G4V8N4_SCHMA Loading...

Peptidyl-prolyl cis-trans isomerase

AlphaFold DB , UniProt , Accession G4V8N4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 139 aa.

						>G4V8N4_SCHMA|G4V8N4
MPKSSAKSDNSKSGKTSGKNSTNSNNKTDNSSSTGSGKQSKLANAVKVRHILCEKQSKCLEALEQLKNGKRFNQVAEIYSEDKARSGGDLGWMSRGSMVGAFQDAAFNLPISTLENPKYTDPPVKTQYGYHIIMVEGRR
					

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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	48	Very low	61.5	Low	244 Å²	244	148.3 Å²	148.3	100%	1.202	85%	0.853	S	S	*	*				0	114.5	0	-74.8	-175.8	150.1	0	0	108.9
2	P	68.7	Low	61.1	Low	123 Å²	123	152 Å²	152	80%	0.799	85%	0.852	S	S	*	*			trans	-99.2	142.4	177.3	35.3	-27.1	0	0	0	111.1
3	K	68.5	Low	60.6	Low	206 Å²	206	149.2 Å²	149.2	90%	0.896	85%	0.848	S	S	*	*			trans	-154.6	98.4	143.7	-78.4	-156.4	179.2	172.5	0	110.1
4	S	60.6	Low	59.9	Low	113 Å²	113	143.4 Å²	143.4	79%	0.79	84%	0.839	S	S	*	*			trans	-47.5	141.9	151.2	46.2	0	0	0	0	112.7
5	S	64.3	Low	59.4	Low	123 Å²	123	147.4 Å²	147.4	86%	0.86	84%	0.842	S	S	*	*			trans	-157.4	101.4	150.4	-61.7	0	0	0	0	109.2
6	A	63.2	Low	58.9	Low	99 Å²	99	145.9 Å²	145.9	82%	0.818	84%	0.836	S	S	*	*			trans	-76	146.8	163.8	0	0	0	0	0	109.5
7	K	63.4	Low	58.1	Low	198 Å²	198	144.2 Å²	144.2	86%	0.861	84%	0.835	S	S	*	*			trans	-160	115.1	150.3	-120.6	171.1	-177	172.5	0	113.4
8	S	62.4	Low	57.6	Low	103 Å²	103	140.8 Å²	140.8	72%	0.72	84%	0.836	S	S	*	*			trans	72.7	100.8	132.1	42.9	0	0	0	0	120.2
9	D	58.3	Low	57.1	Low	160 Å²	160	144.6 Å²	144.6	86%	0.856	84%	0.841	S	S	*	*			trans	-41.1	140.2	139.4	-72.1	-90.9	0	0	0	113.8
10	N	63.8	Low	56.5	Low	151 Å²	151	145.2 Å²	145.2	81%	0.807	84%	0.841	S	S	*	*			trans	-137.2	97.6	156.3	-173.7	20.7	0	0	0	108.9
11	S	54.8	Low	56.2	Low	111 Å²	111	142.8 Å²	142.8	78%	0.776	83%	0.832	S	S	*	*			trans	-87.2	119.5	166.7	40.4	0	0	0	0	108.7
12	K	57.2	Low	56.1	Low	193 Å²	193	136.9 Å²	136.9	84%	0.839	81%	0.81	S	S	*	*			trans	-117.5	115.2	168.4	-166.7	162.2	-176.1	168.3	0	110.8
13	S	54.1	Low	55	Low	115 Å²	115	137.4 Å²	137.4	80%	0.804	81%	0.806	S	S	*	*			trans	-61.5	160.5	172.1	61.8	0	0	0	0	114.9
14	G	51.8	Low	53.9	Low	69 Å²	69	133 Å²	133	71%	0.711	80%	0.801	S	S	*	*			trans	139	91.2	154.5	0	0	0	0	0	111.4
15	K	51.7	Low	53.5	Low	203 Å²	203	134.8 Å²	134.8	88%	0.883	80%	0.802	S	S	*	*				48.8	112.1	91.9	-141.9	175.5	-173.5	179.7	0	110
16	T	51.5	Low	52.8	Low	123 Å²	123	136.8 Å²	136.8	76%	0.755	80%	0.803	S	S	*	*				-173.7	140.1	87.1	-60.5	0	0	0	0	110.7
17	S	44.9	Very low	52.2	Low	118 Å²	118	141.3 Å²	141.3	83%	0.825	80%	0.804	S	S	*	*			trans	-51	136.2	167.9	41.5	0	0	0	0	115.6
18	G	49.6	Very low	51	Low	82 Å²	82	138.1 Å²	138.1	85%	0.845	80%	0.801	S	S	*	*			trans	-145.2	102.7	164.1	0	0	0	0	0	109.8
19	K	47.6	Very low	50.5	Low	213 Å²	213	140.2 Å²	140.2	93%	0.926	80%	0.804	S	S	*	*			trans	-102.7	114.2	-180	-154.7	175.5	-169.1	173.5	0	106.6
20	N	45.9	Very low	49.7	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	80%	0.804	S	S	*	*			trans	-154.5	101	167.3	-146.5	30.1	0	0	0	107
21	S	49.4	Very low	48.8	Very low	94 Å²	94	137.6 Å²	137.6	66%	0.657	80%	0.798	S	S	*	*				90.1	123.6	80.7	-147.7	0	0	0	0	113.2
22	T	45.7	Very low	48	Very low	120 Å²	120	137 Å²	137	74%	0.736	79%	0.794	S	S	*	*			trans	72.3	104.4	146.1	-30.6	0	0	0	0	118.7
23	N	46.3	Very low	47.1	Very low	135 Å²	135	132.6 Å²	132.6	72%	0.722	79%	0.788	S	S	*	*				163.9	117.9	86.3	-158.4	19.2	0	0	0	110.1
24	S	44.6	Very low	46.3	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	78%	0.783	S	S	*	*			trans	-92.5	121.7	169.1	-64.5	0	0	0	0	108.6
25	N	52.6	Low	45.7	Very low	152 Å²	152	133.7 Å²	133.7	81%	0.813	79%	0.794	S	S	*	*			trans	-159.5	91.3	157.8	-98.6	-16.5	0	0	0	107.6
26	N	49.5	Very low	45.4	Very low	164 Å²	164	129 Å²	129	88%	0.877	79%	0.786	S	S	*	*			trans	-102.5	104.9	169	-157.9	-5	0	0	0	108
27	K	50.6	Low	45.1	Very low	194 Å²	194	126.8 Å²	126.8	84%	0.843	79%	0.789	S	S	*	*			trans	-96.9	118.7	178	-159.1	178.9	-169.9	-176.7	0	107.1	D29	K27-D29 PolarHBondContact O-N 3.35Å
28	T	39.5	Very low	44.8	Very low	132 Å²	132	131 Å²	131	81%	0.81	79%	0.792	S	S	*	*			trans	-50.4	120.5	167.9	-42.2	0	0	0	0	110.4
29	D	50.8	Low	44.4	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	79%	0.792	S	S	*	*			trans	-139.6	118.2	154.9	-156.2	-80.7	0	0	0	108.2	K27	K27-D29 PolarHBondContact O-N 3.35Å
30	N	41.3	Very low	44.2	Very low	158 Å²	158	128.3 Å²	128.3	85%	0.845	77%	0.767	S	S	*	*			trans	-97.1	101	177.4	-170.7	-12.2	0	0	0	105.1
31	S	45.9	Very low	44.3	Very low	98 Å²	98	130.9 Å²	130.9	69%	0.685	77%	0.771	S	S	*	*			trans	-150.4	132.7	166.8	-148.6	0	0	0	0	112.3
32	S	37.5	Very low	44.4	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	77%	0.771	S	S	*	*			trans	-58.1	156.3	-179.1	57.3	0	0	0	0	114.3
33	S	38.3	Very low	45	Very low	102 Å²	102	127.9 Å²	127.9	71%	0.713	75%	0.746	S	S	*	*			trans	93.5	130.4	150.6	96.7	0	0	0	0	117.1
34	T	38.3	Very low	46.4	Very low	115 Å²	115	126.9 Å²	126.9	71%	0.706	74%	0.74	S	S	*	*			trans	77	75.4	150.1	-31.6	0	0	0	0	115.5	S36	T34-S36 PolarHBondContact O-N 2.88Å
35	G	39.3	Very low	48.4	Very low	91 Å²	91	121.8 Å²	121.8	94%	0.938	71%	0.705	S	S	*	*			trans	-61.4	80.9	164.9	0	0	0	0	0	112.3	G37	G35-G37 PolarHBondContact O-N 3.39Å
36	S	44.7	Very low	50.2	Low	104 Å²	104	114.5 Å²	114.5	73%	0.727	67%	0.666	S	S	*	*			trans	-93.2	83.3	166.5	-70	0	0	0	0	108.9	T34 K38	T34-S36 PolarHBondContact O-N 2.88Å; S36-K38 PolarHBondContact O-N 3.22Å
37	G	44.2	Very low	52.1	Low	78 Å²	78	109.1 Å²	109.1	80%	0.804	64%	0.635	S	S	*	*			trans	-65.3	97.3	166.7	0	0	0	0	0	110.4	G35 Q39	G35-G37 PolarHBondContact O-N 3.39Å; G37-Q39 PolarHBondContact O-N 3.08Å
38	K	39.4	Very low	54.1	Low	205 Å²	205	99.9 Å²	99.9	89%	0.891	60%	0.595	S	S	*	*			trans	-48.8	127.4	151.2	-103.3	172	178.2	166.4	0	107.8	S36	S36-K38 PolarHBondContact O-N 3.22Å
39	Q	40.3	Very low	56.6	Low	182 Å²	182	94.6 Å²	94.6	85%	0.85	56%	0.56	S	S	*	*			trans	128.9	81.6	150.4	-160.4	155.6	-40.6	0	0	115.1	G37	G37-Q39 PolarHBondContact O-N 3.08Å
40	S	43.5	Very low	58.6	Low	58 Å²	58	88 Å²	88	41%	0.406	52%	0.524	S	S	.	.				172.5	119.7	118.5	66.3	0	0	0	0	110.4	L42 R95	S40-L42 PolarHBondContact O-N 3.28Å; S40-R95 PolarHBondContact OG-NH1 2.99Å
41	K	48.1	Very low	61	Low	211 Å²	211	80.5 Å²	80.5	92%	0.917	48%	0.484	S	S	*	.			trans	-68.9	33.4	175.9	-103.4	171.9	178.3	165.8	0	114.4
42	L	52.2	Low	63.3	Low	127 Å²	127	76.8 Å²	76.8	67%	0.665	46%	0.456	S	S	*	.	S	Bend	trans	-136.6	100.8	-176.2	-69.4	103.1	0	0	0	111.6	S40 R138	S40-L42 PolarHBondContact O-N 3.28Å; L42-R138 PolarHBondContact O-NH2 3.48Å
43	A	58.9	Low	66	Low	24 Å²	24	72.1 Å²	72.1	20%	0.198	42%	0.424	C	S	.	.			trans	62.1	113	-178.4	0	0	0	0	0	116.3	R138 R139	A43-R138 HydrophobicContact CB-CG 3.49Å; A43-R138 VanDerWaalsContact CB-CG 3.49Å; A43-R138 VanDerWaalsContact CB-NE 3.25Å; A43-R139 CarbonylContact C-O 3.53Å; A43-R139 VanDerWaalsContact C-O 3.22Å; A43-R139 VanDerWaalsContact CA-O 3.24Å; A43-R139 WeakPolarHBondContact CA-O 3.33Å; A43-R139 WeakPolarHBondContact CA-OXT 3.48Å; A43-R139 WeakPolarHBondContact CB-O 3.44Å
44	N	75.9	Confident	68.5	Low	114 Å²	114	73.9 Å²	73.9	61%	0.61	42%	0.421	S	S	*	.	S	Bend	trans	-92.6	-20.9	-174.1	-67.9	-24.8	0	0	0	113.6	S94 R95 R139	N44-S94 CarbonylContact O-C 3.58Å; N44-S94 VanDerWaalsContact O-CA 3.24Å; N44-S94 WeakPolarHBondContact O-CA 3.46Å; N44-R95 PolarHBondContact O-N 3.16Å; N44-R139 PolarHBondContact N-O 2.94Å
45	A	85.6	Confident	71.1	Confident	4 Å²	4	75.4 Å²	75.4	3%	0.033	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	144	-177.5	0	0	0	0	0	113	W92 M93 R138 R139	A45-W92 HydrophobicContact CB-CE3 4.17Å; A45-M93 CarbonylContact C-O 3.22Å; A45-M93 WeakPolarHBondContact CA-O 3.27Å; A45-R138 CarbonylContact O-C 3.53Å; A45-R138 WeakPolarHBondContact O-CA 3.48Å; A45-R139 HydrophobicContact CB-CG 3.91Å; A45-R139 PolarHBondContact N-O 3.37Å; A45-R139 PolarHBondContact O-N 2.78Å; A45-R139 VanDerWaalsContact O-O 3.07Å
46	V	89.8	Confident	73.6	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.4	176.9	-75.6	0	0	0	0	109.3	V48 M93 M98 F107 G137 R138	V46-V48 HydrophobicContact CB-CG1 3.83Å; V46-V48 HydrophobicContact CG2-CG1 3.53Å; V46-V48 PolarHBondContact O-N 3.17Å; V46-M93 PolarHBondContact N-O 3.32Å; V46-M93 PolarHBondContact O-N 3.16Å; V46-M98 HydrophobicContact CG2-CE 3.72Å; V46-M98 HydrophobicContact CG2-SD 4.39Å; V46-F107 HydrophobicContact CG1-CD1 4.21Å; V46-F107 HydrophobicContact CG1-CE1 3.89Å; V46-F107 HydrophobicContact CG1-CE2 4.42Å; V46-F107 HydrophobicContact CG1-CZ 4Å; V46-F107 HydrophobicContact CG2-CE2 3.98Å; V46-F107 HydrophobicContact CG2-CZ 4.12Å; V46-G137 CarbonylContact C-O 3.56Å; V46-G137 WeakPolarHBondContact CA-O 3.24Å; V46-R138 HydrophobicContact CG1-CB 3.98Å; V46-R138 HydrophobicContact CG1-CG 3.66Å
47	K	91.2	Very high	75.9	Confident	51 Å²	51	75 Å²	75	22%	0.222	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	109.9	167.8	-166.3	-174.3	-176.3	-147.3	0	107.9	D89 G91 W92 V135 E136 G137	K47-D89 IonicContact NZ-OD2 3.61Å; K47-D89 PolarHBondContact NZ-OD2 3.46Å; K47-G91 VanDerWaalsContact CA-O 3.31Å; K47-G91 WeakPolarHBondContact CA-O 3.47Å; K47-W92 HydrophobicContact CB-CD2 4.01Å; K47-W92 HydrophobicContact CB-CE3 4.11Å; K47-W92 HydrophobicContact CB-CH2 4.42Å; K47-W92 HydrophobicContact CB-CZ2 4.32Å; K47-W92 HydrophobicContact CB-CZ3 4.3Å; K47-V135 WeakPolarHBondContact O-CA 3.45Å; K47-E136 HydrophobicContact CB-CB 4.44Å; K47-E136 HydrophobicContact CD-CB 4.11Å; K47-E136 WeakPolarHBondContact CE-OE2 3.46Å; K47-E136 HydrophobicContact CG-CB 4.37Å; K47-E136 IonicContact NZ-OE2 3.36Å; K47-E136 PolarHBondContact NZ-OE2 3.1Å; K47-E136 PolarHBondContact O-N 3.23Å; K47-G137 PolarHBondContact N-O 3.37Å
48	V	90.8	Very high	78.1	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.3	-172.6	-63	0	0	0	0	111.2	V46 L90 G91 M93 M98 F102 A106 M134 V135	V46-V48 HydrophobicContact CB-CG1 3.83Å; V46-V48 HydrophobicContact CG2-CG1 3.53Å; V46-V48 PolarHBondContact O-N 3.17Å; V48-L90 HydrophobicContact CG2-CB 4Å; V48-L90 HydrophobicContact CG2-CD1 4.19Å; V48-L90 PolarHBondContact O-N 3Å; V48-G91 PolarHBondContact N-O 3.4Å; V48-G91 VanDerWaalsContact N-O 3.11Å; V48-M93 HydrophobicContact CG2-CB 4.1Å; V48-M93 HydrophobicContact CG2-CG 3.66Å; V48-M98 HydrophobicContact CG2-SD 4.34Å; V48-F102 HydrophobicContact CB-CE1 4.36Å; V48-F102 HydrophobicContact CB-CZ 4.44Å; V48-F102 HydrophobicContact CG2-CE1 3.96Å; V48-F102 HydrophobicContact CG2-CZ 4.14Å; V48-A106 HydrophobicContact CG1-CB 3.91Å; V48-M134 WeakPolarHBondContact CA-O 3.5Å; V48-V135 HydrophobicContact CG1-CG2 4.32Å
49	R	92.3	Very high	80.7	Confident	21 Å²	21	64.2 Å²	64.2	8%	0.079	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.2	170.4	-165.9	-177.8	-76.1	-75.5	-9.9	107.5	F72 S86 G87 G88 D89 I133 M134 E136	R49-F72 HydrophobicContact CB-CD1 4.43Å; R49-F72 HydrophobicContact CB-CE1 4.1Å; R49-F72 HydrophobicContact CG-CD1 3.65Å; R49-F72 HydrophobicContact CG-CE1 3.5Å; R49-F72 VanDerWaalsContact CG-CE1 3.5Å; R49-S86 PolarHBondContact NH1-O 2.83Å; R49-G87 VanDerWaalsContact CD-O 3.26Å; R49-G87 WeakPolarHBondContact CD-O 3.34Å; R49-G87 WeakPolarHBondContact CG-O 3.41Å; R49-G87 PolarHBondContact NH1-O 2.78Å; R49-G88 CarbonylContact C-O 3.59Å; R49-G88 VanDerWaalsContact CA-O 3.22Å; R49-G88 WeakPolarHBondContact CA-O 3.39Å; R49-G88 VanDerWaalsContact CG-C 3.48Å; R49-G88 WeakPolarHBondContact CG-O 3.47Å; R49-D89 IonicContact NH2-OD2 2.77Å; R49-I133 CarbonylContact O-C 3.6Å; R49-M134 HydrophobicContact CB-CB 4.25Å; R49-M134 HydrophobicContact CB-CG 4.18Å; R49-M134 HydrophobicContact CB-SD 4.18Å; R49-M134 PolarHBondContact N-O 2.9Å; R49-M134 PolarHBondContact O-N 3.07Å; R49-E136 IonicContact CZ-OE1 2.78Å; R49-E136 IonicContact NE-OE1 3.66Å; R49-E136 PolarHBondContact NE-OE1 2.89Å; R49-E136 VanDerWaalsContact NE-OE1 3.08Å; R49-E136 IonicContact NH2-OE1 3.76Å; R49-E136 PolarHBondContact NH2-OE1 3.32Å; R49-E136 IonicContact NH2-OE2 2.73Å
50	H	92.5	Very high	83.1	Confident	7 Å²	7	58.7 Å²	58.7	3%	0.032	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	165.3	175.5	73.6	-157.3	0	0	0	113.5	D82 G88 L90 F102 I132	H50-D82 IonicContact CE1-OD2 3.14Å; H50-D82 PolarHBondContact CE1-OD2 3.47Å; H50-D82 WeakPolarHBondContact NE2-CB 3.34Å; H50-D82 IonicContact NE2-OD2 3.02Å; H50-D82 PolarHBondContact NE2-OD2 3.38Å; H50-G88 PolarHBondContact N-O 3.25Å; H50-G88 WeakPolarHBondContact O-CA 3.5Å; H50-L90 HydrophobicContact CB-CD1 4.03Å; H50-L90 VanDerWaalsContact CE1-CD1 3.5Å; H50-L90 WeakPolarHBondContact CE1-CD1 3.47Å; H50-L90 VanDerWaalsContact CG-CD1 3.41Å; H50-L90 WeakPolarHBondContact ND1-CD1 3.12Å; H50-F102 HydrophobicContact CB-CE2 3.66Å; H50-F102 HydrophobicContact CB-CZ 3.98Å; H50-F102 AromaticContact CG-CE2 3.88Å; H50-F102 AromaticContact ND1-CE2 3.3Å; H50-F102 VanDerWaalsContact ND1-CE2 3.3Å; H50-F102 WeakPolarHBondContact ND1-CE2 3.32Å; H50-F102 AromaticContact ND1-CZ 3.71Å; H50-I132 CarbonylContact C-O 3.57Å; H50-I132 WeakPolarHBondContact CA-O 3.43Å; H50-I132 WeakPolarHBondContact CB-O 3.35Å
51	I	93.6	Very high	85.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	113	163.1	-60.4	159.8	0	0	0	105.6	A62 L66 F72 V75 A76 H131 I132	I51-A62 HydrophobicContact CG2-CB 4.22Å; I51-L66 HydrophobicContact CD1-CD1 3.93Å; I51-F72 HydrophobicContact CD1-CD1 4.19Å; I51-F72 HydrophobicContact CD1-CD2 4.28Å; I51-F72 HydrophobicContact CD1-CE1 3.81Å; I51-F72 HydrophobicContact CD1-CE2 3.91Å; I51-F72 HydrophobicContact CD1-CG 4.44Å; I51-F72 HydrophobicContact CD1-CZ 3.68Å; I51-F72 HydrophobicContact CG1-CD1 4.25Å; I51-F72 HydrophobicContact CG1-CE1 3.54Å; I51-F72 HydrophobicContact CG1-CE2 4.38Å; I51-F72 HydrophobicContact CG1-CZ 3.64Å; I51-V75 HydrophobicContact CD1-CB 4.14Å; I51-V75 HydrophobicContact CD1-CG1 3.74Å; I51-A76 HydrophobicContact CD1-CB 4.49Å; I51-A76 HydrophobicContact CG1-CB 3.72Å; I51-H131 CarbonylContact O-C 3.57Å; I51-H131 VanDerWaalsContact O-CA 3.25Å; I51-H131 WeakPolarHBondContact O-CA 3.41Å; I51-I132 HydrophobicContact CB-CB 4.19Å; I51-I132 HydrophobicContact CD1-CB 4.38Å; I51-I132 HydrophobicContact CD1-CD1 4.32Å; I51-I132 PolarHBondContact N-O 2.83Å; I51-I132 PolarHBondContact O-N 2.81Å
52	L	93.5	Very high	87.7	Confident	20 Å²	20	50.4 Å²	50.4	11%	0.105	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.7	174.2	172.5	56.2	0	0	0	109.8	S80 E81 D82 Y130 H131	L52-S80 PolarHBondContact N-OG 3.5Å; L52-S80 CarbonylContact O-C 3.53Å; L52-S80 VanDerWaalsContact O-CA 3.29Å; L52-S80 WeakPolarHBondContact O-CA 3.35Å; L52-E81 PolarHBondContact O-N 2.97Å; L52-D82 HydrophobicContact CB-CB 4.06Å; L52-D82 HydrophobicContact CD2-CB 3.8Å; L52-Y130 WeakPolarHBondContact CA-O 3.2Å; L52-H131 WeakPolarHBondContact CD1-CE1 3.28Å; L52-H131 WeakPolarHBondContact CD1-NE2 3.39Å
53	C	93.3	Very high	89.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.6	167.6	-55.2	0	0	0	0	109.5	K55 K58 C59 Y79 Y130	C53-K55 VanDerWaalsContact C-N 3.26Å; C53-K55 PolarHBondContact O-N 3.19Å; C53-K58 HydrophobicContact CB-CB 4.17Å; C53-K58 HydrophobicContact CB-CD 4.34Å; C53-K58 HydrophobicContact CB-CG 4.38Å; C53-C59 HydrophobicContact CB-CB 3.87Å; C53-Y79 PolarHBondContact SG-O 2.88Å; C53-Y79 VanDerWaalsContact SG-O 3.39Å; C53-Y130 PolarHBondContact N-O 3.34Å; C53-Y130 PolarHBondContact O-N 3.22Å
54	E	91.9	Very high	91.1	Very high	139 Å²	139	49.1 Å²	49.1	65%	0.65	24%	0.241	S	C	*	.	S	Bend	trans	-59	-41.2	172.1	-76.8	176.1	167.2	0	0	111.4	E81	E54-E81 WeakPolarHBondContact CB-OE2 3.46Å; E54-E81 VanDerWaalsContact CG-OE2 3.24Å; E54-E81 WeakPolarHBondContact CG-OE2 3.34Å; E54-E81 PolarHBondContact N-OE2 3.4Å
55	K	92.8	Very high	91.9	Very high	148 Å²	148	45.6 Å²	45.6	64%	0.643	22%	0.221	S	C	*	.	S	Bend	trans	-92	132.7	-179.1	-63.8	-176.4	-177.7	178.3	0	111.8	C53 S57 K58 C59	C53-K55 VanDerWaalsContact C-N 3.26Å; C53-K55 PolarHBondContact O-N 3.19Å; K55-S57 VanDerWaalsContact C-N 3.32Å; K55-S57 PolarHBondContact O-N 3.11Å; K55-K58 HydrophobicContact CB-CB 4.26Å; K55-K58 PolarHBondContact O-N 3.33Å; K55-C59 PolarHBondContact O-N 3.35Å
56	Q	90.9	Very high	92.2	Very high	101 Å²	101	45.8 Å²	45.8	47%	0.472	22%	0.221	S	C	.	.	H	α-helix	trans	-58.1	-43.4	174.4	-169.3	177.5	-18.3	0	0	111.8	K58 C59 L60 Y130	Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.2Å; Q56-C59 WeakPolarHBondContact O-CB 3.49Å; Q56-C59 PolarHBondContact O-N 3.21Å; Q56-C59 VanDerWaalsContact O-N 3.13Å; Q56-L60 HydrophobicContact CG-CD1 4.09Å; Q56-L60 HydrophobicContact CG-CG 4.29Å; Q56-L60 WeakPolarHBondContact O-CG 3.36Å; Q56-L60 PolarHBondContact O-N 2.77Å; Q56-Y130 HydrophobicContact CB-CD2 3.92Å; Q56-Y130 HydrophobicContact CB-CE1 4.28Å; Q56-Y130 HydrophobicContact CB-CE2 3.5Å; Q56-Y130 VanDerWaalsContact CB-CE2 3.5Å; Q56-Y130 HydrophobicContact CB-CG 4.47Å; Q56-Y130 HydrophobicContact CG-CD1 4.33Å; Q56-Y130 HydrophobicContact CG-CD2 4.46Å; Q56-Y130 HydrophobicContact CG-CE1 3.96Å; Q56-Y130 HydrophobicContact CG-CE2 4.12Å; Q56-Y130 PolarHBondContact OE1-OH 3.01Å
57	S	92.8	Very high	92.1	Very high	85 Å²	85	51.6 Å²	51.6	59%	0.594	25%	0.246	S	C	*	.	H	α-helix	trans	-57.4	-46.8	-179.5	-48.5	0	0	0	0	111.9	K55 C59 L60 E61	K55-S57 VanDerWaalsContact C-N 3.32Å; K55-S57 PolarHBondContact O-N 3.11Å; S57-C59 VanDerWaalsContact C-N 3.29Å; S57-C59 PolarHBondContact O-N 3.02Å; S57-L60 PolarHBondContact O-N 3.15Å; S57-L60 VanDerWaalsContact O-N 3.14Å; S57-E61 WeakPolarHBondContact O-CG 3.44Å; S57-E61 PolarHBondContact O-N 2.94Å
58	K	92	Very high	92.1	Very high	56 Å²	56	54.9 Å²	54.9	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-62.9	-37.3	178.4	-168.1	-176	-170.6	-155.2	0	111.8	C53 K55 Q56 A62 Y79 E81	C53-K58 HydrophobicContact CB-CB 4.17Å; C53-K58 HydrophobicContact CB-CD 4.34Å; C53-K58 HydrophobicContact CB-CG 4.38Å; K55-K58 HydrophobicContact CB-CB 4.26Å; K55-K58 PolarHBondContact O-N 3.33Å; Q56-K58 VanDerWaalsContact C-N 3.35Å; Q56-K58 PolarHBondContact O-N 3.2Å; K58-A62 PolarHBondContact O-N 3.31Å; K58-Y79 WeakPolarHBondContact CE-O 3.49Å; K58-Y79 HydrophobicContact CG-CD1 3.84Å; K58-Y79 PolarHBondContact NZ-O 3.48Å; K58-Y79 WeakPolarHBondContact O-CD1 3.29Å; K58-E81 IonicContact NZ-OE1 3.08Å; K58-E81 PolarHBondContact NZ-OE1 3.34Å
59	C	92.2	Very high	92	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-67.4	-40.2	175.2	-159.7	0	0	0	0	112.2	C53 K55 Q56 S57 A62 L63 P123 Y130	C53-C59 HydrophobicContact CB-CB 3.87Å; K55-C59 PolarHBondContact O-N 3.35Å; Q56-C59 WeakPolarHBondContact O-CB 3.49Å; Q56-C59 PolarHBondContact O-N 3.21Å; Q56-C59 VanDerWaalsContact O-N 3.13Å; S57-C59 VanDerWaalsContact C-N 3.29Å; S57-C59 PolarHBondContact O-N 3.02Å; C59-A62 WeakPolarHBondContact O-CB 3.31Å; C59-A62 PolarHBondContact O-N 3.04Å; C59-L63 WeakPolarHBondContact O-CB 3.36Å; C59-L63 PolarHBondContact O-N 3.37Å; C59-P123 VanDerWaalsContact SG-CB 3.55Å; C59-Y130 VanDerWaalsContact SG-CB 3.58Å
60	L	92.3	Very high	91.8	Very high	67 Å²	67	61.4 Å²	61.4	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-66.2	-41.4	176.3	-68.9	173.4	0	0	0	111.4	Q56 S57 A62 L63 E64	Q56-L60 HydrophobicContact CG-CD1 4.09Å; Q56-L60 HydrophobicContact CG-CG 4.29Å; Q56-L60 WeakPolarHBondContact O-CG 3.36Å; Q56-L60 PolarHBondContact O-N 2.77Å; S57-L60 PolarHBondContact O-N 3.15Å; S57-L60 VanDerWaalsContact O-N 3.14Å; L60-A62 VanDerWaalsContact C-N 3.32Å; L60-A62 PolarHBondContact O-N 2.87Å; L60-L63 HydrophobicContact CD2-CD2 4.45Å; L60-L63 WeakPolarHBondContact O-CB 3.49Å; L60-L63 PolarHBondContact O-N 3.13Å; L60-L63 VanDerWaalsContact O-N 3.15Å; L60-E64 WeakPolarHBondContact O-CG 3.26Å; L60-E64 PolarHBondContact O-N 3.39Å
61	E	93.8	Very high	91.7	Very high	95 Å²	95	67.6 Å²	67.6	44%	0.444	34%	0.337	S	S	.	.	H	α-helix	trans	-59	-44.5	172.2	-69.8	179.6	92.3	0	0	111.2	S57 L63 E64 Q65 Y79	S57-E61 WeakPolarHBondContact O-CG 3.44Å; S57-E61 PolarHBondContact O-N 2.94Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.44Å; E61-E64 WeakPolarHBondContact O-CB 3.3Å; E61-E64 PolarHBondContact O-N 3.33Å; E61-Q65 WeakPolarHBondContact O-CG 3.06Å; E61-Q65 PolarHBondContact O-N 3.08Å; E61-Y79 HydrophobicContact CB-CD1 4.44Å; E61-Y79 HydrophobicContact CB-CE1 3.69Å
62	A	92.8	Very high	91.5	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-58.5	-43.4	174.8	0	0	0	0	0	111.9	I51 K58 C59 L60 E64 Q65 L66 V75 Y79 I132	I51-A62 HydrophobicContact CG2-CB 4.22Å; K58-A62 PolarHBondContact O-N 3.31Å; C59-A62 WeakPolarHBondContact O-CB 3.31Å; C59-A62 PolarHBondContact O-N 3.04Å; L60-A62 VanDerWaalsContact C-N 3.32Å; L60-A62 PolarHBondContact O-N 2.87Å; A62-E64 PolarHBondContact O-N 3.14Å; A62-Q65 WeakPolarHBondContact O-CB 3.39Å; A62-Q65 PolarHBondContact O-N 2.92Å; A62-L66 WeakPolarHBondContact O-CG 3.37Å; A62-L66 PolarHBondContact O-N 3.21Å; A62-V75 HydrophobicContact CB-CG1 3.58Å; A62-V75 WeakPolarHBondContact O-CG1 3.3Å; A62-Y79 HydrophobicContact CB-CD1 4.07Å; A62-Y79 HydrophobicContact CB-CD2 4.09Å; A62-Y79 HydrophobicContact CB-CG 3.71Å; A62-I132 HydrophobicContact CB-CD1 4.16Å
63	L	91.6	Very high	91.4	Very high	9 Å²	9	68.3 Å²	68.3	5%	0.047	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-39.5	176.7	-169.7	68.4	0	0	0	112.4	C59 L60 E61 L66 K67 Y119 D121 P123 I132	C59-L63 WeakPolarHBondContact O-CB 3.36Å; C59-L63 PolarHBondContact O-N 3.37Å; L60-L63 HydrophobicContact CD2-CD2 4.45Å; L60-L63 WeakPolarHBondContact O-CB 3.49Å; L60-L63 PolarHBondContact O-N 3.13Å; L60-L63 VanDerWaalsContact O-N 3.15Å; E61-L63 VanDerWaalsContact C-N 3.31Å; E61-L63 PolarHBondContact O-N 3.44Å; L63-L66 WeakPolarHBondContact O-CB 3.41Å; L63-L66 PolarHBondContact O-N 3.2Å; L63-K67 WeakPolarHBondContact O-CG 3.11Å; L63-K67 PolarHBondContact O-N 2.85Å; L63-Y119 HydrophobicContact CD1-CD2 3.86Å; L63-Y119 HydrophobicContact CD1-CE2 3.46Å; L63-Y119 VanDerWaalsContact CD1-CE2 3.46Å; L63-D121 WeakPolarHBondContact CD2-OD2 3.4Å; L63-P123 HydrophobicContact CD2-CG 4.43Å; L63-I132 HydrophobicContact CB-CD1 3.97Å; L63-I132 HydrophobicContact CD1-CD1 4.1Å
64	E	92.7	Very high	91.3	Very high	115 Å²	115	72.8 Å²	72.8	54%	0.537	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-42.7	173.4	-73.2	174.9	-164.2	0	0	111.4	L60 E61 A62 L66 K67 N68	L60-E64 WeakPolarHBondContact O-CG 3.26Å; L60-E64 PolarHBondContact O-N 3.39Å; E61-E64 WeakPolarHBondContact O-CB 3.3Å; E61-E64 PolarHBondContact O-N 3.33Å; A62-E64 PolarHBondContact O-N 3.14Å; E64-L66 VanDerWaalsContact C-N 3.31Å; E64-L66 PolarHBondContact O-N 3.43Å; E64-K67 PolarHBondContact O-N 3.49Å; E64-K67 VanDerWaalsContact O-N 3.16Å; E64-N68 PolarHBondContact O-N 3.29Å; E64-N68 PolarHBondContact O-ND2 3.37Å
65	Q	92.1	Very high	91.3	Very high	39 Å²	39	66.2 Å²	66.2	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-61.1	-39.5	174.8	-65	-55.6	-21.6	0	0	112.2	E61 A62 N68 K70 V75 Y79	E61-Q65 WeakPolarHBondContact O-CG 3.06Å; E61-Q65 PolarHBondContact O-N 3.08Å; A62-Q65 WeakPolarHBondContact O-CB 3.39Å; A62-Q65 PolarHBondContact O-N 2.92Å; Q65-N68 PolarHBondContact O-N 2.84Å; Q65-K70 HydrophobicContact CB-CB 4.5Å; Q65-K70 HydrophobicContact CB-CD 4.1Å; Q65-K70 HydrophobicContact CG-CD 4.44Å; Q65-K70 VanDerWaalsContact O-CB 3.27Å; Q65-K70 WeakPolarHBondContact O-CB 3.49Å; Q65-K70 PolarHBondContact O-N 2.91Å; Q65-K70 VanDerWaalsContact O-N 3.08Å; Q65-K70 VanDerWaalsContact OE1-CD 3.26Å; Q65-V75 HydrophobicContact CB-CG1 4.31Å; Q65-V75 HydrophobicContact CB-CG2 3.77Å; Q65-Y79 HydrophobicContact CG-CE2 3.8Å
66	L	90.9	Very high	91.3	Very high	9 Å²	9	59.1 Å²	59.1	5%	0.047	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-43.1	173.6	-68.6	171.7	0	0	0	111.6	I51 A62 L63 E64 N68 G69 F72 V75 Y119 I132	I51-L66 HydrophobicContact CD1-CD1 3.93Å; A62-L66 WeakPolarHBondContact O-CG 3.37Å; A62-L66 PolarHBondContact O-N 3.21Å; L63-L66 WeakPolarHBondContact O-CB 3.41Å; L63-L66 PolarHBondContact O-N 3.2Å; E64-L66 VanDerWaalsContact C-N 3.31Å; E64-L66 PolarHBondContact O-N 3.43Å; L66-N68 VanDerWaalsContact C-N 3.27Å; L66-N68 PolarHBondContact O-N 2.71Å; L66-G69 PolarHBondContact O-N 2.93Å; L66-F72 HydrophobicContact CD1-CD2 4.04Å; L66-F72 HydrophobicContact CD1-CE2 4.15Å; L66-F72 HydrophobicContact CD2-CB 4Å; L66-F72 HydrophobicContact CD2-CD2 3.78Å; L66-F72 HydrophobicContact CD2-CG 4.12Å; L66-V75 HydrophobicContact CD2-CB 4.07Å; L66-V75 HydrophobicContact CD2-CG1 4.47Å; L66-V75 HydrophobicContact CD2-CG2 3.82Å; L66-V75 HydrophobicContact CG-CB 4.36Å; L66-V75 HydrophobicContact CG-CG1 4.24Å; L66-V75 HydrophobicContact CG-CG2 4.13Å; L66-Y119 HydrophobicContact CB-CE1 4.03Å; L66-Y119 HydrophobicContact CD1-CD1 4.28Å; L66-Y119 HydrophobicContact CD1-CE1 4.29Å; L66-Y119 HydrophobicContact CD1-CG 4.4Å; L66-I132 HydrophobicContact CD1-CD1 4.15Å; L66-I132 HydrophobicContact CD1-CG2 3.98Å
67	K	89	Confident	91.3	Very high	121 Å²	121	59.3 Å²	59.3	53%	0.526	30%	0.301	S	S	.	.	H	α-helix	trans	-64.1	-31.3	176.4	-73.7	173.4	179.8	175.6	0	112.6	L63 E64 G69 D121	L63-K67 WeakPolarHBondContact O-CG 3.11Å; L63-K67 PolarHBondContact O-N 2.85Å; E64-K67 PolarHBondContact O-N 3.49Å; E64-K67 VanDerWaalsContact O-N 3.16Å; K67-G69 PolarHBondContact O-N 3.36Å; K67-D121 WeakPolarHBondContact CE-OD2 3.23Å; K67-D121 IonicContact NZ-OD2 3.21Å; K67-D121 PolarHBondContact NZ-OD2 3.16Å
68	N	90.5	Very high	91.3	Very high	120 Å²	120	60.5 Å²	60.5	64%	0.642	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-1.7	172.8	-67.3	-23.8	0	0	0	113.5	E64 Q65 L66	E64-N68 PolarHBondContact O-N 3.29Å; E64-N68 PolarHBondContact O-ND2 3.37Å; Q65-N68 PolarHBondContact O-N 2.84Å; L66-N68 VanDerWaalsContact C-N 3.27Å; L66-N68 PolarHBondContact O-N 2.71Å
69	G	87.9	Confident	91.3	Very high	65 Å²	65	59.4 Å²	59.4	67%	0.67	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	13.2	179.6	0	0	0	0	0	114.3	L66 K67	L66-G69 PolarHBondContact O-N 2.93Å; K67-G69 PolarHBondContact O-N 3.36Å
70	K	89.7	Confident	91.3	Very high	94 Å²	94	59.9 Å²	59.9	41%	0.409	30%	0.297	S	S	.	.			trans	-68.9	145.2	170.8	-65.5	-166.4	179.5	167.2	0	110.2	Q65 V75	Q65-K70 HydrophobicContact CB-CB 4.5Å; Q65-K70 HydrophobicContact CB-CD 4.1Å; Q65-K70 HydrophobicContact CG-CD 4.44Å; Q65-K70 VanDerWaalsContact O-CB 3.27Å; Q65-K70 WeakPolarHBondContact O-CB 3.49Å; Q65-K70 PolarHBondContact O-N 2.91Å; Q65-K70 VanDerWaalsContact O-N 3.08Å; Q65-K70 VanDerWaalsContact OE1-CD 3.26Å; K70-V75 HydrophobicContact CB-CG2 3.81Å
71	R	89.4	Confident	91.2	Very high	136 Å²	136	60.7 Å²	60.7	51%	0.513	30%	0.299	S	S	.	.			trans	-68.1	139.4	-178.8	-55.3	-176.6	72.9	166.8	4.3	110.3	N73 Q74 V75	R71-N73 WeakPolarHBondContact CB-OD1 3.48Å; R71-N73 PolarHBondContact O-N 3.3Å; R71-Q74 HydrophobicContact CB-CG 4.36Å; R71-Q74 WeakPolarHBondContact O-CB 3.48Å; R71-Q74 PolarHBondContact O-N 3.35Å; R71-V75 PolarHBondContact O-N 2.88Å; R71-V75 VanDerWaalsContact O-N 3.11Å
72	F	90.4	Very high	90.9	Very high	2 Å²	2	59 Å²	59	1%	0.009	29%	0.293	C	S	.	.	H	α-helix	trans	-55.4	-40.4	-177.2	-165.9	-72.1	0	0	0	113	R49 I51 L66 Q74 V75 A76 L114 I132 M134	R49-F72 HydrophobicContact CB-CD1 4.43Å; R49-F72 HydrophobicContact CB-CE1 4.1Å; R49-F72 HydrophobicContact CG-CD1 3.65Å; R49-F72 HydrophobicContact CG-CE1 3.5Å; R49-F72 VanDerWaalsContact CG-CE1 3.5Å; I51-F72 HydrophobicContact CD1-CD1 4.19Å; I51-F72 HydrophobicContact CD1-CD2 4.28Å; I51-F72 HydrophobicContact CD1-CE1 3.81Å; I51-F72 HydrophobicContact CD1-CE2 3.91Å; I51-F72 HydrophobicContact CD1-CG 4.44Å; I51-F72 HydrophobicContact CD1-CZ 3.68Å; I51-F72 HydrophobicContact CG1-CD1 4.25Å; I51-F72 HydrophobicContact CG1-CE1 3.54Å; I51-F72 HydrophobicContact CG1-CE2 4.38Å; I51-F72 HydrophobicContact CG1-CZ 3.64Å; L66-F72 HydrophobicContact CD1-CD2 4.04Å; L66-F72 HydrophobicContact CD1-CE2 4.15Å; L66-F72 HydrophobicContact CD2-CB 4Å; L66-F72 HydrophobicContact CD2-CD2 3.78Å; L66-F72 HydrophobicContact CD2-CG 4.12Å; F72-Q74 VanDerWaalsContact C-N 3.35Å; F72-Q74 PolarHBondContact O-N 2.94Å; F72-V75 PolarHBondContact O-N 3.13Å; F72-A76 HydrophobicContact CD1-CB 4.36Å; F72-A76 HydrophobicContact CE1-CB 4.4Å; F72-A76 VanDerWaalsContact O-CB 3.3Å; F72-A76 WeakPolarHBondContact O-CB 3.3Å; F72-A76 PolarHBondContact O-N 3.04Å; F72-L114 HydrophobicContact CB-CD2 4.22Å; F72-I132 HydrophobicContact CE2-CG2 3.87Å; F72-I132 HydrophobicContact CZ-CG2 4.33Å; F72-M134 HydrophobicContact CB-CE 3.92Å; F72-M134 HydrophobicContact CB-SD 4.13Å; F72-M134 HydrophobicContact CD1-SD 4.37Å; F72-M134 HydrophobicContact CD2-CB 4.11Å; F72-M134 HydrophobicContact CD2-CE 3.91Å; F72-M134 HydrophobicContact CD2-SD 4.18Å; F72-M134 HydrophobicContact CE2-CB 3.76Å; F72-M134 HydrophobicContact CG-CE 4.04Å; F72-M134 HydrophobicContact CG-SD 3.98Å; F72-M134 HydrophobicContact CZ-CB 3.99Å
73	N	90.2	Very high	90.6	Very high	34 Å²	34	64 Å²	64	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-61.4	-40.9	178	64.2	-68.1	0	0	0	112.5	R71 A76 E77 G87	R71-N73 WeakPolarHBondContact CB-OD1 3.48Å; R71-N73 PolarHBondContact O-N 3.3Å; N73-A76 PolarHBondContact O-N 3.08Å; N73-E77 WeakPolarHBondContact O-CB 3.04Å; N73-E77 VanDerWaalsContact O-CG 3.3Å; N73-E77 WeakPolarHBondContact O-CG 3.4Å; N73-E77 PolarHBondContact O-N 2.78Å; N73-G87 WeakPolarHBondContact O-CA 3.48Å
74	Q	91.3	Very high	90.5	Very high	93 Å²	93	64.9 Å²	64.9	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-68.2	-42.1	178.2	-67.1	-178.7	-16.6	0	0	111.4	R71 F72 A76 E77 I78	R71-Q74 HydrophobicContact CB-CG 4.36Å; R71-Q74 WeakPolarHBondContact O-CB 3.48Å; R71-Q74 PolarHBondContact O-N 3.35Å; F72-Q74 VanDerWaalsContact C-N 3.35Å; F72-Q74 PolarHBondContact O-N 2.94Å; Q74-A76 VanDerWaalsContact C-N 3.3Å; Q74-A76 PolarHBondContact O-N 3.27Å; Q74-E77 PolarHBondContact O-N 2.9Å; Q74-I78 WeakPolarHBondContact O-CD1 3.38Å; Q74-I78 VanDerWaalsContact O-CG1 3.31Å; Q74-I78 WeakPolarHBondContact O-CG1 2.91Å; Q74-I78 PolarHBondContact O-N 2.85Å
75	V	92.6	Very high	90.2	Very high	1 Å²	1	71.1 Å²	71.1	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-63.5	-41.7	176	-178.2	0	0	0	0	110	I51 A62 Q65 L66 K70 R71 F72 I78 Y79	I51-V75 HydrophobicContact CD1-CB 4.14Å; I51-V75 HydrophobicContact CD1-CG1 3.74Å; A62-V75 HydrophobicContact CB-CG1 3.58Å; A62-V75 WeakPolarHBondContact O-CG1 3.3Å; Q65-V75 HydrophobicContact CB-CG1 4.31Å; Q65-V75 HydrophobicContact CB-CG2 3.77Å; L66-V75 HydrophobicContact CD2-CB 4.07Å; L66-V75 HydrophobicContact CD2-CG1 4.47Å; L66-V75 HydrophobicContact CD2-CG2 3.82Å; L66-V75 HydrophobicContact CG-CB 4.36Å; L66-V75 HydrophobicContact CG-CG1 4.24Å; L66-V75 HydrophobicContact CG-CG2 4.13Å; K70-V75 HydrophobicContact CB-CG2 3.81Å; R71-V75 PolarHBondContact O-N 2.88Å; R71-V75 VanDerWaalsContact O-N 3.11Å; F72-V75 PolarHBondContact O-N 3.13Å; V75-I78 PolarHBondContact O-N 3.19Å; V75-Y79 HydrophobicContact CG1-CD2 3.72Å; V75-Y79 HydrophobicContact CG1-CE2 4.35Å; V75-Y79 HydrophobicContact CG1-CG 4.44Å; V75-Y79 WeakPolarHBondContact O-CB 3.4Å; V75-Y79 WeakPolarHBondContact O-CD2 3.43Å; V75-Y79 PolarHBondContact O-N 3.38Å
76	A	92.5	Very high	90	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-65.6	-38.7	176.4	0	0	0	0	0	113.2	I51 F72 N73 Q74 I78 S80 G87	I51-A76 HydrophobicContact CD1-CB 4.49Å; I51-A76 HydrophobicContact CG1-CB 3.72Å; F72-A76 HydrophobicContact CD1-CB 4.36Å; F72-A76 HydrophobicContact CE1-CB 4.4Å; F72-A76 VanDerWaalsContact O-CB 3.3Å; F72-A76 WeakPolarHBondContact O-CB 3.3Å; F72-A76 PolarHBondContact O-N 3.04Å; N73-A76 PolarHBondContact O-N 3.08Å; Q74-A76 VanDerWaalsContact C-N 3.3Å; Q74-A76 PolarHBondContact O-N 3.27Å; A76-I78 PolarHBondContact O-N 3.14Å; A76-S80 WeakPolarHBondContact O-CA 3.33Å; A76-S80 WeakPolarHBondContact O-CB 3.49Å; A76-S80 PolarHBondContact O-N 3.2Å; A76-G87 WeakPolarHBondContact CB-O 3.21Å
77	E	91.9	Very high	89.9	Confident	104 Å²	104	72.2 Å²	72.2	49%	0.486	36%	0.355	S	S	.	.	H	α-helix	trans	-60.3	-34.6	174.9	-78.4	164.1	-142.9	0	0	112.6	N73 Q74 A84	N73-E77 WeakPolarHBondContact O-CB 3.04Å; N73-E77 VanDerWaalsContact O-CG 3.3Å; N73-E77 WeakPolarHBondContact O-CG 3.4Å; N73-E77 PolarHBondContact O-N 2.78Å; Q74-E77 PolarHBondContact O-N 2.9Å; E77-A84 WeakPolarHBondContact CA-O 3.13Å; E77-A84 WeakPolarHBondContact CG-O 3.36Å
78	I	92.3	Very high	89.9	Confident	111 Å²	111	66.4 Å²	66.4	57%	0.569	33%	0.33	S	S	*	.	H	α-helix	trans	-87.9	-44.8	-176.7	-63.2	166	0	0	0	111.8	Q74 V75 A76	Q74-I78 WeakPolarHBondContact O-CD1 3.38Å; Q74-I78 VanDerWaalsContact O-CG1 3.31Å; Q74-I78 WeakPolarHBondContact O-CG1 2.91Å; Q74-I78 PolarHBondContact O-N 2.85Å; V75-I78 PolarHBondContact O-N 3.19Å; A76-I78 PolarHBondContact O-N 3.14Å
79	Y	92	Very high	89.9	Confident	33 Å²	33	62.6 Å²	62.6	13%	0.129	31%	0.309	C	S	.	.	H	α-helix	trans	-103.6	-28.9	-168.1	-67.8	-90.3	0	0	0	113.7	C53 K58 E61 A62 Q65 V75	C53-Y79 PolarHBondContact SG-O 2.88Å; C53-Y79 VanDerWaalsContact SG-O 3.39Å; K58-Y79 WeakPolarHBondContact CE-O 3.49Å; K58-Y79 HydrophobicContact CG-CD1 3.84Å; K58-Y79 PolarHBondContact NZ-O 3.48Å; K58-Y79 WeakPolarHBondContact O-CD1 3.29Å; E61-Y79 HydrophobicContact CB-CD1 4.44Å; E61-Y79 HydrophobicContact CB-CE1 3.69Å; A62-Y79 HydrophobicContact CB-CD1 4.07Å; A62-Y79 HydrophobicContact CB-CD2 4.09Å; A62-Y79 HydrophobicContact CB-CG 3.71Å; Q65-Y79 HydrophobicContact CG-CE2 3.8Å; V75-Y79 HydrophobicContact CG1-CD2 3.72Å; V75-Y79 HydrophobicContact CG1-CE2 4.35Å; V75-Y79 HydrophobicContact CG1-CG 4.44Å; V75-Y79 WeakPolarHBondContact O-CB 3.4Å; V75-Y79 WeakPolarHBondContact O-CD2 3.43Å; V75-Y79 PolarHBondContact O-N 3.38Å
80	S	91.3	Very high	89.9	Confident	9 Å²	9	61.7 Å²	61.7	6%	0.063	29%	0.289	C	S	.	.			trans	-70.3	135.8	-175	-159	0	0	0	0	110.9	L52 A76 D82 A84	L52-S80 PolarHBondContact N-OG 3.5Å; L52-S80 CarbonylContact O-C 3.53Å; L52-S80 VanDerWaalsContact O-CA 3.29Å; L52-S80 WeakPolarHBondContact O-CA 3.35Å; A76-S80 WeakPolarHBondContact O-CA 3.33Å; A76-S80 WeakPolarHBondContact O-CB 3.49Å; A76-S80 PolarHBondContact O-N 3.2Å; S80-D82 WeakPolarHBondContact CB-O 3.09Å; S80-D82 PolarHBondContact OG-N 2.77Å; S80-D82 PolarHBondContact OG-O 3.03Å; S80-A84 VanDerWaalsContact O-CB 3.32Å; S80-A84 WeakPolarHBondContact O-CB 3.35Å
81	E	90.1	Very high	89.9	Confident	84 Å²	84	58 Å²	58	39%	0.393	28%	0.278	S	S	.	.	S	Bend	trans	-92.9	-12.9	171.5	-77	155.6	-167.1	0	0	111.6	L52 E54 K58	L52-E81 PolarHBondContact O-N 2.97Å; E54-E81 WeakPolarHBondContact CB-OE2 3.46Å; E54-E81 VanDerWaalsContact CG-OE2 3.24Å; E54-E81 WeakPolarHBondContact CG-OE2 3.34Å; E54-E81 PolarHBondContact N-OE2 3.4Å; K58-E81 IonicContact NZ-OE1 3.08Å; K58-E81 PolarHBondContact NZ-OE1 3.34Å
82	D	87.3	Confident	89.9	Confident	59 Å²	59	57.1 Å²	57.1	32%	0.316	28%	0.275	S	S	.	.	S	Bend	trans	-118.1	142	170.6	-172.3	35.8	0	0	0	111.9	H50 L52 S80 A84	H50-D82 IonicContact CE1-OD2 3.14Å; H50-D82 PolarHBondContact CE1-OD2 3.47Å; H50-D82 WeakPolarHBondContact NE2-CB 3.34Å; H50-D82 IonicContact NE2-OD2 3.02Å; H50-D82 PolarHBondContact NE2-OD2 3.38Å; L52-D82 HydrophobicContact CB-CB 4.06Å; L52-D82 HydrophobicContact CD2-CB 3.8Å; S80-D82 WeakPolarHBondContact CB-O 3.09Å; S80-D82 PolarHBondContact OG-N 2.77Å; S80-D82 PolarHBondContact OG-O 3.03Å; D82-A84 PolarHBondContact O-N 2.91Å
83	K	87.5	Confident	89.8	Confident	107 Å²	107	58.9 Å²	58.9	47%	0.465	28%	0.283	S	S	.	.	S	Bend	trans	46.2	26.9	-178.1	-62	-62.2	-178.3	-175.4	0	115.5	R85 S86 G87 G88	K83-R85 VanDerWaalsContact C-N 3.26Å; K83-R85 PolarHBondContact O-N 2.73Å; K83-S86 CarbonylContact O-C 3.47Å; K83-S86 WeakPolarHBondContact O-CA 3.34Å; K83-S86 PolarHBondContact O-N 2.87Å; K83-G87 PolarHBondContact O-N 2.88Å; K83-G88 WeakPolarHBondContact O-CA 3.5Å; K83-G88 PolarHBondContact O-N 3.4Å
84	A	88.2	Confident	89.6	Confident	26 Å²	26	60 Å²	60	22%	0.215	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-52.6	-44.2	-178.7	0	0	0	0	0	112.1	E77 S80 D82 S86 G87	E77-A84 WeakPolarHBondContact CA-O 3.13Å; E77-A84 WeakPolarHBondContact CG-O 3.36Å; S80-A84 VanDerWaalsContact O-CB 3.32Å; S80-A84 WeakPolarHBondContact O-CB 3.35Å; D82-A84 PolarHBondContact O-N 2.91Å; A84-S86 PolarHBondContact O-N 2.85Å; A84-S86 VanDerWaalsContact O-N 3.13Å; A84-G87 PolarHBondContact O-N 3.39Å
85	R	86.8	Confident	89	Confident	246 Å²	246	60.8 Å²	60.8	93%	0.928	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-61.4	-22.3	178.5	-61.8	-176.4	72.4	170.9	3.5	114.4	K83	K83-R85 VanDerWaalsContact C-N 3.26Å; K83-R85 PolarHBondContact O-N 2.73Å
86	S	88.6	Confident	88.6	Confident	71 Å²	71	63.8 Å²	63.8	50%	0.497	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-102.2	12.8	177.1	-56.7	0	0	0	0	112.1	R49 K83 A84 G88 D89	R49-S86 PolarHBondContact NH1-O 2.83Å; K83-S86 CarbonylContact O-C 3.47Å; K83-S86 WeakPolarHBondContact O-CA 3.34Å; K83-S86 PolarHBondContact O-N 2.87Å; A84-S86 PolarHBondContact O-N 2.85Å; A84-S86 VanDerWaalsContact O-N 3.13Å; S86-G88 PolarHBondContact O-N 2.81Å; S86-D89 WeakPolarHBondContact O-CB 3.22Å; S86-D89 PolarHBondContact O-N 2.99Å
87	G	88.4	Confident	88.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	28.5	-171.9	0	0	0	0	0	113.1	R49 N73 A76 K83 A84	R49-G87 VanDerWaalsContact CD-O 3.26Å; R49-G87 WeakPolarHBondContact CD-O 3.34Å; R49-G87 WeakPolarHBondContact CG-O 3.41Å; R49-G87 PolarHBondContact NH1-O 2.78Å; N73-G87 WeakPolarHBondContact O-CA 3.48Å; A76-G87 WeakPolarHBondContact CB-O 3.21Å; K83-G87 PolarHBondContact O-N 2.88Å; A84-G87 PolarHBondContact O-N 3.39Å
88	G	89	Confident	87.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	9.3	-179.3	0	0	0	0	0	115.1	R49 H50 K83 S86 L90	R49-G88 CarbonylContact C-O 3.59Å; R49-G88 VanDerWaalsContact CA-O 3.22Å; R49-G88 WeakPolarHBondContact CA-O 3.39Å; R49-G88 VanDerWaalsContact CG-C 3.48Å; R49-G88 WeakPolarHBondContact CG-O 3.47Å; H50-G88 PolarHBondContact N-O 3.25Å; H50-G88 WeakPolarHBondContact O-CA 3.5Å; K83-G88 WeakPolarHBondContact O-CA 3.5Å; K83-G88 PolarHBondContact O-N 3.4Å; S86-G88 PolarHBondContact O-N 2.81Å; G88-L90 WeakPolarHBondContact O-CD1 3.29Å; G88-L90 PolarHBondContact O-N 2.83Å
89	D	90.7	Very high	87.5	Confident	40 Å²	40	60.4 Å²	60.4	21%	0.214	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	118.2	179.4	-162.9	2.5	0	0	0	110.5	K47 R49 S86 G91	K47-D89 IonicContact NZ-OD2 3.61Å; K47-D89 PolarHBondContact NZ-OD2 3.46Å; R49-D89 IonicContact NH2-OD2 2.77Å; S86-D89 WeakPolarHBondContact O-CB 3.22Å; S86-D89 PolarHBondContact O-N 2.99Å; D89-G91 WeakPolarHBondContact OD1-CA 3.45Å; D89-G91 PolarHBondContact OD1-N 2.82Å
90	L	88.6	Confident	87.3	Confident	45 Å²	45	60.9 Å²	60.9	24%	0.236	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-11.9	169.1	-68.5	94.3	0	0	0	111.7	V48 H50 G88 M93 F102	V48-L90 HydrophobicContact CG2-CB 4Å; V48-L90 HydrophobicContact CG2-CD1 4.19Å; V48-L90 PolarHBondContact O-N 3Å; H50-L90 HydrophobicContact CB-CD1 4.03Å; H50-L90 VanDerWaalsContact CE1-CD1 3.5Å; H50-L90 WeakPolarHBondContact CE1-CD1 3.47Å; H50-L90 VanDerWaalsContact CG-CD1 3.41Å; H50-L90 WeakPolarHBondContact ND1-CD1 3.12Å; G88-L90 WeakPolarHBondContact O-CD1 3.29Å; G88-L90 PolarHBondContact O-N 2.83Å; L90-M93 HydrophobicContact CB-CG 4.01Å; L90-M93 HydrophobicContact CB-SD 4.36Å; L90-M93 HydrophobicContact CD2-CE 4.39Å; L90-M93 HydrophobicContact CD2-SD 4.46Å; L90-F102 HydrophobicContact CD1-CZ 4.44Å
91	G	88.9	Confident	87.2	Confident	18 Å²	18	62.8 Å²	62.8	19%	0.186	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	71.9	-149.3	-170.5	0	0	0	0	0	111.8	K47 V48 D89 M93	K47-G91 VanDerWaalsContact CA-O 3.31Å; K47-G91 WeakPolarHBondContact CA-O 3.47Å; V48-G91 PolarHBondContact N-O 3.4Å; V48-G91 VanDerWaalsContact N-O 3.11Å; D89-G91 WeakPolarHBondContact OD1-CA 3.45Å; D89-G91 PolarHBondContact OD1-N 2.82Å; G91-M93 PolarHBondContact O-N 3.36Å
92	W	89.9	Confident	87.2	Confident	116 Å²	116	59.2 Å²	59.2	44%	0.439	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	110.7	-176.8	-69.9	94.4	0	0	0	111.4	A45 K47 R139	A45-W92 HydrophobicContact CB-CE3 4.17Å; K47-W92 HydrophobicContact CB-CD2 4.01Å; K47-W92 HydrophobicContact CB-CE3 4.11Å; K47-W92 HydrophobicContact CB-CH2 4.42Å; K47-W92 HydrophobicContact CB-CZ2 4.32Å; K47-W92 HydrophobicContact CB-CZ3 4.3Å; W92-R139 HydrophobicContact CE3-CG 3.8Å; W92-R139 HydrophobicContact CH2-CB 4.16Å; W92-R139 HydrophobicContact CH2-CG 4.13Å; W92-R139 HydrophobicContact CZ3-CB 3.8Å; W92-R139 HydrophobicContact CZ3-CG 3.43Å; W92-R139 VanDerWaalsContact CZ3-CG 3.43Å
93	M	88.1	Confident	87.3	Confident	39 Å²	39	57.6 Å²	57.6	19%	0.192	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.8	177.3	-67	-65.1	-76.8	0	0	110.6	A45 V46 V48 L90 G91 S97 M98	A45-M93 CarbonylContact C-O 3.22Å; A45-M93 WeakPolarHBondContact CA-O 3.27Å; V46-M93 PolarHBondContact N-O 3.32Å; V46-M93 PolarHBondContact O-N 3.16Å; V48-M93 HydrophobicContact CG2-CB 4.1Å; V48-M93 HydrophobicContact CG2-CG 3.66Å; L90-M93 HydrophobicContact CB-CG 4.01Å; L90-M93 HydrophobicContact CB-SD 4.36Å; L90-M93 HydrophobicContact CD2-CE 4.39Å; L90-M93 HydrophobicContact CD2-SD 4.46Å; G91-M93 PolarHBondContact O-N 3.36Å; M93-S97 WeakPolarHBondContact CE-O 3.47Å; M93-M98 HydrophobicContact CB-CE 3.86Å; M93-M98 HydrophobicContact CB-CG 4.02Å; M93-M98 HydrophobicContact CB-SD 3.59Å; M93-M98 VanDerWaalsContact CB-SD 3.59Å; M93-M98 HydrophobicContact CE-CG 3.55Å; M93-M98 HydrophobicContact CG-CG 4.36Å; M93-M98 HydrophobicContact CG-SD 4.18Å
94	S	85.9	Confident	87.4	Confident	57 Å²	57	56.4 Å²	56.4	40%	0.399	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	150.3	174.6	-62.7	0	0	0	0	111.4	N44 G96 S97	N44-S94 CarbonylContact O-C 3.58Å; N44-S94 VanDerWaalsContact O-CA 3.24Å; N44-S94 WeakPolarHBondContact O-CA 3.46Å; S94-G96 PolarHBondContact O-N 3.35Å; S94-S97 WeakPolarHBondContact O-CB 3.34Å; S94-S97 PolarHBondContact O-N 2.87Å; S94-S97 VanDerWaalsContact O-N 3.1Å
95	R	79.6	Confident	87.5	Confident	110 Å²	110	56 Å²	56	42%	0.415	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	128.4	171.2	-158.2	170.8	-172.2	173.4	0.5	109.3	S40 N44 Q103 F107	S40-R95 PolarHBondContact OG-NH1 2.99Å; N44-R95 PolarHBondContact O-N 3.16Å; R95-Q103 HydrophobicContact CG-CG 4.25Å; R95-F107 HydrophobicContact CB-CE2 4.02Å; R95-F107 HydrophobicContact CB-CZ 3.71Å; R95-F107 HydrophobicContact CG-CE2 3.8Å; R95-F107 HydrophobicContact CG-CZ 3.83Å
96	G	82.6	Confident	87.7	Confident	64 Å²	64	44.4 Å²	44.4	66%	0.66	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-16.5	-174.5	0	0	0	0	0	115.1	S94 M98	S94-G96 PolarHBondContact O-N 3.35Å; G96-M98 VanDerWaalsContact C-N 3.32Å
97	S	83.3	Confident	87.6	Confident	82 Å²	82	41.9 Å²	41.9	57%	0.573	26%	0.255	S	S	*	.	S	Bend	trans	-87.9	0.3	176.4	-54.1	0	0	0	0	113.7	M93 S94	M93-S97 WeakPolarHBondContact CE-O 3.47Å; S94-S97 WeakPolarHBondContact O-CB 3.34Å; S94-S97 PolarHBondContact O-N 2.87Å; S94-S97 VanDerWaalsContact O-N 3.1Å
98	M	83.8	Confident	87.6	Confident	23 Å²	23	48.4 Å²	48.4	11%	0.113	29%	0.29	C	S	.	.	S	Bend	trans	-120	154	-176.7	-65.4	173.1	-76.4	0	0	110.2	V46 V48 M93 G96 F102 Q103 F107	V46-M98 HydrophobicContact CG2-CE 3.72Å; V46-M98 HydrophobicContact CG2-SD 4.39Å; V48-M98 HydrophobicContact CG2-SD 4.34Å; M93-M98 HydrophobicContact CB-CE 3.86Å; M93-M98 HydrophobicContact CB-CG 4.02Å; M93-M98 HydrophobicContact CB-SD 3.59Å; M93-M98 VanDerWaalsContact CB-SD 3.59Å; M93-M98 HydrophobicContact CE-CG 3.55Å; M93-M98 HydrophobicContact CG-CG 4.36Å; M93-M98 HydrophobicContact CG-SD 4.18Å; G96-M98 VanDerWaalsContact C-N 3.32Å; M98-F102 HydrophobicContact CB-CD1 3.91Å; M98-F102 HydrophobicContact CG-CD1 3.91Å; M98-F102 HydrophobicContact CG-CE1 4.17Å; M98-F102 HydrophobicContact SD-CD1 3.5Å; M98-F102 WeakPolarHBondContact SD-CD1 3.11Å; M98-F102 HydrophobicContact SD-CE1 3.45Å; M98-F102 WeakPolarHBondContact SD-CE1 3.37Å; M98-Q103 HydrophobicContact CB-CB 4.1Å; M98-Q103 HydrophobicContact CE-CB 4.49Å; M98-Q103 HydrophobicContact CE-CG 4.26Å; M98-F107 HydrophobicContact CE-CE2 3.8Å
99	V	87.1	Confident	87.5	Confident	39 Å²	39	49.8 Å²	49.8	24%	0.236	30%	0.297	C	S	.	.			trans	-61.7	143.3	172.2	-63.8	0	0	0	0	110.4	A101 F102 Q103 T126 Y128	V99-A101 PolarHBondContact O-N 2.85Å; V99-F102 HydrophobicContact CG2-CB 3.35Å; V99-F102 HydrophobicContact CG2-CG 4.43Å; V99-F102 WeakPolarHBondContact O-CA 3.32Å; V99-F102 WeakPolarHBondContact O-CB 3.24Å; V99-F102 PolarHBondContact O-N 2.61Å; V99-Q103 PolarHBondContact O-N 3.42Å; V99-T126 HydrophobicContact CG2-CG2 3.73Å; V99-Y128 HydrophobicContact CG1-CD2 4.48Å; V99-Y128 HydrophobicContact CG1-CE2 3.72Å
100	G	88	Confident	87.4	Confident	44 Å²	44	51.5 Å²	51.5	45%	0.454	31%	0.31	S	S	.	.	H	α-helix	trans	-49.2	-51.6	-171.3	0	0	0	0	0	113.9	F102 Q103 D104	G100-F102 VanDerWaalsContact C-N 3.33Å; G100-F102 PolarHBondContact O-N 2.9Å; G100-Q103 WeakPolarHBondContact O-CB 3.42Å; G100-Q103 PolarHBondContact O-N 3.49Å; G100-D104 PolarHBondContact O-N 3.09Å
101	A	89.3	Confident	87.4	Confident	48 Å²	48	54.2 Å²	54.2	40%	0.397	32%	0.324	S	S	.	.	H	α-helix	trans	-61.7	-37.4	178.5	0	0	0	0	0	113.6	V99 A105 V124 T126	V99-A101 PolarHBondContact O-N 2.85Å; A101-A105 VanDerWaalsContact O-CB 3.32Å; A101-A105 WeakPolarHBondContact O-CB 3.16Å; A101-A105 PolarHBondContact O-N 3.38Å; A101-A105 VanDerWaalsContact O-N 3.16Å; A101-V124 HydrophobicContact CB-CG1 3.94Å; A101-T126 HydrophobicContact CB-CG2 4.41Å
102	F	90.8	Very high	87.3	Confident	9 Å²	9	53.8 Å²	53.8	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-68.4	-45.5	176.3	-175.9	-75.5	0	0	0	110.7	V48 H50 L90 M98 V99 G100 A105 A106 H131 I133	V48-F102 HydrophobicContact CB-CE1 4.36Å; V48-F102 HydrophobicContact CB-CZ 4.44Å; V48-F102 HydrophobicContact CG2-CE1 3.96Å; V48-F102 HydrophobicContact CG2-CZ 4.14Å; H50-F102 HydrophobicContact CB-CE2 3.66Å; H50-F102 HydrophobicContact CB-CZ 3.98Å; H50-F102 AromaticContact CG-CE2 3.88Å; H50-F102 AromaticContact ND1-CE2 3.3Å; H50-F102 VanDerWaalsContact ND1-CE2 3.3Å; H50-F102 WeakPolarHBondContact ND1-CE2 3.32Å; H50-F102 AromaticContact ND1-CZ 3.71Å; L90-F102 HydrophobicContact CD1-CZ 4.44Å; M98-F102 HydrophobicContact CB-CD1 3.91Å; M98-F102 HydrophobicContact CG-CD1 3.91Å; M98-F102 HydrophobicContact CG-CE1 4.17Å; M98-F102 HydrophobicContact SD-CD1 3.5Å; M98-F102 WeakPolarHBondContact SD-CD1 3.11Å; M98-F102 HydrophobicContact SD-CE1 3.45Å; M98-F102 WeakPolarHBondContact SD-CE1 3.37Å; V99-F102 HydrophobicContact CG2-CB 3.35Å; V99-F102 HydrophobicContact CG2-CG 4.43Å; V99-F102 WeakPolarHBondContact O-CA 3.32Å; V99-F102 WeakPolarHBondContact O-CB 3.24Å; V99-F102 PolarHBondContact O-N 2.61Å; G100-F102 VanDerWaalsContact C-N 3.33Å; G100-F102 PolarHBondContact O-N 2.9Å; F102-A105 PolarHBondContact O-N 3.5Å; F102-A106 HydrophobicContact CD1-CB 4.43Å; F102-A106 HydrophobicContact CE1-CB 4.31Å; F102-A106 VanDerWaalsContact O-CB 3.26Å; F102-A106 WeakPolarHBondContact O-CB 3.4Å; F102-A106 PolarHBondContact O-N 2.78Å; F102-H131 HydrophobicContact CD2-CB 4.24Å; F102-H131 HydrophobicContact CE2-CB 4.46Å; F102-I133 HydrophobicContact CB-CD1 4.15Å; F102-I133 HydrophobicContact CD1-CD1 4.09Å; F102-I133 HydrophobicContact CD2-CD1 3.32Å; F102-I133 HydrophobicContact CD2-CG1 3.79Å; F102-I133 HydrophobicContact CE1-CD1 4.29Å; F102-I133 HydrophobicContact CE1-CG2 4.16Å; F102-I133 HydrophobicContact CE2-CB 4.45Å; F102-I133 HydrophobicContact CE2-CD1 3.57Å; F102-I133 HydrophobicContact CE2-CG1 3.52Å; F102-I133 HydrophobicContact CE2-CG2 4.2Å; F102-I133 HydrophobicContact CG-CD1 3.6Å; F102-I133 HydrophobicContact CG-CG1 4.48Å; F102-I133 HydrophobicContact CZ-CD1 4.05Å; F102-I133 HydrophobicContact CZ-CG1 4.02Å; F102-I133 HydrophobicContact CZ-CG2 3.78Å
103	Q	89.4	Confident	86.9	Confident	25 Å²	25	51.8 Å²	51.8	12%	0.117	32%	0.319	C	S	.	.	H	α-helix	trans	-58.7	-52.8	177.2	-178.5	-176.1	-88.6	0	0	110.5	R95 M98 V99 G100 A105 A106 F107	R95-Q103 HydrophobicContact CG-CG 4.25Å; M98-Q103 HydrophobicContact CB-CB 4.1Å; M98-Q103 HydrophobicContact CE-CB 4.49Å; M98-Q103 HydrophobicContact CE-CG 4.26Å; V99-Q103 PolarHBondContact O-N 3.42Å; G100-Q103 WeakPolarHBondContact O-CB 3.42Å; G100-Q103 PolarHBondContact O-N 3.49Å; Q103-A105 VanDerWaalsContact C-N 3.27Å; Q103-A105 PolarHBondContact O-N 3.13Å; Q103-A106 PolarHBondContact O-N 2.81Å; Q103-A106 VanDerWaalsContact O-N 3.13Å; Q103-F107 HydrophobicContact CG-CD2 3.5Å; Q103-F107 VanDerWaalsContact CG-CD2 3.5Å; Q103-F107 HydrophobicContact CG-CE2 3.67Å; Q103-F107 VanDerWaalsContact O-CD2 3.28Å; Q103-F107 WeakPolarHBondContact O-CD2 3.26Å; Q103-F107 PolarHBondContact O-N 2.77Å
104	D	88.8	Confident	86.3	Confident	83 Å²	83	52.5 Å²	52.5	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-40.6	-175.6	-64.9	-24.3	0	0	0	110.9	G100 N108	G100-D104 PolarHBondContact O-N 3.09Å; D104-N108 WeakPolarHBondContact O-CB 3.25Å; D104-N108 PolarHBondContact O-N 3.02Å; D104-N108 PolarHBondContact O-ND2 3.42Å
105	A	90.6	Very high	86	Confident	18 Å²	18	57.8 Å²	57.8	15%	0.149	34%	0.342	C	S	.	.	H	α-helix	trans	-66.2	-43.5	173.8	0	0	0	0	0	113.2	A101 F102 Q103 F107 N108 L109 T120 V124 I133	A101-A105 VanDerWaalsContact O-CB 3.32Å; A101-A105 WeakPolarHBondContact O-CB 3.16Å; A101-A105 PolarHBondContact O-N 3.38Å; A101-A105 VanDerWaalsContact O-N 3.16Å; F102-A105 PolarHBondContact O-N 3.5Å; Q103-A105 VanDerWaalsContact C-N 3.27Å; Q103-A105 PolarHBondContact O-N 3.13Å; A105-F107 PolarHBondContact O-N 2.84Å; A105-N108 PolarHBondContact O-N 2.76Å; A105-L109 WeakPolarHBondContact O-CG 3.49Å; A105-L109 PolarHBondContact O-N 3.11Å; A105-L109 VanDerWaalsContact O-N 3.09Å; A105-T120 HydrophobicContact CB-CG2 3.9Å; A105-V124 HydrophobicContact CB-CG1 4.45Å; A105-V124 HydrophobicContact CB-CG2 3.48Å; A105-V124 VanDerWaalsContact CB-CG2 3.48Å; A105-I133 HydrophobicContact CB-CD1 3.84Å
106	A	89.6	Confident	86.1	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.008	35%	0.352	C	S	.	.	H	α-helix	trans	-63.1	-41.1	176.5	0	0	0	0	0	112.3	V48 F102 Q103 L109 I133 V135	V48-A106 HydrophobicContact CG1-CB 3.91Å; F102-A106 HydrophobicContact CD1-CB 4.43Å; F102-A106 HydrophobicContact CE1-CB 4.31Å; F102-A106 VanDerWaalsContact O-CB 3.26Å; F102-A106 WeakPolarHBondContact O-CB 3.4Å; F102-A106 PolarHBondContact O-N 2.78Å; Q103-A106 PolarHBondContact O-N 2.81Å; Q103-A106 VanDerWaalsContact O-N 3.13Å; A106-L109 PolarHBondContact O-N 2.8Å; A106-I133 HydrophobicContact CB-CG2 4.08Å; A106-V135 WeakPolarHBondContact O-CG2 3.24Å
107	F	87.2	Confident	86.2	Confident	19 Å²	19	57.1 Å²	57.1	8%	0.083	33%	0.333	C	S	.	.	H	α-helix	trans	-77	-23.9	179.7	-83.2	-87.9	0	0	0	113.3	V46 R95 M98 Q103 A105 R138	V46-F107 HydrophobicContact CG1-CD1 4.21Å; V46-F107 HydrophobicContact CG1-CE1 3.89Å; V46-F107 HydrophobicContact CG1-CE2 4.42Å; V46-F107 HydrophobicContact CG1-CZ 4Å; V46-F107 HydrophobicContact CG2-CE2 3.98Å; V46-F107 HydrophobicContact CG2-CZ 4.12Å; R95-F107 HydrophobicContact CB-CE2 4.02Å; R95-F107 HydrophobicContact CB-CZ 3.71Å; R95-F107 HydrophobicContact CG-CE2 3.8Å; R95-F107 HydrophobicContact CG-CZ 3.83Å; M98-F107 HydrophobicContact CE-CE2 3.8Å; Q103-F107 HydrophobicContact CG-CD2 3.5Å; Q103-F107 VanDerWaalsContact CG-CD2 3.5Å; Q103-F107 HydrophobicContact CG-CE2 3.67Å; Q103-F107 VanDerWaalsContact O-CD2 3.28Å; Q103-F107 WeakPolarHBondContact O-CD2 3.26Å; Q103-F107 PolarHBondContact O-N 2.77Å; A105-F107 PolarHBondContact O-N 2.84Å; F107-R138 PolarHBondContact O-NH1 3.02Å
108	N	89	Confident	86.5	Confident	137 Å²	137	58.9 Å²	58.9	73%	0.733	33%	0.331	S	S	*	.	H	α-helix	trans	-79.8	-21.7	173.7	-77.9	-18.4	0	0	0	113.2	D104 A105	D104-N108 WeakPolarHBondContact O-CB 3.25Å; D104-N108 PolarHBondContact O-N 3.02Å; D104-N108 PolarHBondContact O-ND2 3.42Å; A105-N108 PolarHBondContact O-N 2.76Å
109	L	87.2	Confident	86.8	Confident	29 Å²	29	60 Å²	60	15%	0.152	33%	0.334	C	S	.	.	S	Bend	trans	-76.5	137.1	176.3	-78.6	174.9	0	0	0	111.6	A105 A106 T120 I133 V135	A105-L109 WeakPolarHBondContact O-CG 3.49Å; A105-L109 PolarHBondContact O-N 3.11Å; A105-L109 VanDerWaalsContact O-N 3.09Å; A106-L109 PolarHBondContact O-N 2.8Å; L109-T120 HydrophobicContact CD1-CG2 3.65Å; L109-T120 HydrophobicContact CG-CG2 4.23Å; L109-I133 HydrophobicContact CD1-CB 4.33Å; L109-I133 WeakPolarHBondContact CD1-O 3.46Å; L109-V135 HydrophobicContact CB-CG2 3.78Å; L109-V135 HydrophobicContact CD1-CG2 4.39Å
110	P	87.5	Confident	86.9	Confident	76 Å²	76	58.7 Å²	58.7	49%	0.494	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-69.1	151.9	169.6	30.8	-34.8	0	0	0	110.4	S112 K118	P110-S112 PolarHBondContact O-N 2.69Å; P110-K118 HydrophobicContact CG-CB 4.06Å; P110-K118 HydrophobicContact CG-CG 4Å
111	I	88.4	Confident	86.9	Confident	101 Å²	101	60.8 Å²	60.8	52%	0.518	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-59.6	133.3	170.1	-62.2	159.8	0	0	0	108.5	V135 E136 R138	I111-V135 HydrophobicContact CG1-CG1 4.22Å; I111-E136 WeakPolarHBondContact CG2-O 3.39Å; I111-R138 HydrophobicContact CD1-CB 3.87Å; I111-R138 HydrophobicContact CG1-CB 4.03Å
112	S	86.9	Confident	86.8	Confident	10 Å²	10	63.3 Å²	63.3	7%	0.07	34%	0.339	C	S	.	.			trans	-138.2	163	-178.1	64.6	0	0	0	0	112	P110 N116 K118 V135	P110-S112 PolarHBondContact O-N 2.69Å; S112-N116 WeakPolarHBondContact CB-O 3.31Å; S112-K118 VanDerWaalsContact CB-N 3.27Å; S112-K118 PolarHBondContact OG-N 3.21Å; S112-K118 PolarHBondContact OG-O 3.45Å; S112-V135 PolarHBondContact N-O 3.32Å; S112-V135 PolarHBondContact OG-O 2.72Å; S112-V135 VanDerWaalsContact OG-O 3.14Å
113	T	81.7	Confident	86.8	Confident	74 Å²	74	63.9 Å²	63.9	45%	0.454	34%	0.344	S	S	.	.			trans	-106.3	165.5	175.5	64.4	0	0	0	0	110.3	E115 N116 P117	T113-E115 PolarHBondContact O-N 3.41Å; T113-E115 VanDerWaalsContact O-N 3.17Å; T113-N116 CarbonylContact O-C 3.55Å; T113-N116 PolarHBondContact O-N 3.02Å; T113-N116 VanDerWaalsContact O-N 3.16Å; T113-N116 PolarHBondContact OG1-N 3.14Å; T113-P117 VanDerWaalsContact O-CA 3.3Å; T113-P117 WeakPolarHBondContact O-CA 3.45Å; T113-P117 VanDerWaalsContact O-N 3.13Å
114	L	76.2	Confident	87	Confident	54 Å²	54	63.7 Å²	63.7	28%	0.283	34%	0.344	S	S	.	.	S	Bend	trans	-61.1	-21.4	174.6	-69.9	171.9	0	0	0	113.2	F72 M134	F72-L114 HydrophobicContact CB-CD2 4.22Å; L114-M134 HydrophobicContact CD2-CE 4.33Å; L114-M134 HydrophobicContact CD2-SD 4.13Å
115	E	78.4	Confident	87.1	Confident	168 Å²	168	66.7 Å²	66.7	79%	0.785	35%	0.354	S	S	*	.	S	Bend	trans	-78.4	-35.7	176.7	-63.4	175.5	116.5	0	0	112.2	T113 P117	T113-E115 PolarHBondContact O-N 3.41Å; T113-E115 VanDerWaalsContact O-N 3.17Å; E115-P117 VanDerWaalsContact C-CD 3.44Å; E115-P117 WeakPolarHBondContact O-CD 3.3Å
116	N	83	Confident	87.2	Confident	117 Å²	117	66.9 Å²	66.9	63%	0.626	35%	0.353	S	S	*	.	S	Bend	trans	-125.7	65.5	177.9	-74.6	-77.1	0	0	0	110	S112 T113 K118	S112-N116 WeakPolarHBondContact CB-O 3.31Å; T113-N116 CarbonylContact O-C 3.55Å; T113-N116 PolarHBondContact O-N 3.02Å; T113-N116 VanDerWaalsContact O-N 3.16Å; T113-N116 PolarHBondContact OG1-N 3.14Å; N116-K118 PolarHBondContact O-N 3.23Å
117	P	84.8	Confident	87.1	Confident	42 Å²	42	74.6 Å²	74.6	27%	0.273	39%	0.389	S	S	.	.			trans	-67.3	120.1	-169.5	30.2	-37.5	0	0	0	110.3	T113 E115 Y119 M134	T113-P117 VanDerWaalsContact O-CA 3.3Å; T113-P117 WeakPolarHBondContact O-CA 3.45Å; T113-P117 VanDerWaalsContact O-N 3.13Å; E115-P117 VanDerWaalsContact C-CD 3.44Å; E115-P117 WeakPolarHBondContact O-CD 3.3Å; P117-Y119 HydrophobicContact CB-CD1 4.06Å; P117-Y119 HydrophobicContact CB-CE1 4.33Å; P117-Y119 HydrophobicContact CG-CD1 4.41Å; P117-Y119 HydrophobicContact CG-CE1 4.18Å; P117-M134 HydrophobicContact CB-CE 3.16Å
118	K	88	Confident	87.2	Confident	119 Å²	119	79.9 Å²	79.9	52%	0.517	41%	0.409	S	S	.	.			trans	-99.2	111.6	169.1	-62.1	-64.2	-174.9	-175.1	0	107.7	P110 S112 N116	P110-K118 HydrophobicContact CG-CB 4.06Å; P110-K118 HydrophobicContact CG-CG 4Å; S112-K118 VanDerWaalsContact CB-N 3.27Å; S112-K118 PolarHBondContact OG-N 3.21Å; S112-K118 PolarHBondContact OG-O 3.45Å; N116-K118 PolarHBondContact O-N 3.23Å
119	Y	90.8	Very high	87.4	Confident	47 Å²	47	74 Å²	74	18%	0.184	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-126.1	166.2	179.2	52	-100.8	0	0	0	111.8	L63 L66 P117 D121 I132 I133	L63-Y119 HydrophobicContact CD1-CD2 3.86Å; L63-Y119 HydrophobicContact CD1-CE2 3.46Å; L63-Y119 VanDerWaalsContact CD1-CE2 3.46Å; L66-Y119 HydrophobicContact CB-CE1 4.03Å; L66-Y119 HydrophobicContact CD1-CD1 4.28Å; L66-Y119 HydrophobicContact CD1-CE1 4.29Å; L66-Y119 HydrophobicContact CD1-CG 4.4Å; P117-Y119 HydrophobicContact CB-CD1 4.06Å; P117-Y119 HydrophobicContact CB-CE1 4.33Å; P117-Y119 HydrophobicContact CG-CD1 4.41Å; P117-Y119 HydrophobicContact CG-CE1 4.18Å; Y119-D121 HydrophobicContact CE2-CB 4.4Å; Y119-D121 PolarHBondContact O-N 2.99Å; Y119-I132 HydrophobicContact CD2-CG2 4.07Å; Y119-I132 HydrophobicContact CG-CG2 4.08Å; Y119-I133 CarbonylContact C-O 3.36Å; Y119-I133 WeakPolarHBondContact CA-O 3.23Å; Y119-I133 VanDerWaalsContact CB-O 3.29Å; Y119-I133 WeakPolarHBondContact CB-O 3.21Å
120	T	89.5	Confident	87.7	Confident	12 Å²	12	74.7 Å²	74.7	7%	0.074	38%	0.381	C	S	.	.			trans	-69.2	114.6	175.8	55.5	0	0	0	0	110.7	A105 L109 P122 V124 H131 I132 I133	A105-T120 HydrophobicContact CB-CG2 3.9Å; L109-T120 HydrophobicContact CD1-CG2 3.65Å; L109-T120 HydrophobicContact CG-CG2 4.23Å; T120-P122 CarbonylContact C-O 3.14Å; T120-P122 CarbonylContact O-C 3.48Å; T120-V124 HydrophobicContact CG2-CG2 3.67Å; T120-H131 PolarHBondContact OG1-O 3.47Å; T120-I132 WeakPolarHBondContact OG1-CA 3.47Å; T120-I133 HydrophobicContact CG2-CB 3.91Å; T120-I133 HydrophobicContact CG2-CD1 4.4Å; T120-I133 HydrophobicContact CG2-CG1 4.28Å; T120-I133 PolarHBondContact N-O 3.32Å; T120-I133 VanDerWaalsContact N-O 3.08Å; T120-I133 PolarHBondContact OG1-N 3.07Å
121	D	87.6	Confident	87.9	Confident	87 Å²	87	71.3 Å²	71.3	47%	0.465	36%	0.359	S	S	.	.	S	Bend	trans	-125.9	107.9	168.4	-174.1	-70.8	0	0	0	106.6	L63 K67 Y119	L63-D121 WeakPolarHBondContact CD2-OD2 3.4Å; K67-D121 WeakPolarHBondContact CE-OD2 3.23Å; K67-D121 IonicContact NZ-OD2 3.21Å; K67-D121 PolarHBondContact NZ-OD2 3.16Å; Y119-D121 HydrophobicContact CE2-CB 4.4Å; Y119-D121 PolarHBondContact O-N 2.99Å
122	P	87.8	Confident	88.2	Confident	101 Å²	101	66.5 Å²	66.5	66%	0.656	33%	0.334	S	S	*	.	S	Bend	cis	-78.5	169.6	7.8	33.2	-37.1	0	0	0	115.1	T120	T120-P122 CarbonylContact C-O 3.14Å; T120-P122 CarbonylContact O-C 3.48Å
123	P	90.7	Very high	88.4	Confident	21 Å²	21	66 Å²	66	14%	0.136	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-59.9	143.7	174.5	-22	32.8	0	0	0	113.3	C59 L63 Y130 H131 I132	C59-P123 VanDerWaalsContact SG-CB 3.55Å; L63-P123 HydrophobicContact CD2-CG 4.43Å; P123-Y130 HydrophobicContact CB-CD1 4.37Å; P123-H131 CarbonylContact C-O 3.59Å; P123-I132 HydrophobicContact CB-CG1 4.2Å; P123-I132 HydrophobicContact CG-CG1 4.18Å
124	V	92.6	Very high	88.9	Confident	21 Å²	21	62.5 Å²	62.5	13%	0.127	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	119	-179.4	-178.4	0	0	0	0	110.1	A101 A105 T120 T126 Y130 H131 I133	A101-V124 HydrophobicContact CB-CG1 3.94Å; A105-V124 HydrophobicContact CB-CG1 4.45Å; A105-V124 HydrophobicContact CB-CG2 3.48Å; A105-V124 VanDerWaalsContact CB-CG2 3.48Å; T120-V124 HydrophobicContact CG2-CG2 3.67Å; V124-T126 HydrophobicContact CG1-CG2 4.17Å; V124-Y130 CarbonylContact O-C 3.5Å; V124-Y130 WeakPolarHBondContact O-CA 3.48Å; V124-H131 HydrophobicContact CB-CB 4.39Å; V124-H131 PolarHBondContact N-O 3.28Å; V124-H131 PolarHBondContact O-N 2.95Å; V124-I133 HydrophobicContact CB-CD1 4.27Å; V124-I133 HydrophobicContact CG2-CD1 3.92Å; V124-I133 HydrophobicContact CG2-CG1 4.48Å
125	K	91.7	Very high	89.6	Confident	147 Å²	147	60 Å²	60	64%	0.639	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	128.3	174.3	-172.3	176.2	179.8	177.2	0	110.7	G129 Y130	K125-G129 CarbonylContact C-O 3.36Å; K125-G129 WeakPolarHBondContact CA-O 3.5Å; K125-Y130 HydrophobicContact CB-CD1 4.32Å; K125-Y130 HydrophobicContact CB-CE1 4.15Å; K125-Y130 HydrophobicContact CD-CE1 4.27Å; K125-Y130 HydrophobicContact CG-CE1 4.22Å
126	T	91.9	Very high	90.2	Very high	21 Å²	21	54.1 Å²	54.1	13%	0.129	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	-177.1	171.6	86.6	0	0	0	0	110.2	V99 A101 V124 Y128 G129 H131	V99-T126 HydrophobicContact CG2-CG2 3.73Å; A101-T126 HydrophobicContact CB-CG2 4.41Å; V124-T126 HydrophobicContact CG1-CG2 4.17Å; T126-Y128 PolarHBondContact O-N 2.83Å; T126-Y128 PolarHBondContact OG1-N 3.21Å; T126-Y128 VanDerWaalsContact OG1-N 3.07Å; T126-G129 PolarHBondContact N-O 2.85Å; T126-G129 PolarHBondContact O-N 2.86Å; T126-H131 WeakPolarHBondContact CG2-CD2 3.43Å; T126-H131 PolarHBondContact OG1-CD2 3.28Å; T126-H131 PolarHBondContact OG1-NE2 2.79Å
127	Q	89.3	Confident	90.4	Very high	163 Å²	163	49.1 Å²	49.1	76%	0.762	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-22	173.1	68.1	-173.6	-79.5	0	0	113.6
128	Y	88.4	Confident	90.5	Very high	131 Å²	131	51.9 Å²	51.9	51%	0.514	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-12.7	179.9	-54.7	-68	0	0	0	113.3	V99 T126	V99-Y128 HydrophobicContact CG1-CD2 4.48Å; V99-Y128 HydrophobicContact CG1-CE2 3.72Å; T126-Y128 PolarHBondContact O-N 2.83Å; T126-Y128 PolarHBondContact OG1-N 3.21Å; T126-Y128 VanDerWaalsContact OG1-N 3.07Å
129	G	92.4	Very high	90.2	Very high	12 Å²	12	54.7 Å²	54.7	12%	0.124	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.3	-142.6	-174.4	0	0	0	0	0	112.3	K125 T126	K125-G129 CarbonylContact C-O 3.36Å; K125-G129 WeakPolarHBondContact CA-O 3.5Å; T126-G129 PolarHBondContact N-O 2.85Å; T126-G129 PolarHBondContact O-N 2.86Å
130	Y	94.4	Very high	90.2	Very high	44 Å²	44	55.1 Å²	55.1	17%	0.173	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.4	-178.5	-65.2	-91.9	0	0	0	110.3	L52 C53 Q56 C59 P123 V124 K125	L52-Y130 WeakPolarHBondContact CA-O 3.2Å; C53-Y130 PolarHBondContact N-O 3.34Å; C53-Y130 PolarHBondContact O-N 3.22Å; Q56-Y130 HydrophobicContact CB-CD2 3.92Å; Q56-Y130 HydrophobicContact CB-CE1 4.28Å; Q56-Y130 HydrophobicContact CB-CE2 3.5Å; Q56-Y130 VanDerWaalsContact CB-CE2 3.5Å; Q56-Y130 HydrophobicContact CB-CG 4.47Å; Q56-Y130 HydrophobicContact CG-CD1 4.33Å; Q56-Y130 HydrophobicContact CG-CD2 4.46Å; Q56-Y130 HydrophobicContact CG-CE1 3.96Å; Q56-Y130 HydrophobicContact CG-CE2 4.12Å; Q56-Y130 PolarHBondContact OE1-OH 3.01Å; C59-Y130 VanDerWaalsContact SG-CB 3.58Å; P123-Y130 HydrophobicContact CB-CD1 4.37Å; V124-Y130 CarbonylContact O-C 3.5Å; V124-Y130 WeakPolarHBondContact O-CA 3.48Å; K125-Y130 HydrophobicContact CB-CD1 4.32Å; K125-Y130 HydrophobicContact CB-CE1 4.15Å; K125-Y130 HydrophobicContact CD-CE1 4.27Å; K125-Y130 HydrophobicContact CG-CE1 4.22Å
131	H	92.4	Very high	90.2	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.028	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.8	-177.9	-58.4	-104.3	0	0	0	110.4	I51 L52 F102 T120 P123 V124 T126 I133	I51-H131 CarbonylContact O-C 3.57Å; I51-H131 VanDerWaalsContact O-CA 3.25Å; I51-H131 WeakPolarHBondContact O-CA 3.41Å; L52-H131 WeakPolarHBondContact CD1-CE1 3.28Å; L52-H131 WeakPolarHBondContact CD1-NE2 3.39Å; F102-H131 HydrophobicContact CD2-CB 4.24Å; F102-H131 HydrophobicContact CE2-CB 4.46Å; T120-H131 PolarHBondContact OG1-O 3.47Å; P123-H131 CarbonylContact C-O 3.59Å; V124-H131 HydrophobicContact CB-CB 4.39Å; V124-H131 PolarHBondContact N-O 3.28Å; V124-H131 PolarHBondContact O-N 2.95Å; T126-H131 WeakPolarHBondContact CG2-CD2 3.43Å; T126-H131 PolarHBondContact OG1-CD2 3.28Å; T126-H131 PolarHBondContact OG1-NE2 2.79Å; H131-I133 HydrophobicContact CB-CG1 4.11Å
132	I	93.4	Very high	90.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.2	162.3	-56.2	171.1	0	0	0	106.4	H50 I51 A62 L63 L66 F72 Y119 T120 P123	H50-I132 CarbonylContact C-O 3.57Å; H50-I132 WeakPolarHBondContact CA-O 3.43Å; H50-I132 WeakPolarHBondContact CB-O 3.35Å; I51-I132 HydrophobicContact CB-CB 4.19Å; I51-I132 HydrophobicContact CD1-CB 4.38Å; I51-I132 HydrophobicContact CD1-CD1 4.32Å; I51-I132 PolarHBondContact N-O 2.83Å; I51-I132 PolarHBondContact O-N 2.81Å; A62-I132 HydrophobicContact CB-CD1 4.16Å; L63-I132 HydrophobicContact CB-CD1 3.97Å; L63-I132 HydrophobicContact CD1-CD1 4.1Å; L66-I132 HydrophobicContact CD1-CD1 4.15Å; L66-I132 HydrophobicContact CD1-CG2 3.98Å; F72-I132 HydrophobicContact CE2-CG2 3.87Å; F72-I132 HydrophobicContact CZ-CG2 4.33Å; Y119-I132 HydrophobicContact CD2-CG2 4.07Å; Y119-I132 HydrophobicContact CG-CG2 4.08Å; T120-I132 WeakPolarHBondContact OG1-CA 3.47Å; P123-I132 HydrophobicContact CB-CG1 4.2Å; P123-I132 HydrophobicContact CG-CG1 4.18Å
133	I	92.4	Very high	90.5	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	139.4	-174	-48.2	171.9	0	0	0	108.9	R49 F102 A105 A106 L109 Y119 T120 V124 H131	R49-I133 CarbonylContact O-C 3.6Å; F102-I133 HydrophobicContact CB-CD1 4.15Å; F102-I133 HydrophobicContact CD1-CD1 4.09Å; F102-I133 HydrophobicContact CD2-CD1 3.32Å; F102-I133 HydrophobicContact CD2-CG1 3.79Å; F102-I133 HydrophobicContact CE1-CD1 4.29Å; F102-I133 HydrophobicContact CE1-CG2 4.16Å; F102-I133 HydrophobicContact CE2-CB 4.45Å; F102-I133 HydrophobicContact CE2-CD1 3.57Å; F102-I133 HydrophobicContact CE2-CG1 3.52Å; F102-I133 HydrophobicContact CE2-CG2 4.2Å; F102-I133 HydrophobicContact CG-CD1 3.6Å; F102-I133 HydrophobicContact CG-CG1 4.48Å; F102-I133 HydrophobicContact CZ-CD1 4.05Å; F102-I133 HydrophobicContact CZ-CG1 4.02Å; F102-I133 HydrophobicContact CZ-CG2 3.78Å; A105-I133 HydrophobicContact CB-CD1 3.84Å; A106-I133 HydrophobicContact CB-CG2 4.08Å; L109-I133 HydrophobicContact CD1-CB 4.33Å; L109-I133 WeakPolarHBondContact CD1-O 3.46Å; Y119-I133 CarbonylContact C-O 3.36Å; Y119-I133 WeakPolarHBondContact CA-O 3.23Å; Y119-I133 VanDerWaalsContact CB-O 3.29Å; Y119-I133 WeakPolarHBondContact CB-O 3.21Å; T120-I133 HydrophobicContact CG2-CB 3.91Å; T120-I133 HydrophobicContact CG2-CD1 4.4Å; T120-I133 HydrophobicContact CG2-CG1 4.28Å; T120-I133 PolarHBondContact N-O 3.32Å; T120-I133 VanDerWaalsContact N-O 3.08Å; T120-I133 PolarHBondContact OG1-N 3.07Å; V124-I133 HydrophobicContact CB-CD1 4.27Å; V124-I133 HydrophobicContact CG2-CD1 3.92Å; V124-I133 HydrophobicContact CG2-CG1 4.48Å; H131-I133 HydrophobicContact CB-CG1 4.11Å
134	M	91.1	Very high	90.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.8	173.2	150.7	-175.6	-80.5	0	0	108.6	V48 R49 F72 L114 P117 E136	V48-M134 WeakPolarHBondContact CA-O 3.5Å; R49-M134 HydrophobicContact CB-CB 4.25Å; R49-M134 HydrophobicContact CB-CG 4.18Å; R49-M134 HydrophobicContact CB-SD 4.18Å; R49-M134 PolarHBondContact N-O 2.9Å; R49-M134 PolarHBondContact O-N 3.07Å; F72-M134 HydrophobicContact CB-CE 3.92Å; F72-M134 HydrophobicContact CB-SD 4.13Å; F72-M134 HydrophobicContact CD1-SD 4.37Å; F72-M134 HydrophobicContact CD2-CB 4.11Å; F72-M134 HydrophobicContact CD2-CE 3.91Å; F72-M134 HydrophobicContact CD2-SD 4.18Å; F72-M134 HydrophobicContact CE2-CB 3.76Å; F72-M134 HydrophobicContact CG-CE 4.04Å; F72-M134 HydrophobicContact CG-SD 3.98Å; F72-M134 HydrophobicContact CZ-CB 3.99Å; L114-M134 HydrophobicContact CD2-CE 4.33Å; L114-M134 HydrophobicContact CD2-SD 4.13Å; P117-M134 HydrophobicContact CB-CE 3.16Å; M134-E136 HydrophobicContact CG-CG 4.3Å; M134-E136 HydrophobicContact SD-CG 4.2Å
135	V	91.7	Very high	90.4	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.006	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.2	174.4	-176	0	0	0	0	109.3	K47 V48 A106 L109 I111 S112 G137	K47-V135 WeakPolarHBondContact O-CA 3.45Å; V48-V135 HydrophobicContact CG1-CG2 4.32Å; A106-V135 WeakPolarHBondContact O-CG2 3.24Å; L109-V135 HydrophobicContact CB-CG2 3.78Å; L109-V135 HydrophobicContact CD1-CG2 4.39Å; I111-V135 HydrophobicContact CG1-CG1 4.22Å; S112-V135 PolarHBondContact N-O 3.32Å; S112-V135 PolarHBondContact OG-O 2.72Å; S112-V135 VanDerWaalsContact OG-O 3.14Å; V135-G137 WeakPolarHBondContact CG1-O 3.45Å
136	E	90.2	Very high	90.3	Very high	45 Å²	45	50.9 Å²	50.9	21%	0.21	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-18.3	176.6	-67.6	-175.4	157.1	0	0	112.3	K47 R49 I111 M134	K47-E136 HydrophobicContact CB-CB 4.44Å; K47-E136 HydrophobicContact CD-CB 4.11Å; K47-E136 WeakPolarHBondContact CE-OE2 3.46Å; K47-E136 HydrophobicContact CG-CB 4.37Å; K47-E136 IonicContact NZ-OE2 3.36Å; K47-E136 PolarHBondContact NZ-OE2 3.1Å; K47-E136 PolarHBondContact O-N 3.23Å; R49-E136 IonicContact CZ-OE1 2.78Å; R49-E136 IonicContact NE-OE1 3.66Å; R49-E136 PolarHBondContact NE-OE1 2.89Å; R49-E136 VanDerWaalsContact NE-OE1 3.08Å; R49-E136 IonicContact NH2-OE1 3.76Å; R49-E136 PolarHBondContact NH2-OE1 3.32Å; R49-E136 IonicContact NH2-OE2 2.73Å; I111-E136 WeakPolarHBondContact CG2-O 3.39Å; M134-E136 HydrophobicContact CG-CG 4.3Å; M134-E136 HydrophobicContact SD-CG 4.2Å
137	G	88	Confident	90.2	Very high	11 Å²	11	53.2 Å²	53.2	11%	0.113	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	161	179.9	0	0	0	0	0	113	V46 K47 V135	V46-G137 CarbonylContact C-O 3.56Å; V46-G137 WeakPolarHBondContact CA-O 3.24Å; K47-G137 PolarHBondContact N-O 3.37Å; V135-G137 WeakPolarHBondContact CG1-O 3.45Å
138	R	85.2	Confident	90.2	Very high	101 Å²	101	44.1 Å²	44.1	38%	0.381	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	137.8	177.1	-177.6	169.8	174.4	-171.9	-7.3	109.5	L42 A43 A45 V46 F107 I111	L42-R138 PolarHBondContact O-NH2 3.48Å; A43-R138 HydrophobicContact CB-CG 3.49Å; A43-R138 VanDerWaalsContact CB-CG 3.49Å; A43-R138 VanDerWaalsContact CB-NE 3.25Å; A45-R138 CarbonylContact O-C 3.53Å; A45-R138 WeakPolarHBondContact O-CA 3.48Å; V46-R138 HydrophobicContact CG1-CB 3.98Å; V46-R138 HydrophobicContact CG1-CG 3.66Å; F107-R138 PolarHBondContact O-NH1 3.02Å; I111-R138 HydrophobicContact CD1-CB 3.87Å; I111-R138 HydrophobicContact CG1-CB 4.03Å
139	R	83.2	Confident	90.4	Very high	178 Å²	178	36.2 Å²	36.2	67%	0.672	16%	0.155	S	C	*	.			trans	-142.5	0	-178.6	73.4	-177.3	179.6	174.3	-1.5	111.7	A43 N44 A45 W92	A43-R139 CarbonylContact C-O 3.53Å; A43-R139 VanDerWaalsContact C-O 3.22Å; A43-R139 VanDerWaalsContact CA-O 3.24Å; A43-R139 WeakPolarHBondContact CA-O 3.33Å; A43-R139 WeakPolarHBondContact CA-OXT 3.48Å; A43-R139 WeakPolarHBondContact CB-O 3.44Å; N44-R139 PolarHBondContact N-O 2.94Å; A45-R139 HydrophobicContact CB-CG 3.91Å; A45-R139 PolarHBondContact N-O 3.37Å; A45-R139 PolarHBondContact O-N 2.78Å; A45-R139 VanDerWaalsContact O-O 3.07Å; W92-R139 HydrophobicContact CE3-CG 3.8Å; W92-R139 HydrophobicContact CH2-CB 4.16Å; W92-R139 HydrophobicContact CH2-CG 4.13Å; W92-R139 HydrophobicContact CZ3-CB 3.8Å; W92-R139 HydrophobicContact CZ3-CG 3.43Å; W92-R139 VanDerWaalsContact CZ3-CG 3.43Å

Retrieved 139 of 139 residues in 495.7 ms (Link to these results)

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