.26Å; T55-S79 VanDerWaalsContact O-CA 3.28Å; T55-S79 WeakPolarHBondContact O-CA 3.27Å; T55-S79 WeakPolarHBondContact O-CB 3.33Å; T55-S79 PolarHBondContact O-OG 2.88Å
56	V	93.4	Very high	93.6	Very high	67 Å²	67	77.5 Å²	77.5	41%	0.406	41%	0.411	S	S	.	.	S	Bend	trans	-94.7	-68.5	161.6	-179.3	0	0	0	0	108.3	P54 S79 Y84	P54-V56 PolarHBondContact O-N 3.41Å; V56-S79 PolarHBondContact O-N 2.79Å; V56-Y84 HydrophobicContact CB-CE1 4.48Å; V56-Y84 HydrophobicContact CG1-CD1 3.98Å; V56-Y84 HydrophobicContact CG1-CE1 3.62Å; V56-Y84 HydrophobicContact CG2-CE1 4.22Å; V56-Y84 HydrophobicContact CG2-CE2 4.45Å
57	F	92.1	Very high	93.3	Very high	59 Å²	59	78.1 Å²	78.1	26%	0.259	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	147.3	162.2	-70.4	-83.3	0	0	0	109.3	D77 T78 V87	F57-D77 WeakPolarHBondContact CA-O 3.18Å; F57-T78 HydrophobicContact CD1-CG2 4.19Å; F57-T78 HydrophobicContact CE1-CG2 4.1Å; F57-V87 HydrophobicContact CE2-CB 4.09Å; F57-V87 HydrophobicContact CE2-CG1 3.61Å; F57-V87 HydrophobicContact CZ-CB 4.3Å; F57-V87 HydrophobicContact CZ-CG1 4.06Å; F57-V87 WeakPolarHBondContact CZ-O 3.44Å
58	E	95.6	Very high	92.8	Very high	106 Å²	106	81.7 Å²	81.7	50%	0.495	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	148.2	165.4	-72.7	-63	165.2	0	0	109.5	T55 Y60 W76 D77	T55-E58 HydrophobicContact CG2-CG 4.36Å; E58-Y60 HydrophobicContact CB-CE2 3.76Å; E58-W76 WeakPolarHBondContact O-CA 3.41Å; E58-D77 HydrophobicContact CB-CB 4.25Å; E58-D77 PolarHBondContact N-O 2.85Å; E58-D77 PolarHBondContact O-N 3.08Å
59	N	95.3	Very high	92.4	Very high	74 Å²	74	78.2 Å²	78.2	40%	0.396	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	121.4	170.3	-170.2	-114.7	0	0	0	110.4	S74 L75 W76	N59-S74 PolarHBondContact ND2-OG 3.46Å; N59-S74 VanDerWaalsContact ND2-OG 3.17Å; N59-L75 WeakPolarHBondContact CA-O 3.12Å; N59-L75 PolarHBondContact ND2-O 3.22Å; N59-W76 VanDerWaalsContact ND2-CE2 3.31Å; N59-W76 PolarHBondContact ND2-NE1 2.98Å; N59-W76 VanDerWaalsContact ND2-NE1 3.15Å
60	Y	95.3	Very high	92.2	Very high	26 Å²	26	84.8 Å²	84.8	10%	0.102	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135.9	173.6	-52.2	-84.1	0	0	0	109.3	L40 A44 E58 L75 D77	L40-Y60 HydrophobicContact CB-CD2 4.1Å; L40-Y60 HydrophobicContact CB-CE2 4.01Å; L40-Y60 HydrophobicContact CD1-CD2 4.38Å; L40-Y60 HydrophobicContact CD1-CE2 4.31Å; A44-Y60 HydrophobicContact CB-CD1 4.32Å; A44-Y60 HydrophobicContact CB-CG 4.24Å; E58-Y60 HydrophobicContact CB-CE2 3.76Å; Y60-L75 PolarHBondContact N-O 3.29Å; Y60-L75 PolarHBondContact O-N 2.81Å; Y60-D77 HydrophobicContact CE2-CB 4.18Å
61	T	95	Very high	92.2	Very high	114 Å²	114	76 Å²	76	70%	0.699	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.5	167.7	48.8	0	0	0	0	109.4	L73	T61-L73 WeakPolarHBondContact CA-O 3.44Å
62	A	94.9	Very high	92.3	Very high	24 Å²	24	73.1 Å²	73.1	20%	0.198	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	171.7	175.5	0	0	0	0	0	109.4	F43 L73 L75	F43-A62 HydrophobicContact CD1-CB 4.37Å; F43-A62 HydrophobicContact CE1-CB 3.7Å; F43-A62 HydrophobicContact CZ-CB 4.33Å; A62-L73 HydrophobicContact CB-CB 4.37Å; A62-L73 PolarHBondContact N-O 2.65Å; A62-L73 PolarHBondContact O-N 2.85Å; A62-L75 HydrophobicContact CB-CD1 4.2Å
63	S	92	Very high	92.4	Very high	51 Å²	51	67.3 Å²	67.3	36%	0.357	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.9	168.3	66.3	0	0	0	0	111.3	R70 I71	S63-R70 VanDerWaalsContact CB-NE 3.3Å; S63-R70 PolarHBondContact OG-NE 3.11Å; S63-R70 PolarHBondContact OG-NH2 2.88Å; S63-I71 CarbonylContact C-O 3.55Å; S63-I71 VanDerWaalsContact CA-O 3.22Å; S63-I71 WeakPolarHBondContact CA-O 3.31Å
64	F	90.2	Very high	92.6	Very high	13 Å²	13	63.9 Å²	63.9	6%	0.057	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	144.9	178.5	-159.3	-72.9	0	0	0	109.2	F43 I66 I71 L73 R187 F190 H191	F43-F64 AromaticContact CE2-CD2 3.88Å; F43-F64 HydrophobicContact CE2-CD2 3.88Å; F43-F64 HydrophobicContact CE2-CE2 4.26Å; F43-F64 AromaticContact CZ-CD2 3.87Å; F43-F64 HydrophobicContact CZ-CD2 3.87Å; F64-I66 HydrophobicContact CD1-CD1 4.29Å; F64-I66 HydrophobicContact CD1-CG1 3.72Å; F64-I66 HydrophobicContact CE1-CG1 3.95Å; F64-I71 PolarHBondContact N-O 3.44Å; F64-I71 PolarHBondContact O-N 3.31Å; F64-L73 HydrophobicContact CB-CD1 3.9Å; F64-L73 HydrophobicContact CB-CG 4.41Å; F64-R187 HydrophobicContact CE2-CG 3.89Å; F64-R187 HydrophobicContact CZ-CG 4.27Å; F64-F190 HydrophobicContact CD2-CB 4.41Å; F64-H191 HydrophobicContact CE1-CB 4.13Å; F64-H191 AromaticContact CE1-ND1 3.36Å; F64-H191 WeakPolarHBondContact CE1-ND1 3.31Å; F64-H191 HydrophobicContact CE2-CB 4.05Å; F64-H191 HydrophobicContact CZ-CB 3.51Å; F64-H191 AromaticContact CZ-CG 3.9Å; F64-H191 AromaticContact CZ-ND1 3.62Å
65	E	90.2	Very high	92.7	Very high	122 Å²	122	59.9 Å²	59.9	57%	0.57	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	130.5	177.8	-164.8	-178	138.8	0	0	110.9	T68 Q69	E65-T68 WeakPolarHBondContact OE1-CA 3.42Å; E65-Q69 WeakPolarHBondContact CA-O 3.48Å
66	I	88.2	Confident	92.9	Very high	17 Å²	17	62.5 Å²	62.5	9%	0.087	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	128.3	175.1	-56.5	-174.2	0	0	0	107.9	F64 T68 Q69 I71 T194 L195	F64-I66 HydrophobicContact CD1-CD1 4.29Å; F64-I66 HydrophobicContact CD1-CG1 3.72Å; F64-I66 HydrophobicContact CE1-CG1 3.95Å; I66-T68 PolarHBondContact O-N 3.26Å; I66-T68 VanDerWaalsContact O-N 3.17Å; I66-Q69 PolarHBondContact N-O 2.92Å; I66-Q69 WeakPolarHBondContact O-CB 3.24Å; I66-Q69 PolarHBondContact O-N 2.66Å; I66-I71 HydrophobicContact CB-CD1 3.97Å; I66-I71 HydrophobicContact CD1-CD1 4.32Å; I66-I71 HydrophobicContact CG1-CD1 3.95Å; I66-T194 HydrophobicContact CD1-CG2 3.66Å; I66-L195 HydrophobicContact CD1-CD2 3.88Å; I66-L195 HydrophobicContact CD1-CG 4.01Å; I66-L195 HydrophobicContact CG2-CD2 4.12Å
67	D	86.6	Confident	93.1	Very high	144 Å²	144	59.3 Å²	59.3	77%	0.77	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	42.2	179.2	-64.7	-20	0	0	0	113.5	Q69	D67-Q69 PolarHBondContact O-N 3.26Å
68	T	84.2	Confident	93.5	Very high	130 Å²	130	56.5 Å²	56.5	80%	0.798	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	3	-174.1	66.9	0	0	0	0	116.7	E65 I66	E65-T68 WeakPolarHBondContact OE1-CA 3.42Å; I66-T68 PolarHBondContact O-N 3.26Å; I66-T68 VanDerWaalsContact O-N 3.17Å
69	Q	87.3	Confident	93.6	Very high	19 Å²	19	51.8 Å²	51.8	9%	0.089	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.5	169.3	-169.6	173.3	41.9	0	0	110.4	D17 Q20 E65 I66 D67 I71	D17-Q69 PolarHBondContact O-NE2 3.17Å; Q20-Q69 PolarHBondContact O-NE2 2.91Å; E65-Q69 WeakPolarHBondContact CA-O 3.48Å; I66-Q69 PolarHBondContact N-O 2.92Å; I66-Q69 WeakPolarHBondContact O-CB 3.24Å; I66-Q69 PolarHBondContact O-N 2.66Å; D67-Q69 PolarHBondContact O-N 3.26Å; Q69-I71 WeakPolarHBondContact O-CD1 3.39Å
70	R	90.9	Very high	93.7	Very high	170 Å²	170	48.7 Å²	48.7	64%	0.642	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.8	172.8	-169.6	178.8	-173.8	-165.8	0.7	110.3	S63	S63-R70 VanDerWaalsContact CB-NE 3.3Å; S63-R70 PolarHBondContact OG-NE 3.11Å; S63-R70 PolarHBondContact OG-NH2 2.88Å
71	I	94	Very high	93.8	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.1	174.6	-56.8	96.5	0	0	0	109	V22 C24 S63 F64 I66 Q69 L73 T194 V198	V22-I71 HydrophobicContact CB-CG1 4.18Å; V22-I71 HydrophobicContact CB-CG2 4.34Å; V22-I71 HydrophobicContact CG1-CG1 4.43Å; V22-I71 HydrophobicContact CG1-CG2 4.17Å; V22-I71 WeakPolarHBondContact O-CA 3.5Å; V22-I71 WeakPolarHBondContact O-CG2 3.23Å; C24-I71 HydrophobicContact CB-CG2 4.25Å; S63-I71 CarbonylContact C-O 3.55Å; S63-I71 VanDerWaalsContact CA-O 3.22Å; S63-I71 WeakPolarHBondContact CA-O 3.31Å; F64-I71 PolarHBondContact N-O 3.44Å; F64-I71 PolarHBondContact O-N 3.31Å; I66-I71 HydrophobicContact CB-CD1 3.97Å; I66-I71 HydrophobicContact CD1-CD1 4.32Å; I66-I71 HydrophobicContact CG1-CD1 3.95Å; Q69-I71 WeakPolarHBondContact O-CD1 3.39Å; I71-L73 HydrophobicContact CG2-CD2 3.94Å; I71-T194 HydrophobicContact CB-CG2 4.1Å; I71-T194 HydrophobicContact CD1-CG2 4.08Å; I71-T194 HydrophobicContact CG1-CG2 4.13Å; I71-T194 HydrophobicContact CG2-CG2 4.01Å; I71-V198 HydrophobicContact CG1-CG1 4.21Å
72	E	95.5	Very high	93.9	Very high	63 Å²	63	47.3 Å²	47.3	29%	0.294	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.4	170.6	-66.5	175.7	-140.2	0	0	110	N21 V22 K23 C24	N21-E72 PolarHBondContact ND2-OE1 3.16Å; V22-E72 PolarHBondContact O-N 3.3Å; K23-E72 CarbonylContact C-O 3.6Å; K23-E72 VanDerWaalsContact CA-O 3.31Å; K23-E72 WeakPolarHBondContact CA-O 3.47Å; K23-E72 HydrophobicContact CD-CB 4.49Å; K23-E72 VanDerWaalsContact CE-OE2 3.23Å; K23-E72 WeakPolarHBondContact CE-OE2 3.49Å; K23-E72 HydrophobicContact CG-CB 4.2Å; K23-E72 IonicContact NZ-OE1 3.57Å; K23-E72 PolarHBondContact NZ-OE1 3.27Å; K23-E72 IonicContact NZ-OE2 3.61Å; K23-E72 PolarHBondContact NZ-OE2 2.84Å; C24-E72 PolarHBondContact N-O 3.32Å
73	L	96.8	Very high	94	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.1	178.3	-58	-176.3	0	0	0	110.3	C24 I26 F43 T61 A62 F64 I71 L75 T194	C24-L73 HydrophobicContact CB-CD2 3.86Å; C24-L73 WeakPolarHBondContact O-CA 3.5Å; I26-L73 HydrophobicContact CD1-CD2 4.22Å; F43-L73 HydrophobicContact CE1-CD1 3.8Å; F43-L73 HydrophobicContact CZ-CD1 3.83Å; T61-L73 WeakPolarHBondContact CA-O 3.44Å; A62-L73 HydrophobicContact CB-CB 4.37Å; A62-L73 PolarHBondContact N-O 2.65Å; A62-L73 PolarHBondContact O-N 2.85Å; F64-L73 HydrophobicContact CB-CD1 3.9Å; F64-L73 HydrophobicContact CB-CG 4.41Å; I71-L73 HydrophobicContact CG2-CD2 3.94Å; L73-L75 HydrophobicContact CB-CD2 3.82Å; L73-L75 HydrophobicContact CB-CG 4.28Å; L73-L75 HydrophobicContact CD1-CD2 4.38Å; L73-T194 HydrophobicContact CD2-CG2 4.24Å
74	S	97.4	Very high	94.3	Very high	36 Å²	36	57.7 Å²	57.7	25%	0.252	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	109.2	166.1	-176.3	0	0	0	0	108.3	C24 K25 I26 N59 W76	C24-S74 PolarHBondContact O-N 3.41Å; K25-S74 WeakPolarHBondContact CA-O 3.39Å; I26-S74 PolarHBondContact N-O 2.87Å; N59-S74 PolarHBondContact ND2-OG 3.46Å; N59-S74 VanDerWaalsContact ND2-OG 3.17Å; S74-W76 PolarHBondContact OG-NE1 3.09Å; S74-W76 VanDerWaalsContact OG-NE1 3.14Å
75	L	98	Very high	94.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.1	-172.9	-46.9	175.2	0	0	0	110	I26 L40 F43 N59 Y60 A62 L73 F190	I26-L75 HydrophobicContact CB-CD2 3.91Å; I26-L75 HydrophobicContact CD1-CD2 4.03Å; I26-L75 HydrophobicContact CG1-CD2 4.32Å; I26-L75 CarbonylContact O-C 3.51Å; I26-L75 WeakPolarHBondContact O-CA 3.45Å; L40-L75 HydrophobicContact CD2-CB 3.64Å; L40-L75 HydrophobicContact CD2-CD1 3.75Å; L40-L75 HydrophobicContact CD2-CG 4.22Å; F43-L75 HydrophobicContact CD1-CD1 3.59Å; F43-L75 HydrophobicContact CE1-CD1 3.79Å; N59-L75 WeakPolarHBondContact CA-O 3.12Å; N59-L75 PolarHBondContact ND2-O 3.22Å; Y60-L75 PolarHBondContact N-O 3.29Å; Y60-L75 PolarHBondContact O-N 2.81Å; A62-L75 HydrophobicContact CB-CD1 4.2Å; L73-L75 HydrophobicContact CB-CD2 3.82Å; L73-L75 HydrophobicContact CB-CG 4.28Å; L73-L75 HydrophobicContact CD1-CD2 4.38Å; L75-F190 HydrophobicContact CD1-CE1 4.28Å; L75-F190 HydrophobicContact CD2-CD1 4.15Å; L75-F190 HydrophobicContact CD2-CE1 3.94Å
76	W	98.4	Very high	94.9	Very high	72 Å²	72	61.4 Å²	61.4	27%	0.273	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	110.5	-177	-63.4	67.1	0	0	0	109.8	I26 V27 V28 E58 N59 S74	I26-W76 PolarHBondContact O-N 3.28Å; V27-W76 HydrophobicContact CB-CB 4.36Å; V27-W76 HydrophobicContact CG1-CB 4.16Å; V27-W76 HydrophobicContact CG2-CB 4.08Å; V27-W76 HydrophobicContact CG2-CG 4.29Å; V28-W76 PolarHBondContact N-O 2.97Å; E58-W76 WeakPolarHBondContact O-CA 3.41Å; N59-W76 VanDerWaalsContact ND2-CE2 3.31Å; N59-W76 PolarHBondContact ND2-NE1 2.98Å; N59-W76 VanDerWaalsContact ND2-NE1 3.15Å; S74-W76 PolarHBondContact OG-NE1 3.09Å; S74-W76 VanDerWaalsContact OG-NE1 3.14Å
77	D	98.4	Very high	95.3	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	148.1	166	-163.2	16.3	0	0	0	109.6	K36 T37 L40 T55 F57 E58 Y60	K36-D77 VanDerWaalsContact CB-OD1 3.32Å; K36-D77 WeakPolarHBondContact CB-OD1 3.5Å; T37-D77 WeakPolarHBondContact CA-OD2 3.4Å; T37-D77 VanDerWaalsContact CB-OD2 3.29Å; T37-D77 WeakPolarHBondContact CB-OD2 3.39Å; T37-D77 WeakPolarHBondContact CG2-OD2 3.36Å; T37-D77 PolarHBondContact OG1-OD2 3.21Å; L40-D77 HydrophobicContact CD1-CB 3.45Å; L40-D77 VanDerWaalsContact CD1-CB 3.45Å; T55-D77 WeakPolarHBondContact CB-OD2 3.39Å; T55-D77 HydrophobicContact CG2-CB 3.99Å; T55-D77 WeakPolarHBondContact CG2-OD2 3.47Å; T55-D77 PolarHBondContact OG1-OD2 3.26Å; F57-D77 WeakPolarHBondContact CA-O 3.18Å; E58-D77 HydrophobicContact CB-CB 4.25Å; E58-D77 PolarHBondContact N-O 2.85Å; E58-D77 PolarHBondContact O-N 3.08Å; Y60-D77 HydrophobicContact CE2-CB 4.18Å
78	T	98.4	Very high	95.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.3	-175.6	68.5	0	0	0	0	111.8	V27 V28 K36 F57 G80 R88	V27-T78 HydrophobicContact CG1-CG2 3.85Å; V28-T78 PolarHBondContact O-OG1 3.25Å; K36-T78 WeakPolarHBondContact CE-O 3.41Å; K36-T78 PolarHBondContact NZ-O 3.25Å; F57-T78 HydrophobicContact CD1-CG2 4.19Å; F57-T78 HydrophobicContact CE1-CG2 4.1Å; T78-G80 PolarHBondContact O-N 3.42Å; T78-R88 HydrophobicContact CG2-CG 4.03Å
79	S	98	Very high	96.5	Very high	8 Å²	8	51.2 Å²	51.2	6%	0.056	25%	0.248	C	C	.	.			trans	-63.3	127.5	173.2	-155.4	0	0	0	0	111.6	T55 V56 S81 Y84 R88	T55-S79 VanDerWaalsContact O-CA 3.28Å; T55-S79 WeakPolarHBondContact O-CA 3.27Å; T55-S79 WeakPolarHBondContact O-CB 3.33Å; T55-S79 PolarHBondContact O-OG 2.88Å; V56-S79 PolarHBondContact O-N 2.79Å; S79-S81 PolarHBondContact O-N 3.31Å; S79-Y84 VanDerWaalsContact CB-CD2 3.4Å; S79-Y84 VanDerWaalsContact OG-CD2 3.24Å; S79-Y84 WeakPolarHBondContact OG-CD2 3.48Å; S79-R88 VanDerWaalsContact O-CZ 3.29Å; S79-R88 PolarHBondContact O-NE 3.01Å; S79-R88 PolarHBondContact O-NH2 3.17Å
80	G	97.8	Very high	96.9	Very high	8 Å²	8	56.7 Å²	56.7	8%	0.082	28%	0.277	C	S	.	.			trans	-76.4	-3.4	170.8	0	0	0	0	0	113.9	G30 S32 T78	G30-G80 WeakPolarHBondContact O-CA 3.49Å; S32-G80 VanDerWaalsContact OG-C 3.31Å; T78-G80 PolarHBondContact O-N 3.42Å
81	S	97.4	Very high	97.2	Very high	22 Å²	22	48.6 Å²	48.6	15%	0.154	25%	0.247	C	C	.	.	S	Bend	trans	-82.7	137.1	-174.3	-179.6	0	0	0	0	112.4	S32 S79 Y83 Y84 R88	S32-S81 PolarHBondContact OG-N 3.44Å; S79-S81 PolarHBondContact O-N 3.31Å; S81-Y83 PolarHBondContact O-N 3.11Å; S81-Y83 VanDerWaalsContact O-N 3.16Å; S81-Y83 WeakPolarHBondContact OG-CD2 3.5Å; S81-Y84 PolarHBondContact O-N 2.9Å; S81-Y84 VanDerWaalsContact O-N 3.14Å; S81-R88 PolarHBondContact O-NH2 3.03Å; S81-R88 VanDerWaalsContact O-NH2 3.12Å
82	P	96.9	Very high	97.4	Very high	90 Å²	90	48.6 Å²	48.6	58%	0.584	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-56.3	-27.1	175.3	-26.9	35.6	0	0	0	114.8	Y84 D85	P82-Y84 PolarHBondContact O-N 3.03Å; P82-D85 WeakPolarHBondContact CA-OD2 3.39Å; P82-D85 WeakPolarHBondContact O-CB 3.39Å; P82-D85 VanDerWaalsContact O-CG 3.31Å; P82-D85 PolarHBondContact O-N 3.14Å
83	Y	97.4	Very high	97.4	Very high	211 Å²	211	49 Å²	49	83%	0.827	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-59.1	-18	177.5	-66.3	-61.4	0	0	0	113.9	S81	S81-Y83 PolarHBondContact O-N 3.11Å; S81-Y83 VanDerWaalsContact O-N 3.16Å; S81-Y83 WeakPolarHBondContact OG-CD2 3.5Å
84	Y	97.6	Very high	97.3	Very high	82 Å²	82	56.2 Å²	56.2	32%	0.322	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-110	11.7	177.9	-60.3	-78.1	0	0	0	113.8	V56 S79 S81 P82 N86 V87 R88	V56-Y84 HydrophobicContact CB-CE1 4.48Å; V56-Y84 HydrophobicContact CG1-CD1 3.98Å; V56-Y84 HydrophobicContact CG1-CE1 3.62Å; V56-Y84 HydrophobicContact CG2-CE1 4.22Å; V56-Y84 HydrophobicContact CG2-CE2 4.45Å; S79-Y84 VanDerWaalsContact CB-CD2 3.4Å; S79-Y84 VanDerWaalsContact OG-CD2 3.24Å; S79-Y84 WeakPolarHBondContact OG-CD2 3.48Å; S81-Y84 PolarHBondContact O-N 2.9Å; S81-Y84 VanDerWaalsContact O-N 3.14Å; P82-Y84 PolarHBondContact O-N 3.03Å; Y84-N86 VanDerWaalsContact C-N 3.25Å; Y84-N86 PolarHBondContact O-N 3.18Å; Y84-V87 HydrophobicContact CD1-CG2 4.5Å; Y84-V87 PolarHBondContact O-N 3.24Å; Y84-R88 PolarHBondContact O-N 3.42Å
85	D	97.5	Very high	97.3	Very high	51 Å²	51	54.6 Å²	54.6	27%	0.273	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.4	-178.4	-73.7	-7.9	0	0	0	113.2	P82 V87 R88 P89 K116	P82-D85 WeakPolarHBondContact CA-OD2 3.39Å; P82-D85 WeakPolarHBondContact O-CB 3.39Å; P82-D85 VanDerWaalsContact O-CG 3.31Å; P82-D85 PolarHBondContact O-N 3.14Å; D85-V87 VanDerWaalsContact C-N 3.26Å; D85-V87 PolarHBondContact O-N 2.92Å; D85-R88 IonicContact OD1-CZ 3.03Å; D85-R88 IonicContact OD1-NH1 2.65Å; D85-R88 PolarHBondContact OD1-NH1 2.85Å; D85-R88 IonicContact OD1-NH2 2.69Å; D85-R88 PolarHBondContact OD1-NH2 3.14Å; D85-P89 WeakPolarHBondContact O-CD 3.34Å; D85-K116 IonicContact OD1-NZ 3.1Å; D85-K116 PolarHBondContact OD1-NZ 2.9Å; D85-K116 IonicContact OD2-NZ 3.34Å; D85-K116 PolarHBondContact OD2-NZ 2.9Å
86	N	96.5	Very high	97.2	Very high	162 Å²	162	56.5 Å²	56.5	87%	0.866	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-12.2	173.9	-67.1	-32.1	0	0	0	114	Y84	Y84-N86 VanDerWaalsContact C-N 3.25Å; Y84-N86 PolarHBondContact O-N 3.18Å
87	V	95.9	Very high	97.2	Very high	53 Å²	53	53 Å²	53	32%	0.321	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-36	-174.9	-157.6	0	0	0	0	111.3	F57 Y84 D85 P89 L90	F57-V87 HydrophobicContact CE2-CB 4.09Å; F57-V87 HydrophobicContact CE2-CG1 3.61Å; F57-V87 HydrophobicContact CZ-CB 4.3Å; F57-V87 HydrophobicContact CZ-CG1 4.06Å; F57-V87 WeakPolarHBondContact CZ-O 3.44Å; Y84-V87 HydrophobicContact CD1-CG2 4.5Å; Y84-V87 PolarHBondContact O-N 3.24Å; D85-V87 VanDerWaalsContact C-N 3.26Å; D85-V87 PolarHBondContact O-N 2.92Å; V87-P89 VanDerWaalsContact O-N 3.09Å; V87-L90 HydrophobicContact CG1-CD1 3.87Å; V87-L90 WeakPolarHBondContact O-CB 3.27Å; V87-L90 WeakPolarHBondContact O-CG 3.21Å; V87-L90 PolarHBondContact O-N 2.68Å
88	R	98.2	Very high	97.2	Very high	1 Å²	1	53 Å²	53	0%	0.004	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-46.3	-39.9	178.4	-157.5	179.3	-51.9	92.3	9	113.6	T78 S79 S81 Y84 D85 L90 S91 Y92 E120	T78-R88 HydrophobicContact CG2-CG 4.03Å; S79-R88 VanDerWaalsContact O-CZ 3.29Å; S79-R88 PolarHBondContact O-NE 3.01Å; S79-R88 PolarHBondContact O-NH2 3.17Å; S81-R88 PolarHBondContact O-NH2 3.03Å; S81-R88 VanDerWaalsContact O-NH2 3.12Å; Y84-R88 PolarHBondContact O-N 3.42Å; D85-R88 IonicContact OD1-CZ 3.03Å; D85-R88 IonicContact OD1-NH1 2.65Å; D85-R88 PolarHBondContact OD1-NH1 2.85Å; D85-R88 IonicContact OD1-NH2 2.69Å; D85-R88 PolarHBondContact OD1-NH2 3.14Å; R88-L90 PolarHBondContact O-N 3.49Å; R88-L90 VanDerWaalsContact O-N 3.09Å; R88-S91 WeakPolarHBondContact O-CB 3.21Å; R88-S91 PolarHBondContact O-N 3.17Å; R88-S91 PolarHBondContact O-OG 3.47Å; R88-Y92 WeakPolarHBondContact CD-OH 3.43Å; R88-Y92 HydrophobicContact CG-CE1 4.49Å; R88-Y92 WeakPolarHBondContact CG-OH 3.38Å; R88-E120 WeakPolarHBondContact CD-OE1 3.42Å; R88-E120 IonicContact CZ-OE1 2.7Å; R88-E120 IonicContact NE-OE1 3.19Å; R88-E120 VanDerWaalsContact NH1-CD 3.32Å; R88-E120 IonicContact NH1-OE1 3Å; R88-E120 PolarHBondContact NH1-OE1 2.97Å; R88-E120 IonicContact NH1-OE2 2.82Å; R88-E120 PolarHBondContact NH1-OE2 3.38Å
89	P	97.7	Very high	97.2	Very high	23 Å²	23	53 Å²	53	15%	0.149	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-57.5	-23	177.4	-29.2	38.4	0	0	0	116.4	D85 V87 S91 Y92 P93 F124	D85-P89 WeakPolarHBondContact O-CD 3.34Å; V87-P89 VanDerWaalsContact O-N 3.09Å; P89-S91 PolarHBondContact O-N 3.41Å; P89-Y92 VanDerWaalsContact CA-CD2 3.45Å; P89-Y92 HydrophobicContact CB-CD2 4.11Å; P89-Y92 HydrophobicContact CB-CE2 4.4Å; P89-Y92 HydrophobicContact CG-CE2 4.32Å; P89-Y92 PolarHBondContact O-N 2.91Å; P89-Y92 VanDerWaalsContact O-N 3.07Å; P89-P93 WeakPolarHBondContact O-CD 3.41Å; P89-F124 HydrophobicContact CB-CD1 3.93Å; P89-F124 HydrophobicContact CB-CD2 4.09Å; P89-F124 HydrophobicContact CB-CE1 3.78Å; P89-F124 HydrophobicContact CB-CE2 3.98Å; P89-F124 HydrophobicContact CB-CG 4.09Å; P89-F124 HydrophobicContact CB-CZ 3.82Å; P89-F124 HydrophobicContact CG-CD2 3.95Å; P89-F124 HydrophobicContact CG-CE1 4.11Å; P89-F124 HydrophobicContact CG-CE2 3.5Å; P89-F124 HydrophobicContact CG-CG 4.46Å; P89-F124 HydrophobicContact CG-CZ 3.6Å
90	L	96.7	Very high	97.2	Very high	134 Å²	134	52.7 Å²	52.7	70%	0.702	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-63.4	-21.3	175.4	-59.3	-179.4	0	0	0	112.9	V87 R88	V87-L90 HydrophobicContact CG1-CD1 3.87Å; V87-L90 WeakPolarHBondContact O-CB 3.27Å; V87-L90 WeakPolarHBondContact O-CG 3.21Å; V87-L90 PolarHBondContact O-N 2.68Å; R88-L90 PolarHBondContact O-N 3.49Å; R88-L90 VanDerWaalsContact O-N 3.09Å
91	S	97.2	Very high	97.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-79.9	-20.8	174.6	67.5	0	0	0	0	113.9	K25 V27 R88 P89	K25-S91 WeakPolarHBondContact CE-O 3.33Å; K25-S91 PolarHBondContact NZ-O 2.99Å; V27-S91 WeakPolarHBondContact CG2-O 3.26Å; R88-S91 WeakPolarHBondContact O-CB 3.21Å; R88-S91 PolarHBondContact O-N 3.17Å; R88-S91 PolarHBondContact O-OG 3.47Å; P89-S91 PolarHBondContact O-N 3.41Å
92	Y	97.9	Very high	97.4	Very high	1 Å²	1	51.3 Å²	51.3	0%	0.004	27%	0.266	C	S	.	.			trans	-78.4	-28.8	-168.5	-61.8	-33.1	0	0	0	118.2	V27 V29 R88 P89 D94 S95 E120 I121 F124 C125	V27-Y92 HydrophobicContact CG1-CD1 4.01Å; V27-Y92 HydrophobicContact CG1-CE1 3.91Å; V29-Y92 HydrophobicContact CG1-CE1 3.69Å; V29-Y92 WeakPolarHBondContact CG1-OH 3.33Å; R88-Y92 WeakPolarHBondContact CD-OH 3.43Å; R88-Y92 HydrophobicContact CG-CE1 4.49Å; R88-Y92 WeakPolarHBondContact CG-OH 3.38Å; P89-Y92 VanDerWaalsContact CA-CD2 3.45Å; P89-Y92 HydrophobicContact CB-CD2 4.11Å; P89-Y92 HydrophobicContact CB-CE2 4.4Å; P89-Y92 HydrophobicContact CG-CE2 4.32Å; P89-Y92 PolarHBondContact O-N 2.91Å; P89-Y92 VanDerWaalsContact O-N 3.07Å; Y92-D94 PolarHBondContact O-N 3.47Å; Y92-S95 WeakPolarHBondContact O-CB 3.39Å; Y92-S95 PolarHBondContact O-N 3.48Å; Y92-S95 PolarHBondContact O-OG 3.19Å; Y92-E120 HydrophobicContact CE2-CG 4.12Å; Y92-E120 PolarHBondContact OH-OE1 2.86Å; Y92-I121 HydrophobicContact CD1-CD1 4.09Å; Y92-I121 HydrophobicContact CE1-CD1 3.45Å; Y92-I121 VanDerWaalsContact CE1-CD1 3.45Å; Y92-I121 HydrophobicContact CE2-CD1 4.03Å; Y92-I121 VanDerWaalsContact CZ-CD1 3.41Å; Y92-F124 HydrophobicContact CD2-CB 3.36Å; Y92-F124 AromaticContact CD2-CD2 3.81Å; Y92-F124 HydrophobicContact CD2-CD2 3.81Å; Y92-F124 AromaticContact CD2-CG 3.74Å; Y92-F124 HydrophobicContact CD2-CG 3.74Å; Y92-F124 HydrophobicContact CE2-CB 4.19Å; Y92-F124 AromaticContact CE2-CD2 3.89Å; Y92-F124 HydrophobicContact CE2-CD2 3.89Å; Y92-F124 HydrophobicContact CE2-CG 4.3Å; Y92-F124 HydrophobicContact CG-CB 4.06Å; Y92-C125 PolarHBondContact O-SG 3.35Å
93	P	96.2	Very high	97.5	Very high	73 Å²	73	47 Å²	47	47%	0.474	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	138.9	-179.4	-30.5	36.3	0	0	0	113.4	K25 P89 S95	K25-P93 WeakPolarHBondContact CE-O 3.36Å; K25-P93 PolarHBondContact NZ-O 3.17Å; P89-P93 WeakPolarHBondContact O-CD 3.41Å; P93-S95 PolarHBondContact O-N 3.3Å; P93-S95 VanDerWaalsContact O-N 3.17Å
94	D	94.1	Very high	97.5	Very high	153 Å²	153	37 Å²	37	82%	0.818	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	27	177.7	-51.1	-50.6	0	0	0	115.5	Y92	Y92-D94 PolarHBondContact O-N 3.47Å
95	S	96.8	Very high	97.6	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.021	19%	0.188	C	C	.	.			trans	-71.6	137.2	176.7	-59	0	0	0	0	112.7	V27 Y92 P93 T128 K200	V27-S95 VanDerWaalsContact CG2-OG 3.23Å; V27-S95 WeakPolarHBondContact CG2-OG 3.3Å; Y92-S95 WeakPolarHBondContact O-CB 3.39Å; Y92-S95 PolarHBondContact O-N 3.48Å; Y92-S95 PolarHBondContact O-OG 3.19Å; P93-S95 PolarHBondContact O-N 3.3Å; P93-S95 VanDerWaalsContact O-N 3.17Å; S95-T128 WeakPolarHBondContact O-CG2 3.47Å; S95-T128 PolarHBondContact O-OG1 3.26Å; S95-K200 PolarHBondContact O-NZ 2.89Å
96	D	96.4	Very high	97.6	Very high	39 Å²	39	34.4 Å²	34.4	21%	0.209	19%	0.187	C	C	.	.	S	Bend	trans	-85.8	-47.7	175.9	-73.8	-58.4	0	0	0	113.5	C24 K25 T128 K129 C197 K200	C24-D96 WeakPolarHBondContact CA-OD2 3.24Å; C24-D96 HydrophobicContact CB-CB 4.47Å; K25-D96 PolarHBondContact N-OD2 3.36Å; K25-D96 VanDerWaalsContact N-OD2 3.11Å; K25-D96 WeakPolarHBondContact O-CA 3.17Å; K25-D96 WeakPolarHBondContact O-CB 3.16Å; K25-D96 PolarHBondContact O-N 2.98Å; D96-T128 WeakPolarHBondContact O-CG2 3.38Å; D96-K129 PolarHBondContact O-N 3.09Å; D96-C197 HydrophobicContact CB-CB 3.79Å; D96-C197 WeakPolarHBondContact CB-SG 3.24Å; D96-K200 VanDerWaalsContact CA-NZ 3.3Å; D96-K200 WeakPolarHBondContact O-CE 3.24Å; D96-K200 PolarHBondContact O-NZ 2.89Å; D96-K200 IonicContact OD1-NZ 2.73Å; D96-K200 PolarHBondContact OD1-NZ 3.49Å
97	A	97.7	Very high	97.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	156.3	170.1	0	0	0	0	0	111.1	K25 I26 V27 K129 L131	K25-A97 PolarHBondContact O-N 3.38Å; I26-A97 WeakPolarHBondContact CA-O 3.28Å; V27-A97 PolarHBondContact N-O 3.06Å; V27-A97 VanDerWaalsContact N-O 3.16Å; A97-K129 CarbonylContact C-O 3.54Å; A97-K129 WeakPolarHBondContact CA-O 3.25Å; A97-K129 HydrophobicContact CB-CB 4.24Å; A97-K129 WeakPolarHBondContact CB-O 3.47Å; A97-L131 HydrophobicContact CB-CD1 4.15Å
98	V	98.5	Very high	97.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.6	165.7	178.4	0	0	0	0	107.9	V27 V29 I100 I121 T128 K129 M130 L131	V27-V98 HydrophobicContact CB-CG2 4.45Å; V27-V98 CarbonylContact O-C 3.56Å; V27-V98 VanDerWaalsContact O-CA 3.3Å; V27-V98 WeakPolarHBondContact O-CA 3.38Å; V29-V98 HydrophobicContact CG1-CG1 4.31Å; V29-V98 HydrophobicContact CG2-CG1 3.77Å; V98-I100 HydrophobicContact CG1-CG1 4.19Å; V98-I121 HydrophobicContact CB-CG2 4.16Å; V98-I121 HydrophobicContact CG1-CD1 3.81Å; V98-I121 HydrophobicContact CG1-CG1 3.98Å; V98-I121 HydrophobicContact CG1-CG2 4.26Å; V98-I121 HydrophobicContact CG2-CD1 4.32Å; V98-I121 HydrophobicContact CG2-CG2 4.09Å; V98-T128 HydrophobicContact CG2-CG2 3.84Å; V98-K129 PolarHBondContact N-O 3.25Å; V98-M130 CarbonylContact O-C 3.6Å; V98-M130 WeakPolarHBondContact O-CA 3.36Å; V98-L131 PolarHBondContact O-N 3.09Å
99	L	98.8	Very high	97.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	116.6	168.6	-53.5	-173.8	0	0	0	107.7	I26 V27 V28 V29 L131 V133 I189 F190 A193	I26-L99 HydrophobicContact CG2-CD1 4.09Å; I26-L99 HydrophobicContact CG2-CD2 4.44Å; I26-L99 HydrophobicContact CG2-CG 3.8Å; V27-L99 PolarHBondContact O-N 2.99Å; V28-L99 WeakPolarHBondContact CA-O 3.38Å; V28-L99 HydrophobicContact CG1-CB 4.17Å; V28-L99 HydrophobicContact CG2-CB 4.25Å; V28-L99 HydrophobicContact CG2-CD1 4.07Å; V28-L99 HydrophobicContact CG2-CG 4.38Å; V29-L99 PolarHBondContact N-O 3.34Å; L99-L131 HydrophobicContact CD2-CB 3.85Å; L99-L131 HydrophobicContact CD2-CD1 4.37Å; L99-L131 HydrophobicContact CD2-CD2 4.11Å; L99-L131 HydrophobicContact CD2-CG 4.34Å; L99-V133 HydrophobicContact CB-CG2 4.18Å; L99-V133 HydrophobicContact CD2-CG2 4.3Å; L99-I189 HydrophobicContact CD1-CG2 3.73Å; L99-I189 HydrophobicContact CD2-CG2 4.39Å; L99-F190 HydrophobicContact CD1-CE1 3.97Å; L99-F190 HydrophobicContact CD1-CZ 4.21Å; L99-A193 HydrophobicContact CD2-CB 4Å
100	I	98.9	Very high	97.9	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	111.2	170.4	-53.1	179.1	0	0	0	106.8	V29 V98 V113 W117 I121 M130 L131 L132 V133	V29-I100 HydrophobicContact CG2-CB 4.3Å; V29-I100 HydrophobicContact CG2-CG1 3.84Å; V29-I100 HydrophobicContact CG2-CG2 4.35Å; V98-I100 HydrophobicContact CG1-CG1 4.19Å; I100-V113 HydrophobicContact CG2-CG1 4.05Å; I100-V113 HydrophobicContact CG2-CG2 4.11Å; I100-W117 HydrophobicContact CD1-CB 4.44Å; I100-W117 HydrophobicContact CG2-CB 3.65Å; I100-W117 HydrophobicContact CG2-CG 4.16Å; I100-I121 HydrophobicContact CD1-CG1 4.32Å; I100-M130 HydrophobicContact CD1-CG 4.43Å; I100-M130 HydrophobicContact CD1-SD 3.98Å; I100-L131 PolarHBondContact N-O 2.95Å; I100-L132 HydrophobicContact CB-CD1 4.36Å; I100-L132 HydrophobicContact CG2-CD1 4.4Å; I100-V133 PolarHBondContact O-N 3.26Å
101	C	98.9	Very high	98	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.007	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	132.7	-176.3	-68.8	0	0	0	0	111.6	V28 V29 G30 C34 K36 V133	V28-C101 VanDerWaalsContact CG1-SG 3.54Å; V29-C101 PolarHBondContact O-N 3.3Å; G30-C101 VanDerWaalsContact CA-O 3.3Å; G30-C101 WeakPolarHBondContact CA-O 3.48Å; C34-C101 PolarHBondContact SG-O 2.94Å; C34-C101 VanDerWaalsContact SG-O 3.37Å; K36-C101 HydrophobicContact CG-CB 3.89Å; C101-V133 WeakPolarHBondContact CA-O 3.47Å
102	F	98.9	Very high	98.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	169	166.4	75	-92	0	0	0	110.5	I104 L110 V113 L132 V133 C135 V157 Y174	F102-I104 HydrophobicContact CE2-CG1 3.85Å; F102-I104 HydrophobicContact CZ-CG1 4.41Å; F102-L110 HydrophobicContact CD1-CD1 3.67Å; F102-L110 HydrophobicContact CD2-CB 4.1Å; F102-L110 HydrophobicContact CD2-CD1 4.04Å; F102-L110 HydrophobicContact CE1-CD1 3.54Å; F102-L110 HydrophobicContact CE2-CB 4.49Å; F102-L110 HydrophobicContact CE2-CD1 3.98Å; F102-L110 HydrophobicContact CG-CB 4.34Å; F102-L110 HydrophobicContact CG-CD1 3.89Å; F102-L110 HydrophobicContact CZ-CD1 3.71Å; F102-V113 HydrophobicContact CB-CG2 3.98Å; F102-V113 HydrophobicContact CD1-CG2 4.37Å; F102-L132 HydrophobicContact CD1-CD1 3.84Å; F102-L132 HydrophobicContact CD1-CG 4.13Å; F102-L132 HydrophobicContact CE1-CD1 4.16Å; F102-L132 HydrophobicContact CE1-CD2 4.08Å; F102-L132 HydrophobicContact CE1-CG 3.93Å; F102-V133 WeakPolarHBondContact CD1-O 3.3Å; F102-V133 PolarHBondContact N-O 2.91Å; F102-C135 WeakPolarHBondContact O-CB 3.3Å; F102-C135 PolarHBondContact O-N 3.34Å; F102-V157 HydrophobicContact CD2-CG2 4.39Å; F102-V157 HydrophobicContact CE2-CB 3.88Å; F102-V157 HydrophobicContact CE2-CG1 3.63Å; F102-V157 HydrophobicContact CE2-CG2 3.94Å; F102-V157 HydrophobicContact CZ-CG1 3.89Å; F102-Y174 AromaticContact CE1-CE2 3.64Å; F102-Y174 HydrophobicContact CE1-CE2 3.64Å; F102-Y174 AromaticContact CZ-CE2 3.81Å; F102-Y174 HydrophobicContact CZ-CE2 3.81Å; F102-Y174 AromaticContact CZ-CZ 4Å; F102-Y174 WeakPolarHBondContact CZ-OH 3.46Å
103	D	98.9	Very high	98.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	115.5	-172.1	-160.5	-6.9	0	0	0	109.5	C34 S105 R106 T109 K136	C34-D103 HydrophobicContact CB-CB 3.84Å; D103-S105 PolarHBondContact O-N 3.1Å; D103-S105 PolarHBondContact OD1-OG 3.35Å; D103-R106 HydrophobicContact CB-CB 4.07Å; D103-R106 CarbonylContact O-C 3.42Å; D103-R106 PolarHBondContact O-N 2.82Å; D103-R106 IonicContact OD2-CZ 2.78Å; D103-R106 IonicContact OD2-NE 2.61Å; D103-R106 PolarHBondContact OD2-NE 2.91Å; D103-R106 IonicContact OD2-NH2 3.48Å; D103-R106 PolarHBondContact OD2-NH2 3Å; D103-T109 HydrophobicContact CB-CG2 4Å; D103-T109 WeakPolarHBondContact CB-OG1 3.46Å; D103-T109 PolarHBondContact N-OG1 2.76Å; D103-T109 PolarHBondContact O-OG1 2.91Å; D103-K136 WeakPolarHBondContact OD1-CD 3.44Å; D103-K136 WeakPolarHBondContact OD1-CE 3.39Å; D103-K136 IonicContact OD1-NZ 2.77Å; D103-K136 PolarHBondContact OD1-NZ 3.47Å; D103-K136 IonicContact OD2-NZ 3.67Å; D103-K136 PolarHBondContact OD2-NZ 3.26Å
104	I	98.9	Very high	98.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.5	-173	-75.7	165.1	0	0	0	112.1	F102 R106 G134 C135 R140 P156 V157 E176	F102-I104 HydrophobicContact CE2-CG1 3.85Å; F102-I104 HydrophobicContact CZ-CG1 4.41Å; I104-R106 PolarHBondContact O-N 2.92Å; I104-G134 WeakPolarHBondContact CD1-O 3.35Å; I104-C135 VanDerWaalsContact CB-O 3.31Å; I104-C135 WeakPolarHBondContact CB-O 3.46Å; I104-C135 WeakPolarHBondContact CG1-O 3.36Å; I104-C135 PolarHBondContact N-O 3.16Å; I104-R140 HydrophobicContact CG2-CB 4.07Å; I104-P156 HydrophobicContact CG2-CB 4.36Å; I104-P156 CarbonylContact O-C 3.5Å; I104-P156 WeakPolarHBondContact O-CA 3.42Å; I104-P156 WeakPolarHBondContact O-CB 3.23Å; I104-V157 PolarHBondContact O-N 3.29Å; I104-E176 HydrophobicContact CD1-CB 4.39Å; I104-E176 HydrophobicContact CD1-CG 4.03Å
105	S	98.8	Very high	98.4	Very high	13 Å²	13	27.2 Å²	27.2	9%	0.091	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-4.3	173.7	60.1	0	0	0	0	114.4	D103 T145 L149	D103-S105 PolarHBondContact O-N 3.1Å; D103-S105 PolarHBondContact OD1-OG 3.35Å; S105-T145 VanDerWaalsContact CB-CG2 3.49Å; S105-L149 WeakPolarHBondContact O-CD1 3.29Å; S105-L149 WeakPolarHBondContact O-CD2 3.38Å
106	R	98.7	Very high	98.5	Very high	67 Å²	67	29.5 Å²	29.5	25%	0.253	15%	0.145	S	C	.	.			trans	-139.4	86.7	-170.8	-75.3	-165.3	-53	120.5	-5.3	112.2	S32 D103 I104 E108 T109	S32-R106 PolarHBondContact O-NH2 3.47Å; S32-R106 VanDerWaalsContact O-NH2 3.08Å; D103-R106 HydrophobicContact CB-CB 4.07Å; D103-R106 CarbonylContact O-C 3.42Å; D103-R106 PolarHBondContact O-N 2.82Å; D103-R106 IonicContact OD2-CZ 2.78Å; D103-R106 IonicContact OD2-NE 2.61Å; D103-R106 PolarHBondContact OD2-NE 2.91Å; D103-R106 IonicContact OD2-NH2 3.48Å; D103-R106 PolarHBondContact OD2-NH2 3Å; I104-R106 PolarHBondContact O-N 2.92Å; R106-E108 WeakPolarHBondContact CA-OE2 3.23Å; R106-E108 WeakPolarHBondContact CB-OE1 3.05Å; R106-E108 WeakPolarHBondContact CB-OE2 3.47Å; R106-E108 WeakPolarHBondContact CD-OE1 3.46Å; R106-E108 IonicContact CZ-OE1 2.7Å; R106-E108 IonicContact NE-OE1 2.7Å; R106-E108 IonicContact NH1-OE1 2.68Å; R106-E108 PolarHBondContact NH1-OE1 2.91Å; R106-E108 PolarHBondContact O-N 3.33Å; R106-E108 VanDerWaalsContact O-N 3.1Å; R106-T109 HydrophobicContact CB-CG2 4.07Å; R106-T109 VanDerWaalsContact CZ-CG2 3.49Å; R106-T109 WeakPolarHBondContact O-CB 3.48Å; R106-T109 PolarHBondContact O-N 3.22Å; R106-T109 PolarHBondContact O-OG1 2.87Å
107	P	98.6	Very high	98.6	Very high	28 Å²	28	27.7 Å²	27.7	18%	0.182	14%	0.135	C	C	.	.	H	α-helix	trans	-57.2	-24.9	-174.4	-27.4	36.4	0	0	0	115.1	T109 L110 D111 T155 V157	P107-T109 PolarHBondContact O-N 3.1Å; P107-L110 WeakPolarHBondContact O-CB 3.47Å; P107-L110 PolarHBondContact O-N 2.69Å; P107-L110 VanDerWaalsContact O-N 3.12Å; P107-D111 PolarHBondContact O-N 2.73Å; P107-T155 WeakPolarHBondContact CG-O 3.49Å; P107-V157 HydrophobicContact CB-CG2 4.27Å; P107-V157 HydrophobicContact CG-CG2 4.28Å
108	E	98.5	Very high	98.6	Very high	80 Å²	80	29.9 Å²	29.9	37%	0.374	15%	0.145	S	C	.	.	H	α-helix	trans	-63.2	-27.2	175.8	81	-68.8	172.6	0	0	112.5	R106 D111 S112	R106-E108 WeakPolarHBondContact CA-OE2 3.23Å; R106-E108 WeakPolarHBondContact CB-OE1 3.05Å; R106-E108 WeakPolarHBondContact CB-OE2 3.47Å; R106-E108 WeakPolarHBondContact CD-OE1 3.46Å; R106-E108 IonicContact CZ-OE1 2.7Å; R106-E108 IonicContact NE-OE1 2.7Å; R106-E108 IonicContact NH1-OE1 2.68Å; R106-E108 PolarHBondContact NH1-OE1 2.91Å; R106-E108 PolarHBondContact O-N 3.33Å; R106-E108 VanDerWaalsContact O-N 3.1Å; E108-D111 VanDerWaalsContact O-CB 3.26Å; E108-D111 WeakPolarHBondContact O-CB 3.49Å; E108-D111 PolarHBondContact O-N 2.9Å; E108-S112 PolarHBondContact O-N 3.16Å; E108-S112 PolarHBondContact O-OG 3.34Å
109	T	98.8	Very high	98.6	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-73.6	-28.2	175.1	69	0	0	0	0	113.1	D31 D103 R106 P107 D111 S112 V113	D31-T109 HydrophobicContact CB-CG2 3.92Å; D31-T109 WeakPolarHBondContact OD2-CA 3.15Å; D103-T109 HydrophobicContact CB-CG2 4Å; D103-T109 WeakPolarHBondContact CB-OG1 3.46Å; D103-T109 PolarHBondContact N-OG1 2.76Å; D103-T109 PolarHBondContact O-OG1 2.91Å; R106-T109 HydrophobicContact CB-CG2 4.07Å; R106-T109 VanDerWaalsContact CZ-CG2 3.49Å; R106-T109 WeakPolarHBondContact O-CB 3.48Å; R106-T109 PolarHBondContact O-N 3.22Å; R106-T109 PolarHBondContact O-OG1 2.87Å; P107-T109 PolarHBondContact O-N 3.1Å; T109-D111 VanDerWaalsContact C-N 3.34Å; T109-S112 WeakPolarHBondContact O-CB 3.47Å; T109-S112 PolarHBondContact O-N 3.47Å; T109-V113 PolarHBondContact O-N 3.35Å
110	L	98.9	Very high	98.6	Very high	16 Å²	16	32.9 Å²	32.9	8%	0.084	17%	0.169	C	C	.	.	H	α-helix	trans	-69.1	-38.2	170	-175.9	71.8	0	0	0	110.2	F102 P107 S112 V113 V157 Q161 M165	F102-L110 HydrophobicContact CD1-CD1 3.67Å; F102-L110 HydrophobicContact CD2-CB 4.1Å; F102-L110 HydrophobicContact CD2-CD1 4.04Å; F102-L110 HydrophobicContact CE1-CD1 3.54Å; F102-L110 HydrophobicContact CE2-CB 4.49Å; F102-L110 HydrophobicContact CE2-CD1 3.98Å; F102-L110 HydrophobicContact CG-CB 4.34Å; F102-L110 HydrophobicContact CG-CD1 3.89Å; F102-L110 HydrophobicContact CZ-CD1 3.71Å; P107-L110 WeakPolarHBondContact O-CB 3.47Å; P107-L110 PolarHBondContact O-N 2.69Å; P107-L110 VanDerWaalsContact O-N 3.12Å; L110-S112 VanDerWaalsContact C-N 3.32Å; L110-S112 PolarHBondContact O-N 2.67Å; L110-V113 VanDerWaalsContact O-CB 3.23Å; L110-V113 WeakPolarHBondContact O-CB 3.27Å; L110-V113 PolarHBondContact O-N 3.01Å; L110-V113 VanDerWaalsContact O-N 3.15Å; L110-V157 HydrophobicContact CB-CG2 4.3Å; L110-V157 HydrophobicContact CD2-CG1 3.84Å; L110-V157 HydrophobicContact CD2-CG2 4.26Å; L110-Q161 HydrophobicContact CD2-CB 4.27Å; L110-M165 HydrophobicContact CD1-CB 3.88Å; L110-M165 HydrophobicContact CD1-CG 3.76Å; L110-M165 HydrophobicContact CG-CB 4.42Å; L110-M165 HydrophobicContact CG-CE 4.16Å; L110-M165 HydrophobicContact CG-CG 4.28Å
111	D	98.6	Very high	98.6	Very high	75 Å²	75	32.9 Å²	32.9	40%	0.401	17%	0.17	S	C	.	.	H	α-helix	trans	-60.9	-40.5	172.7	-107.8	19.9	0	0	0	111.6	P107 E108 T109 V113 L114 K115	P107-D111 PolarHBondContact O-N 2.73Å; E108-D111 VanDerWaalsContact O-CB 3.26Å; E108-D111 WeakPolarHBondContact O-CB 3.49Å; E108-D111 PolarHBondContact O-N 2.9Å; T109-D111 VanDerWaalsContact C-N 3.34Å; D111-V113 PolarHBondContact O-N 3.15Å; D111-L114 PolarHBondContact O-N 3.44Å; D111-K115 HydrophobicContact CB-CD 4.31Å; D111-K115 WeakPolarHBondContact O-CB 3.34Å; D111-K115 VanDerWaalsContact O-CG 3.26Å; D111-K115 WeakPolarHBondContact O-CG 3.37Å; D111-K115 PolarHBondContact O-N 2.9Å; D111-K115 VanDerWaalsContact OD2-CE 3.24Å; D111-K115 WeakPolarHBondContact OD2-CE 3.46Å; D111-K115 IonicContact OD2-NZ 3.9Å; D111-K115 PolarHBondContact OD2-NZ 2.86Å
112	S	98.7	Very high	98.5	Very high	28 Å²	28	37.7 Å²	37.7	20%	0.196	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-30.2	173.6	-61.5	0	0	0	0	113.5	D31 E108 T109 L110 L114 K115 K116 W117	D31-S112 WeakPolarHBondContact OD1-CB 3.49Å; D31-S112 PolarHBondContact OD1-OG 2.9Å; D31-S112 VanDerWaalsContact OD2-CB 3.24Å; D31-S112 WeakPolarHBondContact OD2-CB 3.36Å; D31-S112 PolarHBondContact OD2-OG 3.45Å; E108-S112 PolarHBondContact O-N 3.16Å; E108-S112 PolarHBondContact O-OG 3.34Å; T109-S112 WeakPolarHBondContact O-CB 3.47Å; T109-S112 PolarHBondContact O-N 3.47Å; L110-S112 VanDerWaalsContact C-N 3.32Å; L110-S112 PolarHBondContact O-N 2.67Å; S112-L114 VanDerWaalsContact C-N 3.31Å; S112-L114 PolarHBondContact O-N 3.34Å; S112-K115 PolarHBondContact O-N 3.04Å; S112-K116 PolarHBondContact O-N 2.95Å; S112-W117 VanDerWaalsContact O-CD1 3.29Å; S112-W117 PolarHBondContact O-N 2.73Å; S112-W117 VanDerWaalsContact O-N 3.16Å
113	V	98.8	Very high	98.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	I	π-helix	trans	-57.6	-45.5	175.9	177.1	0	0	0	0	110.9	I100 F102 T109 L110 D111 K118 L132 M165 I169	I100-V113 HydrophobicContact CG2-CG1 4.05Å; I100-V113 HydrophobicContact CG2-CG2 4.11Å; F102-V113 HydrophobicContact CB-CG2 3.98Å; F102-V113 HydrophobicContact CD1-CG2 4.37Å; T109-V113 PolarHBondContact O-N 3.35Å; L110-V113 VanDerWaalsContact O-CB 3.23Å; L110-V113 WeakPolarHBondContact O-CB 3.27Å; L110-V113 PolarHBondContact O-N 3.01Å; L110-V113 VanDerWaalsContact O-N 3.15Å; D111-V113 PolarHBondContact O-N 3.15Å; V113-K118 WeakPolarHBondContact O-CB 3.45Å; V113-K118 PolarHBondContact O-N 3.3Å; V113-L132 HydrophobicContact CB-CD1 4.45Å; V113-L132 HydrophobicContact CG1-CD1 3.66Å; V113-L132 HydrophobicContact CG2-CD1 3.95Å; V113-M165 HydrophobicContact CB-CG 4.49Å; V113-M165 HydrophobicContact CG1-CG 4.19Å; V113-I169 HydrophobicContact CG1-CD1 3.56Å; V113-I169 HydrophobicContact CG1-CG2 4.13Å
114	L	98.2	Very high	98.3	Very high	65 Å²	65	48.6 Å²	48.6	34%	0.34	24%	0.242	S	C	.	.	I	π-helix	trans	-79.1	-41.3	179.3	-175.5	64.6	0	0	0	112.3	D111 S112 K118 M165 Q168 I169	D111-L114 PolarHBondContact O-N 3.44Å; S112-L114 VanDerWaalsContact C-N 3.31Å; S112-L114 PolarHBondContact O-N 3.34Å; L114-K118 HydrophobicContact CD1-CD 4.17Å; L114-M165 HydrophobicContact CB-CE 3.99Å; L114-M165 HydrophobicContact CB-SD 3.92Å; L114-M165 HydrophobicContact CD2-CE 4.45Å; L114-Q168 HydrophobicContact CD1-CG 4.39Å; L114-I169 HydrophobicContact CD1-CG2 4.22Å
115	K	98.1	Very high	98.2	Very high	155 Å²	155	49 Å²	49	67%	0.674	24%	0.244	S	C	*	.	I	π-helix	trans	-74.9	-28.4	-173.6	-66.7	170	-169.2	174.6	0	113.8	D111 S112	D111-K115 HydrophobicContact CB-CD 4.31Å; D111-K115 WeakPolarHBondContact O-CB 3.34Å; D111-K115 VanDerWaalsContact O-CG 3.26Å; D111-K115 WeakPolarHBondContact O-CG 3.37Å; D111-K115 PolarHBondContact O-N 2.9Å; D111-K115 VanDerWaalsContact OD2-CE 3.24Å; D111-K115 WeakPolarHBondContact OD2-CE 3.46Å; D111-K115 IonicContact OD2-NZ 3.9Å; D111-K115 PolarHBondContact OD2-NZ 2.86Å; S112-K115 PolarHBondContact O-N 3.04Å
116	K	98.4	Very high	98	Very high	51 Å²	51	52.8 Å²	52.8	22%	0.222	27%	0.269	C	S	.	.	I	π-helix	trans	-130.6	-66.6	-176	174.5	171.8	173.5	166.1	0	112.7	D85 S112 K118 G119 E120	D85-K116 IonicContact OD1-NZ 3.1Å; D85-K116 PolarHBondContact OD1-NZ 2.9Å; D85-K116 IonicContact OD2-NZ 3.34Å; D85-K116 PolarHBondContact OD2-NZ 2.9Å; S112-K116 PolarHBondContact O-N 2.95Å; K116-K118 VanDerWaalsContact C-N 3.33Å; K116-K118 PolarHBondContact O-N 2.55Å; K116-G119 PolarHBondContact O-N 2.99Å; K116-E120 WeakPolarHBondContact CE-OE2 3.49Å; K116-E120 PolarHBondContact O-N 3.49Å; K116-E120 VanDerWaalsContact O-N 3.11Å
117	W	98.7	Very high	97.7	Very high	1 Å²	1	56.7 Å²	56.7	0%	0.004	30%	0.295	C	S	.	.	I	π-helix	trans	-63.6	-36.4	-161.5	-58.4	110.3	0	0	0	113.5	V29 G30 D31 I100 S112 G119 I121	V29-W117 HydrophobicContact CB-CE3 3.88Å; V29-W117 HydrophobicContact CB-CZ3 4.05Å; V29-W117 HydrophobicContact CG2-CE3 4.04Å; G30-W117 VanDerWaalsContact C-CE2 3.48Å; G30-W117 VanDerWaalsContact CA-CE2 3.4Å; G30-W117 WeakPolarHBondContact O-CZ2 3.5Å; D31-W117 PolarHBondContact OD1-NE1 3.43Å; I100-W117 HydrophobicContact CD1-CB 4.44Å; I100-W117 HydrophobicContact CG2-CB 3.65Å; I100-W117 HydrophobicContact CG2-CG 4.16Å; S112-W117 VanDerWaalsContact O-CD1 3.29Å; S112-W117 PolarHBondContact O-N 2.73Å; S112-W117 VanDerWaalsContact O-N 3.16Å; W117-G119 PolarHBondContact O-N 2.74Å; W117-I121 WeakPolarHBondContact O-CB 3.32Å; W117-I121 VanDerWaalsContact O-CG1 3.29Å; W117-I121 WeakPolarHBondContact O-CG1 3.11Å; W117-I121 PolarHBondContact O-N 3.44Å
118	K	98.1	Very high	97.5	Very high	47 Å²	47	56.6 Å²	56.6	20%	0.204	29%	0.294	C	S	.	.	H	α-helix	trans	-55.8	-48.5	171	-179.5	-172.8	-178.2	174.1	0	112	V113 L114 K116 Q122 Q168 I169	V113-K118 WeakPolarHBondContact O-CB 3.45Å; V113-K118 PolarHBondContact O-N 3.3Å; L114-K118 HydrophobicContact CD1-CD 4.17Å; K116-K118 VanDerWaalsContact C-N 3.33Å; K116-K118 PolarHBondContact O-N 2.55Å; K118-Q122 HydrophobicContact CG-CG 4.47Å; K118-Q122 VanDerWaalsContact O-CB 3.3Å; K118-Q122 WeakPolarHBondContact O-CB 3.21Å; K118-Q122 WeakPolarHBondContact O-CG 3.3Å; K118-Q122 PolarHBondContact O-N 3.37Å; K118-Q168 PolarHBondContact NZ-O 2.83Å; K118-Q168 VanDerWaalsContact NZ-O 3.09Å; K118-I169 HydrophobicContact CB-CB 4.42Å; K118-I169 HydrophobicContact CB-CG2 4.32Å; K118-I169 HydrophobicContact CD-CB 3.88Å; K118-I169 HydrophobicContact CD-CG2 3.91Å; K118-I169 HydrophobicContact CG-CB 4.12Å; K118-I169 HydrophobicContact CG-CG2 4.38Å
119	G	98	Very high	97.4	Very high	41 Å²	41	57.2 Å²	57.2	42%	0.423	30%	0.295	S	S	.	.	H	α-helix	trans	-64.6	-50.7	-177.1	0	0	0	0	0	111.8	K116 W117 I121 Q122 E123	K116-G119 PolarHBondContact O-N 2.99Å; W117-G119 PolarHBondContact O-N 2.74Å; G119-I121 VanDerWaalsContact C-N 3.34Å; G119-I121 PolarHBondContact O-N 3.25Å; G119-Q122 PolarHBondContact O-N 2.94Å; G119-Q122 VanDerWaalsContact O-N 3.12Å; G119-E123 PolarHBondContact O-N 2.91Å
120	E	98.5	Very high	97.4	Very high	21 Å²	21	58.2 Å²	58.2	10%	0.098	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-44	179.7	-163.8	-179.2	133	0	0	111.7	R88 Y92 K116 E123 F124	R88-E120 WeakPolarHBondContact CD-OE1 3.42Å; R88-E120 IonicContact CZ-OE1 2.7Å; R88-E120 IonicContact NE-OE1 3.19Å; R88-E120 VanDerWaalsContact NH1-CD 3.32Å; R88-E120 IonicContact NH1-OE1 3Å; R88-E120 PolarHBondContact NH1-OE1 2.97Å; R88-E120 IonicContact NH1-OE2 2.82Å; R88-E120 PolarHBondContact NH1-OE2 3.38Å; Y92-E120 HydrophobicContact CE2-CG 4.12Å; Y92-E120 PolarHBondContact OH-OE1 2.86Å; K116-E120 WeakPolarHBondContact CE-OE2 3.49Å; K116-E120 PolarHBondContact O-N 3.49Å; K116-E120 VanDerWaalsContact O-N 3.11Å; E120-E123 PolarHBondContact O-N 2.96Å; E120-F124 HydrophobicContact CG-CD2 4.17Å; E120-F124 HydrophobicContact CG-CE2 4.26Å; E120-F124 VanDerWaalsContact O-CD2 3.27Å; E120-F124 WeakPolarHBondContact O-CD2 3.44Å; E120-F124 PolarHBondContact O-N 3.15Å; E120-F124 VanDerWaalsContact O-N 3.13Å
121	I	98.2	Very high	97.3	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-75.5	-27.7	178.3	-59.4	-54.7	0	0	0	112.6	V29 Y92 V98 I100 W117 G119 C125 M130	V29-I121 HydrophobicContact CG1-CD1 4.24Å; V29-I121 HydrophobicContact CG2-CD1 4.17Å; V29-I121 HydrophobicContact CG2-CG1 4.12Å; Y92-I121 HydrophobicContact CD1-CD1 4.09Å; Y92-I121 HydrophobicContact CE1-CD1 3.45Å; Y92-I121 VanDerWaalsContact CE1-CD1 3.45Å; Y92-I121 HydrophobicContact CE2-CD1 4.03Å; Y92-I121 VanDerWaalsContact CZ-CD1 3.41Å; V98-I121 HydrophobicContact CB-CG2 4.16Å; V98-I121 HydrophobicContact CG1-CD1 3.81Å; V98-I121 HydrophobicContact CG1-CG1 3.98Å; V98-I121 HydrophobicContact CG1-CG2 4.26Å; V98-I121 HydrophobicContact CG2-CD1 4.32Å; V98-I121 HydrophobicContact CG2-CG2 4.09Å; I100-I121 HydrophobicContact CD1-CG1 4.32Å; W117-I121 WeakPolarHBondContact O-CB 3.32Å; W117-I121 VanDerWaalsContact O-CG1 3.29Å; W117-I121 WeakPolarHBondContact O-CG1 3.11Å; W117-I121 PolarHBondContact O-N 3.44Å; G119-I121 VanDerWaalsContact C-N 3.34Å; G119-I121 PolarHBondContact O-N 3.25Å; I121-C125 HydrophobicContact CG2-CB 3.84Å; I121-C125 CarbonylContact O-C 3.59Å; I121-C125 WeakPolarHBondContact O-CA 3.5Å; I121-C125 WeakPolarHBondContact O-CB 3.44Å; I121-C125 PolarHBondContact O-N 2.98Å; I121-M130 HydrophobicContact CB-SD 4.14Å; I121-M130 HydrophobicContact CG2-CG 3.69Å; I121-M130 HydrophobicContact CG2-SD 3.67Å
122	Q	97	Very high	97.4	Very high	102 Å²	102	53.9 Å²	53.9	48%	0.477	28%	0.277	S	S	.	.	H	α-helix	trans	-72.7	-29.5	171.6	-75.6	-174.9	-42	0	0	112.8	K118 G119	K118-Q122 HydrophobicContact CG-CG 4.47Å; K118-Q122 VanDerWaalsContact O-CB 3.3Å; K118-Q122 WeakPolarHBondContact O-CB 3.21Å; K118-Q122 WeakPolarHBondContact O-CG 3.3Å; K118-Q122 PolarHBondContact O-N 3.37Å; G119-Q122 PolarHBondContact O-N 2.94Å; G119-Q122 VanDerWaalsContact O-N 3.12Å
123	E	97.5	Very high	97.4	Very high	140 Å²	140	52.6 Å²	52.6	65%	0.654	27%	0.268	S	S	*	.	H	α-helix	trans	-71.5	-55.4	175.2	-177.1	174.3	179.3	0	0	111.8	G119 E120	G119-E123 PolarHBondContact O-N 2.91Å; E120-E123 PolarHBondContact O-N 2.96Å
124	F	97.5	Very high	97.4	Very high	89 Å²	89	52.6 Å²	52.6	39%	0.39	27%	0.268	S	S	.	.	H	α-helix	trans	-92.9	-15.7	-173.3	-61.8	-71.3	0	0	0	114.9	P89 Y92 E120 P126	P89-F124 HydrophobicContact CB-CD1 3.93Å; P89-F124 HydrophobicContact CB-CD2 4.09Å; P89-F124 HydrophobicContact CB-CE1 3.78Å; P89-F124 HydrophobicContact CB-CE2 3.98Å; P89-F124 HydrophobicContact CB-CG 4.09Å; P89-F124 HydrophobicContact CB-CZ 3.82Å; P89-F124 HydrophobicContact CG-CD2 3.95Å; P89-F124 HydrophobicContact CG-CE1 4.11Å; P89-F124 HydrophobicContact CG-CE2 3.5Å; P89-F124 HydrophobicContact CG-CG 4.46Å; P89-F124 HydrophobicContact CG-CZ 3.6Å; Y92-F124 HydrophobicContact CD2-CB 3.36Å; Y92-F124 AromaticContact CD2-CD2 3.81Å; Y92-F124 HydrophobicContact CD2-CD2 3.81Å; Y92-F124 AromaticContact CD2-CG 3.74Å; Y92-F124 HydrophobicContact CD2-CG 3.74Å; Y92-F124 HydrophobicContact CE2-CB 4.19Å; Y92-F124 AromaticContact CE2-CD2 3.89Å; Y92-F124 HydrophobicContact CE2-CD2 3.89Å; Y92-F124 HydrophobicContact CE2-CG 4.3Å; Y92-F124 HydrophobicContact CG-CB 4.06Å; E120-F124 HydrophobicContact CG-CD2 4.17Å; E120-F124 HydrophobicContact CG-CE2 4.26Å; E120-F124 VanDerWaalsContact O-CD2 3.27Å; E120-F124 WeakPolarHBondContact O-CD2 3.44Å; E120-F124 PolarHBondContact O-N 3.15Å; E120-F124 VanDerWaalsContact O-N 3.13Å; F124-P126 VanDerWaalsContact C-CD 3.48Å
125	C	95.4	Very high	97.4	Very high	8 Å²	8	49.7 Å²	49.7	5%	0.054	25%	0.253	C	S	.	.			trans	-135	43.6	-173.3	-102.4	0	0	0	0	114	Y92 I121 N127 T128	Y92-C125 PolarHBondContact O-SG 3.35Å; I121-C125 HydrophobicContact CG2-CB 3.84Å; I121-C125 CarbonylContact O-C 3.59Å; I121-C125 WeakPolarHBondContact O-CA 3.5Å; I121-C125 WeakPolarHBondContact O-CB 3.44Å; I121-C125 PolarHBondContact O-N 2.98Å; C125-N127 PolarHBondContact O-N 2.98Å; C125-T128 HydrophobicContact CB-CG2 4.45Å; C125-T128 WeakPolarHBondContact CB-OG1 3.27Å; C125-T128 VanDerWaalsContact O-CB 3.3Å; C125-T128 WeakPolarHBondContact O-CB 3.29Å; C125-T128 PolarHBondContact O-N 3.4Å; C125-T128 PolarHBondContact O-OG1 3.14Å; C125-T128 PolarHBondContact SG-OG1 3.04Å
126	P	94.2	Very high	97.4	Very high	93 Å²	93	45 Å²	45	60%	0.604	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.1	-168.2	24	-35.8	0	0	0	115.9	F124	F124-P126 VanDerWaalsContact C-CD 3.48Å
127	N	92.4	Very high	97.4	Very high	149 Å²	149	44 Å²	44	80%	0.797	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.1	5.5	179	-65.9	-70.5	0	0	0	113.4	C125	C125-N127 PolarHBondContact O-N 2.98Å
128	T	95.5	Very high	97.4	Very high	26 Å²	26	44.8 Å²	44.8	16%	0.16	24%	0.236	C	C	.	.	S	Bend	trans	-88.6	153.7	-171.9	-54.2	0	0	0	0	111.5	S95 D96 V98 C125 M130	S95-T128 WeakPolarHBondContact O-CG2 3.47Å; S95-T128 PolarHBondContact O-OG1 3.26Å; D96-T128 WeakPolarHBondContact O-CG2 3.38Å; V98-T128 HydrophobicContact CG2-CG2 3.84Å; C125-T128 HydrophobicContact CB-CG2 4.45Å; C125-T128 WeakPolarHBondContact CB-OG1 3.27Å; C125-T128 VanDerWaalsContact O-CB 3.3Å; C125-T128 WeakPolarHBondContact O-CB 3.29Å; C125-T128 PolarHBondContact O-N 3.4Å; C125-T128 PolarHBondContact O-OG1 3.14Å; C125-T128 PolarHBondContact SG-OG1 3.04Å; T128-M130 PolarHBondContact O-N 2.81Å
129	K	96.1	Very high	97.5	Very high	93 Å²	93	44.5 Å²	44.5	40%	0.404	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	102.9	178.3	-68.8	-56.7	-170.7	-178.9	0	111.6	D96 A97 V98 L131 A196	D96-K129 PolarHBondContact O-N 3.09Å; A97-K129 CarbonylContact C-O 3.54Å; A97-K129 WeakPolarHBondContact CA-O 3.25Å; A97-K129 HydrophobicContact CB-CB 4.24Å; A97-K129 WeakPolarHBondContact CB-O 3.47Å; V98-K129 PolarHBondContact N-O 3.25Å; K129-L131 HydrophobicContact CB-CD1 4.42Å; K129-A196 HydrophobicContact CB-CB 4.18Å; K129-A196 HydrophobicContact CG-CB 4.32Å
130	M	97.8	Very high	97.5	Very high	21 Å²	21	45.6 Å²	45.6	10%	0.103	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131	169	-61.4	-172.5	-65.7	0	0	110.7	V98 I100 I121 T128 A171 A172	V98-M130 CarbonylContact O-C 3.6Å; V98-M130 WeakPolarHBondContact O-CA 3.36Å; I100-M130 HydrophobicContact CD1-CG 4.43Å; I100-M130 HydrophobicContact CD1-SD 3.98Å; I121-M130 HydrophobicContact CB-SD 4.14Å; I121-M130 HydrophobicContact CG2-CG 3.69Å; I121-M130 HydrophobicContact CG2-SD 3.67Å; T128-M130 PolarHBondContact O-N 2.81Å; M130-A171 HydrophobicContact CB-CB 4.47Å; M130-A171 CarbonylContact O-C 3.17Å; M130-A171 WeakPolarHBondContact O-CA 3.31Å; M130-A172 PolarHBondContact O-N 3.36Å
131	L	98.5	Very high	97.5	Very high	1 Å²	1	50 Å²	50	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.1	164.6	-70.2	74.9	0	0	0	107.9	A97 V98 L99 I100 K129 T173 V192 A193 A196	A97-L131 HydrophobicContact CB-CD1 4.15Å; V98-L131 PolarHBondContact O-N 3.09Å; L99-L131 HydrophobicContact CD2-CB 3.85Å; L99-L131 HydrophobicContact CD2-CD1 4.37Å; L99-L131 HydrophobicContact CD2-CD2 4.11Å; L99-L131 HydrophobicContact CD2-CG 4.34Å; I100-L131 PolarHBondContact N-O 2.95Å; K129-L131 HydrophobicContact CB-CD1 4.42Å; L131-T173 HydrophobicContact CD2-CG2 4.15Å; L131-T173 HydrophobicContact CG-CG2 4.27Å; L131-V192 HydrophobicContact CD2-CG1 4.05Å; L131-A193 HydrophobicContact CD2-CB 4.12Å; L131-A196 HydrophobicContact CD1-CB 4.11Å
132	L	98.9	Very high	97.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.5	172.9	-173.4	64.7	0	0	0	109.3	I100 F102 V113 G162 M165 A166 I169 A171 T173 Y174 I175	I100-L132 HydrophobicContact CB-CD1 4.36Å; I100-L132 HydrophobicContact CG2-CD1 4.4Å; F102-L132 HydrophobicContact CD1-CD1 3.84Å; F102-L132 HydrophobicContact CD1-CG 4.13Å; F102-L132 HydrophobicContact CE1-CD1 4.16Å; F102-L132 HydrophobicContact CE1-CD2 4.08Å; F102-L132 HydrophobicContact CE1-CG 3.93Å; V113-L132 HydrophobicContact CB-CD1 4.45Å; V113-L132 HydrophobicContact CG1-CD1 3.66Å; V113-L132 HydrophobicContact CG2-CD1 3.95Å; L132-G162 WeakPolarHBondContact CD2-O 3.46Å; L132-M165 HydrophobicContact CD2-CB 3.93Å; L132-M165 HydrophobicContact CD2-CG 3.91Å; L132-A166 HydrophobicContact CB-CB 3.99Å; L132-A166 HydrophobicContact CD2-CB 3.86Å; L132-I169 HydrophobicContact CB-CD1 4.36Å; L132-I169 HydrophobicContact CD1-CD1 4.1Å; L132-I169 HydrophobicContact CD2-CD1 4.42Å; L132-A171 HydrophobicContact CB-CB 4.25Å; L132-T173 PolarHBondContact N-O 2.99Å; L132-T173 VanDerWaalsContact N-O 3.09Å; L132-Y174 HydrophobicContact CB-CD2 4.18Å; L132-Y174 HydrophobicContact CD2-CD2 4.07Å; L132-Y174 HydrophobicContact CG-CD2 4.01Å; L132-Y174 HydrophobicContact CG-CE2 4.42Å; L132-Y174 WeakPolarHBondContact O-CA 3.2Å; L132-Y174 WeakPolarHBondContact O-CD2 3.4Å; L132-I175 PolarHBondContact O-N 3.5Å; L132-I175 VanDerWaalsContact O-N 3.08Å
133	V	98.9	Very high	97.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	119.4	-177	-177.8	0	0	0	0	110	L39 L99 I100 C101 F102 I175 I189	L39-V133 HydrophobicContact CD2-CG1 4.23Å; L99-V133 HydrophobicContact CB-CG2 4.18Å; L99-V133 HydrophobicContact CD2-CG2 4.3Å; I100-V133 PolarHBondContact O-N 3.26Å; C101-V133 WeakPolarHBondContact CA-O 3.47Å; F102-V133 WeakPolarHBondContact CD1-O 3.3Å; F102-V133 PolarHBondContact N-O 2.91Å; V133-I175 WeakPolarHBondContact CA-O 3.22Å; V133-I175 HydrophobicContact CG2-CG2 4.21Å; V133-I189 HydrophobicContact CG1-CD1 3.92Å; V133-I189 HydrophobicContact CG1-CG1 4.41Å; V133-I189 HydrophobicContact CG2-CG2 3.97Å
134	G	98.9	Very high	97.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	108.8	169	0	0	0	0	0	110.6	I104 I175 E176 C177	I104-G134 WeakPolarHBondContact CD1-O 3.35Å; G134-I175 PolarHBondContact N-O 3.46Å; G134-E176 CarbonylContact O-C 3.43Å; G134-E176 VanDerWaalsContact O-CA 3.28Å; G134-E176 WeakPolarHBondContact O-CA 3.41Å; G134-C177 PolarHBondContact O-N 3.08Å
135	C	98.9	Very high	97.6	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.027	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	155.8	178	-65.6	0	0	0	0	111.6	C34 F102 I104 C177	C34-C135 WeakPolarHBondContact O-CB 3.38Å; F102-C135 WeakPolarHBondContact O-CB 3.3Å; F102-C135 PolarHBondContact O-N 3.34Å; I104-C135 VanDerWaalsContact CB-O 3.31Å; I104-C135 WeakPolarHBondContact CB-O 3.46Å; I104-C135 WeakPolarHBondContact CG1-O 3.36Å; I104-C135 PolarHBondContact N-O 3.16Å; C135-C177 CarbonylContact C-O 3.6Å
136	K	98.7	Very high	97.8	Very high	58 Å²	58	49.3 Å²	49.3	25%	0.252	27%	0.274	S	S	.	.			trans	61.7	44.5	178.3	-45	-172.4	-154.7	152.6	0	113.8	Q33 D103 D138 L139 C177	Q33-K136 WeakPolarHBondContact O-CE 3.47Å; Q33-K136 PolarHBondContact O-NZ 3.21Å; D103-K136 WeakPolarHBondContact OD1-CD 3.44Å; D103-K136 WeakPolarHBondContact OD1-CE 3.39Å; D103-K136 IonicContact OD1-NZ 2.77Å; D103-K136 PolarHBondContact OD1-NZ 3.47Å; D103-K136 IonicContact OD2-NZ 3.67Å; D103-K136 PolarHBondContact OD2-NZ 3.26Å; K136-D138 VanDerWaalsContact CA-OD1 3.27Å; K136-D138 WeakPolarHBondContact CA-OD1 3.17Å; K136-D138 PolarHBondContact O-N 3.36Å; K136-D138 VanDerWaalsContact O-N 3.15Å; K136-L139 HydrophobicContact CB-CD1 3.92Å; K136-L139 HydrophobicContact CB-CG 4.1Å; K136-L139 HydrophobicContact CD-CD1 3.7Å; K136-L139 HydrophobicContact CG-CD1 4.46Å; K136-L139 PolarHBondContact O-N 3.47Å; K136-C177 PolarHBondContact N-O 2.82Å
137	S	98.8	Very high	98	Very high	30 Å²	30	48.6 Å²	48.6	21%	0.21	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-60.7	-21	179.7	55.5	0	0	0	0	114.1	R140 E176 C177 S178	S137-R140 VanDerWaalsContact O-CB 3.25Å; S137-R140 WeakPolarHBondContact O-CB 3.44Å; S137-R140 PolarHBondContact O-N 3.12Å; S137-E176 WeakPolarHBondContact CB-OE2 3.5Å; S137-C177 PolarHBondContact N-O 2.95Å; S137-C177 VanDerWaalsContact OG-C 3.29Å; S137-C177 PolarHBondContact OG-O 3.07Å; S137-S178 PolarHBondContact OG-N 2.7Å
138	D	98.6	Very high	98.2	Very high	17 Å²	17	47.6 Å²	47.6	9%	0.091	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-58.7	-39.7	170.2	49	-71.2	0	0	0	113.7	K136 R140 T141 S178 Q181	K136-D138 VanDerWaalsContact CA-OD1 3.27Å; K136-D138 WeakPolarHBondContact CA-OD1 3.17Å; K136-D138 PolarHBondContact O-N 3.36Å; K136-D138 VanDerWaalsContact O-N 3.15Å; D138-R140 PolarHBondContact O-N 2.9Å; D138-R140 VanDerWaalsContact O-N 3.13Å; D138-T141 PolarHBondContact O-N 2.91Å; D138-T141 PolarHBondContact O-OG1 3.37Å; D138-S178 WeakPolarHBondContact OD1-CB 3.17Å; D138-S178 PolarHBondContact OD1-OG 3.41Å; D138-Q181 VanDerWaalsContact CB-CD 3.4Å; D138-Q181 HydrophobicContact CB-CG 3.95Å
139	L	98.6	Very high	98.4	Very high	40 Å²	40	47 Å²	47	21%	0.209	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-70.2	-9.1	-179	-60.4	-176.9	0	0	0	113.3	K136 T141 D142 T145	K136-L139 HydrophobicContact CB-CD1 3.92Å; K136-L139 HydrophobicContact CB-CG 4.1Å; K136-L139 HydrophobicContact CD-CD1 3.7Å; K136-L139 HydrophobicContact CG-CD1 4.46Å; K136-L139 PolarHBondContact O-N 3.47Å; L139-T141 PolarHBondContact O-N 2.9Å; L139-D142 HydrophobicContact CD2-CB 4.06Å; L139-D142 PolarHBondContact O-N 2.8Å; L139-T145 HydrophobicContact CB-CG2 4.31Å; L139-T145 WeakPolarHBondContact O-CG2 3.46Å
140	R	98.5	Very high	98.4	Very high	64 Å²	64	45.8 Å²	45.8	24%	0.242	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-62	-25.2	171	-173.2	174.2	-65.7	124.6	-15.6	112.7	I104 S137 D138 P156 V157 E176	I104-R140 HydrophobicContact CG2-CB 4.07Å; S137-R140 VanDerWaalsContact O-CB 3.25Å; S137-R140 WeakPolarHBondContact O-CB 3.44Å; S137-R140 PolarHBondContact O-N 3.12Å; D138-R140 PolarHBondContact O-N 2.9Å; D138-R140 VanDerWaalsContact O-N 3.13Å; R140-P156 HydrophobicContact CB-CB 4.32Å; R140-P156 HydrophobicContact CG-CB 4.16Å; R140-V157 VanDerWaalsContact CZ-O 3.25Å; R140-V157 PolarHBondContact NE-O 3.13Å; R140-V157 PolarHBondContact NH2-O 3.39Å; R140-E176 IonicContact CZ-OE1 3.99Å; R140-E176 IonicContact CZ-OE2 3.06Å; R140-E176 IonicContact NH1-OE1 3.21Å; R140-E176 IonicContact NH1-OE2 2.83Å; R140-E176 PolarHBondContact NH1-OE2 3.19Å; R140-E176 IonicContact NH2-OE1 2.78Å; R140-E176 PolarHBondContact NH2-OE1 2.65Å; R140-E176 IonicContact NH2-OE2 3.78Å; R140-E176 PolarHBondContact NH2-OE2 2.78Å; R140-E176 VanDerWaalsContact NH2-OE2 3.1Å
141	T	98.2	Very high	98.4	Very high	114 Å²	114	50.5 Å²	50.5	70%	0.699	28%	0.283	S	S	*	.	S	Bend	trans	-115.6	3.3	179.9	43	0	0	0	0	113.8	D138 L139 V143	D138-T141 PolarHBondContact O-N 2.91Å; D138-T141 PolarHBondContact O-OG1 3.37Å; L139-T141 PolarHBondContact O-N 2.9Å; T141-V143 PolarHBondContact O-N 3.02Å
142	D	98.4	Very high	98.3	Very high	48 Å²	48	56.4 Å²	56.4	26%	0.257	31%	0.31	S	S	.	.			trans	-71.6	126.9	172.3	165.1	43.5	0	0	0	110.7	L139 S144 T145 L146	L139-D142 HydrophobicContact CD2-CB 4.06Å; L139-D142 PolarHBondContact O-N 2.8Å; D142-S144 VanDerWaalsContact C-N 3.26Å; D142-S144 PolarHBondContact O-N 2.6Å; D142-S144 PolarHBondContact OD1-N 3.17Å; D142-S144 PolarHBondContact OD1-OG 3.06Å; D142-S144 VanDerWaalsContact OD2-CB 3.3Å; D142-S144 WeakPolarHBondContact OD2-CB 3.27Å; D142-S144 PolarHBondContact OD2-N 3.13Å; D142-T145 PolarHBondContact O-N 3.48Å; D142-T145 VanDerWaalsContact OD2-CB 3.25Å; D142-T145 WeakPolarHBondContact OD2-CB 2.88Å; D142-T145 PolarHBondContact OD2-N 2.9Å; D142-T145 PolarHBondContact OD2-OG1 2.88Å; D142-L146 WeakPolarHBondContact O-CB 3.45Å; D142-L146 WeakPolarHBondContact O-CD1 3.37Å; D142-L146 VanDerWaalsContact O-CG 3.22Å; D142-L146 WeakPolarHBondContact O-CG 3.49Å; D142-L146 PolarHBondContact O-N 3.4Å
143	V	98.4	Very high	98.3	Very high	107 Å²	107	68 Å²	68	65%	0.648	35%	0.354	S	S	*	.	H	α-helix	trans	-62.3	-35.7	179.8	-179	0	0	0	0	111.2	T141 L146 V147	T141-V143 PolarHBondContact O-N 3.02Å; V143-L146 PolarHBondContact O-N 3.15Å; V143-V147 HydrophobicContact CG1-CG2 4.49Å; V143-V147 WeakPolarHBondContact O-CB 3.36Å; V143-V147 VanDerWaalsContact O-CG2 3.31Å; V143-V147 WeakPolarHBondContact O-CG2 3.09Å; V143-V147 PolarHBondContact O-N 3.27Å
144	S	98.2	Very high	98.2	Very high	82 Å²	82	71.7 Å²	71.7	57%	0.573	37%	0.372	S	S	*	.	H	α-helix	trans	-66.5	-51.7	-177.8	-32.9	0	0	0	0	110.7	D142 L146 V147 E148	D142-S144 VanDerWaalsContact C-N 3.26Å; D142-S144 PolarHBondContact O-N 2.6Å; D142-S144 PolarHBondContact OD1-N 3.17Å; D142-S144 PolarHBondContact OD1-OG 3.06Å; D142-S144 VanDerWaalsContact OD2-CB 3.3Å; D142-S144 WeakPolarHBondContact OD2-CB 3.27Å; D142-S144 PolarHBondContact OD2-N 3.13Å; S144-L146 PolarHBondContact O-N 2.7Å; S144-V147 PolarHBondContact O-N 2.7Å; S144-E148 PolarHBondContact O-N 3.24Å
145	T	98.3	Very high	98.2	Very high	14 Å²	14	76.1 Å²	76.1	9%	0.086	40%	0.398	C	S	.	.	H	α-helix	trans	-57	-45.3	174.1	-61.9	0	0	0	0	111.8	S105 L139 D142 V147 E148 L149 P156	S105-T145 VanDerWaalsContact CB-CG2 3.49Å; L139-T145 HydrophobicContact CB-CG2 4.31Å; L139-T145 WeakPolarHBondContact O-CG2 3.46Å; D142-T145 PolarHBondContact O-N 3.48Å; D142-T145 VanDerWaalsContact OD2-CB 3.25Å; D142-T145 WeakPolarHBondContact OD2-CB 2.88Å; D142-T145 PolarHBondContact OD2-N 2.9Å; D142-T145 PolarHBondContact OD2-OG1 2.88Å; T145-V147 PolarHBondContact O-N 3.01Å; T145-E148 PolarHBondContact O-N 3.05Å; T145-L149 HydrophobicContact CG2-CD1 3.79Å; T145-L149 HydrophobicContact CG2-CG 4.5Å; T145-L149 WeakPolarHBondContact O-CB 3.45Å; T145-L149 WeakPolarHBondContact O-CG 3.4Å; T145-L149 PolarHBondContact O-N 3.32Å; T145-P156 HydrophobicContact CG2-CG 4.31Å
146	L	98.5	Very high	98.2	Very high	74 Å²	74	76.4 Å²	76.4	39%	0.387	40%	0.401	S	S	.	.	H	α-helix	trans	-62.5	-41.7	178.1	-74.4	166.7	0	0	0	112	D142 V143 S144 S150 P156	D142-L146 WeakPolarHBondContact O-CB 3.45Å; D142-L146 WeakPolarHBondContact O-CD1 3.37Å; D142-L146 VanDerWaalsContact O-CG 3.22Å; D142-L146 WeakPolarHBondContact O-CG 3.49Å; D142-L146 PolarHBondContact O-N 3.4Å; V143-L146 PolarHBondContact O-N 3.15Å; S144-L146 PolarHBondContact O-N 2.7Å; L146-S150 VanDerWaalsContact O-CB 3.31Å; L146-S150 WeakPolarHBondContact O-CB 3.32Å; L146-S150 PolarHBondContact O-N 3.07Å; L146-P156 HydrophobicContact CD2-CG 3.79Å
147	V	98.3	Very high	98.2	Very high	79 Å²	79	73.8 Å²	73.8	48%	0.479	39%	0.389	S	S	.	.	H	α-helix	trans	-65.7	-48.4	175	169.1	0	0	0	0	111.1	V143 S144 T145 L149 S150 N151	V143-V147 HydrophobicContact CG1-CG2 4.49Å; V143-V147 WeakPolarHBondContact O-CB 3.36Å; V143-V147 VanDerWaalsContact O-CG2 3.31Å; V143-V147 WeakPolarHBondContact O-CG2 3.09Å; V143-V147 PolarHBondContact O-N 3.27Å; S144-V147 PolarHBondContact O-N 2.7Å; T145-V147 PolarHBondContact O-N 3.01Å; V147-L149 PolarHBondContact O-N 3.19Å; V147-S150 PolarHBondContact O-N 3.3Å; V147-S150 VanDerWaalsContact O-N 3.15Å; V147-S150 PolarHBondContact O-OG 3.05Å; V147-N151 PolarHBondContact O-N 3.24Å; V147-N151 PolarHBondContact O-ND2 3.09Å
148	E	97.9	Very high	98.2	Very high	128 Å²	128	74.5 Å²	74.5	60%	0.598	39%	0.394	S	S	*	.	H	α-helix	trans	-59.8	-44	-178.2	-175	173.9	-174.8	0	0	112.7	S144 T145 H152	S144-E148 PolarHBondContact O-N 3.24Å; T145-E148 PolarHBondContact O-N 3.05Å; E148-H152 PolarHBondContact O-ND1 3.28Å
149	L	98.3	Very high	98.2	Very high	13 Å²	13	79.8 Å²	79.8	7%	0.068	41%	0.414	C	S	.	.	H	α-helix	trans	-69.4	-35.2	175.8	-69	169.1	0	0	0	112.3	S105 T145 V147 N151 H152 R153 Q154 P156	S105-L149 WeakPolarHBondContact O-CD1 3.29Å; S105-L149 WeakPolarHBondContact O-CD2 3.38Å; T145-L149 HydrophobicContact CG2-CD1 3.79Å; T145-L149 HydrophobicContact CG2-CG 4.5Å; T145-L149 WeakPolarHBondContact O-CB 3.45Å; T145-L149 WeakPolarHBondContact O-CG 3.4Å; T145-L149 PolarHBondContact O-N 3.32Å; V147-L149 PolarHBondContact O-N 3.19Å; L149-N151 VanDerWaalsContact C-N 3.28Å; L149-N151 PolarHBondContact O-N 2.75Å; L149-H152 CarbonylContact O-C 3.44Å; L149-H152 WeakPolarHBondContact O-CA 3.46Å; L149-H152 PolarHBondContact O-N 2.65Å; L149-R153 PolarHBondContact O-N 3.12Å; L149-R153 VanDerWaalsContact O-N 3.17Å; L149-Q154 CarbonylContact C-O 3.4Å; L149-Q154 HydrophobicContact CB-CB 4.11Å; L149-Q154 HydrophobicContact CD2-CB 3.96Å; L149-Q154 PolarHBondContact O-N 3.21Å; L149-P156 HydrophobicContact CD1-CB 4.3Å; L149-P156 HydrophobicContact CD1-CG 3.69Å
150	S	97.6	Very high	98.2	Very high	67 Å²	67	83 Å²	83	47%	0.469	43%	0.431	S	S	.	.	H	α-helix	trans	-62.4	-35	178.6	77.6	0	0	0	0	112.8	L146 V147 H152 R153	L146-S150 VanDerWaalsContact O-CB 3.31Å; L146-S150 WeakPolarHBondContact O-CB 3.32Å; L146-S150 PolarHBondContact O-N 3.07Å; V147-S150 PolarHBondContact O-N 3.3Å; V147-S150 VanDerWaalsContact O-N 3.15Å; V147-S150 PolarHBondContact O-OG 3.05Å; S150-H152 PolarHBondContact O-N 2.96Å; S150-R153 PolarHBondContact O-N 3.22Å
151	N	97.6	Very high	98.2	Very high	120 Å²	120	84.5 Å²	84.5	64%	0.642	44%	0.441	S	S	*	.	H	α-helix	trans	-59.6	-31.4	173.7	-65.2	-38.7	0	0	0	112.2	V147 L149	V147-N151 PolarHBondContact O-N 3.24Å; V147-N151 PolarHBondContact O-ND2 3.09Å; L149-N151 VanDerWaalsContact C-N 3.28Å; L149-N151 PolarHBondContact O-N 2.75Å
152	H	96.8	Very high	98.3	Very high	125 Å²	125	79 Å²	79	58%	0.579	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	6.9	178	-59.8	97	0	0	0	113.2	E148 L149 S150 Q154	E148-H152 PolarHBondContact O-ND1 3.28Å; L149-H152 CarbonylContact O-C 3.44Å; L149-H152 WeakPolarHBondContact O-CA 3.46Å; L149-H152 PolarHBondContact O-N 2.65Å; S150-H152 PolarHBondContact O-N 2.96Å; H152-Q154 HydrophobicContact CB-CG 4.43Å; H152-Q154 PolarHBondContact O-N 3.41Å
153	R	97.4	Very high	98.3	Very high	243 Å²	243	77.4 Å²	77.4	92%	0.917	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	29.3	-173.7	-52.2	-179	-178.7	-178.8	0.1	113.8	L149 S150	L149-R153 PolarHBondContact O-N 3.12Å; L149-R153 VanDerWaalsContact O-N 3.17Å; S150-R153 PolarHBondContact O-N 3.22Å
154	Q	98.1	Very high	98.3	Very high	79 Å²	79	76.2 Å²	76.2	37%	0.369	39%	0.391	S	S	.	.			trans	-107.2	169.8	177.2	-69.8	177.1	-49.2	0	0	111.1	L149 H152	L149-Q154 CarbonylContact C-O 3.4Å; L149-Q154 HydrophobicContact CB-CB 4.11Å; L149-Q154 HydrophobicContact CD2-CB 3.96Å; L149-Q154 PolarHBondContact O-N 3.21Å; H152-Q154 HydrophobicContact CB-CG 4.43Å; H152-Q154 PolarHBondContact O-N 3.41Å
155	T	98.4	Very high	98.3	Very high	92 Å²	92	73 Å²	73	56%	0.564	37%	0.367	S	S	*	.			trans	-137.1	156.8	170.3	51.3	0	0	0	0	108.3	P107	P107-T155 WeakPolarHBondContact CG-O 3.49Å
156	P	98.7	Very high	98.3	Very high	11 Å²	11	72.6 Å²	72.6	7%	0.071	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-57	149.3	171.8	-22.1	31.8	0	0	0	111	I104 R140 T145 L146 L149 S158	I104-P156 HydrophobicContact CG2-CB 4.36Å; I104-P156 CarbonylContact O-C 3.5Å; I104-P156 WeakPolarHBondContact O-CA 3.42Å; I104-P156 WeakPolarHBondContact O-CB 3.23Å; R140-P156 HydrophobicContact CB-CB 4.32Å; R140-P156 HydrophobicContact CG-CB 4.16Å; T145-P156 HydrophobicContact CG2-CG 4.31Å; L146-P156 HydrophobicContact CD2-CG 3.79Å; L149-P156 HydrophobicContact CD1-CB 4.3Å; L149-P156 HydrophobicContact CD1-CG 3.69Å; P156-S158 PolarHBondContact O-N 3.15Å
157	V	98.8	Very high	98.3	Very high	2 Å²	2	76 Å²	76	1%	0.012	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-59.6	122.7	-177.8	177.4	0	0	0	0	110.2	F102 I104 P107 L110 R140 Q161	F102-V157 HydrophobicContact CD2-CG2 4.39Å; F102-V157 HydrophobicContact CE2-CB 3.88Å; F102-V157 HydrophobicContact CE2-CG1 3.63Å; F102-V157 HydrophobicContact CE2-CG2 3.94Å; F102-V157 HydrophobicContact CZ-CG1 3.89Å; I104-V157 PolarHBondContact O-N 3.29Å; P107-V157 HydrophobicContact CB-CG2 4.27Å; P107-V157 HydrophobicContact CG-CG2 4.28Å; L110-V157 HydrophobicContact CB-CG2 4.3Å; L110-V157 HydrophobicContact CD2-CG1 3.84Å; L110-V157 HydrophobicContact CD2-CG2 4.26Å; R140-V157 VanDerWaalsContact CZ-O 3.25Å; R140-V157 PolarHBondContact NE-O 3.13Å; R140-V157 PolarHBondContact NH2-O 3.39Å; V157-Q161 HydrophobicContact CG1-CB 3.91Å
158	S	98.8	Very high	98.3	Very high	45 Å²	45	77.8 Å²	77.8	32%	0.315	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-75.3	156.7	174.2	79	0	0	0	0	111.7	P156 D160 Q161 G162	P156-S158 PolarHBondContact O-N 3.15Å; S158-D160 PolarHBondContact O-N 3.42Å; S158-Q161 WeakPolarHBondContact O-CB 3.39Å; S158-Q161 PolarHBondContact O-N 3.29Å; S158-Q161 VanDerWaalsContact O-N 3.09Å; S158-Q161 WeakPolarHBondContact OG-CG 3.44Å; S158-Q161 PolarHBondContact OG-N 2.9Å; S158-Q161 PolarHBondContact OG-OE1 3.23Å; S158-G162 PolarHBondContact O-N 3.38Å; S158-G162 VanDerWaalsContact O-N 3.16Å
159	Y	98.8	Very high	98.3	Very high	129 Å²	129	71.8 Å²	71.8	51%	0.506	35%	0.352	S	S	.	.	H	α-helix	trans	-56	-39.7	177.2	-175	-88.4	0	0	0	111.7	G162 A163 Y174 E176	Y159-G162 PolarHBondContact O-N 3.48Å; Y159-A163 HydrophobicContact CD1-CB 4.36Å; Y159-A163 HydrophobicContact CE1-CB 4.15Å; Y159-A163 VanDerWaalsContact O-CB 3.26Å; Y159-A163 WeakPolarHBondContact O-CB 3.38Å; Y159-A163 PolarHBondContact O-N 3Å; Y159-Y174 HydrophobicContact CD2-CD1 4.11Å; Y159-Y174 AromaticContact CD2-CE1 3.67Å; Y159-Y174 HydrophobicContact CD2-CE1 3.67Å; Y159-Y174 HydrophobicContact CE1-CD1 4.39Å; Y159-Y174 AromaticContact CE2-CD1 3.79Å; Y159-Y174 HydrophobicContact CE2-CD1 3.79Å; Y159-Y174 AromaticContact CE2-CE1 3.8Å; Y159-Y174 HydrophobicContact CE2-CE1 3.8Å; Y159-Y174 HydrophobicContact CG-CE1 4.12Å; Y159-Y174 AromaticContact CZ-CD1 3.94Å; Y159-Y174 WeakPolarHBondContact O-CE1 3.46Å; Y159-E176 HydrophobicContact CD2-CG 4.3Å; Y159-E176 WeakPolarHBondContact CD2-OE1 3.5Å
160	D	98.7	Very high	98.3	Very high	108 Å²	108	73.9 Å²	73.9	58%	0.578	38%	0.376	S	S	*	.	H	α-helix	trans	-66.4	-35.8	177.6	-71.5	-47.1	0	0	0	113.2	S158 N164	S158-D160 PolarHBondContact O-N 3.42Å; D160-N164 WeakPolarHBondContact O-CB 3.34Å; D160-N164 PolarHBondContact O-N 3.01Å; D160-N164 PolarHBondContact O-ND2 3.11Å
161	Q	98.7	Very high	98.3	Very high	94 Å²	94	71.5 Å²	71.5	44%	0.439	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-45.9	174.4	-75.3	170	-51.4	0	0	110.8	L110 V157 S158 N164 M165	L110-Q161 HydrophobicContact CD2-CB 4.27Å; V157-Q161 HydrophobicContact CG1-CB 3.91Å; S158-Q161 WeakPolarHBondContact O-CB 3.39Å; S158-Q161 PolarHBondContact O-N 3.29Å; S158-Q161 VanDerWaalsContact O-N 3.09Å; S158-Q161 WeakPolarHBondContact OG-CG 3.44Å; S158-Q161 PolarHBondContact OG-N 2.9Å; S158-Q161 PolarHBondContact OG-OE1 3.23Å; Q161-N164 PolarHBondContact O-N 2.9Å; Q161-M165 WeakPolarHBondContact O-CB 3.22Å; Q161-M165 PolarHBondContact O-N 2.94Å
162	G	98.8	Very high	98.3	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-63.5	-46.6	174.5	0	0	0	0	0	112.9	L132 S158 Y159 N164 M165 A166	L132-G162 WeakPolarHBondContact CD2-O 3.46Å; S158-G162 PolarHBondContact O-N 3.38Å; S158-G162 VanDerWaalsContact O-N 3.16Å; Y159-G162 PolarHBondContact O-N 3.48Å; G162-N164 VanDerWaalsContact C-N 3.31Å; G162-N164 PolarHBondContact O-N 3.46Å; G162-M165 PolarHBondContact O-N 2.88Å; G162-A166 PolarHBondContact O-N 3.4Å
163	A	98.8	Very high	98.3	Very high	14 Å²	14	65.5 Å²	65.5	12%	0.116	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-34.4	178.8	0	0	0	0	0	112.9	Y159 K167 Y174	Y159-A163 HydrophobicContact CD1-CB 4.36Å; Y159-A163 HydrophobicContact CE1-CB 4.15Å; Y159-A163 VanDerWaalsContact O-CB 3.26Å; Y159-A163 WeakPolarHBondContact O-CB 3.38Å; Y159-A163 PolarHBondContact O-N 3Å; A163-K167 WeakPolarHBondContact O-CE 3.33Å; A163-K167 WeakPolarHBondContact O-CG 3.43Å; A163-K167 PolarHBondContact O-N 3.16Å; A163-Y174 HydrophobicContact CB-CD1 3.93Å; A163-Y174 VanDerWaalsContact N-CD1 3.32Å
164	N	98.7	Very high	98.4	Very high	81 Å²	81	54.5 Å²	54.5	43%	0.433	30%	0.302	S	S	.	.	H	α-helix	trans	-77.4	-37.2	175.7	-68.8	-32.4	0	0	0	112.1	D160 Q161 G162 A166 K167 Q168	D160-N164 WeakPolarHBondContact O-CB 3.34Å; D160-N164 PolarHBondContact O-N 3.01Å; D160-N164 PolarHBondContact O-ND2 3.11Å; Q161-N164 PolarHBondContact O-N 2.9Å; G162-N164 VanDerWaalsContact C-N 3.31Å; G162-N164 PolarHBondContact O-N 3.46Å; N164-A166 VanDerWaalsContact C-N 3.34Å; N164-A166 PolarHBondContact O-N 2.98Å; N164-K167 PolarHBondContact O-N 2.89Å; N164-K167 PolarHBondContact OD1-NZ 2.7Å; N164-Q168 WeakPolarHBondContact O-CB 3.12Å; N164-Q168 PolarHBondContact O-N 3.35Å
165	M	98.7	Very high	98.4	Very high	15 Å²	15	52.2 Å²	52.2	7%	0.074	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-43.3	170.7	-176.8	58.4	76.3	0	0	111.5	L110 V113 L114 L132 Q161 G162 K167 Q168 I169	L110-M165 HydrophobicContact CD1-CB 3.88Å; L110-M165 HydrophobicContact CD1-CG 3.76Å; L110-M165 HydrophobicContact CG-CB 4.42Å; L110-M165 HydrophobicContact CG-CE 4.16Å; L110-M165 HydrophobicContact CG-CG 4.28Å; V113-M165 HydrophobicContact CB-CG 4.49Å; V113-M165 HydrophobicContact CG1-CG 4.19Å; L114-M165 HydrophobicContact CB-CE 3.99Å; L114-M165 HydrophobicContact CB-SD 3.92Å; L114-M165 HydrophobicContact CD2-CE 4.45Å; L132-M165 HydrophobicContact CD2-CB 3.93Å; L132-M165 HydrophobicContact CD2-CG 3.91Å; Q161-M165 WeakPolarHBondContact O-CB 3.22Å; Q161-M165 PolarHBondContact O-N 2.94Å; G162-M165 PolarHBondContact O-N 2.88Å; M165-K167 VanDerWaalsContact C-N 3.32Å; M165-K167 PolarHBondContact O-N 2.97Å; M165-Q168 PolarHBondContact O-N 3.06Å; M165-I169 HydrophobicContact CG-CG2 4.3Å; M165-I169 WeakPolarHBondContact O-CG2 3.46Å; M165-I169 PolarHBondContact O-N 2.98Å; M165-I169 HydrophobicContact SD-CG2 3.75Å
166	A	98.7	Very high	98.4	Very high	5 Å²	5	49.4 Å²	49.4	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-57	-43.5	176.9	0	0	0	0	0	112.4	L132 G162 N164 G170 A171	L132-A166 HydrophobicContact CB-CB 3.99Å; L132-A166 HydrophobicContact CD2-CB 3.86Å; G162-A166 PolarHBondContact O-N 3.4Å; N164-A166 VanDerWaalsContact C-N 3.34Å; N164-A166 PolarHBondContact O-N 2.98Å; A166-G170 PolarHBondContact O-N 2.72Å; A166-G170 VanDerWaalsContact O-N 3.1Å; A166-A171 HydrophobicContact CB-CB 4.2Å; A166-A171 PolarHBondContact O-N 3.35Å
167	K	98.4	Very high	98.4	Very high	147 Å²	147	49 Å²	49	64%	0.639	27%	0.27	S	S	*	.	H	α-helix	trans	-63	-43.5	173.7	-63.3	163.5	-159.4	162.5	0	111.5	A163 N164 M165 I169 G170	A163-K167 WeakPolarHBondContact O-CE 3.33Å; A163-K167 WeakPolarHBondContact O-CG 3.43Å; A163-K167 PolarHBondContact O-N 3.16Å; N164-K167 PolarHBondContact O-N 2.89Å; N164-K167 PolarHBondContact OD1-NZ 2.7Å; M165-K167 VanDerWaalsContact C-N 3.32Å; M165-K167 PolarHBondContact O-N 2.97Å; K167-I169 PolarHBondContact O-N 3.1Å; K167-G170 PolarHBondContact O-N 3.27Å
168	Q	98.2	Very high	98.4	Very high	115 Å²	115	49.1 Å²	49.1	54%	0.537	27%	0.271	S	S	.	.	H	α-helix	trans	-68.1	-30.3	-178.2	-176.6	175.5	-6.3	0	0	113.9	L114 K118 N164 M165	L114-Q168 HydrophobicContact CD1-CG 4.39Å; K118-Q168 PolarHBondContact NZ-O 2.83Å; K118-Q168 VanDerWaalsContact NZ-O 3.09Å; N164-Q168 WeakPolarHBondContact O-CB 3.12Å; N164-Q168 PolarHBondContact O-N 3.35Å; M165-Q168 PolarHBondContact O-N 3.06Å
169	I	97.8	Very high	98.4	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-88.6	-16.2	174.7	74	-176.4	0	0	0	113.6	V113 L114 K118 L132 M165 K167 A171	V113-I169 HydrophobicContact CG1-CD1 3.56Å; V113-I169 HydrophobicContact CG1-CG2 4.13Å; L114-I169 HydrophobicContact CD1-CG2 4.22Å; K118-I169 HydrophobicContact CB-CB 4.42Å; K118-I169 HydrophobicContact CB-CG2 4.32Å; K118-I169 HydrophobicContact CD-CB 3.88Å; K118-I169 HydrophobicContact CD-CG2 3.91Å; K118-I169 HydrophobicContact CG-CB 4.12Å; K118-I169 HydrophobicContact CG-CG2 4.38Å; L132-I169 HydrophobicContact CB-CD1 4.36Å; L132-I169 HydrophobicContact CD1-CD1 4.1Å; L132-I169 HydrophobicContact CD2-CD1 4.42Å; M165-I169 HydrophobicContact CG-CG2 4.3Å; M165-I169 WeakPolarHBondContact O-CG2 3.46Å; M165-I169 PolarHBondContact O-N 2.98Å; M165-I169 HydrophobicContact SD-CG2 3.75Å; K167-I169 PolarHBondContact O-N 3.1Å; I169-A171 HydrophobicContact CD1-CB 4.11Å; I169-A171 HydrophobicContact CG1-CB 3.92Å
170	G	97.4	Very high	98.3	Very high	56 Å²	56	46.6 Å²	46.6	58%	0.577	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	27.5	-176.4	0	0	0	0	0	113.8	A166 K167	A166-G170 PolarHBondContact O-N 2.72Å; A166-G170 VanDerWaalsContact O-N 3.1Å; K167-G170 PolarHBondContact O-N 3.27Å
171	A	98	Very high	98.3	Very high	17 Å²	17	48.3 Å²	48.3	14%	0.14	27%	0.269	C	S	.	.			trans	-68.4	151.2	173.9	0	0	0	0	0	111.3	M130 L132 A166 I169 T173	M130-A171 HydrophobicContact CB-CB 4.47Å; M130-A171 CarbonylContact O-C 3.17Å; M130-A171 WeakPolarHBondContact O-CA 3.31Å; L132-A171 HydrophobicContact CB-CB 4.25Å; A166-A171 HydrophobicContact CB-CB 4.2Å; A166-A171 PolarHBondContact O-N 3.35Å; I169-A171 HydrophobicContact CD1-CB 4.11Å; I169-A171 HydrophobicContact CG1-CB 3.92Å; A171-T173 VanDerWaalsContact C-N 3.31Å; A171-T173 PolarHBondContact O-N 3.47Å
172	A	96.8	Very high	98.2	Very high	66 Å²	66	45.9 Å²	45.9	55%	0.545	26%	0.262	S	S	.	.	S	Bend	trans	-68.6	-30.2	-179.7	0	0	0	0	0	112.8	M130	M130-A172 PolarHBondContact O-N 3.36Å
173	T	97.6	Very high	98	Very high	54 Å²	54	51.9 Å²	51.9	33%	0.331	29%	0.29	S	S	.	.			trans	-157.2	165.1	169.9	-163.8	0	0	0	0	110.6	L131 L132 A171 V192	L131-T173 HydrophobicContact CD2-CG2 4.15Å; L131-T173 HydrophobicContact CG-CG2 4.27Å; L132-T173 PolarHBondContact N-O 2.99Å; L132-T173 VanDerWaalsContact N-O 3.09Å; A171-T173 VanDerWaalsContact C-N 3.31Å; A171-T173 PolarHBondContact O-N 3.47Å; T173-V192 HydrophobicContact CG2-CG1 3.92Å
174	Y	98.7	Very high	97.9	Very high	12 Å²	12	56.7 Å²	56.7	5%	0.047	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	149.3	152.5	-178.4	-132.1	0	0	0	109.5	F102 L132 Y159 A163 E176	F102-Y174 AromaticContact CE1-CE2 3.64Å; F102-Y174 HydrophobicContact CE1-CE2 3.64Å; F102-Y174 AromaticContact CZ-CE2 3.81Å; F102-Y174 HydrophobicContact CZ-CE2 3.81Å; F102-Y174 AromaticContact CZ-CZ 4Å; F102-Y174 WeakPolarHBondContact CZ-OH 3.46Å; L132-Y174 HydrophobicContact CB-CD2 4.18Å; L132-Y174 HydrophobicContact CD2-CD2 4.07Å; L132-Y174 HydrophobicContact CG-CD2 4.01Å; L132-Y174 HydrophobicContact CG-CE2 4.42Å; L132-Y174 WeakPolarHBondContact O-CA 3.2Å; L132-Y174 WeakPolarHBondContact O-CD2 3.4Å; Y159-Y174 HydrophobicContact CD2-CD1 4.11Å; Y159-Y174 AromaticContact CD2-CE1 3.67Å; Y159-Y174 HydrophobicContact CD2-CE1 3.67Å; Y159-Y174 HydrophobicContact CE1-CD1 4.39Å; Y159-Y174 AromaticContact CE2-CD1 3.79Å; Y159-Y174 HydrophobicContact CE2-CD1 3.79Å; Y159-Y174 AromaticContact CE2-CE1 3.8Å; Y159-Y174 HydrophobicContact CE2-CE1 3.8Å; Y159-Y174 HydrophobicContact CG-CE1 4.12Å; Y159-Y174 AromaticContact CZ-CD1 3.94Å; Y159-Y174 WeakPolarHBondContact O-CE1 3.46Å; A163-Y174 HydrophobicContact CB-CD1 3.93Å; A163-Y174 VanDerWaalsContact N-CD1 3.32Å; Y174-E176 HydrophobicContact CE1-CG 3.82Å; Y174-E176 HydrophobicContact CE2-CG 4.22Å; Y174-E176 VanDerWaalsContact CZ-CG 3.49Å; Y174-E176 VanDerWaalsContact OH-CG 3.24Å; Y174-E176 WeakPolarHBondContact OH-CG 3.31Å; Y174-E176 PolarHBondContact OH-OE1 2.78Å
175	I	98.7	Very high	97.9	Very high	31 Å²	31	53.8 Å²	53.8	16%	0.159	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	157.3	170.2	-172.1	164.1	0	0	0	109.1	L132 V133 G134 D188 I189 V192	L132-I175 PolarHBondContact O-N 3.5Å; L132-I175 VanDerWaalsContact O-N 3.08Å; V133-I175 WeakPolarHBondContact CA-O 3.22Å; V133-I175 HydrophobicContact CG2-CG2 4.21Å; G134-I175 PolarHBondContact N-O 3.46Å; I175-D188 HydrophobicContact CD1-CB 4.34Å; I175-I189 HydrophobicContact CB-CD1 4.16Å; I175-I189 HydrophobicContact CD1-CD1 3.98Å; I175-I189 HydrophobicContact CG1-CD1 3.72Å; I175-I189 HydrophobicContact CG2-CD1 3.51Å; I175-V192 HydrophobicContact CD1-CG2 4.19Å
176	E	98.8	Very high	97.9	Very high	33 Å²	33	53.1 Å²	53.1	15%	0.154	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	153.3	-179.8	-64.6	-171.1	-168.3	0	0	112.1	I104 G134 S137 R140 Y159 Y174	I104-E176 HydrophobicContact CD1-CB 4.39Å; I104-E176 HydrophobicContact CD1-CG 4.03Å; G134-E176 CarbonylContact O-C 3.43Å; G134-E176 VanDerWaalsContact O-CA 3.28Å; G134-E176 WeakPolarHBondContact O-CA 3.41Å; S137-E176 WeakPolarHBondContact CB-OE2 3.5Å; R140-E176 IonicContact CZ-OE1 3.99Å; R140-E176 IonicContact CZ-OE2 3.06Å; R140-E176 IonicContact NH1-OE1 3.21Å; R140-E176 IonicContact NH1-OE2 2.83Å; R140-E176 PolarHBondContact NH1-OE2 3.19Å; R140-E176 IonicContact NH2-OE1 2.78Å; R140-E176 PolarHBondContact NH2-OE1 2.65Å; R140-E176 IonicContact NH2-OE2 3.78Å; R140-E176 PolarHBondContact NH2-OE2 2.78Å; R140-E176 VanDerWaalsContact NH2-OE2 3.1Å; Y159-E176 HydrophobicContact CD2-CG 4.3Å; Y159-E176 WeakPolarHBondContact CD2-OE1 3.5Å; Y174-E176 HydrophobicContact CE1-CG 3.82Å; Y174-E176 HydrophobicContact CE2-CG 4.22Å; Y174-E176 VanDerWaalsContact CZ-CG 3.49Å; Y174-E176 VanDerWaalsContact OH-CG 3.24Å; Y174-E176 WeakPolarHBondContact OH-CG 3.31Å; Y174-E176 PolarHBondContact OH-OE1 2.78Å
177	C	98.7	Very high	97.8	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.014	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	149.1	172.8	60	0	0	0	0	112.9	G134 C135 K136 S137 S185 V186 I189	G134-C177 PolarHBondContact O-N 3.08Å; C135-C177 CarbonylContact C-O 3.6Å; K136-C177 PolarHBondContact N-O 2.82Å; S137-C177 PolarHBondContact N-O 2.95Å; S137-C177 VanDerWaalsContact OG-C 3.29Å; S137-C177 PolarHBondContact OG-O 3.07Å; C177-S185 WeakPolarHBondContact CA-OG 3.25Å; C177-S185 WeakPolarHBondContact CB-OG 3.21Å; C177-V186 HydrophobicContact CB-CG2 4.29Å; C177-I189 HydrophobicContact CB-CD1 3.97Å; C177-I189 HydrophobicContact CB-CG1 3.94Å
178	S	98.6	Very high	97.8	Very high	4 Å²	4	56.8 Å²	56.8	3%	0.028	31%	0.312	C	S	.	.			trans	-109	104.9	157.9	180	0	0	0	0	108.4	S137 D138 L180 Q181 S182 S185	S137-S178 PolarHBondContact OG-N 2.7Å; D138-S178 WeakPolarHBondContact OD1-CB 3.17Å; D138-S178 PolarHBondContact OD1-OG 3.41Å; S178-L180 PolarHBondContact O-N 3.14Å; S178-L180 PolarHBondContact OG-N 3.28Å; S178-Q181 PolarHBondContact O-N 3.22Å; S178-Q181 WeakPolarHBondContact OG-CB 3.4Å; S178-Q181 PolarHBondContact OG-N 3.05Å; S178-S182 CarbonylContact O-C 3.56Å; S178-S182 PolarHBondContact O-N 2.79Å; S178-S182 VanDerWaalsContact O-O 3.12Å; S178-S185 PolarHBondContact N-OG 3Å; S178-S185 PolarHBondContact O-OG 2.97Å
179	A	98.4	Very high	97.8	Very high	15 Å²	15	51.3 Å²	51.3	12%	0.124	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.6	172.5	0	0	0	0	0	112.2	A38 V42 F48 V186	A38-A179 HydrophobicContact CB-CB 4.17Å; V42-A179 HydrophobicContact CG2-CB 4.28Å; F48-A179 HydrophobicContact CD2-CB 4.36Å; F48-A179 WeakPolarHBondContact CD2-O 3.14Å; F48-A179 HydrophobicContact CE2-CB 4.16Å; A179-V186 HydrophobicContact CB-CG2 3.9Å
180	L	97.7	Very high	97.8	Very high	107 Å²	107	51.1 Å²	51.1	56%	0.56	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-35.9	179.5	-178.1	61.3	0	0	0	113	F48 S178	F48-L180 HydrophobicContact CD1-CD1 4.34Å; F48-L180 HydrophobicContact CD2-CB 4.39Å; F48-L180 HydrophobicContact CD2-CD1 4.32Å; F48-L180 HydrophobicContact CE1-CD1 4.25Å; F48-L180 HydrophobicContact CE2-CB 3.92Å; F48-L180 HydrophobicContact CE2-CD1 4.21Å; F48-L180 HydrophobicContact CG-CD1 4.37Å; F48-L180 HydrophobicContact CZ-CB 4.38Å; F48-L180 HydrophobicContact CZ-CD1 4.18Å; S178-L180 PolarHBondContact O-N 3.14Å; S178-L180 PolarHBondContact OG-N 3.28Å
181	Q	97.2	Very high	97.7	Very high	144 Å²	144	51.4 Å²	51.4	67%	0.673	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	-13	-172.6	-60.3	-171.3	-5.1	0	0	114.9	D138 S178	D138-Q181 VanDerWaalsContact CB-CD 3.4Å; D138-Q181 HydrophobicContact CB-CG 3.95Å; S178-Q181 PolarHBondContact O-N 3.22Å; S178-Q181 WeakPolarHBondContact OG-CB 3.4Å; S178-Q181 PolarHBondContact OG-N 3.05Å
182	S	96.4	Very high	97.7	Very high	43 Å²	43	52.9 Å²	52.9	30%	0.301	28%	0.279	S	S	.	.			trans	-152.9	92.6	-174.8	-177	0	0	0	0	113.5	S178 N184 S185 V186	S178-S182 CarbonylContact O-C 3.56Å; S178-S182 PolarHBondContact O-N 2.79Å; S178-S182 VanDerWaalsContact O-O 3.12Å; S182-N184 PolarHBondContact O-N 2.78Å; S182-S185 WeakPolarHBondContact CB-OG 3.36Å; S182-S185 WeakPolarHBondContact O-CB 3.3Å; S182-S185 PolarHBondContact O-N 3.36Å; S182-S185 PolarHBondContact O-OG 3.46Å; S182-S185 PolarHBondContact OG-N 3.35Å; S182-S185 VanDerWaalsContact OG-N 3.14Å; S182-V186 PolarHBondContact O-N 2.99Å
183	E	96	Very high	97.6	Very high	125 Å²	125	49.7 Å²	49.7	58%	0.584	25%	0.253	S	S	*	.	H	α-helix	trans	-53.6	-35.5	168.1	-62.7	172.3	172.6	0	0	112.1	V42 S185 V186 R187	V42-E183 HydrophobicContact CG1-CB 4.49Å; V42-E183 HydrophobicContact CG1-CG 4.03Å; E183-S185 PolarHBondContact O-N 2.84Å; E183-V186 WeakPolarHBondContact O-CB 3.01Å; E183-V186 PolarHBondContact O-N 2.86Å; E183-R187 WeakPolarHBondContact O-CB 3.28Å; E183-R187 PolarHBondContact O-N 3Å
184	N	97.1	Very high	97.5	Very high	116 Å²	116	47.1 Å²	47.1	62%	0.62	24%	0.237	S	C	*	.	H	α-helix	trans	-60.6	-44.7	173.9	-72.6	-39.8	0	0	0	111.6	S182 V186 R187 D188	S182-N184 PolarHBondContact O-N 2.78Å; N184-V186 PolarHBondContact O-N 2.84Å; N184-R187 WeakPolarHBondContact O-CB 3.34Å; N184-R187 PolarHBondContact O-N 2.88Å; N184-R187 VanDerWaalsContact O-N 3.16Å; N184-D188 PolarHBondContact O-N 3.13Å
185	S	98.1	Very high	97.3	Very high	20 Å²	20	49.3 Å²	49.3	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-32.3	176.7	76.3	0	0	0	0	112.5	C177 S178 S182 E183 I189	C177-S185 WeakPolarHBondContact CA-OG 3.25Å; C177-S185 WeakPolarHBondContact CB-OG 3.21Å; S178-S185 PolarHBondContact N-OG 3Å; S178-S185 PolarHBondContact O-OG 2.97Å; S182-S185 WeakPolarHBondContact CB-OG 3.36Å; S182-S185 WeakPolarHBondContact O-CB 3.3Å; S182-S185 PolarHBondContact O-N 3.36Å; S182-S185 PolarHBondContact O-OG 3.46Å; S182-S185 PolarHBondContact OG-N 3.35Å; S182-S185 VanDerWaalsContact OG-N 3.14Å; E183-S185 PolarHBondContact O-N 2.84Å; S185-I189 WeakPolarHBondContact O-CG1 3.39Å; S185-I189 PolarHBondContact O-N 2.95Å
186	V	98.4	Very high	97	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-68.9	-47.9	172.4	163.4	0	0	0	0	111.2	L39 V42 F43 C177 A179 S182 E183 N184 D188 I189 F190	L39-V186 HydrophobicContact CD1-CB 4.19Å; L39-V186 HydrophobicContact CD1-CG1 3.88Å; L39-V186 HydrophobicContact CD1-CG2 3.87Å; V42-V186 HydrophobicContact CB-CG1 4.4Å; V42-V186 HydrophobicContact CG1-CB 4.3Å; V42-V186 HydrophobicContact CG1-CG1 4.07Å; V42-V186 HydrophobicContact CG1-CG2 4.24Å; F43-V186 HydrophobicContact CB-CG1 3.64Å; C177-V186 HydrophobicContact CB-CG2 4.29Å; A179-V186 HydrophobicContact CB-CG2 3.9Å; S182-V186 PolarHBondContact O-N 2.99Å; E183-V186 WeakPolarHBondContact O-CB 3.01Å; E183-V186 PolarHBondContact O-N 2.86Å; N184-V186 PolarHBondContact O-N 2.84Å; V186-D188 PolarHBondContact O-N 3.49Å; V186-I189 WeakPolarHBondContact O-CB 3.24Å; V186-I189 PolarHBondContact O-N 3.35Å; V186-I189 VanDerWaalsContact O-N 3.11Å; V186-F190 HydrophobicContact CG1-CD2 4.35Å; V186-F190 HydrophobicContact CG1-CE2 4.24Å; V186-F190 WeakPolarHBondContact O-CD2 3.26Å; V186-F190 PolarHBondContact O-N 2.88Å
187	R	97.3	Very high	96.6	Very high	143 Å²	143	47.4 Å²	47.4	54%	0.54	24%	0.243	S	C	.	.	H	α-helix	trans	-57.1	-38.4	176.6	-175.7	-176.8	173.4	106.4	1.6	111.8	F64 E183 N184 F190 H191	F64-R187 HydrophobicContact CE2-CG 3.89Å; F64-R187 HydrophobicContact CZ-CG 4.27Å; E183-R187 WeakPolarHBondContact O-CB 3.28Å; E183-R187 PolarHBondContact O-N 3Å; N184-R187 WeakPolarHBondContact O-CB 3.34Å; N184-R187 PolarHBondContact O-N 2.88Å; N184-R187 VanDerWaalsContact O-N 3.16Å; R187-F190 PolarHBondContact O-N 2.79Å; R187-H191 PolarHBondContact O-N 2.61Å
188	D	97.7	Very high	96	Very high	85 Å²	85	48.1 Å²	48.1	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-65.5	-35.3	177.4	-71.7	-23.7	0	0	0	112.8	I175 N184 V186 F190 H191 V192	I175-D188 HydrophobicContact CD1-CB 4.34Å; N184-D188 PolarHBondContact O-N 3.13Å; V186-D188 PolarHBondContact O-N 3.49Å; D188-F190 VanDerWaalsContact C-N 3.33Å; D188-F190 PolarHBondContact O-N 3.49Å; D188-H191 PolarHBondContact O-N 2.72Å; D188-V192 WeakPolarHBondContact O-CG2 3.37Å; D188-V192 PolarHBondContact O-N 3.07Å
189	I	98.3	Very high	95.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-54.9	-51.9	171	-51.8	-56	0	0	0	110	L39 L99 V133 I175 C177 S185 V186 V192 A193	L39-I189 HydrophobicContact CD1-CB 4.35Å; L39-I189 HydrophobicContact CD1-CG1 3.92Å; L99-I189 HydrophobicContact CD1-CG2 3.73Å; L99-I189 HydrophobicContact CD2-CG2 4.39Å; V133-I189 HydrophobicContact CG1-CD1 3.92Å; V133-I189 HydrophobicContact CG1-CG1 4.41Å; V133-I189 HydrophobicContact CG2-CG2 3.97Å; I175-I189 HydrophobicContact CB-CD1 4.16Å; I175-I189 HydrophobicContact CD1-CD1 3.98Å; I175-I189 HydrophobicContact CG1-CD1 3.72Å; I175-I189 HydrophobicContact CG2-CD1 3.51Å; C177-I189 HydrophobicContact CB-CD1 3.97Å; C177-I189 HydrophobicContact CB-CG1 3.94Å; S185-I189 WeakPolarHBondContact O-CG1 3.39Å; S185-I189 PolarHBondContact O-N 2.95Å; V186-I189 WeakPolarHBondContact O-CB 3.24Å; V186-I189 PolarHBondContact O-N 3.35Å; V186-I189 VanDerWaalsContact O-N 3.11Å; I189-V192 PolarHBondContact O-N 3.15Å; I189-A193 VanDerWaalsContact O-CB 3.27Å; I189-A193 WeakPolarHBondContact O-CB 3.26Å; I189-A193 PolarHBondContact O-N 3Å
190	F	97.3	Very high	93.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-75.7	-27.5	-174.9	-68.2	-76.9	0	0	0	112.8	I26 L39 L40 F43 F64 L75 L99 V186 R187 D188 T194	I26-F190 HydrophobicContact CD1-CD1 4.32Å; L39-F190 HydrophobicContact CD1-CE2 3.72Å; L39-F190 HydrophobicContact CD1-CZ 4.36Å; L39-F190 HydrophobicContact CG-CE2 3.93Å; L39-F190 HydrophobicContact CG-CZ 4.09Å; L40-F190 HydrophobicContact CD2-CE1 4.06Å; L40-F190 HydrophobicContact CD2-CZ 3.74Å; L40-F190 HydrophobicContact CG-CZ 4.47Å; F43-F190 HydrophobicContact CB-CD2 3.6Å; F43-F190 HydrophobicContact CB-CE2 3.45Å; F43-F190 VanDerWaalsContact CB-CE2 3.45Å; F43-F190 HydrophobicContact CB-CZ 4.26Å; F43-F190 HydrophobicContact CD1-CB 4.24Å; F43-F190 AromaticContact CD1-CD1 3.85Å; F43-F190 HydrophobicContact CD1-CD1 3.85Å; F43-F190 AromaticContact CD1-CD2 3.52Å; F43-F190 HydrophobicContact CD1-CD2 3.52Å; F43-F190 HydrophobicContact CD1-CE1 4.09Å; F43-F190 AromaticContact CD1-CE2 3.77Å; F43-F190 HydrophobicContact CD1-CE2 3.77Å; F43-F190 AromaticContact CD1-CG 3.57Å; F43-F190 HydrophobicContact CD1-CG 3.57Å; F43-F190 HydrophobicContact CD1-CZ 4.06Å; F43-F190 HydrophobicContact CD2-CB 3.93Å; F43-F190 AromaticContact CD2-CD2 3.44Å; F43-F190 HydrophobicContact CD2-CD2 3.44Å; F43-F190 VanDerWaalsContact CD2-CD2 3.44Å; F43-F190 HydrophobicContact CD2-CE2 4.21Å; F43-F190 AromaticContact CD2-CG 3.83Å; F43-F190 HydrophobicContact CD2-CG 3.83Å; F43-F190 HydrophobicContact CE1-CB 3.89Å; F43-F190 AromaticContact CE1-CD1 3.85Å; F43-F190 HydrophobicContact CE1-CD1 3.85Å; F43-F190 HydrophobicContact CE1-CD2 4.06Å; F43-F190 HydrophobicContact CE1-CE1 4.46Å; F43-F190 AromaticContact CE1-CG 3.64Å; F43-F190 HydrophobicContact CE1-CG 3.64Å; F43-F190 HydrophobicContact CE2-CB 3.55Å; F43-F190 HydrophobicContact CE2-CD2 4Å; F43-F190 AromaticContact CE2-CG 3.9Å; F43-F190 HydrophobicContact CE2-CG 3.9Å; F43-F190 HydrophobicContact CG-CB 4.27Å; F43-F190 HydrophobicContact CG-CD1 4.37Å; F43-F190 AromaticContact CG-CD2 3.18Å; F43-F190 HydrophobicContact CG-CD2 3.18Å; F43-F190 AromaticContact CG-CE2 3.52Å; F43-F190 HydrophobicContact CG-CE2 3.52Å; F43-F190 AromaticContact CG-CG 3.67Å; F43-F190 HydrophobicContact CG-CG 3.67Å; F43-F190 HydrophobicContact CG-CZ 4.26Å; F43-F190 HydrophobicContact CZ-CB 3.54Å; F43-F190 HydrophobicContact CZ-CD1 4.4Å; F43-F190 HydrophobicContact CZ-CD2 4.29Å; F43-F190 AromaticContact CZ-CG 3.82Å; F43-F190 HydrophobicContact CZ-CG 3.82Å; F64-F190 HydrophobicContact CD2-CB 4.41Å; L75-F190 HydrophobicContact CD1-CE1 4.28Å; L75-F190 HydrophobicContact CD2-CD1 4.15Å; L75-F190 HydrophobicContact CD2-CE1 3.94Å; L99-F190 HydrophobicContact CD1-CE1 3.97Å; L99-F190 HydrophobicContact CD1-CZ 4.21Å; V186-F190 HydrophobicContact CG1-CD2 4.35Å; V186-F190 HydrophobicContact CG1-CE2 4.24Å; V186-F190 WeakPolarHBondContact O-CD2 3.26Å; V186-F190 PolarHBondContact O-N 2.88Å; R187-F190 PolarHBondContact O-N 2.79Å; D188-F190 VanDerWaalsContact C-N 3.33Å; D188-F190 PolarHBondContact O-N 3.49Å; F190-T194 VanDerWaalsContact O-CB 3.24Å; F190-T194 WeakPolarHBondContact O-CB 3.45Å; F190-T194 PolarHBondContact O-N 2.71Å; F190-T194 PolarHBondContact O-OG1 2.68Å
191	H	96.5	Very high	91.5	Very high	61 Å²	61	53.8 Å²	53.8	28%	0.282	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-54.3	167.7	-175.3	55.9	0	0	0	111.2	F64 R187 D188 A193 T194 L195	F64-H191 HydrophobicContact CE1-CB 4.13Å; F64-H191 AromaticContact CE1-ND1 3.36Å; F64-H191 WeakPolarHBondContact CE1-ND1 3.31Å; F64-H191 HydrophobicContact CE2-CB 4.05Å; F64-H191 HydrophobicContact CZ-CB 3.51Å; F64-H191 AromaticContact CZ-CG 3.9Å; F64-H191 AromaticContact CZ-ND1 3.62Å; R187-H191 PolarHBondContact O-N 2.61Å; D188-H191 PolarHBondContact O-N 2.72Å; H191-A193 PolarHBondContact O-N 3.34Å; H191-T194 PolarHBondContact O-N 2.7Å; H191-L195 WeakPolarHBondContact O-CG 3.45Å; H191-L195 PolarHBondContact O-N 3.4Å
192	V	96.6	Very high	89	Confident	48 Å²	48	51.4 Å²	51.4	29%	0.291	27%	0.268	S	S	.	.	H	α-helix	trans	-67.9	-36.1	-177.4	177.5	0	0	0	0	111.6	L131 T173 I175 D188 I189 A196	L131-V192 HydrophobicContact CD2-CG1 4.05Å; T173-V192 HydrophobicContact CG2-CG1 3.92Å; I175-V192 HydrophobicContact CD1-CG2 4.19Å; D188-V192 WeakPolarHBondContact O-CG2 3.37Å; D188-V192 PolarHBondContact O-N 3.07Å; I189-V192 PolarHBondContact O-N 3.15Å; V192-A196 PolarHBondContact O-N 3.25Å
193	A	96.5	Very high	86.5	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-47.1	171.9	0	0	0	0	0	111.9	I26 L99 L131 I189 H191 L195 A196 C197	I26-A193 HydrophobicContact CD1-CB 3.94Å; L99-A193 HydrophobicContact CD2-CB 4Å; L131-A193 HydrophobicContact CD2-CB 4.12Å; I189-A193 VanDerWaalsContact O-CB 3.27Å; I189-A193 WeakPolarHBondContact O-CB 3.26Å; I189-A193 PolarHBondContact O-N 3Å; H191-A193 PolarHBondContact O-N 3.34Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.29Å; A193-A196 WeakPolarHBondContact O-CA 3.49Å; A193-A196 WeakPolarHBondContact O-CB 3.35Å; A193-A196 PolarHBondContact O-N 3.01Å; A193-C197 PolarHBondContact O-N 2.77Å; A193-C197 PolarHBondContact O-SG 3.23Å
194	T	95.3	Very high	83.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-41.6	178.3	-55.8	0	0	0	0	111.2	I66 I71 L73 F190 H191 A196 C197 V198	I66-T194 HydrophobicContact CD1-CG2 3.66Å; I71-T194 HydrophobicContact CB-CG2 4.1Å; I71-T194 HydrophobicContact CD1-CG2 4.08Å; I71-T194 HydrophobicContact CG1-CG2 4.13Å; I71-T194 HydrophobicContact CG2-CG2 4.01Å; L73-T194 HydrophobicContact CD2-CG2 4.24Å; F190-T194 VanDerWaalsContact O-CB 3.24Å; F190-T194 WeakPolarHBondContact O-CB 3.45Å; F190-T194 PolarHBondContact O-N 2.71Å; F190-T194 PolarHBondContact O-OG1 2.68Å; H191-T194 PolarHBondContact O-N 2.7Å; T194-A196 VanDerWaalsContact C-N 3.32Å; T194-A196 PolarHBondContact O-N 3.39Å; T194-C197 WeakPolarHBondContact O-CB 3.42Å; T194-C197 PolarHBondContact O-N 2.91Å; T194-C197 VanDerWaalsContact O-N 3.15Å; T194-V198 HydrophobicContact CG2-CG1 4.38Å; T194-V198 PolarHBondContact O-N 3.31Å
195	L	94.1	Very high	81.2	Confident	58 Å²	58	59.1 Å²	59.1	30%	0.304	31%	0.305	S	S	.	.	H	α-helix	trans	-58.2	-40.8	171	-74.8	176.8	0	0	0	112.4	I66 H191 A193 C197 N199	I66-L195 HydrophobicContact CD1-CD2 3.88Å; I66-L195 HydrophobicContact CD1-CG 4.01Å; I66-L195 HydrophobicContact CG2-CD2 4.12Å; H191-L195 WeakPolarHBondContact O-CG 3.45Å; H191-L195 PolarHBondContact O-N 3.4Å; A193-L195 VanDerWaalsContact C-N 3.34Å; A193-L195 PolarHBondContact O-N 3.29Å; L195-C197 VanDerWaalsContact C-N 3.31Å; L195-C197 PolarHBondContact O-N 3.41Å; L195-N199 WeakPolarHBondContact O-CB 3.13Å; L195-N199 PolarHBondContact O-N 3.49Å; L195-N199 PolarHBondContact O-ND2 3.14Å
196	A	92.1	Very high	78	Confident	20 Å²	20	67.4 Å²	67.4	17%	0.165	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-33.9	176.5	0	0	0	0	0	112.6	K129 L131 V192 A193 T194	K129-A196 HydrophobicContact CB-CB 4.18Å; K129-A196 HydrophobicContact CG-CB 4.32Å; L131-A196 HydrophobicContact CD1-CB 4.11Å; V192-A196 PolarHBondContact O-N 3.25Å; A193-A196 WeakPolarHBondContact O-CA 3.49Å; A193-A196 WeakPolarHBondContact O-CB 3.35Å; A193-A196 PolarHBondContact O-N 3.01Å; T194-A196 VanDerWaalsContact C-N 3.32Å; T194-A196 PolarHBondContact O-N 3.39Å
197	C	90.2	Very high	75	Confident	3 Å²	3	78.9 Å²	78.9	2%	0.02	38%	0.382	C	S	.	.	H	α-helix	trans	-69.7	-59.3	174.9	-58.9	0	0	0	0	112	C24 D96 A193 T194 L195 N199 K200	C24-C197 HydrophobicContact CB-CB 3.77Å; C24-C197 WeakPolarHBondContact SG-CB 3.43Å; D96-C197 HydrophobicContact CB-CB 3.79Å; D96-C197 WeakPolarHBondContact CB-SG 3.24Å; A193-C197 PolarHBondContact O-N 2.77Å; A193-C197 PolarHBondContact O-SG 3.23Å; T194-C197 WeakPolarHBondContact O-CB 3.42Å; T194-C197 PolarHBondContact O-N 2.91Å; T194-C197 VanDerWaalsContact O-N 3.15Å; L195-C197 VanDerWaalsContact C-N 3.31Å; L195-C197 PolarHBondContact O-N 3.41Å; C197-N199 PolarHBondContact O-N 3.12Å; C197-N199 VanDerWaalsContact O-N 3.17Å; C197-K200 VanDerWaalsContact O-CB 3.32Å; C197-K200 WeakPolarHBondContact O-CB 3.4Å; C197-K200 WeakPolarHBondContact O-CG 3.39Å; C197-K200 PolarHBondContact O-N 3.03Å
198	V	87	Confident	72.1	Confident	17 Å²	17	80.3 Å²	80.3	10%	0.103	40%	0.4	C	S	.	.	H	α-helix	trans	-61.1	-32.8	-172.9	-61	0	0	0	0	112.7	V22 I71 T194 K200 T201	V22-V198 HydrophobicContact CG1-CG1 4.11Å; I71-V198 HydrophobicContact CG1-CG1 4.21Å; T194-V198 HydrophobicContact CG2-CG1 4.38Å; T194-V198 PolarHBondContact O-N 3.31Å; V198-K200 PolarHBondContact O-N 3.16Å; V198-K200 VanDerWaalsContact O-N 3.15Å; V198-T201 WeakPolarHBondContact O-CG2 3.47Å; V198-T201 PolarHBondContact O-N 3.25Å; V198-T201 PolarHBondContact O-OG1 2.7Å
199	N	80.4	Confident	69.6	Low	96 Å²	96	85.6 Å²	85.6	51%	0.513	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-8.8	177.6	-83	-67.8	0	0	0	114.7	L195 C197 T201	L195-N199 WeakPolarHBondContact O-CB 3.13Å; L195-N199 PolarHBondContact O-N 3.49Å; L195-N199 PolarHBondContact O-ND2 3.14Å; C197-N199 PolarHBondContact O-N 3.12Å; C197-N199 VanDerWaalsContact O-N 3.17Å; N199-T201 VanDerWaalsContact C-N 3.34Å
200	K	65.2	Low	66.8	Low	63 Å²	63	90.7 Å²	90.7	27%	0.274	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-39.5	170.1	-74.3	-174.2	176.1	-176.8	0	112.4	S95 D96 C197 V198 N202 K203	S95-K200 PolarHBondContact O-NZ 2.89Å; D96-K200 VanDerWaalsContact CA-NZ 3.3Å; D96-K200 WeakPolarHBondContact O-CE 3.24Å; D96-K200 PolarHBondContact O-NZ 2.89Å; D96-K200 IonicContact OD1-NZ 2.73Å; D96-K200 PolarHBondContact OD1-NZ 3.49Å; C197-K200 VanDerWaalsContact O-CB 3.32Å; C197-K200 WeakPolarHBondContact O-CB 3.4Å; C197-K200 WeakPolarHBondContact O-CG 3.39Å; C197-K200 PolarHBondContact O-N 3.03Å; V198-K200 PolarHBondContact O-N 3.16Å; V198-K200 VanDerWaalsContact O-N 3.15Å; K200-N202 VanDerWaalsContact C-N 3.26Å; K200-N202 PolarHBondContact O-N 3.04Å; K200-K203 PolarHBondContact O-N 3.17Å
201	T	54.1	Low	64.3	Low	86 Å²	86	99.9 Å²	99.9	53%	0.528	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-54.8	-39.6	-170.8	56.9	0	0	0	0	112.9	V198 N199 K203	V198-T201 WeakPolarHBondContact O-CG2 3.47Å; V198-T201 PolarHBondContact O-N 3.25Å; V198-T201 PolarHBondContact O-OG1 2.7Å; N199-T201 VanDerWaalsContact C-N 3.34Å; T201-K203 PolarHBondContact O-N 2.98Å; T201-K203 VanDerWaalsContact O-N 3.09Å
202	N	44.7	Very low	61.3	Low	94 Å²	94	108.7 Å²	108.7	50%	0.503	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-68.6	-4.7	-175.4	-80.8	-47	0	0	0	115.9	K200	K200-N202 VanDerWaalsContact C-N 3.26Å; K200-N202 PolarHBondContact O-N 3.04Å
203	K	43	Very low	58.6	Low	183 Å²	183	111 Å²	111	80%	0.796	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-101.3	-11.6	-177.6	-67.8	-161.4	176.8	-171.2	0	116.3	K200 T201	K200-K203 PolarHBondContact O-N 3.17Å; T201-K203 PolarHBondContact O-N 2.98Å; T201-K203 VanDerWaalsContact O-N 3.09Å
204	N	40.1	Very low	55.9	Low	158 Å²	158	117.8 Å²	117.8	85%	0.845	59%	0.594	S	S	*	*	S	Bend	trans	-90	4.1	-179.3	-75	-12.4	0	0	0	114.4
205	V	41.7	Very low	53	Low	105 Å²	105	126.8 Å²	126.8	64%	0.636	63%	0.633	S	S	*	*	S	Bend	trans	-92.9	112.2	-179.8	179.2	0	0	0	0	111.3
206	K	32.4	Very low	50.2	Low	195 Å²	195	136 Å²	136	85%	0.848	66%	0.664	S	S	*	*			trans	73.4	96.8	170.3	-59.9	164.2	-176.5	171	0	117.8
207	R	34.7	Very low	47.5	Very low	242 Å²	242	142.1 Å²	142.1	91%	0.913	69%	0.692	S	S	*	*			trans	-138.7	21.7	142	-141.6	177.6	-177.1	-179.5	0.2	116.4	K209	R207-K209 PolarHBondContact O-N 3.22Å
208	N	35.9	Very low	45.1	Very low	173 Å²	173	147.2 Å²	147.2	93%	0.925	73%	0.728	S	S	*	*			trans	-69.6	89.7	168.4	-78.9	-0.1	0	0	0	110.9	S210	N208-S210 PolarHBondContact O-N 3.24Å
209	K	44.8	Very low	42.7	Very low	196 Å²	196	155.2 Å²	155.2	85%	0.852	76%	0.764	S	S	*	*			trans	-72.5	116.8	162.7	-93.9	-168.6	171.7	-173.1	0	108.7	R207 Q211	R207-K209 PolarHBondContact O-N 3.22Å; K209-Q211 PolarHBondContact O-N 2.89Å
210	S	39.8	Very low	40.6	Very low	106 Å²	106	158.9 Å²	158.9	74%	0.741	78%	0.78	S	S	*	*			trans	-61.3	124.1	169	-176.4	0	0	0	0	110.3	N208	N208-S210 PolarHBondContact O-N 3.24Å
211	Q	44.8	Very low	39.4	Very low	193 Å²	193	161 Å²	161	90%	0.902	80%	0.8	S	S	*	*			trans	-119	121.8	153.4	-77.3	-167.8	-18.4	0	0	107.8	K209	K209-Q211 PolarHBondContact O-N 2.89Å
212	R	35	Very low	38.7	Very low	247 Å²	247	162.7 Å²	162.7	93%	0.932	82%	0.815	S	S	*	*			trans	-119.7	82.9	-170.8	-171.2	-175.7	-170.5	-171.2	3.8	108.7
213	A	38.6	Very low	38.4	Very low	97 Å²	97	169.6 Å²	169.6	80%	0.802	83%	0.834	S	S	*	*			trans	-116.5	128.4	178.1	0	0	0	0	0	110.8
214	T	40.5	Very low	38.5	Very low	141 Å²	141	165.5 Å²	165.5	87%	0.865	83%	0.826	S	S	*	*			trans	-57.2	139.6	-172.4	42.6	0	0	0	0	115.6
215	K	34.4	Very low	38.5	Very low	190 Å²	190	166 Å²	166	83%	0.826	82%	0.824	S	S	*	*			trans	-66.8	146.8	163.9	-63.6	-178.8	178.1	-178.4	0	111.3
216	R	34.3	Very low	38.5	Very low	251 Å²	251	168 Å²	168	95%	0.947	83%	0.83	S	S	*	*			trans	-136.2	146.1	149.3	-114.7	-179.4	176.3	176.9	-1.6	108.4
217	I	35.5	Very low	38.9	Very low	148 Å²	148	164 Å²	164	76%	0.759	83%	0.827	S	S	*	*			trans	-133.2	132.6	-173.7	-63.1	171.2	0	0	0	108.3
218	S	40.3	Very low	39.4	Very low	111 Å²	111	157 Å²	157	78%	0.776	82%	0.821	S	S	*	*			trans	-159.2	103.8	166	54.5	0	0	0	0	111.8
219	H	36	Very low	39.7	Very low	184 Å²	184	155.6 Å²	155.6	85%	0.852	82%	0.818	S	S	*	*			trans	43.3	133.2	149.1	-86.9	57.9	0	0	0	122.3
220	M	38	Very low	39.6	Very low	174 Å²	174	149.9 Å²	149.9	86%	0.857	81%	0.807	S	S	*	*			trans	-109.6	159.9	151.8	-92.1	-79.9	170.6	0	0	108.4
221	P	39	Very low	39.8	Very low	107 Å²	107	150.6 Å²	150.6	70%	0.695	81%	0.807	S	S	*	*				-148.9	159.3	123.7	37.6	-22.3	0	0	0	117.2
222	S	39.7	Very low	39.8	Very low	122 Å²	122	147.5 Å²	147.5	85%	0.853	80%	0.797	S	S	*	*			trans	74.6	155.3	152.7	34.9	0	0	0	0	122
223	R	38.4	Very low	40.4	Very low	238 Å²	238	140.8 Å²	140.8	90%	0.898	78%	0.779	S	S	*	*			trans	-133	-170.6	-168.8	-135.1	-173.5	168.3	-164.6	-1.1	106.2
224	P	44.7	Very low	40.6	Very low	97 Å²	97	146.3 Å²	146.3	63%	0.63	78%	0.779	S	S	*	*			cis	-138.2	-150.8	-6	31.9	-5.2	0	0	0	114.5
225	E	39.6	Very low	40.7	Very low	168 Å²	168	147 Å²	147	79%	0.785	77%	0.77	S	S	*	*			trans	87.1	151.8	160.1	-55.3	-153.7	157.4	0	0	119.9
226	L	42.5	Very low	41.1	Very low	149 Å²	149	142.2 Å²	142.2	78%	0.78	75%	0.753	S	S	*	*			cis	-171.2	131.1	-43.6	-117.4	171.3	0	0	0	111.1
227	S	40.8	Very low	41.5	Very low	110 Å²	110	139 Å²	139	77%	0.769	75%	0.746	S	S	*	*			trans	170.7	127.5	154.5	27.8	0	0	0	0	109.9
228	A	44.9	Very low	41.5	Very low	95 Å²	95	136.5 Å²	136.5	79%	0.785	75%	0.748	S	S	*	*				66.9	135.9	92.8	0	0	0	0	0	113.7
229	V	42.8	Very low	41.6	Very low	144 Å²	144	141.3 Å²	141.3	87%	0.873	76%	0.755	S	S	*	*			cis	-142.3	157.3	34.2	168.3	0	0	0	0	112
230	A	42.4	Very low	41.6	Very low	75 Å²	75	138.1 Å²	138.1	62%	0.62	75%	0.753	S	S	*	*			trans	-92.4	160.4	176.8	0	0	0	0	0	113.7
231	T	44.8	Very low	41.6	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	75%	0.752	S	S	*	*				168.2	170.5	107	38.5	0	0	0	0	107.7
232	D	44.2	Very low	41.5	Very low	128 Å²	128	136.9 Å²	136.9	68%	0.684	76%	0.757	S	S	*	*			cis	-175.8	176.4	-14.5	-97.1	3.9	0	0	0	107.6
233	L	46.5	Very low	41.1	Very low	106 Å²	106	137.3 Å²	137.3	56%	0.555	75%	0.754	S	S	*	*			cis	-164.8	139.1	-10.5	-110.4	166.4	0	0	0	109.8
234	R	43.1	Very low	41.2	Very low	213 Å²	213	137.9 Å²	137.9	80%	0.804	77%	0.771	S	S	*	*			trans	62.4	157.7	148.6	-76.8	176.8	-160.6	150.8	14.5	120.5
235	K	43.8	Very low	41	Very low	155 Å²	155	140 Å²	140	67%	0.674	78%	0.778	S	S	*	*			cis	-170.6	169.1	-29	-146.1	176.1	159.3	-126.5	0	112.1
236	D	43.1	Very low	41	Very low	89 Å²	89	138.5 Å²	138.5	48%	0.476	78%	0.777	S	S	.	*			trans	77.6	104.9	145.5	-78.9	-36.7	0	0	0	122.3
237	K	42.6	Very low	41	Very low	183 Å²	183	137.9 Å²	137.9	80%	0.796	78%	0.777	S	S	*	*				82.8	138	124.6	-67.8	165.6	-177.1	158.7	0	122.2
238	A	34.7	Very low	41	Very low	96 Å²	96	139.5 Å²	139.5	79%	0.793	78%	0.778	S	S	*	*			trans	-104.4	163.1	169.5	0	0	0	0	0	112.4
239	K	42.4	Very low	40.7	Very low	213 Å²	213	142.3 Å²	142.3	93%	0.926	78%	0.777	S	S	*	*			trans	-145.5	157	158.9	-84.9	-161.6	173	-175.6	0	111
240	S	35.1	Very low	40.6	Very low	117 Å²	117	142.2 Å²	142.2	82%	0.818	77%	0.771	S	S	*	*			trans	-82.2	168.1	-179.9	-165	0	0	0	0	113
241	C	39	Very low	40.5	Very low	123 Å²	123	147 Å²	147	83%	0.831	78%	0.781	S	S	*	*			trans	-135.9	155.8	163.2	-159.2	0	0	0	0	110.1
242	T	36.4	Very low	40.1	Very low	131 Å²	131	148.9 Å²	148.9	80%	0.804	78%	0.784	S	S	*	*			trans	-118.1	155	-170	-53.7	0	0	0	0	111
243	V	31.8	Very low	39.8	Very low	131 Å²	131	150.7 Å²	150.7	79%	0.794	79%	0.792	S	S	*	*			trans	-69.8	149.7	177.9	177	0	0	0	0	112
244	M	39.3	Very low	39.2	Very low	251 Å²	251	154.7 Å²	154.7	100%	1.236	81%	0.814	S	S	*	*			trans	-105.6	0	152.7	-75.8	-164	-61.1	0	0	108.8

Retrieved 244 of 244 residues in 42.2 ms (Link to these results)

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