RANG_BOVIN Loading...

Ran-specific GTPase-activating protein

Plays a role in RAN-dependent nucleocytoplasmic transport. Alleviates the TNPO1-dependent inhibition of RAN GTPase activity and mediates the dissociation of RAN from proteins involved in transport into the nucleus (By similarity). Induces a conformation change in the complex formed by XPO1 and RAN that triggers the release of the nuclear export signal of cargo proteins (By similarity). Promotes the disassembly of the complex formed by RAN and importin beta. Promotes dissociation of RAN from a complex with KPNA2 and CSE1L (By similarity). Required for normal mitotic spindle assembly and normal progress through mitosis via its effect on RAN. Does not increase the RAN GTPase activity by itself, but increases GTP hydrolysis mediated by RANGAP1. Inhibits RCC1-dependent exchange of RAN-bound GDP by GTP (By similarity).

AlphaFold DB , UniProt , Accession Q3T0M7, Species BOVIN (Bos taurus, Bovine), Gene RANBP1, Length 206 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.5	Very low	46.2	Very low	245 Å²	245	146.1 Å²	146.1	100%	1.207	81%	0.808	S	S	*	*				0	126.1	0	-89.5	-177.5	172.8	0	0	108
2	A	46	Very low	45.9	Very low	97 Å²	97	143.6 Å²	143.6	80%	0.802	79%	0.792	S	S	*	*			trans	50.4	104.5	158.8	0	0	0	0	0	118.6
3	A	49.8	Very low	45.1	Very low	106 Å²	106	141 Å²	141	88%	0.876	78%	0.783	S	S	*	*				86.5	133.2	78.4	0	0	0	0	0	111.7
4	A	51	Low	45	Very low	86 Å²	86	137.7 Å²	137.7	71%	0.711	78%	0.775	S	S	*	*			cis	-161	135.5	8.9	0	0	0	0	0	107.5
5	K	47	Very low	44.9	Very low	183 Å²	183	137.7 Å²	137.7	80%	0.796	78%	0.779	S	S	*	*				51.8	141.5	91.8	-76.6	-170.8	160.6	-158.4	0	115
6	D	49.8	Very low	45	Very low	116 Å²	116	139.3 Å²	139.3	62%	0.62	78%	0.778	S	S	*	*			cis	-168.8	119.7	-1	-104.3	-32.2	0	0	0	103.3
7	T	44.4	Very low	44.9	Very low	123 Å²	123	140.8 Å²	140.8	76%	0.755	78%	0.784	S	S	*	*				41.2	116.5	113.1	36.5	0	0	0	0	118.7
8	H	43.6	Very low	45.1	Very low	163 Å²	163	137.3 Å²	137.3	76%	0.755	78%	0.776	S	S	*	*			trans	-36.1	133.4	148.2	-177.2	-17.3	0	0	0	113
9	E	46.4	Very low	45.6	Very low	181 Å²	181	139.5 Å²	139.5	85%	0.846	79%	0.786	S	S	*	*			trans	-165.3	142.3	155.9	-111.7	168	-167.4	0	0	111
10	D	42	Very low	46.1	Very low	138 Å²	138	141.1 Å²	141.1	74%	0.738	79%	0.787	S	S	*	*			trans	-63.7	148.6	-176	-55.6	-77.5	0	0	0	113.9
11	H	44.6	Very low	46.9	Very low	169 Å²	169	139.4 Å²	139.4	78%	0.782	79%	0.785	S	S	*	*			trans	-162.5	98.5	151.7	-149.2	-81.8	0	0	0	108.4
12	D	42.5	Very low	48.2	Very low	116 Å²	116	135.9 Å²	135.9	62%	0.62	77%	0.771	S	S	*	*				69.9	112.8	80.2	-155.4	8.2	0	0	0	112.7
13	T	35.5	Very low	50.1	Low	110 Å²	110	139.4 Å²	139.4	68%	0.675	77%	0.77	S	S	*	*			trans	33	114.3	154.6	46.1	0	0	0	0	120.4
14	S	44.7	Very low	52	Low	95 Å²	95	140.8 Å²	140.8	66%	0.664	76%	0.763	S	S	*	*			trans	-153.4	105.8	131	43.2	0	0	0	0	110.8	E16	S14-E16 PolarHBondContact O-N 3.45Å
15	T	42.3	Very low	53.9	Low	137 Å²	137	139.6 Å²	139.6	84%	0.84	75%	0.748	S	S	*	*			trans	-71.8	78.3	168.7	-31.5	0	0	0	0	107.8
16	E	47.2	Very low	56.1	Low	164 Å²	164	138.6 Å²	138.6	77%	0.766	75%	0.746	S	S	*	*			trans	-100.6	107.8	176.1	-76.1	-173.5	135.7	0	0	110.1	S14 A18	S14-E16 PolarHBondContact O-N 3.45Å; E16-A18 PolarHBondContact O-N 3.44Å; E16-A18 VanDerWaalsContact O-N 3.17Å
17	N	43.6	Very low	58.2	Low	164 Å²	164	140.8 Å²	140.8	88%	0.877	75%	0.75	S	S	*	*			trans	-43.2	113	167.7	-58.5	-80.7	0	0	0	111.2
18	A	48.5	Very low	60.5	Low	78 Å²	78	143.9 Å²	143.9	65%	0.645	76%	0.756	S	S	*	*			trans	-129.6	113.5	164.2	0	0	0	0	0	107.7	E16 E20	E16-A18 PolarHBondContact O-N 3.44Å; E16-A18 VanDerWaalsContact O-N 3.17Å; A18-E20 PolarHBondContact O-N 2.67Å
19	D	53.3	Low	62.9	Low	179 Å²	179	141.3 Å²	141.3	96%	0.957	75%	0.754	S	S	*	*			trans	-57.6	73.1	175.2	-77.7	-60.9	0	0	0	112.3	S21	D19-S21 PolarHBondContact O-N 2.92Å
20	E	55.5	Low	65.2	Low	171 Å²	171	141 Å²	141	80%	0.799	76%	0.756	S	S	*	*			trans	-84.9	99.4	177.2	-72.3	-161.6	142.3	0	0	111.7	A18	A18-E20 PolarHBondContact O-N 2.67Å
21	S	63.3	Low	67.7	Low	107 Å²	107	139 Å²	139	75%	0.748	75%	0.749	S	S	*	*			trans	68.1	57.5	135.1	71.6	0	0	0	0	119.3	D19 H23	D19-S21 PolarHBondContact O-N 2.92Å; S21-H23 PolarHBondContact O-N 3.21Å; S21-H23 VanDerWaalsContact O-N 3.08Å
22	N	72.2	Confident	70.1	Confident	170 Å²	170	136.7 Å²	136.7	91%	0.909	75%	0.752	S	S	*	*			trans	-72.4	102.8	156.8	-118.7	0.9	0	0	0	108.9	D24	N22-D24 PolarHBondContact O-N 3.47Å; N22-D24 VanDerWaalsContact O-N 3.1Å
23	H	85.5	Confident	72.5	Confident	172 Å²	172	138 Å²	138	80%	0.796	76%	0.758	S	S	*	*			trans	-66.5	104.1	173.6	179.7	67.7	0	0	0	109.8	S21 P25	S21-H23 PolarHBondContact O-N 3.21Å; S21-H23 VanDerWaalsContact O-N 3.08Å; H23-P25 WeakPolarHBondContact NE2-CG 3.22Å
24	D	89.8	Confident	75.3	Confident	134 Å²	134	137.9 Å²	137.9	72%	0.717	76%	0.759	S	S	*	*			trans	-118.2	92.5	178.3	-173	30.7	0	0	0	110.3	N22 Q26	N22-D24 PolarHBondContact O-N 3.47Å; N22-D24 VanDerWaalsContact O-N 3.1Å; D24-Q26 PolarHBondContact O-N 3.48Å
25	P	91	Very high	77.6	Confident	62 Å²	62	143 Å²	143	40%	0.403	77%	0.773	S	S	.	*			trans	-63.8	121.6	178.8	-23.3	34.5	0	0	0	112.3	H23 F27	H23-P25 WeakPolarHBondContact NE2-CG 3.22Å; P25-F27 HydrophobicContact CB-CE2 3.86Å; P25-F27 HydrophobicContact CB-CZ 4.12Å; P25-F27 WeakPolarHBondContact O-CD2 3.19Å; P25-F27 WeakPolarHBondContact O-CE2 3.45Å
26	Q	91.7	Very high	80.1	Confident	161 Å²	161	143.5 Å²	143.5	75%	0.752	77%	0.766	S	S	*	*			trans	-86.8	133.8	176.4	-171.9	62.8	35.3	0	0	111.5	D24	D24-Q26 PolarHBondContact O-N 3.48Å
27	F	93.8	Very high	82.3	Confident	162 Å²	162	145 Å²	145	71%	0.711	77%	0.772	S	S	*	*			trans	-121	150.7	172.6	-58.8	-88.2	0	0	0	110.7	P25	P25-F27 HydrophobicContact CB-CE2 3.86Å; P25-F27 HydrophobicContact CB-CZ 4.12Å; P25-F27 WeakPolarHBondContact O-CD2 3.19Å; P25-F27 WeakPolarHBondContact O-CE2 3.45Å
28	E	92.8	Very high	84.6	Confident	188 Å²	188	143.9 Å²	143.9	88%	0.879	77%	0.765	S	S	*	*			trans	-74.7	128.1	169.7	-68.7	-173.2	175.5	0	0	109.8	I30	E28-I30 PolarHBondContact O-N 3.46Å
29	P	94.1	Very high	86.8	Confident	110 Å²	110	147.8 Å²	147.8	71%	0.714	77%	0.767	S	S	*	*			trans	-61.6	130.1	177.1	-23.6	34	0	0	0	112	V31	P29-V31 VanDerWaalsContact C-N 3.27Å; P29-V31 PolarHBondContact O-N 3.44Å
30	I	95.3	Very high	88.7	Confident	173 Å²	173	142.6 Å²	142.6	89%	0.887	74%	0.742	S	S	*	*	S	Bend	trans	-69.6	-31.2	175	-56.1	173.4	0	0	0	110.7	E28	E28-I30 PolarHBondContact O-N 3.46Å
31	V	95.2	Very high	90.6	Very high	98 Å²	98	140.7 Å²	140.7	59%	0.594	74%	0.737	S	S	*	*			trans	-140.4	147.6	-177.7	-64.8	0	0	0	0	110.4	P29 L33	P29-V31 VanDerWaalsContact C-N 3.27Å; P29-V31 PolarHBondContact O-N 3.44Å; V31-L33 HydrophobicContact CG2-CD2 4.24Å; V31-L33 HydrophobicContact CG2-CG 4.27Å
32	S	93.3	Very high	92.2	Very high	119 Å²	119	136.7 Å²	136.7	83%	0.832	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-101.4	118.5	167	-175.1	0	0	0	0	108.3
33	L	94	Very high	93.3	Very high	143 Å²	143	132.6 Å²	132.6	75%	0.749	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-97.9	127.6	178.1	-62.6	177.3	0	0	0	108.7	V31	V31-L33 HydrophobicContact CG2-CD2 4.24Å; V31-L33 HydrophobicContact CG2-CG 4.27Å
34	P	93.8	Very high	93.8	Very high	109 Å²	109	129.2 Å²	129.2	71%	0.708	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-66	150.6	172.7	29.8	-34	0	0	0	110	Q36	P34-Q36 PolarHBondContact O-N 2.9Å
35	E	94.4	Very high	94.2	Very high	203 Å²	203	123.9 Å²	123.9	95%	0.949	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-63.1	132	167.3	-172.2	168.4	-164.9	0	0	109.1
36	Q	93.7	Very high	94.5	Very high	147 Å²	147	125.9 Å²	125.9	69%	0.687	65%	0.645	S	S	*	*			trans	-129.9	128.1	-175	-175.9	177.6	-29.9	0	0	110.2	P34 I38	P34-Q36 PolarHBondContact O-N 2.9Å; Q36-I38 HydrophobicContact CG-CG1 4.47Å; Q36-I38 PolarHBondContact O-N 3.18Å
37	E	93.2	Very high	94.8	Very high	194 Å²	194	122.5 Å²	122.5	91%	0.907	63%	0.629	S	S	*	*			trans	-73.1	117.2	167.8	-65.7	-177.2	-176.9	0	0	109.6
38	I	92.6	Very high	95	Very high	141 Å²	141	116.5 Å²	116.5	72%	0.723	60%	0.604	S	S	*	*			trans	-104.2	124.3	178.8	-59	171.8	0	0	0	108.5	Q36	Q36-I38 HydrophobicContact CG-CG1 4.47Å; Q36-I38 PolarHBondContact O-N 3.18Å
39	K	93.8	Very high	95.3	Very high	160 Å²	160	108.7 Å²	108.7	70%	0.696	57%	0.567	S	S	*	*			trans	-81	145	172.8	-64	-173.6	178.8	-175.6	0	110.6	L41	K39-L41 VanDerWaalsContact C-N 3.31Å; K39-L41 HydrophobicContact CB-CD2 4.26Å
40	T	94.4	Very high	95.5	Very high	70 Å²	70	108.4 Å²	108.4	43%	0.429	56%	0.555	S	S	.	*			trans	-77.6	-22.9	175.3	62.4	0	0	0	0	112.3	E42 E43 R91	T40-E42 WeakPolarHBondContact OG1-CB 3.44Å; T40-E42 PolarHBondContact OG1-N 2.7Å; T40-E43 PolarHBondContact N-OE1 3.47Å; T40-E43 VanDerWaalsContact OG1-CD 3.26Å; T40-E43 PolarHBondContact OG1-OE1 3.26Å; T40-R91 PolarHBondContact O-NH2 3.13Å
41	L	95.1	Very high	95.6	Very high	132 Å²	132	101.7 Å²	101.7	69%	0.691	52%	0.52	S	S	*	.	S	Bend	trans	61.8	30.8	-169.5	-52.7	176	0	0	0	112.1	K39 E43 R87	K39-L41 VanDerWaalsContact C-N 3.31Å; K39-L41 HydrophobicContact CB-CD2 4.26Å; L41-E43 WeakPolarHBondContact CA-OE2 2.83Å; L41-E43 PolarHBondContact N-OE1 2.77Å; L41-E43 PolarHBondContact N-OE2 3.47Å; L41-R87 PolarHBondContact O-NH2 2.94Å
42	E	95.7	Very high	95.8	Very high	23 Å²	23	102.4 Å²	102.4	11%	0.107	51%	0.512	C	S	.	.			trans	-119.2	-0.3	176.1	-59	172.3	-140	0	0	111.1	T40 D44 E45 K76 L78 L89 R91	T40-E42 WeakPolarHBondContact OG1-CB 3.44Å; T40-E42 PolarHBondContact OG1-N 2.7Å; E42-D44 VanDerWaalsContact C-N 3.34Å; E42-D44 PolarHBondContact O-N 3.42Å; E42-E45 PolarHBondContact O-N 3.1Å; E42-E45 VanDerWaalsContact O-N 3.17Å; E42-K76 IonicContact OE2-NZ 3.78Å; E42-K76 PolarHBondContact OE2-NZ 2.92Å; E42-L78 HydrophobicContact CB-CD1 4.36Å; E42-L78 HydrophobicContact CG-CD1 4Å; E42-L89 HydrophobicContact CG-CD2 3.69Å; E42-L89 WeakPolarHBondContact OE1-CD2 3.43Å; E42-R91 IonicContact OE1-CZ 2.76Å; E42-R91 VanDerWaalsContact OE1-CZ 3.31Å; E42-R91 IonicContact OE1-NE 3.99Å; E42-R91 PolarHBondContact OE1-NE 3.14Å; E42-R91 IonicContact OE1-NH2 3.23Å; E42-R91 PolarHBondContact OE1-NH2 2.99Å
43	E	95.5	Very high	96	Very high	83 Å²	83	97 Å²	97	39%	0.388	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-30.5	-169.5	-61	77.8	-168.5	0	0	113.5	T40 L41 E45 K81	T40-E43 PolarHBondContact N-OE1 3.47Å; T40-E43 VanDerWaalsContact OG1-CD 3.26Å; T40-E43 PolarHBondContact OG1-OE1 3.26Å; L41-E43 WeakPolarHBondContact CA-OE2 2.83Å; L41-E43 PolarHBondContact N-OE1 2.77Å; L41-E43 PolarHBondContact N-OE2 3.47Å; E43-E45 PolarHBondContact O-N 3.38Å; E43-K81 PolarHBondContact O-NZ 3.34Å
44	D	96.6	Very high	96.2	Very high	101 Å²	101	93.4 Å²	93.4	54%	0.54	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	10.2	178.2	-62.4	-43.1	0	0	0	113	E42 K81	E42-D44 VanDerWaalsContact C-N 3.34Å; E42-D44 PolarHBondContact O-N 3.42Å; D44-K81 WeakPolarHBondContact O-CB 3.43Å; D44-K81 VanDerWaalsContact O-CG 3.27Å; D44-K81 WeakPolarHBondContact O-CG 3.38Å; D44-K81 PolarHBondContact O-N 3.48Å
45	E	97.9	Very high	96.5	Very high	22 Å²	22	88.2 Å²	88.2	10%	0.103	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	150.3	-177.9	-54.7	-175.3	124.8	0	0	112.3	E42 E43 L78 K79 H80 R87	E42-E45 PolarHBondContact O-N 3.1Å; E42-E45 VanDerWaalsContact O-N 3.17Å; E43-E45 PolarHBondContact O-N 3.38Å; E45-L78 HydrophobicContact CB-CB 4.02Å; E45-L78 VanDerWaalsContact OE2-CD1 3.24Å; E45-L78 WeakPolarHBondContact OE2-CD1 3.35Å; E45-K79 CarbonylContact C-O 3.59Å; E45-K79 VanDerWaalsContact CA-O 3.24Å; E45-K79 WeakPolarHBondContact CA-O 3.38Å; E45-H80 HydrophobicContact CG-CB 4.41Å; E45-R87 VanDerWaalsContact CD-NE 3.27Å; E45-R87 WeakPolarHBondContact OE1-CD 3.45Å; E45-R87 IonicContact OE1-CZ 3.65Å; E45-R87 IonicContact OE1-NE 2.73Å; E45-R87 PolarHBondContact OE1-NE 3.42Å; E45-R87 IonicContact OE1-NH2 3.71Å; E45-R87 IonicContact OE2-CZ 3.31Å; E45-R87 IonicContact OE2-NE 2.78Å; E45-R87 PolarHBondContact OE2-NE 3.09Å; E45-R87 IonicContact OE2-NH2 3.33Å; E45-R87 PolarHBondContact OE2-NH2 3.36Å
46	E	97.7	Very high	96.6	Very high	105 Å²	105	79.2 Å²	79.2	49%	0.491	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.5	172.5	-176.3	-175.8	178.8	0	0	109.5	L48 L78 K79	E46-L48 HydrophobicContact CG-CD2 4.16Å; E46-L48 PolarHBondContact O-N 3.1Å; E46-L78 CarbonylContact O-C 3.53Å; E46-L78 WeakPolarHBondContact O-CA 3.5Å; E46-K79 PolarHBondContact N-O 3.29Å; E46-K79 PolarHBondContact O-N 2.98Å
47	E	98.3	Very high	96.8	Very high	90 Å²	90	74.7 Å²	74.7	42%	0.421	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	103.7	175.3	-171.9	177	103.2	0	0	110.2	K50 K76 L78	E47-K50 HydrophobicContact CG-CB 4.21Å; E47-K50 WeakPolarHBondContact OE1-CB 3.12Å; E47-K50 VanDerWaalsContact OE1-CD 3.26Å; E47-K50 WeakPolarHBondContact OE1-CD 3.37Å; E47-K76 VanDerWaalsContact OE2-CD 3.32Å; E47-K76 WeakPolarHBondContact OE2-CD 3.22Å; E47-K76 VanDerWaalsContact OE2-CE 3.24Å; E47-K76 WeakPolarHBondContact OE2-CE 3.12Å; E47-K76 IonicContact OE2-NZ 3.82Å; E47-L78 HydrophobicContact CB-CD2 4.02Å; E47-L78 HydrophobicContact CG-CD2 4.21Å
48	L	98.2	Very high	97	Very high	36 Å²	36	68.2 Å²	68.2	19%	0.188	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-24.6	179.9	-59.2	-174.8	0	0	0	113	E46 L77 K79 I86 K154	E46-L48 HydrophobicContact CG-CD2 4.16Å; E46-L48 PolarHBondContact O-N 3.1Å; L48-L77 HydrophobicContact CB-CB 4.33Å; L48-L77 PolarHBondContact N-O 3.08Å; L48-K79 HydrophobicContact CD1-CB 3.76Å; L48-K79 HydrophobicContact CD1-CD 4.31Å; L48-K79 HydrophobicContact CD2-CB 4.25Å; L48-K79 HydrophobicContact CG-CB 3.97Å; L48-I86 HydrophobicContact CD1-CD1 4.02Å; L48-I86 HydrophobicContact CD1-CG1 4.39Å; L48-I86 HydrophobicContact CD1-CG2 4.43Å; L48-K154 WeakPolarHBondContact O-CE 3.37Å
49	F	98.5	Very high	97.1	Very high	24 Å²	24	61.5 Å²	61.5	11%	0.105	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	143	-178.3	-175.3	-96.2	0	0	0	109.4	M51 V75 K76 L77 K150 F151 K154	F49-M51 HydrophobicContact CD1-CB 4.36Å; F49-M51 HydrophobicContact CE1-CB 3.38Å; F49-M51 HydrophobicContact CE1-SD 4.48Å; F49-M51 HydrophobicContact CE2-CE 3.81Å; F49-M51 HydrophobicContact CZ-CB 3.53Å; F49-M51 HydrophobicContact CZ-CE 3.49Å; F49-M51 VanDerWaalsContact CZ-CE 3.49Å; F49-M51 HydrophobicContact CZ-CG 4.27Å; F49-M51 HydrophobicContact CZ-SD 3.77Å; F49-V75 HydrophobicContact CE1-CG1 4.23Å; F49-K76 WeakPolarHBondContact O-CA 3.45Å; F49-L77 HydrophobicContact CB-CB 3.97Å; F49-L77 HydrophobicContact CB-CD1 4.11Å; F49-L77 HydrophobicContact CB-CG 4.01Å; F49-L77 PolarHBondContact O-N 2.96Å; F49-K150 HydrophobicContact CE2-CB 4.37Å; F49-F151 HydrophobicContact CD1-CD2 4.04Å; F49-F151 HydrophobicContact CE1-CB 4.1Å; F49-F151 AromaticContact CE1-CD2 3.58Å; F49-F151 HydrophobicContact CE1-CD2 3.58Å; F49-F151 HydrophobicContact CE1-CG 4.33Å; F49-F151 HydrophobicContact CZ-CB 3.75Å; F49-F151 HydrophobicContact CZ-CD2 4.11Å; F49-F151 HydrophobicContact CZ-CG 4.45Å; F49-K154 HydrophobicContact CB-CB 4.5Å; F49-K154 HydrophobicContact CB-CG 3.79Å; F49-K154 HydrophobicContact CD2-CB 3.89Å; F49-K154 HydrophobicContact CD2-CG 3.9Å; F49-K154 HydrophobicContact CE2-CB 4.48Å; F49-K154 HydrophobicContact CG-CB 4.39Å; F49-K154 HydrophobicContact CG-CG 4.17Å
50	K	98.4	Very high	97	Very high	104 Å²	104	58 Å²	58	45%	0.452	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	128.9	170.1	178.4	178.4	176.8	-178.2	0	110.3	E47 D74 V75 K76	E47-K50 HydrophobicContact CG-CB 4.21Å; E47-K50 WeakPolarHBondContact OE1-CB 3.12Å; E47-K50 VanDerWaalsContact OE1-CD 3.26Å; E47-K50 WeakPolarHBondContact OE1-CD 3.37Å; K50-D74 WeakPolarHBondContact CE-OD2 3.12Å; K50-D74 HydrophobicContact CG-CB 4.22Å; K50-D74 IonicContact NZ-OD2 2.86Å; K50-V75 WeakPolarHBondContact CA-O 3.44Å; K50-K76 HydrophobicContact CB-CG 4.49Å; K50-K76 HydrophobicContact CG-CG 4.33Å
51	M	98	Very high	96.8	Very high	32 Å²	32	61 Å²	61	16%	0.158	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	148.3	177.7	-165.4	170.4	-72.7	0	0	112.9	F49 A53 D74 V75 F142 N147 K150	F49-M51 HydrophobicContact CD1-CB 4.36Å; F49-M51 HydrophobicContact CE1-CB 3.38Å; F49-M51 HydrophobicContact CE1-SD 4.48Å; F49-M51 HydrophobicContact CE2-CE 3.81Å; F49-M51 HydrophobicContact CZ-CB 3.53Å; F49-M51 HydrophobicContact CZ-CE 3.49Å; F49-M51 VanDerWaalsContact CZ-CE 3.49Å; F49-M51 HydrophobicContact CZ-CG 4.27Å; F49-M51 HydrophobicContact CZ-SD 3.77Å; M51-A53 PolarHBondContact O-N 3.36Å; M51-D74 CarbonylContact O-C 3.56Å; M51-D74 WeakPolarHBondContact O-CA 3.49Å; M51-V75 PolarHBondContact N-O 3.07Å; M51-V75 WeakPolarHBondContact O-CG1 3.42Å; M51-V75 PolarHBondContact O-N 3.24Å; M51-F142 HydrophobicContact CB-CE1 4.32Å; M51-F142 HydrophobicContact CG-CD1 4.16Å; M51-F142 HydrophobicContact CG-CE1 4.28Å; M51-F142 HydrophobicContact SD-CD1 3.8Å; M51-F142 HydrophobicContact SD-CE1 4.06Å; M51-N147 HydrophobicContact CE-CB 4.37Å; M51-N147 HydrophobicContact SD-CB 3.45Å; M51-N147 WeakPolarHBondContact SD-CB 3.35Å; M51-K150 HydrophobicContact CE-CB 4.24Å; M51-K150 HydrophobicContact CE-CD 4.28Å
52	R	98.4	Very high	96.5	Very high	113 Å²	113	57.6 Å²	57.6	43%	0.426	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	128.4	172.2	-178.9	62.7	169.5	177	-1.8	111.9	D93	R52-D93 IonicContact CZ-OD1 3.52Å; R52-D93 IonicContact CZ-OD2 2.95Å; R52-D93 IonicContact NH1-OD1 3.11Å; R52-D93 PolarHBondContact NH1-OD1 3.15Å; R52-D93 IonicContact NH1-OD2 3.1Å; R52-D93 PolarHBondContact NH1-OD2 3.18Å; R52-D93 IonicContact NH2-OD2 3.66Å; R52-D93 PolarHBondContact NH2-OD2 3.35Å
53	A	98.6	Very high	96.2	Very high	5 Å²	5	64.6 Å²	64.6	4%	0.041	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	167.5	177.7	0	0	0	0	0	113.3	M51 G73 V75 M90 I140 R141 F142	M51-A53 PolarHBondContact O-N 3.36Å; A53-G73 PolarHBondContact N-O 2.89Å; A53-G73 PolarHBondContact O-N 3.48Å; A53-G73 VanDerWaalsContact O-N 3.08Å; A53-G73 VanDerWaalsContact O-O 3.09Å; A53-V75 HydrophobicContact CB-CG1 4.06Å; A53-M90 HydrophobicContact CB-CE 4.18Å; A53-M90 WeakPolarHBondContact O-CE 3.39Å; A53-I140 HydrophobicContact CB-CD1 3.65Å; A53-I140 HydrophobicContact CB-CG1 3.61Å; A53-R141 WeakPolarHBondContact CA-O 3.49Å; A53-F142 HydrophobicContact CB-CD1 3.99Å; A53-F142 HydrophobicContact CB-CE1 3.73Å; A53-F142 HydrophobicContact CB-CZ 4.27Å
54	K	98.5	Very high	96	Very high	67 Å²	67	67.4 Å²	67.4	29%	0.291	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128	166.2	-178.3	177.8	-80.1	-157.7	0	109.4	F56 E69 T72 I140 R141	K54-F56 HydrophobicContact CB-CE2 4.21Å; K54-F56 HydrophobicContact CD-CE1 4.11Å; K54-F56 HydrophobicContact CD-CE2 3.86Å; K54-F56 HydrophobicContact CD-CZ 3.35Å; K54-F56 HydrophobicContact CG-CD2 4.48Å; K54-F56 HydrophobicContact CG-CE2 3.69Å; K54-F56 HydrophobicContact CG-CZ 3.71Å; K54-E69 IonicContact NZ-OE1 3.87Å; K54-E69 PolarHBondContact NZ-OE1 2.99Å; K54-E69 IonicContact NZ-OE2 3.73Å; K54-T72 HydrophobicContact CB-CG2 4.48Å; K54-T72 WeakPolarHBondContact CE-OG1 2.95Å; K54-I140 WeakPolarHBondContact O-CA 3.41Å; K54-R141 PolarHBondContact N-O 3.5Å; K54-R141 PolarHBondContact O-N 2.84Å
55	L	98.6	Very high	95.9	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	139	-178.6	-172	74.5	0	0	0	110.8	R70 G71 M90 C99 A100 W122 L138 A139 I140	L55-R70 HydrophobicContact CB-CB 4.4Å; L55-R70 HydrophobicContact CD2-CB 4.08Å; L55-R70 HydrophobicContact CD2-CG 3.83Å; L55-R70 HydrophobicContact CG-CB 4.14Å; L55-R70 HydrophobicContact CG-CG 4.43Å; L55-R70 PolarHBondContact O-N 3.35Å; L55-G71 PolarHBondContact N-O 3.31Å; L55-G71 PolarHBondContact O-N 2.84Å; L55-M90 HydrophobicContact CB-CE 4.12Å; L55-M90 HydrophobicContact CB-SD 3.7Å; L55-M90 HydrophobicContact CD2-SD 4.21Å; L55-M90 HydrophobicContact CG-SD 4.4Å; L55-C99 WeakPolarHBondContact CD2-O 3.48Å; L55-A100 HydrophobicContact CD2-CB 3.67Å; L55-W122 HydrophobicContact CD1-CH2 3.77Å; L55-W122 HydrophobicContact CD1-CZ2 4.46Å; L55-L138 HydrophobicContact CD1-CB 4.29Å; L55-A139 CarbonylContact C-O 3.5Å; L55-A139 WeakPolarHBondContact CA-O 3.16Å; L55-I140 HydrophobicContact CD1-CB 4.21Å; L55-I140 HydrophobicContact CD1-CG1 4.5Å
56	F	98	Very high	95.7	Very high	15 Å²	15	69.7 Å²	69.7	7%	0.066	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	152.5	176.6	-56.3	-98	0	0	0	109.4	K54 W67 K68 E69 L138 A139 R141	K54-F56 HydrophobicContact CB-CE2 4.21Å; K54-F56 HydrophobicContact CD-CE1 4.11Å; K54-F56 HydrophobicContact CD-CE2 3.86Å; K54-F56 HydrophobicContact CD-CZ 3.35Å; K54-F56 HydrophobicContact CG-CD2 4.48Å; K54-F56 HydrophobicContact CG-CE2 3.69Å; K54-F56 HydrophobicContact CG-CZ 3.71Å; F56-W67 HydrophobicContact CB-CE3 3.82Å; F56-W67 HydrophobicContact CB-CZ3 4.49Å; F56-K68 CarbonylContact C-O 3.6Å; F56-K68 VanDerWaalsContact CA-O 3.29Å; F56-K68 WeakPolarHBondContact CA-O 3.37Å; F56-E69 HydrophobicContact CD1-CG 4.09Å; F56-E69 HydrophobicContact CE1-CG 3.78Å; F56-L138 WeakPolarHBondContact O-CA 3.29Å; F56-A139 HydrophobicContact CB-CB 4.26Å; F56-A139 PolarHBondContact N-O 3.44Å; F56-A139 PolarHBondContact O-N 3.47Å; F56-R141 HydrophobicContact CE2-CB 4.02Å
57	R	97.1	Very high	95.7	Very high	51 Å²	51	69 Å²	69	19%	0.192	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.5	171.9	-172.5	-151	-68.4	108.4	-15.5	108.8	A59 K68 R70 E136 L138	R57-A59 PolarHBondContact O-N 3.35Å; R57-K68 PolarHBondContact N-O 3.26Å; R57-K68 PolarHBondContact O-N 3.45Å; R57-R70 HydrophobicContact CB-CB 4.41Å; R57-R70 VanDerWaalsContact CZ-CD 3.46Å; R57-R70 VanDerWaalsContact CZ-NH1 3.29Å; R57-R70 VanDerWaalsContact NH2-NH1 3.1Å; R57-E136 WeakPolarHBondContact CD-OE1 3.38Å; R57-E136 WeakPolarHBondContact CD-OE2 3.49Å; R57-E136 WeakPolarHBondContact CG-OE2 3.41Å; R57-E136 IonicContact CZ-OE1 2.93Å; R57-E136 IonicContact NE-OE1 2.62Å; R57-E136 PolarHBondContact NE-OE1 3.29Å; R57-E136 IonicContact NE-OE2 2.8Å; R57-E136 PolarHBondContact NE-OE2 2.89Å; R57-E136 IonicContact NH2-OE1 3.07Å; R57-L138 HydrophobicContact CB-CD2 4.37Å; R57-L138 HydrophobicContact CG-CD2 4.4Å
58	F	96.8	Very high	95.6	Very high	59 Å²	59	67.8 Å²	67.8	26%	0.259	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118.9	170.4	-165.5	-113.6	0	0	0	110.1	P65 W67 L137	F58-P65 HydrophobicContact CE1-CB 3.74Å; F58-P65 HydrophobicContact CE2-CB 3.93Å; F58-P65 HydrophobicContact CZ-CB 3.24Å; F58-P65 HydrophobicContact CZ-CG 4.43Å; F58-W67 HydrophobicContact CB-CD2 4.47Å; F58-W67 HydrophobicContact CB-CE3 3.99Å; F58-W67 HydrophobicContact CB-CH2 3.92Å; F58-W67 HydrophobicContact CB-CZ2 4.4Å; F58-W67 HydrophobicContact CB-CZ3 3.7Å; F58-W67 AromaticContact CD2-CD2 3.97Å; F58-W67 HydrophobicContact CD2-CD2 3.97Å; F58-W67 AromaticContact CD2-CE2 3.78Å; F58-W67 HydrophobicContact CD2-CE3 4.34Å; F58-W67 HydrophobicContact CD2-CG 4.4Å; F58-W67 HydrophobicContact CD2-CH2 4.37Å; F58-W67 HydrophobicContact CD2-CZ2 4.01Å; F58-W67 HydrophobicContact CG-CH2 4.5Å; F58-L137 HydrophobicContact CB-CB 3.91Å; F58-L137 HydrophobicContact CB-CD2 3.82Å; F58-L137 HydrophobicContact CB-CG 4.11Å; F58-L137 HydrophobicContact CD1-CD2 3.9Å; F58-L137 HydrophobicContact CG-CD2 3.89Å; F58-L137 PolarHBondContact N-O 2.86Å
59	A	94.9	Very high	95.6	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	96.4	174.6	0	0	0	0	0	108.9	R57 E61 P65 E66 K68	R57-A59 PolarHBondContact O-N 3.35Å; A59-E61 VanDerWaalsContact CA-OE2 3.28Å; A59-E61 WeakPolarHBondContact CA-OE2 3.42Å; A59-E61 WeakPolarHBondContact CB-OE1 3.45Å; A59-P65 WeakPolarHBondContact O-CA 3.21Å; A59-E66 HydrophobicContact CB-CG 4.34Å; A59-E66 PolarHBondContact N-O 2.92Å; A59-E66 PolarHBondContact O-N 3.48Å; A59-K68 HydrophobicContact CB-CD 3.68Å; A59-K68 HydrophobicContact CB-CG 4.02Å
60	S	92.3	Very high	95.5	Very high	86 Å²	86	71.1 Å²	71.1	60%	0.601	35%	0.345	S	S	*	.			trans	-89.8	-6.2	176.7	61.1	0	0	0	0	113.1	N62	S60-N62 PolarHBondContact O-N 3.44Å
61	E	90.3	Very high	95.5	Very high	134 Å²	134	66.6 Å²	66.6	63%	0.626	33%	0.328	S	S	*	.	S	Bend	trans	-73.5	-14.6	179.2	68.3	-81.2	179.5	0	0	114.1	A59 K68	A59-E61 VanDerWaalsContact CA-OE2 3.28Å; A59-E61 WeakPolarHBondContact CA-OE2 3.42Å; A59-E61 WeakPolarHBondContact CB-OE1 3.45Å; E61-K68 IonicContact OE1-NZ 2.71Å; E61-K68 PolarHBondContact OE1-NZ 3.47Å
62	N	87.4	Confident	95.5	Very high	59 Å²	59	67 Å²	67	32%	0.316	33%	0.332	S	S	.	.	S	Bend	trans	-88.1	155.3	178.4	-68.9	-15.9	0	0	0	111.2	S60 L64 E66 K68	S60-N62 PolarHBondContact O-N 3.44Å; N62-L64 PolarHBondContact O-N 3Å; N62-L64 VanDerWaalsContact O-N 3.09Å; N62-E66 PolarHBondContact ND2-OE1 2.84Å; N62-E66 VanDerWaalsContact ND2-OE1 3.07Å; N62-K68 WeakPolarHBondContact ND2-CE 3.32Å; N62-K68 PolarHBondContact ND2-NZ 3Å
63	D	89.3	Confident	95.6	Very high	171 Å²	171	61.6 Å²	61.6	91%	0.914	31%	0.312	S	S	*	.	S	Bend	trans	-53.7	-32	174.4	-66.8	-31.9	0	0	0	112.9
64	L	92.1	Very high	95.6	Very high	141 Å²	141	64.3 Å²	64.3	74%	0.738	33%	0.326	S	S	*	.	S	Bend	trans	-115.9	108.8	173.6	-65.9	172.9	0	0	0	109	N62 E66	N62-L64 PolarHBondContact O-N 3Å; N62-L64 VanDerWaalsContact O-N 3.09Å; L64-E66 PolarHBondContact O-N 2.74Å
65	P	93.6	Very high	95.6	Very high	78 Å²	78	61.1 Å²	61.1	51%	0.506	31%	0.312	S	S	.	.			trans	-61.6	128.1	176.9	-24.8	34.3	0	0	0	111.7	F58 A59	F58-P65 HydrophobicContact CE1-CB 3.74Å; F58-P65 HydrophobicContact CE2-CB 3.93Å; F58-P65 HydrophobicContact CZ-CB 3.24Å; F58-P65 HydrophobicContact CZ-CG 4.43Å; A59-P65 WeakPolarHBondContact O-CA 3.21Å
66	E	95.6	Very high	95.6	Very high	93 Å²	93	63.3 Å²	63.3	44%	0.435	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	157.9	-173.4	65.7	176.3	175.5	0	0	112.8	A59 N62 L64 K68	A59-E66 HydrophobicContact CB-CG 4.34Å; A59-E66 PolarHBondContact N-O 2.92Å; A59-E66 PolarHBondContact O-N 3.48Å; N62-E66 PolarHBondContact ND2-OE1 2.84Å; N62-E66 VanDerWaalsContact ND2-OE1 3.07Å; L64-E66 PolarHBondContact O-N 2.74Å; E66-K68 HydrophobicContact CG-CG 4.24Å; E66-K68 WeakPolarHBondContact OE1-CE 3.32Å; E66-K68 IonicContact OE1-NZ 3.77Å
67	W	96.1	Very high	95.6	Very high	91 Å²	91	62.6 Å²	62.6	35%	0.345	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	115.5	171.9	-71.1	104.1	0	0	0	110.3	F56 F58 V121 L137 A139	F56-W67 HydrophobicContact CB-CE3 3.82Å; F56-W67 HydrophobicContact CB-CZ3 4.49Å; F58-W67 HydrophobicContact CB-CD2 4.47Å; F58-W67 HydrophobicContact CB-CE3 3.99Å; F58-W67 HydrophobicContact CB-CH2 3.92Å; F58-W67 HydrophobicContact CB-CZ2 4.4Å; F58-W67 HydrophobicContact CB-CZ3 3.7Å; F58-W67 AromaticContact CD2-CD2 3.97Å; F58-W67 HydrophobicContact CD2-CD2 3.97Å; F58-W67 AromaticContact CD2-CE2 3.78Å; F58-W67 HydrophobicContact CD2-CE3 4.34Å; F58-W67 HydrophobicContact CD2-CG 4.4Å; F58-W67 HydrophobicContact CD2-CH2 4.37Å; F58-W67 HydrophobicContact CD2-CZ2 4.01Å; F58-W67 HydrophobicContact CG-CH2 4.5Å; W67-V121 HydrophobicContact CH2-CG1 3.84Å; W67-V121 HydrophobicContact CH2-CG2 4.39Å; W67-V121 HydrophobicContact CZ2-CG1 4.26Å; W67-V121 HydrophobicContact CZ2-CG2 4.35Å; W67-L137 HydrophobicContact CH2-CD2 4.18Å; W67-L137 HydrophobicContact CH2-CG 4.06Å; W67-A139 HydrophobicContact CE3-CB 3.96Å; W67-A139 HydrophobicContact CH2-CB 3.65Å; W67-A139 HydrophobicContact CZ2-CB 4.23Å; W67-A139 HydrophobicContact CZ3-CB 3.49Å; W67-A139 VanDerWaalsContact CZ3-CB 3.49Å
68	K	96.8	Very high	95.7	Very high	65 Å²	65	60.4 Å²	60.4	28%	0.283	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140	172.6	-63.5	-178.9	-173.4	158.8	0	110.2	F56 R57 A59 E61 N62 E66 R70	F56-K68 CarbonylContact C-O 3.6Å; F56-K68 VanDerWaalsContact CA-O 3.29Å; F56-K68 WeakPolarHBondContact CA-O 3.37Å; R57-K68 PolarHBondContact N-O 3.26Å; R57-K68 PolarHBondContact O-N 3.45Å; A59-K68 HydrophobicContact CB-CD 3.68Å; A59-K68 HydrophobicContact CB-CG 4.02Å; E61-K68 IonicContact OE1-NZ 2.71Å; E61-K68 PolarHBondContact OE1-NZ 3.47Å; N62-K68 WeakPolarHBondContact ND2-CE 3.32Å; N62-K68 PolarHBondContact ND2-NZ 3Å; E66-K68 HydrophobicContact CG-CG 4.24Å; E66-K68 WeakPolarHBondContact OE1-CE 3.32Å; E66-K68 IonicContact OE1-NZ 3.77Å; K68-R70 PolarHBondContact O-N 3.37Å
69	E	97.6	Very high	95.7	Very high	123 Å²	123	60 Å²	60	58%	0.575	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	130.4	173.1	-62.6	-159.3	156.1	0	0	110.3	K54 F56	K54-E69 IonicContact NZ-OE1 3.87Å; K54-E69 PolarHBondContact NZ-OE1 2.99Å; K54-E69 IonicContact NZ-OE2 3.73Å; F56-E69 HydrophobicContact CD1-CG 4.09Å; F56-E69 HydrophobicContact CE1-CG 3.78Å
70	R	97.6	Very high	95.9	Very high	7 Å²	7	61.2 Å²	61.2	3%	0.026	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-38.5	178.8	-175.3	60.4	175.2	-91.3	17.3	111.8	L55 R57 K68 R92 C99 D130 E136	L55-R70 HydrophobicContact CB-CB 4.4Å; L55-R70 HydrophobicContact CD2-CB 4.08Å; L55-R70 HydrophobicContact CD2-CG 3.83Å; L55-R70 HydrophobicContact CG-CB 4.14Å; L55-R70 HydrophobicContact CG-CG 4.43Å; L55-R70 PolarHBondContact O-N 3.35Å; R57-R70 HydrophobicContact CB-CB 4.41Å; R57-R70 VanDerWaalsContact CZ-CD 3.46Å; R57-R70 VanDerWaalsContact CZ-NH1 3.29Å; R57-R70 VanDerWaalsContact NH2-NH1 3.1Å; K68-R70 PolarHBondContact O-N 3.37Å; R70-R92 VanDerWaalsContact O-CZ 3.26Å; R70-R92 PolarHBondContact O-NE 3.16Å; R70-R92 PolarHBondContact O-NH2 3.43Å; R70-C99 HydrophobicContact CG-CB 4.19Å; R70-C99 VanDerWaalsContact CG-O 3.25Å; R70-C99 WeakPolarHBondContact CG-O 3.37Å; R70-C99 PolarHBondContact NE-O 2.98Å; R70-D130 IonicContact NH2-OD1 2.82Å; R70-D130 PolarHBondContact NH2-OD1 2.81Å; R70-D130 VanDerWaalsContact NH2-OD1 3.1Å; R70-D130 IonicContact NH2-OD2 2.64Å; R70-D130 PolarHBondContact NH2-OD2 2.98Å; R70-D130 VanDerWaalsContact NH2-OD2 3.11Å; R70-E136 IonicContact CZ-OE1 3.81Å; R70-E136 IonicContact NH1-OE1 2.76Å; R70-E136 PolarHBondContact NH1-OE1 3.37Å; R70-E136 IonicContact NH2-OE1 3.18Å
71	G	98.2	Very high	96.1	Very high	9 Å²	9	63.6 Å²	63.6	9%	0.093	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.1	156.7	179.1	0	0	0	0	0	113.7	L55	L55-G71 PolarHBondContact N-O 3.31Å; L55-G71 PolarHBondContact O-N 2.84Å
72	T	98.7	Very high	96.4	Very high	40 Å²	40	65.4 Å²	65.4	25%	0.245	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.3	169.1	-54.2	0	0	0	0	107.9	K54 R92 D93	K54-T72 HydrophobicContact CB-CG2 4.48Å; K54-T72 WeakPolarHBondContact CE-OG1 2.95Å; T72-R92 WeakPolarHBondContact O-CA 3.29Å; T72-D93 PolarHBondContact O-N 3.27Å
73	G	98.6	Very high	96.7	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.7	-171.4	-166.8	0	0	0	0	0	113.4	A53 R91	A53-G73 PolarHBondContact N-O 2.89Å; A53-G73 PolarHBondContact O-N 3.48Å; A53-G73 VanDerWaalsContact O-N 3.08Å; A53-G73 VanDerWaalsContact O-O 3.09Å; G73-R91 VanDerWaalsContact CA-O 3.29Å; G73-R91 WeakPolarHBondContact CA-O 3.23Å
74	D	98.5	Very high	97	Very high	62 Å²	62	61.1 Å²	61.1	33%	0.332	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.3	169.7	-69.3	-20.5	0	0	0	109.7	K50 M51 M90	K50-D74 WeakPolarHBondContact CE-OD2 3.12Å; K50-D74 HydrophobicContact CG-CB 4.22Å; K50-D74 IonicContact NZ-OD2 2.86Å; M51-D74 CarbonylContact O-C 3.56Å; M51-D74 WeakPolarHBondContact O-CA 3.49Å; D74-M90 WeakPolarHBondContact O-CG 3.1Å
75	V	98.7	Very high	97.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	134.5	166.3	62	0	0	0	0	108.9	F49 K50 M51 A53 L88 M90 I140 F142 F151	F49-V75 HydrophobicContact CE1-CG1 4.23Å; K50-V75 WeakPolarHBondContact CA-O 3.44Å; M51-V75 PolarHBondContact N-O 3.07Å; M51-V75 WeakPolarHBondContact O-CG1 3.42Å; M51-V75 PolarHBondContact O-N 3.24Å; A53-V75 HydrophobicContact CB-CG1 4.06Å; V75-L88 HydrophobicContact CG2-CD1 3.98Å; V75-L88 HydrophobicContact CG2-CD2 3.93Å; V75-L88 HydrophobicContact CG2-CG 3.78Å; V75-M90 HydrophobicContact CB-CB 4.49Å; V75-M90 HydrophobicContact CB-CG 4.26Å; V75-M90 HydrophobicContact CB-SD 4.22Å; V75-I140 HydrophobicContact CB-CD1 3.92Å; V75-I140 HydrophobicContact CG1-CD1 3.79Å; V75-I140 HydrophobicContact CG2-CD1 4Å; V75-F142 HydrophobicContact CG1-CE1 3.99Å; V75-F142 HydrophobicContact CG1-CZ 4.23Å; V75-F151 HydrophobicContact CG1-CD2 4.39Å; V75-F151 HydrophobicContact CG1-CE2 4.35Å; V75-F151 HydrophobicContact CG2-CE2 4.15Å
76	K	98.7	Very high	97.4	Very high	45 Å²	45	52.4 Å²	52.4	20%	0.196	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	144.7	175.6	-59.4	-176.6	-176.6	-177.3	0	111.2	E42 E47 F49 K50 L78 L88 L89	E42-K76 IonicContact OE2-NZ 3.78Å; E42-K76 PolarHBondContact OE2-NZ 2.92Å; E47-K76 VanDerWaalsContact OE2-CD 3.32Å; E47-K76 WeakPolarHBondContact OE2-CD 3.22Å; E47-K76 VanDerWaalsContact OE2-CE 3.24Å; E47-K76 WeakPolarHBondContact OE2-CE 3.12Å; E47-K76 IonicContact OE2-NZ 3.82Å; F49-K76 WeakPolarHBondContact O-CA 3.45Å; K50-K76 HydrophobicContact CB-CG 4.49Å; K50-K76 HydrophobicContact CG-CG 4.33Å; K76-L78 HydrophobicContact CB-CD2 3.99Å; K76-L78 HydrophobicContact CB-CG 4.03Å; K76-L78 HydrophobicContact CD-CD1 4.48Å; K76-L78 HydrophobicContact CD-CD2 4.03Å; K76-L88 WeakPolarHBondContact O-CA 3.41Å; K76-L89 PolarHBondContact N-O 2.83Å; K76-L89 PolarHBondContact O-N 2.85Å
77	L	98.7	Very high	97.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.3	161.5	-61.3	-176.5	0	0	0	107.9	L48 F49 R87 L88 I104 K154 F155	L48-L77 HydrophobicContact CB-CB 4.33Å; L48-L77 PolarHBondContact N-O 3.08Å; F49-L77 HydrophobicContact CB-CB 3.97Å; F49-L77 HydrophobicContact CB-CD1 4.11Å; F49-L77 HydrophobicContact CB-CG 4.01Å; F49-L77 PolarHBondContact O-N 2.96Å; L77-R87 WeakPolarHBondContact CA-O 3.21Å; L77-L88 HydrophobicContact CD2-CB 4.03Å; L77-L88 HydrophobicContact CD2-CD1 4.25Å; L77-L88 HydrophobicContact CD2-CG 4.18Å; L77-I104 HydrophobicContact CD1-CD1 4.48Å; L77-I104 HydrophobicContact CD2-CD1 3.83Å; L77-K154 HydrophobicContact CD1-CB 4.47Å; L77-K154 HydrophobicContact CD1-CG 4.24Å; L77-F155 HydrophobicContact CD1-CB 4.42Å; L77-F155 HydrophobicContact CD2-CD2 4.36Å
78	L	98.6	Very high	97.7	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.2	-172.4	-61.6	-179	0	0	0	109.8	E42 E45 E46 E47 K76 I86 R87 L89	E42-L78 HydrophobicContact CB-CD1 4.36Å; E42-L78 HydrophobicContact CG-CD1 4Å; E45-L78 HydrophobicContact CB-CB 4.02Å; E45-L78 VanDerWaalsContact OE2-CD1 3.24Å; E45-L78 WeakPolarHBondContact OE2-CD1 3.35Å; E46-L78 CarbonylContact O-C 3.53Å; E46-L78 WeakPolarHBondContact O-CA 3.5Å; E47-L78 HydrophobicContact CB-CD2 4.02Å; E47-L78 HydrophobicContact CG-CD2 4.21Å; K76-L78 HydrophobicContact CB-CD2 3.99Å; K76-L78 HydrophobicContact CB-CG 4.03Å; K76-L78 HydrophobicContact CD-CD1 4.48Å; K76-L78 HydrophobicContact CD-CD2 4.03Å; L78-I86 CarbonylContact O-C 3.6Å; L78-I86 VanDerWaalsContact O-CA 3.25Å; L78-I86 WeakPolarHBondContact O-CA 3.14Å; L78-R87 HydrophobicContact CB-CG 4.12Å; L78-R87 PolarHBondContact N-O 3.41Å; L78-R87 PolarHBondContact O-N 3.47Å; L78-L89 HydrophobicContact CD1-CB 3.95Å; L78-L89 HydrophobicContact CD1-CD2 3.69Å; L78-L89 HydrophobicContact CD1-CG 4.49Å
79	K	98.4	Very high	97.8	Very high	51 Å²	51	42.4 Å²	42.4	22%	0.222	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	120.9	176.9	179.6	177.2	169.5	-179.4	0	110.6	E45 E46 L48 K81 T85 I86 E161	E45-K79 CarbonylContact C-O 3.59Å; E45-K79 VanDerWaalsContact CA-O 3.24Å; E45-K79 WeakPolarHBondContact CA-O 3.38Å; E46-K79 PolarHBondContact N-O 3.29Å; E46-K79 PolarHBondContact O-N 2.98Å; L48-K79 HydrophobicContact CD1-CB 3.76Å; L48-K79 HydrophobicContact CD1-CD 4.31Å; L48-K79 HydrophobicContact CD2-CB 4.25Å; L48-K79 HydrophobicContact CG-CB 3.97Å; K79-K81 PolarHBondContact O-N 3.23Å; K79-T85 CarbonylContact C-O 3.53Å; K79-T85 WeakPolarHBondContact CA-O 3.48Å; K79-I86 HydrophobicContact CB-CG1 3.92Å; K79-I86 HydrophobicContact CD-CD1 4.46Å; K79-I86 HydrophobicContact CD-CG1 4.36Å; K79-I86 HydrophobicContact CG-CG1 3.91Å; K79-E161 WeakPolarHBondContact CE-OE1 3.44Å; K79-E161 IonicContact NZ-OE1 2.74Å; K79-E161 PolarHBondContact NZ-OE1 3.31Å; K79-E161 IonicContact NZ-OE2 2.77Å
80	H	98.1	Very high	97.8	Very high	26 Å²	26	36.6 Å²	36.6	12%	0.12	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	126.7	175.3	-167.7	-58.4	0	0	0	111.1	E45 E82 K83 G84 T85	E45-H80 HydrophobicContact CG-CB 4.41Å; H80-E82 PolarHBondContact ND1-N 3.44Å; H80-E82 PolarHBondContact O-N 2.91Å; H80-K83 HydrophobicContact CB-CB 4.16Å; H80-K83 PolarHBondContact ND1-N 3.09Å; H80-K83 VanDerWaalsContact ND1-N 3.18Å; H80-G84 VanDerWaalsContact O-CA 3.24Å; H80-G84 WeakPolarHBondContact O-CA 3.45Å; H80-G84 PolarHBondContact O-N 3.38Å; H80-T85 WeakPolarHBondContact CB-OG1 3.12Å; H80-T85 PolarHBondContact N-O 3.38Å
81	K	96.7	Very high	97.9	Very high	136 Å²	136	39.6 Å²	39.6	59%	0.591	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-47.8	-173.5	-69.1	165	-174.3	163.7	0	112.6	E43 D44 K79	E43-K81 PolarHBondContact O-NZ 3.34Å; D44-K81 WeakPolarHBondContact O-CB 3.43Å; D44-K81 VanDerWaalsContact O-CG 3.27Å; D44-K81 WeakPolarHBondContact O-CG 3.38Å; D44-K81 PolarHBondContact O-N 3.48Å; K79-K81 PolarHBondContact O-N 3.23Å
82	E	95.5	Very high	97.9	Very high	171 Å²	171	42 Å²	42	80%	0.799	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-50.6	-179.4	-55.8	-177.1	162.4	0	0	113.5	H80 G84	H80-E82 PolarHBondContact ND1-N 3.44Å; H80-E82 PolarHBondContact O-N 2.91Å; E82-G84 VanDerWaalsContact C-N 3.34Å; E82-G84 PolarHBondContact O-N 3.48Å
83	K	94.6	Very high	97.8	Very high	128 Å²	128	43.3 Å²	43.3	56%	0.557	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-23.6	-174.3	-65.4	175.4	-175.1	165.6	0	112.6	H80 T85 K165	H80-K83 HydrophobicContact CB-CB 4.16Å; H80-K83 PolarHBondContact ND1-N 3.09Å; H80-K83 VanDerWaalsContact ND1-N 3.18Å; K83-T85 HydrophobicContact CB-CG2 4.23Å; K83-T85 PolarHBondContact O-N 3.33Å; K83-K165 VanDerWaalsContact O-CE 3.28Å; K83-K165 WeakPolarHBondContact O-CE 3.44Å; K83-K165 PolarHBondContact O-NZ 2.72Å
84	G	95	Very high	97.7	Very high	12 Å²	12	53 Å²	53	12%	0.124	24%	0.242	C	C	.	.			trans	60.7	24.6	-173.7	0	0	0	0	0	113.6	H80 E82 K165	H80-G84 VanDerWaalsContact O-CA 3.24Å; H80-G84 WeakPolarHBondContact O-CA 3.45Å; H80-G84 PolarHBondContact O-N 3.38Å; E82-G84 VanDerWaalsContact C-N 3.34Å; E82-G84 PolarHBondContact O-N 3.48Å; G84-K165 PolarHBondContact O-NZ 2.98Å
85	T	96.9	Very high	97.6	Very high	36 Å²	36	54 Å²	54	22%	0.221	25%	0.251	C	S	.	.			trans	-85.4	144	171.7	47.8	0	0	0	0	109	K79 H80 K83	K79-T85 CarbonylContact C-O 3.53Å; K79-T85 WeakPolarHBondContact CA-O 3.48Å; H80-T85 WeakPolarHBondContact CB-OG1 3.12Å; H80-T85 PolarHBondContact N-O 3.38Å; K83-T85 HydrophobicContact CB-CG2 4.23Å; K83-T85 PolarHBondContact O-N 3.33Å
86	I	98.3	Very high	97.5	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	130	179.5	-58.5	172	0	0	0	109	L48 L78 K79 Y103 I104 C158 I162	L48-I86 HydrophobicContact CD1-CD1 4.02Å; L48-I86 HydrophobicContact CD1-CG1 4.39Å; L48-I86 HydrophobicContact CD1-CG2 4.43Å; L78-I86 CarbonylContact O-C 3.6Å; L78-I86 VanDerWaalsContact O-CA 3.25Å; L78-I86 WeakPolarHBondContact O-CA 3.14Å; K79-I86 HydrophobicContact CB-CG1 3.92Å; K79-I86 HydrophobicContact CD-CD1 4.46Å; K79-I86 HydrophobicContact CD-CG1 4.36Å; K79-I86 HydrophobicContact CG-CG1 3.91Å; I86-Y103 WeakPolarHBondContact O-CA 3.24Å; I86-I104 HydrophobicContact CG2-CD1 4Å; I86-I104 HydrophobicContact CG2-CG1 4.5Å; I86-I104 PolarHBondContact O-N 3.41Å; I86-C158 HydrophobicContact CD1-CB 3.77Å; I86-C158 HydrophobicContact CG2-CB 4Å; I86-I162 HydrophobicContact CB-CD1 4.14Å; I86-I162 HydrophobicContact CB-CG1 4.29Å; I86-I162 HydrophobicContact CD1-CD1 4.16Å; I86-I162 HydrophobicContact CD1-CG1 4.19Å; I86-I162 HydrophobicContact CG1-CD1 3.94Å; I86-I162 HydrophobicContact CG1-CG1 4.33Å
87	R	98.4	Very high	97.4	Very high	34 Å²	34	64.2 Å²	64.2	13%	0.128	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152.3	176.1	66.2	176.3	179.1	172.6	-3	112.4	L41 E45 L77 L78 H102 Y103	L41-R87 PolarHBondContact O-NH2 2.94Å; E45-R87 VanDerWaalsContact CD-NE 3.27Å; E45-R87 WeakPolarHBondContact OE1-CD 3.45Å; E45-R87 IonicContact OE1-CZ 3.65Å; E45-R87 IonicContact OE1-NE 2.73Å; E45-R87 PolarHBondContact OE1-NE 3.42Å; E45-R87 IonicContact OE1-NH2 3.71Å; E45-R87 IonicContact OE2-CZ 3.31Å; E45-R87 IonicContact OE2-NE 2.78Å; E45-R87 PolarHBondContact OE2-NE 3.09Å; E45-R87 IonicContact OE2-NH2 3.33Å; E45-R87 PolarHBondContact OE2-NH2 3.36Å; L77-R87 WeakPolarHBondContact CA-O 3.21Å; L78-R87 HydrophobicContact CB-CG 4.12Å; L78-R87 PolarHBondContact N-O 3.41Å; L78-R87 PolarHBondContact O-N 3.47Å; R87-H102 CarbonylContact C-O 3.51Å; R87-H102 VanDerWaalsContact CA-O 3.26Å; R87-H102 WeakPolarHBondContact CA-O 3.41Å; R87-H102 WeakPolarHBondContact CB-O 3.01Å; R87-Y103 HydrophobicContact CB-CD1 3.82Å; R87-Y103 HydrophobicContact CB-CE1 4.14Å
88	L	98.6	Very high	97.4	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125	166	-174	153.8	0	0	0	108.2	V75 K76 L77 A100 N101 H102 W122 F151 F155	V75-L88 HydrophobicContact CG2-CD1 3.98Å; V75-L88 HydrophobicContact CG2-CD2 3.93Å; V75-L88 HydrophobicContact CG2-CG 3.78Å; K76-L88 WeakPolarHBondContact O-CA 3.41Å; L77-L88 HydrophobicContact CD2-CB 4.03Å; L77-L88 HydrophobicContact CD2-CD1 4.25Å; L77-L88 HydrophobicContact CD2-CG 4.18Å; L88-A100 HydrophobicContact CD2-CB 3.6Å; L88-N101 VanDerWaalsContact O-CA 3.29Å; L88-N101 WeakPolarHBondContact O-CA 3.2Å; L88-H102 PolarHBondContact N-O 2.71Å; L88-H102 PolarHBondContact O-N 3.05Å; L88-H102 VanDerWaalsContact O-N 3.16Å; L88-W122 HydrophobicContact CD1-CH2 4.33Å; L88-W122 HydrophobicContact CD1-CZ2 3.82Å; L88-F151 HydrophobicContact CD1-CE2 4.31Å; L88-F151 HydrophobicContact CD1-CZ 3.98Å; L88-F155 HydrophobicContact CD1-CE2 4.34Å
89	L	98.7	Very high	97.4	Very high	4 Å²	4	66.2 Å²	66.2	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.8	175.6	-175.8	68.5	0	0	0	109.7	E42 K76 L78 I98 A100 N101	E42-L89 HydrophobicContact CG-CD2 3.69Å; E42-L89 WeakPolarHBondContact OE1-CD2 3.43Å; K76-L89 PolarHBondContact N-O 2.83Å; K76-L89 PolarHBondContact O-N 2.85Å; L78-L89 HydrophobicContact CD1-CB 3.95Å; L78-L89 HydrophobicContact CD1-CD2 3.69Å; L78-L89 HydrophobicContact CD1-CG 4.49Å; L89-I98 HydrophobicContact CD1-CD1 4.17Å; L89-I98 HydrophobicContact CD1-CG1 4.34Å; L89-I98 HydrophobicContact CD1-CG2 3.9Å; L89-A100 WeakPolarHBondContact CA-O 3.49Å; L89-N101 HydrophobicContact CD1-CB 3.92Å
90	M	98.7	Very high	97.4	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.8	177.1	-169	179.2	174.7	0	0	110.6	A53 L55 D74 V75 C99 A100	A53-M90 HydrophobicContact CB-CE 4.18Å; A53-M90 WeakPolarHBondContact O-CE 3.39Å; L55-M90 HydrophobicContact CB-CE 4.12Å; L55-M90 HydrophobicContact CB-SD 3.7Å; L55-M90 HydrophobicContact CD2-SD 4.21Å; L55-M90 HydrophobicContact CG-SD 4.4Å; D74-M90 WeakPolarHBondContact O-CG 3.1Å; V75-M90 HydrophobicContact CB-CB 4.49Å; V75-M90 HydrophobicContact CB-CG 4.26Å; V75-M90 HydrophobicContact CB-SD 4.22Å; M90-C99 VanDerWaalsContact CG-SG 3.56Å; M90-C99 PolarHBondContact O-N 2.78Å; M90-C99 PolarHBondContact O-SG 2.84Å; M90-A100 HydrophobicContact CB-CB 4.17Å; M90-A100 PolarHBondContact N-O 3.28Å; M90-A100 PolarHBondContact O-N 2.99Å
91	R	98.5	Very high	97.4	Very high	70 Å²	70	63.7 Å²	63.7	26%	0.264	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	143	178.9	-65.8	176.9	-177.5	-86.3	2.5	110.4	T40 E42 G73 L96 K97 I98	T40-R91 PolarHBondContact O-NH2 3.13Å; E42-R91 IonicContact OE1-CZ 2.76Å; E42-R91 VanDerWaalsContact OE1-CZ 3.31Å; E42-R91 IonicContact OE1-NE 3.99Å; E42-R91 PolarHBondContact OE1-NE 3.14Å; E42-R91 IonicContact OE1-NH2 3.23Å; E42-R91 PolarHBondContact OE1-NH2 2.99Å; G73-R91 VanDerWaalsContact CA-O 3.29Å; G73-R91 WeakPolarHBondContact CA-O 3.23Å; R91-L96 PolarHBondContact NH1-O 3.22Å; R91-K97 CarbonylContact C-O 3.6Å; R91-K97 WeakPolarHBondContact CA-O 3.27Å; R91-I98 HydrophobicContact CG-CG1 4.3Å
92	R	98.3	Very high	97.5	Very high	59 Å²	59	57.4 Å²	57.4	22%	0.223	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	144.3	176	-62.3	-177.9	-171.8	84.9	-2.5	110.9	R70 T72 T95 L96 K97 I98 C99	R70-R92 VanDerWaalsContact O-CZ 3.26Å; R70-R92 PolarHBondContact O-NE 3.16Å; R70-R92 PolarHBondContact O-NH2 3.43Å; T72-R92 WeakPolarHBondContact O-CA 3.29Å; R92-T95 WeakPolarHBondContact CB-OG1 3.27Å; R92-L96 VanDerWaalsContact O-CA 3.29Å; R92-L96 WeakPolarHBondContact O-CA 3.44Å; R92-L96 PolarHBondContact O-N 3.17Å; R92-K97 PolarHBondContact N-O 2.78Å; R92-I98 PolarHBondContact NH1-O 2.87Å; R92-C99 HydrophobicContact CG-CB 3.93Å
93	D	97.5	Very high	97.7	Very high	69 Å²	69	55.1 Å²	55.1	37%	0.369	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	151.3	170.6	-60.7	-29.9	0	0	0	112	R52 T72 T95	R52-D93 IonicContact CZ-OD1 3.52Å; R52-D93 IonicContact CZ-OD2 2.95Å; R52-D93 IonicContact NH1-OD1 3.11Å; R52-D93 PolarHBondContact NH1-OD1 3.15Å; R52-D93 IonicContact NH1-OD2 3.1Å; R52-D93 PolarHBondContact NH1-OD2 3.18Å; R52-D93 IonicContact NH2-OD2 3.66Å; R52-D93 PolarHBondContact NH2-OD2 3.35Å; T72-D93 PolarHBondContact O-N 3.27Å; D93-T95 PolarHBondContact O-N 3.34Å
94	K	96.4	Very high	97.8	Very high	202 Å²	202	49.2 Å²	49.2	88%	0.878	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	-49.5	175	-50	-59.1	-177.4	177.3	0	114.3
95	T	96.7	Very high	97.9	Very high	85 Å²	85	51 Å²	51	52%	0.521	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-20.2	179.8	64.5	0	0	0	0	113.5	R92 D93 K97	R92-T95 WeakPolarHBondContact CB-OG1 3.27Å; D93-T95 PolarHBondContact O-N 3.34Å; T95-K97 PolarHBondContact O-N 3.04Å
96	L	96	Very high	97.8	Very high	117 Å²	117	50.1 Å²	50.1	61%	0.613	24%	0.236	S	C	*	.			trans	56.6	9.2	-178.3	-54.4	178.5	0	0	0	115.3	R91 R92	R91-L96 PolarHBondContact NH1-O 3.22Å; R92-L96 VanDerWaalsContact O-CA 3.29Å; R92-L96 WeakPolarHBondContact O-CA 3.44Å; R92-L96 PolarHBondContact O-N 3.17Å
97	K	98	Very high	97.6	Very high	141 Å²	141	58.3 Å²	58.3	61%	0.613	28%	0.276	S	S	*	.			trans	-64.9	135.4	176.4	-70.8	-172.7	176.6	-175.4	0	110.3	R91 R92 T95	R91-K97 CarbonylContact C-O 3.6Å; R91-K97 WeakPolarHBondContact CA-O 3.27Å; R92-K97 PolarHBondContact N-O 2.78Å; T95-K97 PolarHBondContact O-N 3.04Å
98	I	98.2	Very high	97.5	Very high	47 Å²	47	57.1 Å²	57.1	24%	0.241	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	138.4	174.2	-57.8	177.4	0	0	0	109.2	L89 R91 R92 A100 N101 A129	L89-I98 HydrophobicContact CD1-CD1 4.17Å; L89-I98 HydrophobicContact CD1-CG1 4.34Å; L89-I98 HydrophobicContact CD1-CG2 3.9Å; R91-I98 HydrophobicContact CG-CG1 4.3Å; R92-I98 PolarHBondContact NH1-O 2.87Å; I98-A100 WeakPolarHBondContact CG2-O 3.26Å; I98-N101 HydrophobicContact CG2-CB 3.76Å; I98-A129 HydrophobicContact CG2-CB 3.99Å
99	C	98.2	Very high	97.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	-13	179.1	66.7	0	0	0	0	113.7	L55 R70 M90 R92	L55-C99 WeakPolarHBondContact CD2-O 3.48Å; R70-C99 HydrophobicContact CG-CB 4.19Å; R70-C99 VanDerWaalsContact CG-O 3.25Å; R70-C99 WeakPolarHBondContact CG-O 3.37Å; R70-C99 PolarHBondContact NE-O 2.98Å; M90-C99 VanDerWaalsContact CG-SG 3.56Å; M90-C99 PolarHBondContact O-N 2.78Å; M90-C99 PolarHBondContact O-SG 2.84Å; R92-C99 HydrophobicContact CG-CB 3.93Å
100	A	98.6	Very high	97.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	140.1	160.7	0	0	0	0	0	109	L55 L88 L89 M90 I98 D127	L55-A100 HydrophobicContact CD2-CB 3.67Å; L88-A100 HydrophobicContact CD2-CB 3.6Å; L89-A100 WeakPolarHBondContact CA-O 3.49Å; M90-A100 HydrophobicContact CB-CB 4.17Å; M90-A100 PolarHBondContact N-O 3.28Å; M90-A100 PolarHBondContact O-N 2.99Å; I98-A100 WeakPolarHBondContact CG2-O 3.26Å; A100-D127 WeakPolarHBondContact CA-OD1 2.99Å
101	N	98.6	Very high	97.2	Very high	24 Å²	24	68 Å²	68	13%	0.128	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	95.5	174.7	180	18.3	0	0	0	109.3	L88 L89 I98 D127 F128	L88-N101 VanDerWaalsContact O-CA 3.29Å; L88-N101 WeakPolarHBondContact O-CA 3.2Å; L89-N101 HydrophobicContact CD1-CB 3.92Å; I98-N101 HydrophobicContact CG2-CB 3.76Å; N101-D127 PolarHBondContact N-OD1 2.61Å; N101-F128 WeakPolarHBondContact O-CB 3.33Å; N101-F128 PolarHBondContact O-N 3.46Å
102	H	98.6	Very high	97.1	Very high	5 Å²	5	69.1 Å²	69.1	2%	0.023	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	153.4	177	50.6	-104	0	0	0	111.6	R87 L88 W122 T124 D127 L138	R87-H102 CarbonylContact C-O 3.51Å; R87-H102 VanDerWaalsContact CA-O 3.26Å; R87-H102 WeakPolarHBondContact CA-O 3.41Å; R87-H102 WeakPolarHBondContact CB-O 3.01Å; L88-H102 PolarHBondContact N-O 2.71Å; L88-H102 PolarHBondContact O-N 3.05Å; L88-H102 VanDerWaalsContact O-N 3.16Å; H102-W122 AromaticContact CE1-CE2 4Å; H102-W122 AromaticContact CE1-CZ2 3.88Å; H102-W122 AromaticContact CE1-NE1 3.48Å; H102-W122 PolarHBondContact CE1-NE1 3Å; H102-W122 AromaticContact NE2-CE2 3.83Å; H102-W122 AromaticContact NE2-CZ2 3.95Å; H102-W122 AromaticContact NE2-NE1 3.1Å; H102-W122 PolarHBondContact NE2-NE1 3.49Å; H102-W122 VanDerWaalsContact NE2-NE1 3.1Å; H102-T124 WeakPolarHBondContact CB-OG1 3.2Å; H102-D127 IonicContact CE1-OD1 2.61Å; H102-D127 IonicContact CG-OD1 3.93Å; H102-D127 IonicContact ND1-OD1 3.79Å; H102-D127 PolarHBondContact ND1-OD1 3.36Å; H102-L138 VanDerWaalsContact CE1-CD1 3.44Å; H102-L138 WeakPolarHBondContact CE1-CD1 3.22Å
103	Y	98.2	Very high	96.7	Very high	122 Å²	122	68.7 Å²	68.7	48%	0.478	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	144.8	171.6	-66.9	-69.2	0	0	0	111.6	I86 R87 M108	I86-Y103 WeakPolarHBondContact O-CA 3.24Å; R87-Y103 HydrophobicContact CB-CD1 3.82Å; R87-Y103 HydrophobicContact CB-CE1 4.14Å; Y103-M108 WeakPolarHBondContact O-CE 3.41Å
104	I	98	Very high	96.1	Very high	4 Å²	4	70 Å²	70	2%	0.021	36%	0.36	C	S	.	.			trans	-75.6	127	165.5	-62.9	-176.8	0	0	0	107.7	L77 I86 F155 C158 R159	L77-I104 HydrophobicContact CD1-CD1 4.48Å; L77-I104 HydrophobicContact CD2-CD1 3.83Å; I86-I104 HydrophobicContact CG2-CD1 4Å; I86-I104 HydrophobicContact CG2-CG1 4.5Å; I86-I104 PolarHBondContact O-N 3.41Å; I104-F155 HydrophobicContact CD1-CD2 3.73Å; I104-F155 HydrophobicContact CD1-CE2 3.63Å; I104-F155 HydrophobicContact CD1-CG 4.31Å; I104-F155 HydrophobicContact CD1-CZ 4.13Å; I104-F155 HydrophobicContact CG1-CD2 4.43Å; I104-F155 HydrophobicContact CG1-CE2 3.82Å; I104-F155 HydrophobicContact CG1-CZ 4.06Å; I104-F155 HydrophobicContact CG2-CE1 4.3Å; I104-F155 HydrophobicContact CG2-CZ 4.15Å; I104-C158 HydrophobicContact CD1-CB 3.86Å; I104-R159 HydrophobicContact CG2-CB 3.98Å; I104-R159 HydrophobicContact CG2-CG 4.47Å
105	T	96.2	Very high	95.7	Very high	49 Å²	49	64.8 Å²	64.8	30%	0.301	36%	0.364	S	S	.	.			trans	-111.2	156.5	175.2	70.5	0	0	0	0	110.9	M107 M108	T105-M107 PolarHBondContact O-N 2.95Å; T105-M107 VanDerWaalsContact O-N 3.11Å; T105-M108 HydrophobicContact CG2-CE 4.21Å; T105-M108 WeakPolarHBondContact O-CB 3.36Å; T105-M108 PolarHBondContact O-N 3.45Å; T105-M108 VanDerWaalsContact O-N 3.08Å; T105-M108 WeakPolarHBondContact OG1-CG 3.24Å
106	P	95	Very high	95.5	Very high	19 Å²	19	62.1 Å²	62.1	12%	0.123	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-21.1	179.2	-28.9	40.1	0	0	0	114.2	R159 I162 E163 E166	P106-R159 PolarHBondContact O-NE 3.46Å; P106-R159 PolarHBondContact O-NH2 2.86Å; P106-I162 HydrophobicContact CG-CG2 3.93Å; P106-E163 HydrophobicContact CB-CB 3.97Å; P106-E163 HydrophobicContact CB-CG 4.1Å; P106-E163 HydrophobicContact CG-CB 4.12Å; P106-E166 WeakPolarHBondContact CG-OE2 3.32Å
107	M	93.9	Very high	95.4	Very high	172 Å²	172	61.2 Å²	61.2	85%	0.847	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-10.5	-180	-63.3	-94.7	-89.5	0	0	112.8	T105	T105-M107 PolarHBondContact O-N 2.95Å; T105-M107 VanDerWaalsContact O-N 3.11Å
108	M	96.6	Very high	95.4	Very high	10 Å²	10	59.4 Å²	59.4	5%	0.049	33%	0.333	C	S	.	.			trans	-72.1	138	178.8	-73.8	179.3	-178.2	0	0	111.8	Y103 T105 F155 R159	Y103-M108 WeakPolarHBondContact O-CE 3.41Å; T105-M108 HydrophobicContact CG2-CE 4.21Å; T105-M108 WeakPolarHBondContact O-CB 3.36Å; T105-M108 PolarHBondContact O-N 3.45Å; T105-M108 VanDerWaalsContact O-N 3.08Å; T105-M108 WeakPolarHBondContact OG1-CG 3.24Å; M108-F155 HydrophobicContact CB-CE1 4.24Å; M108-F155 HydrophobicContact CB-CZ 4.22Å; M108-F155 HydrophobicContact SD-CZ 4.23Å; M108-R159 WeakPolarHBondContact O-CD 2.95Å; M108-R159 PolarHBondContact O-NE 2.82Å
109	E	95.4	Very high	95.3	Very high	110 Å²	110	57.3 Å²	57.3	51%	0.514	32%	0.323	S	S	.	.			trans	-136.5	134	176.8	-175.4	-172.5	-167	0	0	109.5	K111 W122	E109-K111 HydrophobicContact CG-CG 4.38Å; E109-K111 WeakPolarHBondContact OE2-CE 3.24Å; E109-K111 IonicContact OE2-NZ 3.6Å; E109-W122 WeakPolarHBondContact O-CB 3.28Å
110	L	97.4	Very high	95.3	Very high	5 Å²	5	58 Å²	58	3%	0.026	33%	0.326	C	S	.	.			trans	-85.4	110.3	172.6	-65.8	-178.3	0	0	0	109.9	W120 W122 F151 K152 F155	L110-W120 HydrophobicContact CB-CB 4.14Å; L110-W120 HydrophobicContact CB-CD2 4.36Å; L110-W120 HydrophobicContact CB-CE3 4.33Å; L110-W120 HydrophobicContact CB-CG 4.28Å; L110-W120 HydrophobicContact CD1-CG 4.34Å; L110-W120 HydrophobicContact CD2-CB 4.11Å; L110-W120 HydrophobicContact CG-CB 4.49Å; L110-W122 HydrophobicContact CD2-CB 4.04Å; L110-W122 HydrophobicContact CD2-CD2 4.02Å; L110-W122 HydrophobicContact CD2-CE3 3.8Å; L110-W122 HydrophobicContact CD2-CG 4.15Å; L110-F151 HydrophobicContact CD1-CD1 3.96Å; L110-F151 HydrophobicContact CD1-CE1 3.66Å; L110-F151 HydrophobicContact CD2-CE1 4.15Å; L110-K152 HydrophobicContact CD1-CB 4.11Å; L110-K152 HydrophobicContact CD1-CG 4.16Å; L110-F155 HydrophobicContact CD1-CB 3.69Å; L110-F155 HydrophobicContact CD1-CD1 3.77Å; L110-F155 HydrophobicContact CD1-CD2 4.34Å; L110-F155 HydrophobicContact CD1-CG 3.68Å; L110-F155 HydrophobicContact CD2-CD1 4.26Å; L110-F155 HydrophobicContact CD2-CD2 4.48Å; L110-F155 HydrophobicContact CD2-CE1 4.22Å; L110-F155 HydrophobicContact CD2-CE2 4.43Å; L110-F155 HydrophobicContact CD2-CG 4.4Å; L110-F155 HydrophobicContact CD2-CZ 4.3Å; L110-F155 HydrophobicContact CG-CD1 3.72Å; L110-F155 HydrophobicContact CG-CE1 4.01Å; L110-F155 HydrophobicContact CG-CG 4.06Å
111	K	96.7	Very high	95.3	Very high	119 Å²	119	58.9 Å²	58.9	52%	0.517	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.4	177.4	-65.6	-177.5	179.1	179.6	0	110.8	E109 W120 V121	E109-K111 HydrophobicContact CG-CG 4.38Å; E109-K111 WeakPolarHBondContact OE2-CE 3.24Å; E109-K111 IonicContact OE2-NZ 3.6Å; K111-W120 CarbonylContact O-C 3.57Å; K111-W120 WeakPolarHBondContact O-CA 3.33Å; K111-V121 PolarHBondContact N-O 3.24Å; K111-V121 PolarHBondContact O-N 3.25Å
112	P	96.1	Very high	95.3	Very high	92 Å²	92	58 Å²	58	60%	0.597	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.2	139.7	176.3	26.3	-32.7	0	0	0	110.4	W120	P112-W120 HydrophobicContact CB-CE3 4.29Å; P112-W120 HydrophobicContact CB-CZ3 3.83Å; P112-W120 HydrophobicContact CG-CZ3 4.44Å
113	N	90.9	Very high	95.2	Very high	51 Å²	51	60.7 Å²	60.7	27%	0.273	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-80	133.9	172.7	-170.5	46.9	0	0	0	110.4	G115 S116 A119 V121	N113-G115 PolarHBondContact O-N 3.49Å; N113-S116 PolarHBondContact O-N 3.49Å; N113-A119 HydrophobicContact CB-CB 4.03Å; N113-A119 PolarHBondContact N-O 2.94Å; N113-V121 HydrophobicContact CB-CG2 3.82Å
114	A	85	Confident	95.2	Very high	96 Å²	96	55 Å²	55	79%	0.793	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	124.1	179.1	0	0	0	0	0	110.8
115	G	87	Confident	95.1	Very high	93 Å²	93	61 Å²	61	96%	0.959	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	7.7	179.7	0	0	0	0	0	115.9	N113	N113-G115 PolarHBondContact O-N 3.49Å
116	S	93	Very high	95.2	Very high	28 Å²	28	61.1 Å²	61.1	20%	0.196	35%	0.353	C	S	.	.			trans	-133.5	127.3	174.5	-165.7	0	0	0	0	112.9	N113 R118	N113-S116 PolarHBondContact O-N 3.49Å; S116-R118 VanDerWaalsContact C-N 3.29Å; S116-R118 WeakPolarHBondContact OG-CG 3.37Å; S116-R118 PolarHBondContact OG-N 2.93Å
117	D	94.4	Very high	95.3	Very high	98 Å²	98	60.3 Å²	60.3	52%	0.524	35%	0.347	S	S	.	.	S	Bend	trans	-81.7	-8.8	172	63.3	-16.6	0	0	0	113.5	A145	D117-A145 HydrophobicContact CB-CB 4.21Å
118	R	96.5	Very high	95.5	Very high	103 Å²	103	56.4 Å²	56.4	39%	0.389	33%	0.326	S	S	.	.	S	Bend	trans	-123.4	16.3	-171.3	70.7	-176	85.5	170.3	10	113.5	S116 R141 F142 L143 A148	S116-R118 VanDerWaalsContact C-N 3.29Å; S116-R118 WeakPolarHBondContact OG-CG 3.37Å; S116-R118 PolarHBondContact OG-N 2.93Å; R118-R141 HydrophobicContact CG-CG 3.97Å; R118-R141 WeakPolarHBondContact O-CA 3.49Å; R118-F142 WeakPolarHBondContact CD-O 3.29Å; R118-F142 PolarHBondContact O-N 2.98Å; R118-L143 PolarHBondContact NH1-O 2.81Å; R118-A148 HydrophobicContact CB-CB 4.31Å
119	A	97.8	Very high	95.6	Very high	4 Å²	4	56.4 Å²	56.4	3%	0.033	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	140	-178.7	0	0	0	0	0	113.3	N113 I140 R141	N113-A119 HydrophobicContact CB-CB 4.03Å; N113-A119 PolarHBondContact N-O 2.94Å; A119-I140 CarbonylContact C-O 3.57Å; A119-I140 WeakPolarHBondContact CA-O 3.41Å; A119-I140 WeakPolarHBondContact CB-O 3.24Å; A119-R141 HydrophobicContact CB-CB 4.27Å; A119-R141 HydrophobicContact CB-CG 4.24Å
120	W	98.4	Very high	95.6	Very high	14 Å²	14	54.3 Å²	54.3	5%	0.053	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	147.7	176.9	-56.9	112.7	0	0	0	110.7	L110 K111 P112 A139 I140 A148 F151 K152	L110-W120 HydrophobicContact CB-CB 4.14Å; L110-W120 HydrophobicContact CB-CD2 4.36Å; L110-W120 HydrophobicContact CB-CE3 4.33Å; L110-W120 HydrophobicContact CB-CG 4.28Å; L110-W120 HydrophobicContact CD1-CG 4.34Å; L110-W120 HydrophobicContact CD2-CB 4.11Å; L110-W120 HydrophobicContact CG-CB 4.49Å; K111-W120 CarbonylContact O-C 3.57Å; K111-W120 WeakPolarHBondContact O-CA 3.33Å; P112-W120 HydrophobicContact CB-CE3 4.29Å; P112-W120 HydrophobicContact CB-CZ3 3.83Å; P112-W120 HydrophobicContact CG-CZ3 4.44Å; W120-A139 CarbonylContact O-C 3.56Å; W120-A139 WeakPolarHBondContact O-CA 3.4Å; W120-I140 HydrophobicContact CB-CG2 4.21Å; W120-I140 PolarHBondContact N-O 3.02Å; W120-I140 PolarHBondContact O-N 2.85Å; W120-A148 PolarHBondContact NE1-O 2.96Å; W120-F151 AromaticContact CD1-CD1 3.86Å; W120-K152 HydrophobicContact CD2-CD 4.29Å; W120-K152 HydrophobicContact CE3-CD 4.23Å; W120-K152 HydrophobicContact CH2-CD 3.36Å; W120-K152 HydrophobicContact CZ2-CB 3.87Å; W120-K152 HydrophobicContact CZ2-CD 3.35Å; W120-K152 HydrophobicContact CZ2-CG 4.21Å; W120-K152 HydrophobicContact CZ3-CD 3.8Å
121	V	98.1	Very high	95.6	Very high	19 Å²	19	62 Å²	62	12%	0.115	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.2	178.1	-175.3	0	0	0	0	109.2	W67 K111 N113 L137 L138 A139	W67-V121 HydrophobicContact CH2-CG1 3.84Å; W67-V121 HydrophobicContact CH2-CG2 4.39Å; W67-V121 HydrophobicContact CZ2-CG1 4.26Å; W67-V121 HydrophobicContact CZ2-CG2 4.35Å; K111-V121 PolarHBondContact N-O 3.24Å; K111-V121 PolarHBondContact O-N 3.25Å; N113-V121 HydrophobicContact CB-CG2 3.82Å; V121-L137 HydrophobicContact CG1-CD1 3.79Å; V121-L137 HydrophobicContact CG1-CG 4.14Å; V121-L138 CarbonylContact C-O 3.54Å; V121-L138 VanDerWaalsContact CA-O 3.27Å; V121-L138 WeakPolarHBondContact CA-O 3.48Å; V121-L138 WeakPolarHBondContact CG1-O 3.25Å; V121-A139 HydrophobicContact CG2-CB 3.93Å
122	W	98.4	Very high	95.5	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.015	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	158.9	173.6	72.6	103.9	0	0	0	111.7	L55 L88 H102 E109 L110 L138 I140	L55-W122 HydrophobicContact CD1-CH2 3.77Å; L55-W122 HydrophobicContact CD1-CZ2 4.46Å; L88-W122 HydrophobicContact CD1-CH2 4.33Å; L88-W122 HydrophobicContact CD1-CZ2 3.82Å; H102-W122 AromaticContact CE1-CE2 4Å; H102-W122 AromaticContact CE1-CZ2 3.88Å; H102-W122 AromaticContact CE1-NE1 3.48Å; H102-W122 PolarHBondContact CE1-NE1 3Å; H102-W122 AromaticContact NE2-CE2 3.83Å; H102-W122 AromaticContact NE2-CZ2 3.95Å; H102-W122 AromaticContact NE2-NE1 3.1Å; H102-W122 PolarHBondContact NE2-NE1 3.49Å; H102-W122 VanDerWaalsContact NE2-NE1 3.1Å; E109-W122 WeakPolarHBondContact O-CB 3.28Å; L110-W122 HydrophobicContact CD2-CB 4.04Å; L110-W122 HydrophobicContact CD2-CD2 4.02Å; L110-W122 HydrophobicContact CD2-CE3 3.8Å; L110-W122 HydrophobicContact CD2-CG 4.15Å; W122-L138 HydrophobicContact CD2-CB 4.23Å; W122-L138 HydrophobicContact CE3-CB 4.34Å; W122-L138 HydrophobicContact CH2-CB 3.95Å; W122-L138 HydrophobicContact CZ2-CB 3.83Å; W122-L138 HydrophobicContact CZ2-CD1 3.78Å; W122-L138 HydrophobicContact CZ2-CG 4.48Å; W122-L138 HydrophobicContact CZ3-CB 4.19Å; W122-L138 PolarHBondContact N-O 3.08Å; W122-L138 PolarHBondContact O-N 2.86Å; W122-I140 HydrophobicContact CE3-CG2 4.49Å; W122-I140 HydrophobicContact CH2-CB 3.85Å; W122-I140 HydrophobicContact CH2-CG2 4.01Å; W122-I140 HydrophobicContact CZ3-CB 3.65Å; W122-I140 HydrophobicContact CZ3-CG2 3.48Å; W122-I140 VanDerWaalsContact CZ3-CG2 3.48Å
123	N	97.4	Very high	95.6	Very high	62 Å²	62	59.1 Å²	59.1	33%	0.332	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	141.5	173.4	-164.4	-81.2	0	0	0	110	Q135 L137	N123-Q135 PolarHBondContact OD1-NE2 3.03Å; N123-L137 HydrophobicContact CB-CD1 4.4Å
124	T	97.4	Very high	95.8	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.018	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.8	167.9	180	0	0	0	0	109.6	H102 D127 Q135 E136 L138	H102-T124 WeakPolarHBondContact CB-OG1 3.2Å; T124-D127 HydrophobicContact CG2-CB 3.85Å; T124-Q135 CarbonylContact O-C 3.58Å; T124-Q135 WeakPolarHBondContact O-CA 3.44Å; T124-E136 HydrophobicContact CG2-CB 3.8Å; T124-E136 PolarHBondContact N-O 2.79Å; T124-E136 PolarHBondContact O-N 2.9Å; T124-L138 HydrophobicContact CG2-CD1 3.91Å; T124-L138 HydrophobicContact CG2-CG 4.42Å
125	H	96.4	Very high	96.4	Very high	129 Å²	129	61.9 Å²	61.9	60%	0.597	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	-22.4	-177.3	-66.1	-68.3	0	0	0	113.4
126	A	97.3	Very high	96.8	Very high	53 Å²	53	58.2 Å²	58.2	44%	0.438	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	67.8	-172.7	0	0	0	0	0	111	P133	A126-P133 HydrophobicContact CB-CB 4.23Å
127	D	98.3	Very high	97	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.011	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	134.7	164.2	-169	77.3	0	0	0	110.5	A100 N101 H102 T124 A129 C132 P133 K134 E136	A100-D127 WeakPolarHBondContact CA-OD1 2.99Å; N101-D127 PolarHBondContact N-OD1 2.61Å; H102-D127 IonicContact CE1-OD1 2.61Å; H102-D127 IonicContact CG-OD1 3.93Å; H102-D127 IonicContact ND1-OD1 3.79Å; H102-D127 PolarHBondContact ND1-OD1 3.36Å; T124-D127 HydrophobicContact CG2-CB 3.85Å; D127-A129 WeakPolarHBondContact OD2-CB 3.47Å; D127-A129 PolarHBondContact OD2-N 3.08Å; D127-A129 VanDerWaalsContact OD2-N 3.11Å; D127-C132 VanDerWaalsContact O-O 3.13Å; D127-P133 WeakPolarHBondContact O-CA 3.26Å; D127-K134 PolarHBondContact N-O 3.39Å; D127-K134 PolarHBondContact O-N 2.78Å; D127-E136 HydrophobicContact CB-CB 4.3Å; D127-E136 HydrophobicContact CB-CG 3.83Å
128	F	98.2	Very high	97.2	Very high	89 Å²	89	55 Å²	55	39%	0.39	28%	0.281	S	S	.	.			trans	-118.1	26.2	-173.9	-156.2	-104.7	0	0	0	112	N101 D130 E131 P133	N101-F128 WeakPolarHBondContact O-CB 3.33Å; N101-F128 PolarHBondContact O-N 3.46Å; F128-D130 VanDerWaalsContact C-N 3.25Å; F128-D130 PolarHBondContact O-N 2.83Å; F128-E131 HydrophobicContact CE1-CB 4.19Å; F128-E131 WeakPolarHBondContact CE2-O 3.46Å; F128-E131 HydrophobicContact CZ-CB 4.34Å; F128-E131 WeakPolarHBondContact CZ-O 3.44Å; F128-E131 PolarHBondContact O-N 2.99Å; F128-P133 HydrophobicContact CD2-CB 4.47Å; F128-P133 HydrophobicContact CD2-CG 3.92Å; F128-P133 HydrophobicContact CE2-CG 3.94Å
129	A	97.6	Very high	97.3	Very high	11 Å²	11	50.3 Å²	50.3	9%	0.091	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-28.3	-179.7	0	0	0	0	0	113.8	I98 D127	I98-A129 HydrophobicContact CG2-CB 3.99Å; D127-A129 WeakPolarHBondContact OD2-CB 3.47Å; D127-A129 PolarHBondContact OD2-N 3.08Å; D127-A129 VanDerWaalsContact OD2-N 3.11Å
130	D	96	Very high	97.3	Very high	66 Å²	66	50.1 Å²	50.1	35%	0.353	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	23.8	178.9	-49.2	-31.7	0	0	0	111.8	R70 F128 C132 K134	R70-D130 IonicContact NH2-OD1 2.82Å; R70-D130 PolarHBondContact NH2-OD1 2.81Å; R70-D130 VanDerWaalsContact NH2-OD1 3.1Å; R70-D130 IonicContact NH2-OD2 2.64Å; R70-D130 PolarHBondContact NH2-OD2 2.98Å; R70-D130 VanDerWaalsContact NH2-OD2 3.11Å; F128-D130 VanDerWaalsContact C-N 3.25Å; F128-D130 PolarHBondContact O-N 2.83Å; D130-C132 PolarHBondContact O-N 3.11Å; D130-K134 IonicContact OD2-NZ 2.71Å; D130-K134 PolarHBondContact OD2-NZ 3.04Å
131	E	96.1	Very high	97.3	Very high	166 Å²	166	54.8 Å²	54.8	78%	0.776	28%	0.281	S	S	*	.	S	Bend	trans	56.7	20.9	-177.7	-55.6	-175	143.9	0	0	114.6	F128	F128-E131 HydrophobicContact CE1-CB 4.19Å; F128-E131 WeakPolarHBondContact CE2-O 3.46Å; F128-E131 HydrophobicContact CZ-CB 4.34Å; F128-E131 WeakPolarHBondContact CZ-O 3.44Å; F128-E131 PolarHBondContact O-N 2.99Å
132	C	96.3	Very high	97.3	Very high	63 Å²	63	54.1 Å²	54.1	43%	0.426	28%	0.277	S	S	.	.	S	Bend	trans	-140.6	129.7	177.5	179.2	0	0	0	0	108.4	D127 D130 K134	D127-C132 VanDerWaalsContact O-O 3.13Å; D130-C132 PolarHBondContact O-N 3.11Å; C132-K134 PolarHBondContact O-N 2.97Å
133	P	96.7	Very high	97.3	Very high	87 Å²	87	60.4 Å²	60.4	57%	0.565	31%	0.31	S	S	*	.			trans	-66.6	120.6	-177.9	-15.9	30.8	0	0	0	110.6	A126 D127 F128	A126-P133 HydrophobicContact CB-CB 4.23Å; D127-P133 WeakPolarHBondContact O-CA 3.26Å; F128-P133 HydrophobicContact CD2-CB 4.47Å; F128-P133 HydrophobicContact CD2-CG 3.92Å; F128-P133 HydrophobicContact CE2-CG 3.94Å
134	K	96.2	Very high	97.3	Very high	83 Å²	83	60.2 Å²	60.2	36%	0.361	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.7	178.4	-65.6	176	-170.7	175	0	110.4	D127 D130 C132 E136	D127-K134 PolarHBondContact N-O 3.39Å; D127-K134 PolarHBondContact O-N 2.78Å; D130-K134 IonicContact OD2-NZ 2.71Å; D130-K134 PolarHBondContact OD2-NZ 3.04Å; C132-K134 PolarHBondContact O-N 2.97Å; K134-E136 HydrophobicContact CB-CG 4.31Å
135	Q	96.6	Very high	97.3	Very high	123 Å²	123	61.6 Å²	61.6	58%	0.575	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	129.1	166.4	-176.4	170.9	12.4	0	0	108.7	N123 T124	N123-Q135 PolarHBondContact OD1-NE2 3.03Å; T124-Q135 CarbonylContact O-C 3.58Å; T124-Q135 WeakPolarHBondContact O-CA 3.44Å
136	E	96.5	Very high	97.4	Very high	16 Å²	16	60.9 Å²	60.9	8%	0.075	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.6	-176.1	-66.7	-77.6	-148.5	0	0	110.4	R57 R70 T124 D127 K134 L138	R57-E136 WeakPolarHBondContact CD-OE1 3.38Å; R57-E136 WeakPolarHBondContact CD-OE2 3.49Å; R57-E136 WeakPolarHBondContact CG-OE2 3.41Å; R57-E136 IonicContact CZ-OE1 2.93Å; R57-E136 IonicContact NE-OE1 2.62Å; R57-E136 PolarHBondContact NE-OE1 3.29Å; R57-E136 IonicContact NE-OE2 2.8Å; R57-E136 PolarHBondContact NE-OE2 2.89Å; R57-E136 IonicContact NH2-OE1 3.07Å; R70-E136 IonicContact CZ-OE1 3.81Å; R70-E136 IonicContact NH1-OE1 2.76Å; R70-E136 PolarHBondContact NH1-OE1 3.37Å; R70-E136 IonicContact NH2-OE1 3.18Å; T124-E136 HydrophobicContact CG2-CB 3.8Å; T124-E136 PolarHBondContact N-O 2.79Å; T124-E136 PolarHBondContact O-N 2.9Å; D127-E136 HydrophobicContact CB-CB 4.3Å; D127-E136 HydrophobicContact CB-CG 3.83Å; K134-E136 HydrophobicContact CB-CG 4.31Å; E136-L138 HydrophobicContact CB-CD1 4.49Å; E136-L138 HydrophobicContact CB-CD2 3.96Å; E136-L138 HydrophobicContact CB-CG 3.97Å
137	L	97.4	Very high	97.4	Very high	57 Å²	57	59.9 Å²	59.9	30%	0.298	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	111	162.9	-178.7	71.5	0	0	0	107.6	F58 W67 V121 N123	F58-L137 HydrophobicContact CB-CB 3.91Å; F58-L137 HydrophobicContact CB-CD2 3.82Å; F58-L137 HydrophobicContact CB-CG 4.11Å; F58-L137 HydrophobicContact CD1-CD2 3.9Å; F58-L137 HydrophobicContact CG-CD2 3.89Å; F58-L137 PolarHBondContact N-O 2.86Å; W67-L137 HydrophobicContact CH2-CD2 4.18Å; W67-L137 HydrophobicContact CH2-CG 4.06Å; V121-L137 HydrophobicContact CG1-CD1 3.79Å; V121-L137 HydrophobicContact CG1-CG 4.14Å; N123-L137 HydrophobicContact CB-CD1 4.4Å
138	L	98.2	Very high	97.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	145	-172.1	-62.9	175.6	0	0	0	110.3	L55 F56 R57 H102 V121 W122 T124 E136	L55-L138 HydrophobicContact CD1-CB 4.29Å; F56-L138 WeakPolarHBondContact O-CA 3.29Å; R57-L138 HydrophobicContact CB-CD2 4.37Å; R57-L138 HydrophobicContact CG-CD2 4.4Å; H102-L138 VanDerWaalsContact CE1-CD1 3.44Å; H102-L138 WeakPolarHBondContact CE1-CD1 3.22Å; V121-L138 CarbonylContact C-O 3.54Å; V121-L138 VanDerWaalsContact CA-O 3.27Å; V121-L138 WeakPolarHBondContact CA-O 3.48Å; V121-L138 WeakPolarHBondContact CG1-O 3.25Å; W122-L138 HydrophobicContact CD2-CB 4.23Å; W122-L138 HydrophobicContact CE3-CB 4.34Å; W122-L138 HydrophobicContact CH2-CB 3.95Å; W122-L138 HydrophobicContact CZ2-CB 3.83Å; W122-L138 HydrophobicContact CZ2-CD1 3.78Å; W122-L138 HydrophobicContact CZ2-CG 4.48Å; W122-L138 HydrophobicContact CZ3-CB 4.19Å; W122-L138 PolarHBondContact N-O 3.08Å; W122-L138 PolarHBondContact O-N 2.86Å; T124-L138 HydrophobicContact CG2-CD1 3.91Å; T124-L138 HydrophobicContact CG2-CG 4.42Å; E136-L138 HydrophobicContact CB-CD1 4.49Å; E136-L138 HydrophobicContact CB-CD2 3.96Å; E136-L138 HydrophobicContact CB-CG 3.97Å
139	A	98.1	Very high	97.4	Very high	5 Å²	5	59.7 Å²	59.7	4%	0.041	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136.5	166.5	0	0	0	0	0	110	L55 F56 W67 W120 V121	L55-A139 CarbonylContact C-O 3.5Å; L55-A139 WeakPolarHBondContact CA-O 3.16Å; F56-A139 HydrophobicContact CB-CB 4.26Å; F56-A139 PolarHBondContact N-O 3.44Å; F56-A139 PolarHBondContact O-N 3.47Å; W67-A139 HydrophobicContact CE3-CB 3.96Å; W67-A139 HydrophobicContact CH2-CB 3.65Å; W67-A139 HydrophobicContact CZ2-CB 4.23Å; W67-A139 HydrophobicContact CZ3-CB 3.49Å; W67-A139 VanDerWaalsContact CZ3-CB 3.49Å; W120-A139 CarbonylContact O-C 3.56Å; W120-A139 WeakPolarHBondContact O-CA 3.4Å; V121-A139 HydrophobicContact CG2-CB 3.93Å
140	I	98.6	Very high	97.4	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137	177.1	-165.6	166.1	0	0	0	109.5	A53 K54 L55 V75 A119 W120 W122 F142 F151	A53-I140 HydrophobicContact CB-CD1 3.65Å; A53-I140 HydrophobicContact CB-CG1 3.61Å; K54-I140 WeakPolarHBondContact O-CA 3.41Å; L55-I140 HydrophobicContact CD1-CB 4.21Å; L55-I140 HydrophobicContact CD1-CG1 4.5Å; V75-I140 HydrophobicContact CB-CD1 3.92Å; V75-I140 HydrophobicContact CG1-CD1 3.79Å; V75-I140 HydrophobicContact CG2-CD1 4Å; A119-I140 CarbonylContact C-O 3.57Å; A119-I140 WeakPolarHBondContact CA-O 3.41Å; A119-I140 WeakPolarHBondContact CB-O 3.24Å; W120-I140 HydrophobicContact CB-CG2 4.21Å; W120-I140 PolarHBondContact N-O 3.02Å; W120-I140 PolarHBondContact O-N 2.85Å; W122-I140 HydrophobicContact CE3-CG2 4.49Å; W122-I140 HydrophobicContact CH2-CB 3.85Å; W122-I140 HydrophobicContact CH2-CG2 4.01Å; W122-I140 HydrophobicContact CZ3-CB 3.65Å; W122-I140 HydrophobicContact CZ3-CG2 3.48Å; W122-I140 VanDerWaalsContact CZ3-CG2 3.48Å; I140-F142 HydrophobicContact CB-CE2 4.49Å; I140-F142 HydrophobicContact CD1-CE1 4.39Å; I140-F142 HydrophobicContact CD1-CE2 4.3Å; I140-F142 HydrophobicContact CD1-CZ 3.74Å; I140-F142 HydrophobicContact CG1-CE2 4.08Å; I140-F142 HydrophobicContact CG1-CZ 3.97Å; I140-F142 HydrophobicContact CG2-CE2 3.7Å; I140-F142 HydrophobicContact CG2-CZ 4.18Å; I140-F151 HydrophobicContact CD1-CZ 4.47Å; I140-F151 HydrophobicContact CG2-CD1 4.38Å; I140-F151 HydrophobicContact CG2-CE1 3.91Å; I140-F151 HydrophobicContact CG2-CZ 4.45Å
141	R	98.2	Very high	97.5	Very high	112 Å²	112	60.7 Å²	60.7	42%	0.423	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.7	179.6	-167.5	-173.7	-48.4	176.3	5.5	110.4	A53 K54 F56 R118 A119	A53-R141 WeakPolarHBondContact CA-O 3.49Å; K54-R141 PolarHBondContact N-O 3.5Å; K54-R141 PolarHBondContact O-N 2.84Å; F56-R141 HydrophobicContact CE2-CB 4.02Å; R118-R141 HydrophobicContact CG-CG 3.97Å; R118-R141 WeakPolarHBondContact O-CA 3.49Å; A119-R141 HydrophobicContact CB-CB 4.27Å; A119-R141 HydrophobicContact CB-CG 4.24Å
142	F	98.5	Very high	97.6	Very high	6 Å²	6	55 Å²	55	3%	0.026	28%	0.277	C	S	.	.			trans	-105.6	169	177.4	-63.1	-85.7	0	0	0	111.5	M51 A53 V75 R118 I140 N144 N147 A148 F151	M51-F142 HydrophobicContact CB-CE1 4.32Å; M51-F142 HydrophobicContact CG-CD1 4.16Å; M51-F142 HydrophobicContact CG-CE1 4.28Å; M51-F142 HydrophobicContact SD-CD1 3.8Å; M51-F142 HydrophobicContact SD-CE1 4.06Å; A53-F142 HydrophobicContact CB-CD1 3.99Å; A53-F142 HydrophobicContact CB-CE1 3.73Å; A53-F142 HydrophobicContact CB-CZ 4.27Å; V75-F142 HydrophobicContact CG1-CE1 3.99Å; V75-F142 HydrophobicContact CG1-CZ 4.23Å; R118-F142 WeakPolarHBondContact CD-O 3.29Å; R118-F142 PolarHBondContact O-N 2.98Å; I140-F142 HydrophobicContact CB-CE2 4.49Å; I140-F142 HydrophobicContact CD1-CE1 4.39Å; I140-F142 HydrophobicContact CD1-CE2 4.3Å; I140-F142 HydrophobicContact CD1-CZ 3.74Å; I140-F142 HydrophobicContact CG1-CE2 4.08Å; I140-F142 HydrophobicContact CG1-CZ 3.97Å; I140-F142 HydrophobicContact CG2-CE2 3.7Å; I140-F142 HydrophobicContact CG2-CZ 4.18Å; F142-N144 PolarHBondContact O-N 2.88Å; F142-N147 HydrophobicContact CB-CB 3.92Å; F142-N147 HydrophobicContact CD1-CB 4.46Å; F142-N147 HydrophobicContact CG-CB 4.4Å; F142-A148 HydrophobicContact CB-CB 4.25Å; F142-A148 HydrophobicContact CD2-CB 3.76Å; F142-A148 HydrophobicContact CG-CB 4.33Å; F142-F151 HydrophobicContact CE1-CB 4.01Å; F142-F151 HydrophobicContact CE1-CD2 4.43Å; F142-F151 HydrophobicContact CE1-CG 4.21Å; F142-F151 HydrophobicContact CE2-CB 3.68Å; F142-F151 AromaticContact CE2-CD1 3.61Å; F142-F151 HydrophobicContact CE2-CD1 3.61Å; F142-F151 HydrophobicContact CE2-CD2 4.47Å; F142-F151 HydrophobicContact CE2-CE1 4.35Å; F142-F151 AromaticContact CE2-CG 3.67Å; F142-F151 HydrophobicContact CE2-CG 3.67Å; F142-F151 HydrophobicContact CZ-CB 3.38Å; F142-F151 AromaticContact CZ-CD1 3.63Å; F142-F151 HydrophobicContact CZ-CD1 3.63Å; F142-F151 AromaticContact CZ-CD2 3.67Å; F142-F151 HydrophobicContact CZ-CD2 3.67Å; F142-F151 HydrophobicContact CZ-CE1 4.29Å; F142-F151 HydrophobicContact CZ-CE2 4.32Å; F142-F151 AromaticContact CZ-CG 3.25Å; F142-F151 HydrophobicContact CZ-CG 3.25Å
143	L	97.5	Very high	97.7	Very high	135 Å²	135	55.4 Å²	55.4	71%	0.707	28%	0.277	S	S	*	.	S	Bend	trans	-57.9	-47.8	179.1	179.1	61.9	0	0	0	112	R118	R118-L143 PolarHBondContact NH1-O 2.81Å
144	N	97.1	Very high	97.8	Very high	58 Å²	58	54 Å²	54	31%	0.31	26%	0.262	S	S	.	.	S	Bend	trans	-138.4	168.1	-176.4	61.7	28	0	0	0	111	F142 E146 N147 A148	F142-N144 PolarHBondContact O-N 2.88Å; N144-E146 VanDerWaalsContact C-N 3.33Å; N144-E146 PolarHBondContact O-N 3.08Å; N144-E146 PolarHBondContact OD1-N 2.83Å; N144-N147 PolarHBondContact O-N 2.87Å; N144-N147 WeakPolarHBondContact OD1-CB 3.38Å; N144-N147 PolarHBondContact OD1-N 2.75Å; N144-N147 PolarHBondContact OD1-ND2 3.1Å; N144-N147 PolarHBondContact OD1-OD1 3.48Å; N144-A148 PolarHBondContact O-N 2.86Å
145	A	97.2	Very high	97.9	Very high	32 Å²	32	50 Å²	50	26%	0.264	25%	0.245	S	C	.	.	H	α-helix	trans	-63.8	-36	-179.7	0	0	0	0	0	112.7	D117 N147 A148 Q149	D117-A145 HydrophobicContact CB-CB 4.21Å; A145-N147 PolarHBondContact O-N 2.93Å; A145-A148 WeakPolarHBondContact O-CB 3.47Å; A145-A148 PolarHBondContact O-N 2.6Å; A145-Q149 WeakPolarHBondContact O-CG 3.44Å; A145-Q149 PolarHBondContact O-N 3.25Å
146	E	97.9	Very high	97.9	Very high	115 Å²	115	48.3 Å²	48.3	54%	0.537	24%	0.237	S	C	.	.	H	α-helix	trans	-59	-46.5	178.1	-171.5	-166.8	156.3	0	0	111.8	N144 A148 Q149 K150	N144-E146 VanDerWaalsContact C-N 3.33Å; N144-E146 PolarHBondContact O-N 3.08Å; N144-E146 PolarHBondContact OD1-N 2.83Å; E146-A148 VanDerWaalsContact C-N 3.32Å; E146-A148 PolarHBondContact O-N 2.87Å; E146-Q149 PolarHBondContact O-N 2.73Å; E146-K150 WeakPolarHBondContact O-CG 3.49Å; E146-K150 PolarHBondContact O-N 2.8Å; E146-K150 WeakPolarHBondContact OE1-CE 3.34Å; E146-K150 IonicContact OE1-NZ 2.67Å; E146-K150 PolarHBondContact OE1-NZ 2.91Å
147	N	98.1	Very high	98	Very high	32 Å²	32	52 Å²	52	17%	0.171	25%	0.254	C	S	.	.	H	α-helix	trans	-63.3	-39.7	176.4	-76.7	-4.6	0	0	0	111.7	M51 F142 N144 A145 Q149 K150 F151	M51-N147 HydrophobicContact CE-CB 4.37Å; M51-N147 HydrophobicContact SD-CB 3.45Å; M51-N147 WeakPolarHBondContact SD-CB 3.35Å; F142-N147 HydrophobicContact CB-CB 3.92Å; F142-N147 HydrophobicContact CD1-CB 4.46Å; F142-N147 HydrophobicContact CG-CB 4.4Å; N144-N147 PolarHBondContact O-N 2.87Å; N144-N147 WeakPolarHBondContact OD1-CB 3.38Å; N144-N147 PolarHBondContact OD1-N 2.75Å; N144-N147 PolarHBondContact OD1-ND2 3.1Å; N144-N147 PolarHBondContact OD1-OD1 3.48Å; A145-N147 PolarHBondContact O-N 2.93Å; N147-Q149 VanDerWaalsContact C-N 3.34Å; N147-K150 PolarHBondContact O-N 2.91Å; N147-F151 PolarHBondContact O-N 3.32Å
148	A	98	Very high	98	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-40.8	174.7	0	0	0	0	0	111.8	R118 W120 F142 N144 A145 E146 F151 K152	R118-A148 HydrophobicContact CB-CB 4.31Å; W120-A148 PolarHBondContact NE1-O 2.96Å; F142-A148 HydrophobicContact CB-CB 4.25Å; F142-A148 HydrophobicContact CD2-CB 3.76Å; F142-A148 HydrophobicContact CG-CB 4.33Å; N144-A148 PolarHBondContact O-N 2.86Å; A145-A148 WeakPolarHBondContact O-CB 3.47Å; A145-A148 PolarHBondContact O-N 2.6Å; E146-A148 VanDerWaalsContact C-N 3.32Å; E146-A148 PolarHBondContact O-N 2.87Å; A148-F151 PolarHBondContact O-N 3.43Å; A148-K152 PolarHBondContact O-N 2.94Å
149	Q	97.8	Very high	97.9	Very high	87 Å²	87	53.3 Å²	53.3	41%	0.407	26%	0.255	S	S	.	.	H	α-helix	trans	-66.2	-43.7	175	-64.9	-54.5	-37.3	0	0	111.8	A145 E146 N147 F151 K152 T153	A145-Q149 WeakPolarHBondContact O-CG 3.44Å; A145-Q149 PolarHBondContact O-N 3.25Å; E146-Q149 PolarHBondContact O-N 2.73Å; N147-Q149 VanDerWaalsContact C-N 3.34Å; Q149-F151 VanDerWaalsContact C-N 3.31Å; Q149-F151 PolarHBondContact O-N 2.86Å; Q149-K152 PolarHBondContact O-N 2.82Å; Q149-T153 PolarHBondContact O-N 3.17Å; Q149-T153 PolarHBondContact O-OG1 2.71Å; Q149-T153 VanDerWaalsContact O-OG1 3.13Å
150	K	98.3	Very high	97.8	Very high	97 Å²	97	59 Å²	59	42%	0.422	28%	0.279	S	S	.	.	H	α-helix	trans	-55.6	-45.5	175	-73.8	174.4	-176.5	166.6	0	111.9	F49 M51 E146 N147 K154	F49-K150 HydrophobicContact CE2-CB 4.37Å; M51-K150 HydrophobicContact CE-CB 4.24Å; M51-K150 HydrophobicContact CE-CD 4.28Å; E146-K150 WeakPolarHBondContact O-CG 3.49Å; E146-K150 PolarHBondContact O-N 2.8Å; E146-K150 WeakPolarHBondContact OE1-CE 3.34Å; E146-K150 IonicContact OE1-NZ 2.67Å; E146-K150 PolarHBondContact OE1-NZ 2.91Å; N147-K150 PolarHBondContact O-N 2.91Å; K150-K154 WeakPolarHBondContact O-CB 3.25Å; K150-K154 PolarHBondContact O-N 2.71Å; K150-K154 VanDerWaalsContact O-N 3.09Å
151	F	98.5	Very high	97.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-47	174.3	173.5	-102.4	0	0	0	111.6	F49 V75 L88 L110 W120 I140 F142 N147 A148 Q149 K154 F155	F49-F151 HydrophobicContact CD1-CD2 4.04Å; F49-F151 HydrophobicContact CE1-CB 4.1Å; F49-F151 AromaticContact CE1-CD2 3.58Å; F49-F151 HydrophobicContact CE1-CD2 3.58Å; F49-F151 HydrophobicContact CE1-CG 4.33Å; F49-F151 HydrophobicContact CZ-CB 3.75Å; F49-F151 HydrophobicContact CZ-CD2 4.11Å; F49-F151 HydrophobicContact CZ-CG 4.45Å; V75-F151 HydrophobicContact CG1-CD2 4.39Å; V75-F151 HydrophobicContact CG1-CE2 4.35Å; V75-F151 HydrophobicContact CG2-CE2 4.15Å; L88-F151 HydrophobicContact CD1-CE2 4.31Å; L88-F151 HydrophobicContact CD1-CZ 3.98Å; L110-F151 HydrophobicContact CD1-CD1 3.96Å; L110-F151 HydrophobicContact CD1-CE1 3.66Å; L110-F151 HydrophobicContact CD2-CE1 4.15Å; W120-F151 AromaticContact CD1-CD1 3.86Å; I140-F151 HydrophobicContact CD1-CZ 4.47Å; I140-F151 HydrophobicContact CG2-CD1 4.38Å; I140-F151 HydrophobicContact CG2-CE1 3.91Å; I140-F151 HydrophobicContact CG2-CZ 4.45Å; F142-F151 HydrophobicContact CE1-CB 4.01Å; F142-F151 HydrophobicContact CE1-CD2 4.43Å; F142-F151 HydrophobicContact CE1-CG 4.21Å; F142-F151 HydrophobicContact CE2-CB 3.68Å; F142-F151 AromaticContact CE2-CD1 3.61Å; F142-F151 HydrophobicContact CE2-CD1 3.61Å; F142-F151 HydrophobicContact CE2-CD2 4.47Å; F142-F151 HydrophobicContact CE2-CE1 4.35Å; F142-F151 AromaticContact CE2-CG 3.67Å; F142-F151 HydrophobicContact CE2-CG 3.67Å; F142-F151 HydrophobicContact CZ-CB 3.38Å; F142-F151 AromaticContact CZ-CD1 3.63Å; F142-F151 HydrophobicContact CZ-CD1 3.63Å; F142-F151 AromaticContact CZ-CD2 3.67Å; F142-F151 HydrophobicContact CZ-CD2 3.67Å; F142-F151 HydrophobicContact CZ-CE1 4.29Å; F142-F151 HydrophobicContact CZ-CE2 4.32Å; F142-F151 AromaticContact CZ-CG 3.25Å; F142-F151 HydrophobicContact CZ-CG 3.25Å; N147-F151 PolarHBondContact O-N 3.32Å; A148-F151 PolarHBondContact O-N 3.43Å; Q149-F151 VanDerWaalsContact C-N 3.31Å; Q149-F151 PolarHBondContact O-N 2.86Å; F151-K154 PolarHBondContact O-N 2.83Å; F151-F155 HydrophobicContact CE1-CD2 4.36Å; F151-F155 HydrophobicContact CE2-CD2 4.45Å; F151-F155 AromaticContact CZ-CD2 3.87Å; F151-F155 HydrophobicContact CZ-CD2 3.87Å; F151-F155 VanDerWaalsContact O-CB 3.29Å; F151-F155 WeakPolarHBondContact O-CB 3.4Å; F151-F155 PolarHBondContact O-N 3.37Å
152	K	97.9	Very high	97.6	Very high	48 Å²	48	57.7 Å²	57.7	21%	0.209	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-50.2	-179.8	176.4	172.3	176.2	179.5	0	112.2	L110 W120 A148 Q149 K154 F155 E156	L110-K152 HydrophobicContact CD1-CB 4.11Å; L110-K152 HydrophobicContact CD1-CG 4.16Å; W120-K152 HydrophobicContact CD2-CD 4.29Å; W120-K152 HydrophobicContact CE3-CD 4.23Å; W120-K152 HydrophobicContact CH2-CD 3.36Å; W120-K152 HydrophobicContact CZ2-CB 3.87Å; W120-K152 HydrophobicContact CZ2-CD 3.35Å; W120-K152 HydrophobicContact CZ2-CG 4.21Å; W120-K152 HydrophobicContact CZ3-CD 3.8Å; A148-K152 PolarHBondContact O-N 2.94Å; Q149-K152 PolarHBondContact O-N 2.82Å; K152-K154 VanDerWaalsContact C-N 3.29Å; K152-K154 PolarHBondContact O-N 3.25Å; K152-F155 PolarHBondContact O-N 2.64Å; K152-E156 WeakPolarHBondContact CE-OE1 3.29Å; K152-E156 HydrophobicContact CG-CG 4.37Å; K152-E156 IonicContact NZ-OE1 3.96Å; K152-E156 WeakPolarHBondContact O-CB 3.47Å; K152-E156 WeakPolarHBondContact O-CG 3.49Å; K152-E156 PolarHBondContact O-N 2.93Å
153	T	98.2	Very high	97.4	Very high	70 Å²	70	60.2 Å²	60.2	43%	0.429	29%	0.29	S	S	.	.	H	α-helix	trans	-55	-47.6	176.8	-58.9	0	0	0	0	110.5	Q149 F155 E156 E157	Q149-T153 PolarHBondContact O-N 3.17Å; Q149-T153 PolarHBondContact O-OG1 2.71Å; Q149-T153 VanDerWaalsContact O-OG1 3.13Å; T153-F155 PolarHBondContact O-N 3.18Å; T153-E156 PolarHBondContact O-N 3.23Å; T153-E157 WeakPolarHBondContact O-CG 3.29Å; T153-E157 PolarHBondContact O-N 2.62Å
154	K	98.2	Very high	97.3	Very high	57 Å²	57	57.8 Å²	57.8	25%	0.248	28%	0.275	C	S	.	.	H	α-helix	trans	-69.7	-35.2	-178.2	-161.3	45.7	167	169.5	0	113.2	L48 F49 L77 K150 F151 K152 E157 C158	L48-K154 WeakPolarHBondContact O-CE 3.37Å; F49-K154 HydrophobicContact CB-CB 4.5Å; F49-K154 HydrophobicContact CB-CG 3.79Å; F49-K154 HydrophobicContact CD2-CB 3.89Å; F49-K154 HydrophobicContact CD2-CG 3.9Å; F49-K154 HydrophobicContact CE2-CB 4.48Å; F49-K154 HydrophobicContact CG-CB 4.39Å; F49-K154 HydrophobicContact CG-CG 4.17Å; L77-K154 HydrophobicContact CD1-CB 4.47Å; L77-K154 HydrophobicContact CD1-CG 4.24Å; K150-K154 WeakPolarHBondContact O-CB 3.25Å; K150-K154 PolarHBondContact O-N 2.71Å; K150-K154 VanDerWaalsContact O-N 3.09Å; F151-K154 PolarHBondContact O-N 2.83Å; K152-K154 VanDerWaalsContact C-N 3.29Å; K152-K154 PolarHBondContact O-N 3.25Å; K154-E157 HydrophobicContact CD-CB 4.49Å; K154-E157 WeakPolarHBondContact CD-OE2 3.44Å; K154-E157 IonicContact NZ-OE2 2.7Å; K154-E157 PolarHBondContact NZ-OE2 2.91Å; K154-C158 PolarHBondContact O-N 2.8Å; K154-C158 VanDerWaalsContact O-N 3.08Å; K154-C158 PolarHBondContact O-SG 3.42Å
155	F	98.4	Very high	97	Very high	1 Å²	1	59.2 Å²	59.2	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-65.6	-43.5	174.2	-171.6	-80.5	0	0	0	111.6	L77 L88 I104 M108 L110 F151 K152 T153 C158 R159	L77-F155 HydrophobicContact CD1-CB 4.42Å; L77-F155 HydrophobicContact CD2-CD2 4.36Å; L88-F155 HydrophobicContact CD1-CE2 4.34Å; I104-F155 HydrophobicContact CD1-CD2 3.73Å; I104-F155 HydrophobicContact CD1-CE2 3.63Å; I104-F155 HydrophobicContact CD1-CG 4.31Å; I104-F155 HydrophobicContact CD1-CZ 4.13Å; I104-F155 HydrophobicContact CG1-CD2 4.43Å; I104-F155 HydrophobicContact CG1-CE2 3.82Å; I104-F155 HydrophobicContact CG1-CZ 4.06Å; I104-F155 HydrophobicContact CG2-CE1 4.3Å; I104-F155 HydrophobicContact CG2-CZ 4.15Å; M108-F155 HydrophobicContact CB-CE1 4.24Å; M108-F155 HydrophobicContact CB-CZ 4.22Å; M108-F155 HydrophobicContact SD-CZ 4.23Å; L110-F155 HydrophobicContact CD1-CB 3.69Å; L110-F155 HydrophobicContact CD1-CD1 3.77Å; L110-F155 HydrophobicContact CD1-CD2 4.34Å; L110-F155 HydrophobicContact CD1-CG 3.68Å; L110-F155 HydrophobicContact CD2-CD1 4.26Å; L110-F155 HydrophobicContact CD2-CD2 4.48Å; L110-F155 HydrophobicContact CD2-CE1 4.22Å; L110-F155 HydrophobicContact CD2-CE2 4.43Å; L110-F155 HydrophobicContact CD2-CG 4.4Å; L110-F155 HydrophobicContact CD2-CZ 4.3Å; L110-F155 HydrophobicContact CG-CD1 3.72Å; L110-F155 HydrophobicContact CG-CE1 4.01Å; L110-F155 HydrophobicContact CG-CG 4.06Å; F151-F155 HydrophobicContact CE1-CD2 4.36Å; F151-F155 HydrophobicContact CE2-CD2 4.45Å; F151-F155 AromaticContact CZ-CD2 3.87Å; F151-F155 HydrophobicContact CZ-CD2 3.87Å; F151-F155 VanDerWaalsContact O-CB 3.29Å; F151-F155 WeakPolarHBondContact O-CB 3.4Å; F151-F155 PolarHBondContact O-N 3.37Å; K152-F155 PolarHBondContact O-N 2.64Å; T153-F155 PolarHBondContact O-N 3.18Å; F155-C158 PolarHBondContact O-N 3.27Å; F155-R159 WeakPolarHBondContact O-CB 3.36Å; F155-R159 PolarHBondContact O-N 2.96Å
156	E	97.7	Very high	96.6	Very high	86 Å²	86	63.4 Å²	63.4	40%	0.402	29%	0.292	S	S	.	.	H	α-helix	trans	-66.4	-39.4	177.5	-73.6	178.5	171.3	0	0	112.3	K152 T153 R159 K160	K152-E156 WeakPolarHBondContact CE-OE1 3.29Å; K152-E156 HydrophobicContact CG-CG 4.37Å; K152-E156 IonicContact NZ-OE1 3.96Å; K152-E156 WeakPolarHBondContact O-CB 3.47Å; K152-E156 WeakPolarHBondContact O-CG 3.49Å; K152-E156 PolarHBondContact O-N 2.93Å; T153-E156 PolarHBondContact O-N 3.23Å; E156-R159 PolarHBondContact O-N 3.16Å; E156-K160 WeakPolarHBondContact O-CB 2.94Å; E156-K160 PolarHBondContact O-N 3.33Å
157	E	97.5	Very high	96.2	Very high	94 Å²	94	64.2 Å²	64.2	44%	0.439	29%	0.294	S	S	.	.	H	α-helix	trans	-55.9	-49.9	169.8	-76.2	174.1	-165	0	0	111.2	T153 K154 K160 E161	T153-E157 WeakPolarHBondContact O-CG 3.29Å; T153-E157 PolarHBondContact O-N 2.62Å; K154-E157 HydrophobicContact CD-CB 4.49Å; K154-E157 WeakPolarHBondContact CD-OE2 3.44Å; K154-E157 IonicContact NZ-OE2 2.7Å; K154-E157 PolarHBondContact NZ-OE2 2.91Å; E157-K160 PolarHBondContact O-N 2.8Å; E157-E161 PolarHBondContact O-N 3.5Å
158	C	97.5	Very high	95.5	Very high	1 Å²	1	70.4 Å²	70.4	1%	0.007	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-44.3	178.9	-66.8	0	0	0	0	111.9	I86 I104 K154 F155 K160 E161 I162	I86-C158 HydrophobicContact CD1-CB 3.77Å; I86-C158 HydrophobicContact CG2-CB 4Å; I104-C158 HydrophobicContact CD1-CB 3.86Å; K154-C158 PolarHBondContact O-N 2.8Å; K154-C158 VanDerWaalsContact O-N 3.08Å; K154-C158 PolarHBondContact O-SG 3.42Å; F155-C158 PolarHBondContact O-N 3.27Å; C158-K160 PolarHBondContact O-N 2.88Å; C158-E161 PolarHBondContact O-N 3.34Å; C158-I162 WeakPolarHBondContact O-CG1 3.32Å; C158-I162 PolarHBondContact O-N 2.82Å; C158-I162 VanDerWaalsContact O-N 3.08Å
159	R	96.8	Very high	94.1	Very high	84 Å²	84	73.1 Å²	73.1	32%	0.317	35%	0.348	S	S	.	.	H	α-helix	trans	-58.4	-47	176.9	-178.8	-153.2	173.4	-143.4	-1.1	111	I104 P106 M108 F155 E156 I162 E163	I104-R159 HydrophobicContact CG2-CB 3.98Å; I104-R159 HydrophobicContact CG2-CG 4.47Å; P106-R159 PolarHBondContact O-NE 3.46Å; P106-R159 PolarHBondContact O-NH2 2.86Å; M108-R159 WeakPolarHBondContact O-CD 2.95Å; M108-R159 PolarHBondContact O-NE 2.82Å; F155-R159 WeakPolarHBondContact O-CB 3.36Å; F155-R159 PolarHBondContact O-N 2.96Å; E156-R159 PolarHBondContact O-N 3.16Å; R159-I162 PolarHBondContact O-N 3.39Å; R159-E163 PolarHBondContact O-N 2.86Å
160	K	96.5	Very high	92.2	Very high	124 Å²	124	73.4 Å²	73.4	54%	0.539	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-41.3	178.9	-173.8	-177.3	176.4	-169	0	111.6	E156 E157 C158 I162 E163 E164	E156-K160 WeakPolarHBondContact O-CB 2.94Å; E156-K160 PolarHBondContact O-N 3.33Å; E157-K160 PolarHBondContact O-N 2.8Å; C158-K160 PolarHBondContact O-N 2.88Å; K160-I162 VanDerWaalsContact C-N 3.32Å; K160-I162 PolarHBondContact O-N 2.85Å; K160-E163 WeakPolarHBondContact O-CB 3.28Å; K160-E163 PolarHBondContact O-N 2.82Å; K160-E164 WeakPolarHBondContact CE-OE1 3.19Å; K160-E164 IonicContact NZ-OE1 3.48Å; K160-E164 WeakPolarHBondContact O-CG 3.15Å; K160-E164 PolarHBondContact O-N 2.78Å
161	E	96.2	Very high	89.8	Confident	71 Å²	71	71.9 Å²	71.9	33%	0.332	37%	0.371	S	S	.	.	H	α-helix	trans	-59.9	-42.6	176	-171.8	-176.7	149.1	0	0	111.9	K79 E157 C158 E164 K165	K79-E161 WeakPolarHBondContact CE-OE1 3.44Å; K79-E161 IonicContact NZ-OE1 2.74Å; K79-E161 PolarHBondContact NZ-OE1 3.31Å; K79-E161 IonicContact NZ-OE2 2.77Å; E157-E161 PolarHBondContact O-N 3.5Å; C158-E161 PolarHBondContact O-N 3.34Å; E161-E164 PolarHBondContact O-N 3.25Å; E161-K165 WeakPolarHBondContact O-CB 3.34Å; E161-K165 PolarHBondContact O-N 3.45Å
162	I	95.6	Very high	87.1	Confident	14 Å²	14	81 Å²	81	7%	0.072	41%	0.411	C	S	.	.	H	α-helix	trans	-65.1	-42.7	175.6	-63.4	-62.8	0	0	0	111.1	I86 P106 C158 R159 K160 E164 K165 E166	I86-I162 HydrophobicContact CB-CD1 4.14Å; I86-I162 HydrophobicContact CB-CG1 4.29Å; I86-I162 HydrophobicContact CD1-CD1 4.16Å; I86-I162 HydrophobicContact CD1-CG1 4.19Å; I86-I162 HydrophobicContact CG1-CD1 3.94Å; I86-I162 HydrophobicContact CG1-CG1 4.33Å; P106-I162 HydrophobicContact CG-CG2 3.93Å; C158-I162 WeakPolarHBondContact O-CG1 3.32Å; C158-I162 PolarHBondContact O-N 2.82Å; C158-I162 VanDerWaalsContact O-N 3.08Å; R159-I162 PolarHBondContact O-N 3.39Å; K160-I162 VanDerWaalsContact C-N 3.32Å; K160-I162 PolarHBondContact O-N 2.85Å; I162-E164 PolarHBondContact O-N 2.68Å; I162-K165 PolarHBondContact O-N 3.24Å; I162-E166 PolarHBondContact O-N 3.09Å
163	E	95.4	Very high	84.4	Confident	59 Å²	59	84.2 Å²	84.2	28%	0.276	43%	0.43	S	S	.	.	H	α-helix	trans	-60.5	-44.2	176.5	-169.9	-172.2	173.6	0	0	112.1	P106 R159 K160 K165 E166 K167	P106-E163 HydrophobicContact CB-CB 3.97Å; P106-E163 HydrophobicContact CB-CG 4.1Å; P106-E163 HydrophobicContact CG-CB 4.12Å; R159-E163 PolarHBondContact O-N 2.86Å; K160-E163 WeakPolarHBondContact O-CB 3.28Å; K160-E163 PolarHBondContact O-N 2.82Å; E163-K165 VanDerWaalsContact C-N 3.31Å; E163-K165 PolarHBondContact O-N 2.84Å; E163-E166 PolarHBondContact O-N 3Å; E163-K167 WeakPolarHBondContact O-CG 3.29Å; E163-K167 PolarHBondContact O-N 3.4Å; E163-K167 VanDerWaalsContact O-N 3.09Å; E163-K167 WeakPolarHBondContact OE1-CE 3.38Å; E163-K167 IonicContact OE1-NZ 3.81Å; E163-K167 PolarHBondContact OE1-NZ 2.86Å
164	E	94.1	Very high	81.9	Confident	84 Å²	84	85.7 Å²	85.7	39%	0.393	44%	0.436	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176.7	-73.4	-179.7	-173.2	0	0	112.3	K160 E161 I162 K167 K168	K160-E164 WeakPolarHBondContact CE-OE1 3.19Å; K160-E164 IonicContact NZ-OE1 3.48Å; K160-E164 WeakPolarHBondContact O-CG 3.15Å; K160-E164 PolarHBondContact O-N 2.78Å; E161-E164 PolarHBondContact O-N 3.25Å; I162-E164 PolarHBondContact O-N 2.68Å; E164-K167 PolarHBondContact O-N 2.78Å; E164-K168 WeakPolarHBondContact O-CG 3.41Å; E164-K168 PolarHBondContact O-N 2.95Å
165	K	91.6	Very high	79.7	Confident	88 Å²	88	86.6 Å²	86.6	38%	0.383	45%	0.449	S	S	.	.	H	α-helix	trans	-67.9	-40	177.1	-177.9	-178.9	167.7	-145	0	112.2	K83 G84 E161 I162 E163 K168 G169	K83-K165 VanDerWaalsContact O-CE 3.28Å; K83-K165 WeakPolarHBondContact O-CE 3.44Å; K83-K165 PolarHBondContact O-NZ 2.72Å; G84-K165 PolarHBondContact O-NZ 2.98Å; E161-K165 WeakPolarHBondContact O-CB 3.34Å; E161-K165 PolarHBondContact O-N 3.45Å; I162-K165 PolarHBondContact O-N 3.24Å; E163-K165 VanDerWaalsContact C-N 3.31Å; E163-K165 PolarHBondContact O-N 2.84Å; K165-K168 PolarHBondContact O-N 3.37Å; K165-G169 PolarHBondContact O-N 2.99Å
166	E	89	Confident	77.6	Confident	119 Å²	119	91.5 Å²	91.5	56%	0.556	48%	0.479	S	S	*	.	H	α-helix	trans	-63.7	-42	174	-72.7	-173.8	-179.4	0	0	111.6	P106 I162 E163 K168 G169 S170	P106-E166 WeakPolarHBondContact CG-OE2 3.32Å; I162-E166 PolarHBondContact O-N 3.09Å; E163-E166 PolarHBondContact O-N 3Å; E166-K168 PolarHBondContact O-N 3.28Å; E166-G169 PolarHBondContact O-N 2.87Å; E166-S170 PolarHBondContact O-N 2.91Å
167	K	89.2	Confident	75.6	Confident	133 Å²	133	94.3 Å²	94.3	58%	0.578	49%	0.492	S	S	*	.	H	α-helix	trans	-61.5	-43.1	175	-70.8	173.6	-174.7	168.3	0	112.4	E163 E164 S170 G171	E163-K167 WeakPolarHBondContact O-CG 3.29Å; E163-K167 PolarHBondContact O-N 3.4Å; E163-K167 VanDerWaalsContact O-N 3.09Å; E163-K167 WeakPolarHBondContact OE1-CE 3.38Å; E163-K167 IonicContact OE1-NZ 3.81Å; E163-K167 PolarHBondContact OE1-NZ 2.86Å; E164-K167 PolarHBondContact O-N 2.78Å; K167-S170 PolarHBondContact O-N 3.3Å; K167-G171 PolarHBondContact O-N 2.88Å
168	K	83.4	Confident	73.7	Confident	162 Å²	162	95.1 Å²	95.1	70%	0.704	49%	0.494	S	S	*	.	H	α-helix	trans	-66.9	-34.8	175.9	-73.6	174.4	-177.8	170.6	0	112.7	E164 K165 E166 G171	E164-K168 WeakPolarHBondContact O-CG 3.41Å; E164-K168 PolarHBondContact O-N 2.95Å; K165-K168 PolarHBondContact O-N 3.37Å; E166-K168 PolarHBondContact O-N 3.28Å; K168-G171 PolarHBondContact O-N 3.36Å
169	G	69	Low	72	Confident	57 Å²	57	98.8 Å²	98.8	59%	0.588	52%	0.516	S	S	*	.	H	α-helix	trans	-67.5	-36.5	176	0	0	0	0	0	113	K165 E166 G171	K165-G169 PolarHBondContact O-N 2.99Å; E166-G169 PolarHBondContact O-N 2.87Å; G169-G171 VanDerWaalsContact C-N 3.32Å; G169-G171 PolarHBondContact O-N 3.11Å
170	S	57.1	Low	70.6	Confident	93 Å²	93	98.7 Å²	98.7	65%	0.65	53%	0.525	S	S	*	.	H	α-helix	trans	-76.9	-17.1	179	-156.3	0	0	0	0	113.8	E166 K167 K172	E166-S170 PolarHBondContact O-N 2.91Å; K167-S170 PolarHBondContact O-N 3.3Å; S170-K172 VanDerWaalsContact C-N 3.31Å; S170-K172 PolarHBondContact O-N 3.1Å
171	G	47.5	Very low	68.9	Low	65 Å²	65	99.2 Å²	99.2	67%	0.67	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	3.7	-179.9	0	0	0	0	0	116	K167 K168 G169	K167-G171 PolarHBondContact O-N 2.88Å; K168-G171 PolarHBondContact O-N 3.36Å; G169-G171 VanDerWaalsContact C-N 3.32Å; G169-G171 PolarHBondContact O-N 3.11Å
172	K	42.6	Very low	67.5	Low	190 Å²	190	103 Å²	103	83%	0.826	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	7.8	176	-121.3	172.2	-175.8	173.7	0	114.5	S170 D174	S170-K172 VanDerWaalsContact C-N 3.31Å; S170-K172 PolarHBondContact O-N 3.1Å; K172-D174 PolarHBondContact O-N 3.11Å
173	N	40.1	Very low	66	Low	117 Å²	117	108.2 Å²	108.2	63%	0.626	57%	0.572	S	S	*	*			trans	-95.2	83.5	165.4	-71.6	-11.5	0	0	0	109.3	S175 T176	N173-S175 PolarHBondContact O-N 2.76Å; N173-T176 PolarHBondContact O-OG1 2.91Å
174	D	45.7	Very low	64.6	Low	101 Å²	101	112.6 Å²	112.6	54%	0.54	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61	28.5	161.5	-177.4	49.1	0	0	0	112.6	K172 K178	K172-D174 PolarHBondContact O-N 3.11Å; D174-K178 IonicContact OD2-NZ 2.83Å; D174-K178 PolarHBondContact OD2-NZ 2.8Å
175	S	53.2	Low	63.3	Low	75 Å²	75	112.7 Å²	112.7	52%	0.524	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.6	-20.2	-178.2	-124.3	0	0	0	0	111.5	N173 V179	N173-S175 PolarHBondContact O-N 2.76Å; S175-V179 VanDerWaalsContact O-CB 3.32Å; S175-V179 WeakPolarHBondContact O-CB 3Å; S175-V179 WeakPolarHBondContact O-CG2 3.38Å; S175-V179 PolarHBondContact O-N 2.9Å; S175-V179 VanDerWaalsContact O-N 3.15Å
176	T	54.4	Low	61.8	Low	104 Å²	104	115 Å²	115	64%	0.638	62%	0.624	S	S	*	*	H	α-helix	trans	-77.3	-38.5	178	25.6	0	0	0	0	112.6	N173 V179 V180	N173-T176 PolarHBondContact O-OG1 2.91Å; T176-V179 PolarHBondContact O-N 3.23Å; T176-V180 VanDerWaalsContact O-CG2 3.32Å; T176-V180 WeakPolarHBondContact O-CG2 3.48Å; T176-V180 PolarHBondContact O-N 3.08Å; T176-V180 VanDerWaalsContact O-N 3.16Å
177	E	55	Low	60.3	Low	146 Å²	146	114.3 Å²	114.3	68%	0.682	63%	0.632	S	S	*	*	H	α-helix	trans	-70.6	-39.8	174.8	-70.7	-174.4	169.3	0	0	111.8	V179 V180 E181	E177-V179 VanDerWaalsContact C-N 3.3Å; E177-V179 PolarHBondContact O-N 3.26Å; E177-V180 PolarHBondContact O-N 2.76Å; E177-E181 PolarHBondContact O-N 3.37Å
178	K	58.3	Low	58.6	Low	110 Å²	110	114.2 Å²	114.2	48%	0.478	64%	0.642	S	S	.	*	H	α-helix	trans	-64.7	-28.3	173.4	-81.3	177.6	-179.8	135.3	0	114.4	D174 K182	D174-K178 IonicContact OD2-NZ 2.83Å; D174-K178 PolarHBondContact OD2-NZ 2.8Å; K178-K182 VanDerWaalsContact O-CB 3.29Å; K178-K182 WeakPolarHBondContact O-CB 3.12Å; K178-K182 WeakPolarHBondContact O-CG 3.47Å; K178-K182 PolarHBondContact O-N 3.07Å
179	V	62	Low	57.2	Low	78 Å²	78	115.4 Å²	115.4	47%	0.473	65%	0.65	S	S	.	*	H	α-helix	trans	-78.4	-35.7	176.8	169.4	0	0	0	0	110.7	S175 T176 E177 L183	S175-V179 VanDerWaalsContact O-CB 3.32Å; S175-V179 WeakPolarHBondContact O-CB 3Å; S175-V179 WeakPolarHBondContact O-CG2 3.38Å; S175-V179 PolarHBondContact O-N 2.9Å; S175-V179 VanDerWaalsContact O-N 3.15Å; T176-V179 PolarHBondContact O-N 3.23Å; E177-V179 VanDerWaalsContact C-N 3.3Å; E177-V179 PolarHBondContact O-N 3.26Å; V179-L183 HydrophobicContact CG1-CD1 3.85Å; V179-L183 WeakPolarHBondContact O-CB 3.45Å; V179-L183 VanDerWaalsContact O-CD1 3.23Å; V179-L183 WeakPolarHBondContact O-CD1 3.49Å; V179-L183 PolarHBondContact O-N 3.03Å
180	V	65.7	Low	56.3	Low	82 Å²	82	122 Å²	122	50%	0.497	67%	0.666	S	S	.	*	H	α-helix	trans	-69.6	-46.6	174.9	178	0	0	0	0	111	T176 E177 K182 L183 E184	T176-V180 VanDerWaalsContact O-CG2 3.32Å; T176-V180 WeakPolarHBondContact O-CG2 3.48Å; T176-V180 PolarHBondContact O-N 3.08Å; T176-V180 VanDerWaalsContact O-N 3.16Å; E177-V180 PolarHBondContact O-N 2.76Å; V180-K182 VanDerWaalsContact C-N 3.31Å; V180-K182 PolarHBondContact O-N 3.3Å; V180-L183 PolarHBondContact O-N 2.98Å; V180-L183 VanDerWaalsContact O-N 3.14Å; V180-E184 WeakPolarHBondContact O-CG 3.19Å; V180-E184 PolarHBondContact O-N 3.17Å
181	E	61.2	Low	55.4	Low	136 Å²	136	121.3 Å²	121.3	64%	0.636	67%	0.673	S	S	*	*	H	α-helix	trans	-62.2	-35.9	175.7	-75	-174.4	156	0	0	112.6	E177 A185	E177-E181 PolarHBondContact O-N 3.37Å; E181-A185 WeakPolarHBondContact O-CB 3.36Å; E181-A185 PolarHBondContact O-N 2.77Å; E181-A185 VanDerWaalsContact O-N 3.1Å
182	K	66.4	Low	55.2	Low	149 Å²	149	127.7 Å²	127.7	65%	0.648	69%	0.686	S	S	*	*	H	α-helix	trans	-71.2	-34.7	174	-85.1	-179.2	175	-179.2	0	113.1	K178 V180 L186	K178-K182 VanDerWaalsContact O-CB 3.29Å; K178-K182 WeakPolarHBondContact O-CB 3.12Å; K178-K182 WeakPolarHBondContact O-CG 3.47Å; K178-K182 PolarHBondContact O-N 3.07Å; V180-K182 VanDerWaalsContact C-N 3.31Å; V180-K182 PolarHBondContact O-N 3.3Å; K182-L186 WeakPolarHBondContact O-CD1 3.48Å; K182-L186 PolarHBondContact O-N 3.08Å
183	L	66	Low	55.5	Low	125 Å²	125	127.7 Å²	127.7	65%	0.654	69%	0.689	S	S	*	*	H	α-helix	trans	-68.9	-39.2	175.9	-105.2	92.5	0	0	0	111.4	V179 V180 A185 L186	V179-L183 HydrophobicContact CG1-CD1 3.85Å; V179-L183 WeakPolarHBondContact O-CB 3.45Å; V179-L183 VanDerWaalsContact O-CD1 3.23Å; V179-L183 WeakPolarHBondContact O-CD1 3.49Å; V179-L183 PolarHBondContact O-N 3.03Å; V180-L183 PolarHBondContact O-N 2.98Å; V180-L183 VanDerWaalsContact O-N 3.14Å; L183-A185 VanDerWaalsContact C-N 3.34Å; L183-L186 PolarHBondContact O-N 3.1Å
184	E	64.5	Low	55.5	Low	150 Å²	150	127.4 Å²	127.4	70%	0.701	69%	0.693	S	S	*	*	H	α-helix	trans	-69.3	-31.9	177.5	-70.4	-178.3	169.6	0	0	112.2	V180 L186	V180-E184 WeakPolarHBondContact O-CG 3.19Å; V180-E184 PolarHBondContact O-N 3.17Å; E184-L186 VanDerWaalsContact C-N 3.28Å; E184-L186 PolarHBondContact O-N 3.42Å
185	A	67.2	Low	55.6	Low	86 Å²	86	131.8 Å²	131.8	71%	0.711	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-9.4	175.6	0	0	0	0	0	115	E181 L183	E181-A185 WeakPolarHBondContact O-CB 3.36Å; E181-A185 PolarHBondContact O-N 2.77Å; E181-A185 VanDerWaalsContact O-N 3.1Å; L183-A185 VanDerWaalsContact C-N 3.34Å
186	L	60.8	Low	55.1	Low	138 Å²	138	135.8 Å²	135.8	72%	0.723	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	0.6	-176.5	-100.4	116.7	0	0	0	114.5	K182 L183 E184 V188	K182-L186 WeakPolarHBondContact O-CD1 3.48Å; K182-L186 PolarHBondContact O-N 3.08Å; L183-L186 PolarHBondContact O-N 3.1Å; E184-L186 VanDerWaalsContact C-N 3.28Å; E184-L186 PolarHBondContact O-N 3.42Å; L186-V188 PolarHBondContact O-N 3.29Å
187	S	56.4	Low	54.8	Low	104 Å²	104	135.9 Å²	135.9	73%	0.727	74%	0.737	S	S	*	*			trans	-86.8	96.2	178	-140.9	0	0	0	0	111	Q189	S187-Q189 PolarHBondContact O-N 3.38Å
188	V	54.6	Low	54.6	Low	131 Å²	131	133.3 Å²	133.3	79%	0.794	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-65.5	119.5	176.5	177.6	0	0	0	0	110	L186	L186-V188 PolarHBondContact O-N 3.29Å
189	Q	54.6	Low	54.3	Low	187 Å²	187	134 Å²	134	87%	0.874	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-81.8	120	168.2	-71.2	-176.9	-8.3	0	0	109.3	S187 G191	S187-Q189 PolarHBondContact O-N 3.38Å; Q189-G191 PolarHBondContact O-N 3.49Å
190	E	48.5	Very low	53.8	Low	194 Å²	194	134.8 Å²	134.8	91%	0.907	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-58.3	127.1	175.1	-66.3	178.2	147.1	0	0	110.2
191	G	38.9	Very low	53.2	Low	79 Å²	79	135.3 Å²	135.3	81%	0.814	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-80.9	130.7	-178.1	0	0	0	0	0	112.4	Q189	Q189-G191 PolarHBondContact O-N 3.49Å
192	E	44.3	Very low	52.9	Low	199 Å²	199	135.1 Å²	135.1	93%	0.93	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-94.2	118.5	170.9	-140	173.7	163.2	0	0	109.2
193	Q	48.5	Very low	52.1	Low	190 Å²	190	136.2 Å²	136.2	89%	0.888	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-80.9	146.8	179.4	-78.8	-176.3	-30.4	0	0	112
194	P	39.1	Very low	51.3	Low	111 Å²	111	138 Å²	138	72%	0.721	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-96.6	148.8	177.5	36.5	-29.9	0	0	0	111.9
195	Q	47.2	Very low	50.9	Low	194 Å²	194	138.6 Å²	138.6	91%	0.907	81%	0.808	S	S	*	*			trans	-166.7	128.2	150.2	-108.1	157	47.6	0	0	114.5
196	D	43.5	Very low	49.9	Very low	158 Å²	158	147 Å²	147	85%	0.845	83%	0.833	S	S	*	*			trans	-10.7	135	161.4	-68.4	-50.3	0	0	0	120.7
197	A	47.9	Very low	49.4	Very low	106 Å²	106	147.5 Å²	147.5	88%	0.876	84%	0.838	S	S	*	*				174.6	134.5	116.5	0	0	0	0	0	111.8
198	A	50.9	Low	49	Very low	93 Å²	93	149.8 Å²	149.8	77%	0.769	84%	0.844	S	S	*	*			trans	-117.8	-178.9	166.7	0	0	0	0	0	108.7
199	P	51.3	Low	48.7	Very low	124 Å²	124	150.8 Å²	150.8	81%	0.805	85%	0.847	S	S	*	*				-131.9	167.5	-62.7	37	-22.1	0	0	0	112
200	A	53.1	Low	48.4	Very low	94 Å²	94	148.7 Å²	148.7	78%	0.777	85%	0.845	S	S	*	*			trans	176.7	109.3	152.1	0	0	0	0	0	108.1
201	A	51.7	Low	48.4	Very low	94 Å²	94	145.9 Å²	145.9	78%	0.777	84%	0.841	S	S	*	*				59.8	110.1	92.4	0	0	0	0	0	113.7
202	V	55.5	Low	49	Very low	132 Å²	132	150.3 Å²	150.3	80%	0.8	84%	0.843	S	S	*	*				157.5	141.2	107.2	177.4	0	0	0	0	109.1
203	E	50	Low	49.3	Very low	171 Å²	171	146.9 Å²	146.9	80%	0.799	84%	0.837	S	S	*	*			trans	-37.6	158.9	167.5	-64.7	151.8	142.9	0	0	113.7
204	E	50.1	Low	49.4	Very low	163 Å²	163	143.5 Å²	143.5	76%	0.762	83%	0.833	S	S	*	*				178.2	149.9	59.8	-150.1	168.7	-160.4	0	0	109.6
205	E	54.8	Low	50.3	Low	163 Å²	163	146.3 Å²	146.3	76%	0.762	84%	0.842	S	S	*	*			trans	26.1	117.3	155	-73.1	-173.7	112.3	0	0	122.8
206	Q	47.3	Very low	50.5	Low	263 Å²	263	141.9 Å²	141.9	100%	1.229	84%	0.836	S	S	*	*				-177.5	0	94.9	-94.2	-179.2	20.8	0	0	111

Retrieved 206 of 206 residues in 141.3 ms (Link to these results)

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