A0A096N8T9_PAPAN Loading...

Centromere protein W

Component of the CENPA-NAC (nucleosome-associated) complex, a complex that plays a central role in assembly of kinetochore proteins, mitotic progression and chromosome segregation. The CENPA-NAC complex recruits the CENPA-CAD (nucleosome distal) complex and may be involved in incorporation of newly synthesized CENPA into centromeres. Part of a nucleosome-associated complex that binds specifically to histone H3-containing nucleosomes at the centromere, as opposed to nucleosomes containing CENPA. Component of the heterotetrameric CENP-T-W-S-X complex that binds and supercoils DNA, and plays an important role in kinetochore assembly. CENPW has a fundamental role in kinetochore assembly and function. It is one of the inner kinetochore proteins, with most further proteins binding downstream. Required for normal chromosome organization and normal progress through mitosis.

AlphaFold DB , UniProt , Accession A0A096N8T9, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 103 aa.

						>A0A096N8T9_PAPAN|A0A096N8T9
MALSTIVSQKKQIKRKAPRGFLKRVFRRQKPQLRLEKSGDLLVRFHPFSGWEWGTGEVHLNCLLFVHRLAEESRTNACESKCRVINKEHVLAAAKVILKKSRG
					

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(Predicted Aligned Error values between residue pairs)

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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	36	Very low	48.2	Very low	244 Å²	244	151.7 Å²	151.7	100%	1.202	83%	0.827	S	S	*	*				0	111.7	0	-74	-179	165.5	0	0	107.8
2	A	41.8	Very low	48.2	Very low	104 Å²	104	153.7 Å²	153.7	86%	0.86	83%	0.826	S	S	*	*			trans	-84.5	120.3	-175.3	0	0	0	0	0	110	S4	A2-S4 PolarHBondContact O-N 3.19Å
3	L	47.5	Very low	49.1	Very low	170 Å²	170	149.8 Å²	149.8	89%	0.89	80%	0.803	S	S	*	*			trans	-67.7	113.6	177.5	-70.7	163.5	0	0	0	109.1	T5	L3-T5 PolarHBondContact O-N 3.15Å; L3-T5 VanDerWaalsContact O-N 3.15Å
4	S	46.8	Very low	49.6	Very low	97 Å²	97	153.4 Å²	153.4	68%	0.678	81%	0.808	S	S	*	*			trans	-68.3	105.8	173.7	47.4	0	0	0	0	109.6	A2 I6	A2-S4 PolarHBondContact O-N 3.19Å; S4-I6 PolarHBondContact O-N 2.9Å
5	T	53	Low	50.8	Low	135 Å²	135	156.8 Å²	156.8	83%	0.828	81%	0.806	S	S	*	*			trans	-73	73.1	166.1	52.5	0	0	0	0	109	L3 V7	L3-T5 PolarHBondContact O-N 3.15Å; L3-T5 VanDerWaalsContact O-N 3.15Å; T5-V7 PolarHBondContact O-N 3.36Å; T5-V7 VanDerWaalsContact O-N 3.11Å
6	I	54.5	Low	52.2	Low	143 Å²	143	159.6 Å²	159.6	73%	0.733	81%	0.81	S	S	*	*			trans	-67.9	108.6	168.3	-62.4	176.2	0	0	0	106.1	S4 S8	S4-I6 PolarHBondContact O-N 2.9Å; I6-S8 PolarHBondContact O-N 3.32Å
7	V	49.2	Very low	53.6	Low	136 Å²	136	151.5 Å²	151.5	82%	0.824	77%	0.773	S	S	*	*			trans	-50.3	110.8	175.9	171.6	0	0	0	0	108.9	T5 Q9	T5-V7 PolarHBondContact O-N 3.36Å; T5-V7 VanDerWaalsContact O-N 3.11Å; V7-Q9 PolarHBondContact O-N 3.43Å
8	S	45.7	Very low	55	Low	91 Å²	91	146.8 Å²	146.8	64%	0.636	75%	0.754	S	S	*	*			trans	-62.8	128.7	179.7	-174.6	0	0	0	0	110.6	I6	I6-S8 PolarHBondContact O-N 3.32Å
9	Q	51.3	Low	56.3	Low	167 Å²	167	146.2 Å²	146.2	78%	0.78	74%	0.741	S	S	*	*			trans	74	99.3	157.2	-63.7	171.8	14.9	0	0	117.4	V7 K11	V7-Q9 PolarHBondContact O-N 3.43Å; Q9-K11 PolarHBondContact O-N 3.19Å
10	K	52.6	Low	57.5	Low	205 Å²	205	141.4 Å²	141.4	89%	0.891	73%	0.731	S	S	*	*			trans	-55.5	78.1	147.1	-168.9	-178.5	-172.1	177.9	0	108.6	Q12	K10-Q12 PolarHBondContact O-N 3.38Å
11	K	51.4	Low	58.7	Low	177 Å²	177	140.8 Å²	140.8	77%	0.77	72%	0.723	S	S	*	*			trans	-56	108.2	172.4	-168.1	173.7	-172.5	173.6	0	106	Q9 I13	Q9-K11 PolarHBondContact O-N 3.19Å; K11-I13 PolarHBondContact O-N 3.47Å
12	Q	48.9	Very low	60.9	Low	175 Å²	175	130 Å²	130	82%	0.818	67%	0.67	S	S	*	*			trans	-64	93.8	173.1	-79.8	-166.2	-4	0	0	107.3	K10 K14	K10-Q12 PolarHBondContact O-N 3.38Å; Q12-K14 PolarHBondContact O-N 2.92Å
13	I	59.2	Low	62.8	Low	104 Å²	104	129.3 Å²	129.3	53%	0.533	65%	0.647	S	S	.	*			trans	-68.7	107.6	173.4	-53.7	173.7	0	0	0	105.2	K11 R15	K11-I13 PolarHBondContact O-N 3.47Å; I13-R15 HydrophobicContact CB-CG 4.02Å; I13-R15 HydrophobicContact CG2-CG 3.47Å; I13-R15 VanDerWaalsContact CG2-CG 3.47Å; I13-R15 PolarHBondContact O-N 2.76Å
14	K	56.5	Low	64.6	Low	199 Å²	199	128.4 Å²	128.4	87%	0.865	63%	0.632	S	S	*	*			trans	-65.8	82	170.7	-68.9	-174.9	-179.9	179.7	0	108.5	Q12	Q12-K14 PolarHBondContact O-N 2.92Å
15	R	68.4	Low	66.4	Low	205 Å²	205	126 Å²	126	77%	0.774	61%	0.613	S	S	*	*			trans	-85.1	112.1	177.2	-64.8	-174.8	178	170.4	-1.8	108.1	I13	I13-R15 HydrophobicContact CB-CG 4.02Å; I13-R15 HydrophobicContact CG2-CG 3.47Å; I13-R15 VanDerWaalsContact CG2-CG 3.47Å; I13-R15 PolarHBondContact O-N 2.76Å
16	K	72.8	Confident	67.7	Low	201 Å²	201	121.8 Å²	121.8	87%	0.874	58%	0.583	S	S	*	*			trans	-82.4	139.4	169.8	-71.7	-176.9	-179.6	177.6	0	109.1
17	A	75.4	Confident	69.2	Low	22 Å²	22	123.8 Å²	123.8	18%	0.182	58%	0.582	C	S	.	*			trans	-60.2	138.6	172.3	0	0	0	0	0	111	R19 L41 H59	A17-R19 PolarHBondContact O-N 2.89Å; A17-L41 HydrophobicContact CB-CD2 3.33Å; A17-H59 WeakPolarHBondContact CB-CD2 3.49Å; A17-H59 VanDerWaalsContact CB-NE2 3.29Å; A17-H59 WeakPolarHBondContact CB-NE2 3.33Å
18	P	79.5	Confident	71	Confident	68 Å²	68	126.2 Å²	126.2	44%	0.442	58%	0.576	S	S	.	*			trans	-79.1	69.4	-178.4	34.3	-37	0	0	0	111.3	G20 F21 L22	P18-G20 VanDerWaalsContact C-N 3.34Å; P18-G20 PolarHBondContact O-N 3.08Å; P18-F21 HydrophobicContact CB-CB 4.08Å; P18-F21 WeakPolarHBondContact O-CB 3.49Å; P18-F21 PolarHBondContact O-N 3.2Å; P18-F21 VanDerWaalsContact O-N 3.14Å; P18-L22 WeakPolarHBondContact O-CG 3.43Å; P18-L22 PolarHBondContact O-N 3.21Å; P18-L22 VanDerWaalsContact O-N 3.08Å
19	R	79.9	Confident	72.9	Confident	134 Å²	134	129 Å²	129	51%	0.506	58%	0.579	S	S	.	*	H	α-helix	trans	-56.6	-42.3	-173.2	-57.3	-175.7	-170	-158.3	-1.4	113.5	A17 F21 L22 K23 D40 L41	A17-R19 PolarHBondContact O-N 2.89Å; R19-F21 VanDerWaalsContact C-N 3.35Å; R19-F21 PolarHBondContact O-N 3.07Å; R19-L22 PolarHBondContact O-N 3.47Å; R19-K23 WeakPolarHBondContact O-CG 3.45Å; R19-K23 PolarHBondContact O-N 3.31Å; R19-D40 WeakPolarHBondContact CB-OD2 3.43Å; R19-D40 VanDerWaalsContact CD-OD2 3.24Å; R19-D40 WeakPolarHBondContact CD-OD2 3.24Å; R19-D40 VanDerWaalsContact CG-OD2 3.22Å; R19-D40 WeakPolarHBondContact CG-OD2 3.12Å; R19-L41 HydrophobicContact CG-CD1 4.32Å; R19-L41 HydrophobicContact CG-CG 4.41Å
20	G	80.3	Confident	74.4	Confident	51 Å²	51	127 Å²	127	53%	0.526	57%	0.568	S	S	.	*	H	α-helix	trans	-65.6	-37.1	179.6	0	0	0	0	0	112.9	P18 R24	P18-G20 VanDerWaalsContact C-N 3.34Å; P18-G20 PolarHBondContact O-N 3.08Å; G20-R24 WeakPolarHBondContact O-CB 3.35Å; G20-R24 PolarHBondContact O-N 2.78Å; G20-R24 VanDerWaalsContact O-N 3.16Å
21	F	82.8	Confident	75.9	Confident	128 Å²	128	122.2 Å²	122.2	56%	0.561	56%	0.558	S	S	*	*	H	α-helix	trans	-65.9	-49	174.6	174.1	-97.9	0	0	0	111	P18 R19 K23 R24 V25	P18-F21 HydrophobicContact CB-CB 4.08Å; P18-F21 WeakPolarHBondContact O-CB 3.49Å; P18-F21 PolarHBondContact O-N 3.2Å; P18-F21 VanDerWaalsContact O-N 3.14Å; R19-F21 VanDerWaalsContact C-N 3.35Å; R19-F21 PolarHBondContact O-N 3.07Å; F21-K23 PolarHBondContact O-N 3.24Å; F21-R24 WeakPolarHBondContact O-CB 3.22Å; F21-R24 PolarHBondContact O-N 3.47Å; F21-R24 VanDerWaalsContact O-N 3.11Å; F21-V25 HydrophobicContact CD1-CG2 4.2Å; F21-V25 HydrophobicContact CD2-CG2 4.28Å; F21-V25 HydrophobicContact CE1-CG2 3.77Å; F21-V25 HydrophobicContact CE2-CG2 3.85Å; F21-V25 HydrophobicContact CG-CG2 4.44Å; F21-V25 HydrophobicContact CZ-CG2 3.58Å; F21-V25 WeakPolarHBondContact O-CG2 3.43Å; F21-V25 PolarHBondContact O-N 3.39Å
22	L	80.7	Confident	77.5	Confident	18 Å²	18	122.9 Å²	122.9	9%	0.094	56%	0.564	C	S	.	*	H	α-helix	trans	-58.5	-46.3	-179.8	-65.8	173.8	0	0	0	111.9	P18 R19 R24 V25 F26 V58 H59	P18-L22 WeakPolarHBondContact O-CG 3.43Å; P18-L22 PolarHBondContact O-N 3.21Å; P18-L22 VanDerWaalsContact O-N 3.08Å; R19-L22 PolarHBondContact O-N 3.47Å; L22-R24 VanDerWaalsContact C-N 3.3Å; L22-R24 PolarHBondContact O-N 3.49Å; L22-V25 PolarHBondContact O-N 2.95Å; L22-F26 WeakPolarHBondContact O-CB 3.44Å; L22-F26 PolarHBondContact O-N 3.5Å; L22-V58 HydrophobicContact CD2-CG1 4.25Å; L22-H59 HydrophobicContact CD1-CB 3.64Å
23	K	82.9	Confident	79	Confident	90 Å²	90	118.5 Å²	118.5	39%	0.391	55%	0.545	S	S	.	.	H	α-helix	trans	-61.2	-37.9	176.5	-71.5	-179.2	-176.7	-174.4	0	112.5	R19 F21 R27 D40	R19-K23 WeakPolarHBondContact O-CG 3.45Å; R19-K23 PolarHBondContact O-N 3.31Å; F21-K23 PolarHBondContact O-N 3.24Å; K23-R27 WeakPolarHBondContact O-CB 3.44Å; K23-R27 WeakPolarHBondContact O-CG 3.15Å; K23-R27 PolarHBondContact O-N 3.26Å; K23-D40 VanDerWaalsContact CE-CG 3.47Å; K23-D40 WeakPolarHBondContact CE-OD1 3.29Å; K23-D40 IonicContact NZ-OD1 3.15Å; K23-D40 PolarHBondContact NZ-OD1 3.42Å; K23-D40 VanDerWaalsContact NZ-OD1 3.15Å
24	R	85.8	Confident	79.9	Confident	151 Å²	151	124.8 Å²	124.8	57%	0.57	56%	0.563	S	S	*	*	H	α-helix	trans	-68.8	-46.3	178.5	-171	-174.7	-61.3	170.4	-0.6	111.8	G20 F21 L22 F26 R27 R28	G20-R24 WeakPolarHBondContact O-CB 3.35Å; G20-R24 PolarHBondContact O-N 2.78Å; G20-R24 VanDerWaalsContact O-N 3.16Å; F21-R24 WeakPolarHBondContact O-CB 3.22Å; F21-R24 PolarHBondContact O-N 3.47Å; F21-R24 VanDerWaalsContact O-N 3.11Å; L22-R24 VanDerWaalsContact C-N 3.3Å; L22-R24 PolarHBondContact O-N 3.49Å; R24-F26 VanDerWaalsContact C-N 3.31Å; R24-F26 PolarHBondContact O-N 3.16Å; R24-R27 PolarHBondContact O-N 2.98Å; R24-R28 VanDerWaalsContact O-CG 3.29Å; R24-R28 WeakPolarHBondContact O-CG 3.39Å; R24-R28 PolarHBondContact O-N 3.34Å
25	V	84.4	Confident	80.7	Confident	46 Å²	46	118.2 Å²	118.2	28%	0.279	54%	0.537	S	S	.	.	H	α-helix	trans	-60	-45.3	177.3	172.1	0	0	0	0	110.2	F21 L22 R28 Q29	F21-V25 HydrophobicContact CD1-CG2 4.2Å; F21-V25 HydrophobicContact CD2-CG2 4.28Å; F21-V25 HydrophobicContact CE1-CG2 3.77Å; F21-V25 HydrophobicContact CE2-CG2 3.85Å; F21-V25 HydrophobicContact CG-CG2 4.44Å; F21-V25 HydrophobicContact CZ-CG2 3.58Å; F21-V25 WeakPolarHBondContact O-CG2 3.43Å; F21-V25 PolarHBondContact O-N 3.39Å; L22-V25 PolarHBondContact O-N 2.95Å; V25-R28 PolarHBondContact O-N 2.67Å; V25-Q29 PolarHBondContact O-N 2.94Å
26	F	80.1	Confident	81.1	Confident	46 Å²	46	115.3 Å²	115.3	20%	0.202	53%	0.532	C	S	.	.	H	α-helix	trans	-65.3	-44.7	179.5	-161.5	-92.4	0	0	0	112.6	L22 R24 R28 Q29 K30 L33 L35	L22-F26 WeakPolarHBondContact O-CB 3.44Å; L22-F26 PolarHBondContact O-N 3.5Å; R24-F26 VanDerWaalsContact C-N 3.31Å; R24-F26 PolarHBondContact O-N 3.16Å; F26-R28 VanDerWaalsContact C-N 3.27Å; F26-R28 PolarHBondContact O-N 3.49Å; F26-Q29 PolarHBondContact O-N 2.89Å; F26-K30 PolarHBondContact O-N 3.38Å; F26-L33 HydrophobicContact CE1-CB 3.89Å; F26-L33 HydrophobicContact CE1-CD2 3.46Å; F26-L33 VanDerWaalsContact CE1-CD2 3.46Å; F26-L33 HydrophobicContact CE1-CG 3.63Å; F26-L33 HydrophobicContact CE2-CD2 4.45Å; F26-L33 HydrophobicContact CZ-CD2 3.29Å; F26-L33 HydrophobicContact CZ-CG 3.95Å; F26-L35 HydrophobicContact CB-CD1 3.99Å; F26-L35 HydrophobicContact CD1-CD1 3.25Å; F26-L35 HydrophobicContact CD1-CG 4.29Å; F26-L35 HydrophobicContact CD2-CD1 4.15Å; F26-L35 HydrophobicContact CE1-CD1 3.52Å; F26-L35 HydrophobicContact CE1-CG 4.09Å; F26-L35 HydrophobicContact CE2-CD1 4.39Å; F26-L35 HydrophobicContact CG-CD1 3.54Å; F26-L35 HydrophobicContact CZ-CD1 4.07Å; F26-L35 HydrophobicContact CZ-CG 4.46Å
27	R	84.6	Confident	81	Confident	185 Å²	185	114 Å²	114	70%	0.698	53%	0.526	S	S	*	.	H	α-helix	trans	-61.7	-33.2	174.7	-79.3	-171.7	177.9	-147.6	1.4	113.2	K23 R24 P31	K23-R27 WeakPolarHBondContact O-CB 3.44Å; K23-R27 WeakPolarHBondContact O-CG 3.15Å; K23-R27 PolarHBondContact O-N 3.26Å; R24-R27 PolarHBondContact O-N 2.98Å; R27-P31 WeakPolarHBondContact O-CA 3.15Å
28	R	87.4	Confident	80.6	Confident	187 Å²	187	114 Å²	114	71%	0.706	53%	0.525	S	S	*	.	H	α-helix	trans	-68.3	-42	175.4	-75.7	173.1	178.1	-175.3	-3.3	111.9	R24 V25 F26	R24-R28 VanDerWaalsContact O-CG 3.29Å; R24-R28 WeakPolarHBondContact O-CG 3.39Å; R24-R28 PolarHBondContact O-N 3.34Å; V25-R28 PolarHBondContact O-N 2.67Å; F26-R28 VanDerWaalsContact C-N 3.27Å; F26-R28 PolarHBondContact O-N 3.49Å
29	Q	85.3	Confident	80	Confident	151 Å²	151	111.1 Å²	111.1	71%	0.706	51%	0.507	S	S	*	.	H	α-helix	trans	-78.5	-37.1	-178.9	-71.2	-178.5	-7.4	0	0	112.8	V25 F26	V25-Q29 PolarHBondContact O-N 2.94Å; F26-Q29 PolarHBondContact O-N 2.89Å
30	K	84.3	Confident	79.5	Confident	123 Å²	123	104.9 Å²	104.9	54%	0.535	48%	0.483	S	S	.	.			trans	-137.2	83.6	-178.7	-66.5	-169.2	176.7	-175.1	0	110.2	F26 Q32 L33	F26-K30 PolarHBondContact O-N 3.38Å; K30-Q32 VanDerWaalsContact C-N 3.3Å; K30-Q32 PolarHBondContact O-N 3.05Å; K30-L33 HydrophobicContact CB-CB 3.84Å; K30-L33 HydrophobicContact CB-CD2 4.33Å; K30-L33 HydrophobicContact CD-CD2 3.68Å; K30-L33 PolarHBondContact O-N 3.32Å
31	P	83.1	Confident	78.9	Confident	106 Å²	106	103.3 Å²	103.3	69%	0.688	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-28.2	-173.6	24	-33.2	0	0	0	114	R27	R27-P31 WeakPolarHBondContact O-CA 3.15Å
32	Q	84.3	Confident	77.8	Confident	190 Å²	190	97.9 Å²	97.9	89%	0.888	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-14	-179.8	-66.1	176.1	-13.3	0	0	113.3	K30	K30-Q32 VanDerWaalsContact C-N 3.3Å; K30-Q32 PolarHBondContact O-N 3.05Å
33	L	80.7	Confident	76.6	Confident	83 Å²	83	100 Å²	100	44%	0.435	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-86.4	117.8	-175.2	-170.4	57.8	0	0	0	110.7	F26 K30	F26-L33 HydrophobicContact CE1-CB 3.89Å; F26-L33 HydrophobicContact CE1-CD2 3.46Å; F26-L33 VanDerWaalsContact CE1-CD2 3.46Å; F26-L33 HydrophobicContact CE1-CG 3.63Å; F26-L33 HydrophobicContact CE2-CD2 4.45Å; F26-L33 HydrophobicContact CZ-CD2 3.29Å; F26-L33 HydrophobicContact CZ-CG 3.95Å; K30-L33 HydrophobicContact CB-CB 3.84Å; K30-L33 HydrophobicContact CB-CD2 4.33Å; K30-L33 HydrophobicContact CD-CD2 3.68Å; K30-L33 PolarHBondContact O-N 3.32Å
34	R	78.8	Confident	75.2	Confident	237 Å²	237	101.1 Å²	101.1	89%	0.894	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-91.3	119.6	178.1	-66.3	-175.7	173.8	-173.3	-0.9	109.8
35	L	73.3	Confident	73.6	Confident	61 Å²	61	100.1 Å²	100.1	32%	0.319	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-75.6	131.3	168.1	-94.5	131	0	0	0	109.8	F26 G39 V58	F26-L35 HydrophobicContact CB-CD1 3.99Å; F26-L35 HydrophobicContact CD1-CD1 3.25Å; F26-L35 HydrophobicContact CD1-CG 4.29Å; F26-L35 HydrophobicContact CD2-CD1 4.15Å; F26-L35 HydrophobicContact CE1-CD1 3.52Å; F26-L35 HydrophobicContact CE1-CG 4.09Å; F26-L35 HydrophobicContact CE2-CD1 4.39Å; F26-L35 HydrophobicContact CG-CD1 3.54Å; F26-L35 HydrophobicContact CZ-CD1 4.07Å; F26-L35 HydrophobicContact CZ-CG 4.46Å; L35-G39 WeakPolarHBondContact CD2-O 3.45Å; L35-V58 HydrophobicContact CD2-CG2 4.15Å
36	E	76.4	Confident	72.1	Confident	144 Å²	144	101.8 Å²	101.8	67%	0.673	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-59.5	160.6	170.8	-153	-165.7	146.8	0	0	111	S38 G39	E36-S38 PolarHBondContact O-N 3.26Å; E36-G39 PolarHBondContact O-N 2.95Å
37	K	70.6	Confident	70.6	Confident	174 Å²	174	105.2 Å²	105.2	76%	0.757	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	130.7	175.4	-165.1	173.4	-175.5	178.1	0	108.3	G39	K37-G39 PolarHBondContact O-N 3.36Å; K37-G39 VanDerWaalsContact O-N 3.13Å
38	S	67.3	Low	69.3	Low	22 Å²	22	106 Å²	106	15%	0.154	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	7.4	-174.1	50.5	0	0	0	0	117.3	E36 D40 L41 R44	E36-S38 PolarHBondContact O-N 3.26Å; S38-D40 PolarHBondContact O-N 3.07Å; S38-L41 PolarHBondContact O-N 3.12Å; S38-R44 WeakPolarHBondContact OG-CD 3.43Å; S38-R44 PolarHBondContact OG-NH1 2.88Å
39	G	66.4	Low	67.7	Low	6 Å²	6	100.1 Å²	100.1	6%	0.062	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-2.6	173.9	0	0	0	0	0	114.8	L35 E36 K37 G56	L35-G39 WeakPolarHBondContact CD2-O 3.45Å; E36-G39 PolarHBondContact O-N 2.95Å; K37-G39 PolarHBondContact O-N 3.36Å; K37-G39 VanDerWaalsContact O-N 3.13Å; G39-G56 CarbonylContact C-O 3.51Å; G39-G56 CarbonylContact O-C 2.99Å; G39-G56 VanDerWaalsContact O-CA 3.29Å; G39-G56 WeakPolarHBondContact O-CA 3.48Å
40	D	69.6	Low	66.4	Low	3 Å²	3	94.2 Å²	94.2	2%	0.016	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-19.7	167.6	51.4	-82.1	0	0	0	113.5	R19 K23 S38 H59	R19-D40 WeakPolarHBondContact CB-OD2 3.43Å; R19-D40 VanDerWaalsContact CD-OD2 3.24Å; R19-D40 WeakPolarHBondContact CD-OD2 3.24Å; R19-D40 VanDerWaalsContact CG-OD2 3.22Å; R19-D40 WeakPolarHBondContact CG-OD2 3.12Å; K23-D40 VanDerWaalsContact CE-CG 3.47Å; K23-D40 WeakPolarHBondContact CE-OD1 3.29Å; K23-D40 IonicContact NZ-OD1 3.15Å; K23-D40 PolarHBondContact NZ-OD1 3.42Å; K23-D40 VanDerWaalsContact NZ-OD1 3.15Å; S38-D40 PolarHBondContact O-N 3.07Å; D40-H59 VanDerWaalsContact O-CB 3.23Å; D40-H59 WeakPolarHBondContact O-CB 3.42Å; D40-H59 PolarHBondContact O-N 2.97Å
41	L	67.6	Low	64.8	Low	18 Å²	18	96.8 Å²	96.8	9%	0.094	47%	0.469	C	S	.	.			trans	-132.5	134.4	-178.6	-62.8	-176.6	0	0	0	112.6	A17 R19 S38 V43 G56 H59	A17-L41 HydrophobicContact CB-CD2 3.33Å; R19-L41 HydrophobicContact CG-CD1 4.32Å; R19-L41 HydrophobicContact CG-CG 4.41Å; S38-L41 PolarHBondContact O-N 3.12Å; L41-V43 PolarHBondContact O-N 3.23Å; L41-G56 CarbonylContact C-O 3.46Å; L41-H59 HydrophobicContact CD2-CB 3.71Å
42	L	59.3	Low	63.4	Low	15 Å²	15	96.4 Å²	96.4	8%	0.079	46%	0.458	C	S	.	.	S	Bend	trans	-78.5	-20.3	-176.9	-149.5	141.2	0	0	0	113.4	W53 G54 E57 L60	L42-W53 HydrophobicContact CD2-CE3 3.3Å; L42-W53 HydrophobicContact CD2-CZ3 3.47Å; L42-W53 VanDerWaalsContact CD2-CZ3 3.47Å; L42-G54 PolarHBondContact O-N 3.4Å; L42-E57 HydrophobicContact CD1-CB 3.65Å; L42-E57 HydrophobicContact CD1-CG 3.45Å; L42-E57 VanDerWaalsContact CD1-CG 3.45Å; L42-E57 HydrophobicContact CG-CG 4.29Å; L42-L60 HydrophobicContact CB-CB 3.74Å; L42-L60 HydrophobicContact CB-CD2 4.06Å; L42-L60 HydrophobicContact CD1-CB 3.75Å; L42-L60 HydrophobicContact CD1-CD2 3.68Å; L42-L60 HydrophobicContact CD1-CG 4.2Å; L42-L60 HydrophobicContact CD2-CD2 3.73Å; L42-L60 HydrophobicContact CG-CB 4.31Å; L42-L60 HydrophobicContact CG-CD2 4.03Å
43	V	56	Low	61.6	Low	62 Å²	62	97.4 Å²	97.4	38%	0.376	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	120.3	-171.9	-177.4	0	0	0	0	110.5	L41 W51	L41-V43 PolarHBondContact O-N 3.23Å; V43-W51 HydrophobicContact CG1-CD2 4.26Å; V43-W51 HydrophobicContact CG1-CE3 3.14Å; V43-W51 HydrophobicContact CG1-CZ3 3.44Å; V43-W51 VanDerWaalsContact CG1-CZ3 3.44Å
44	R	54.1	Low	60.1	Low	113 Å²	113	94.4 Å²	94.4	43%	0.426	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.5	167.1	-69.4	-179.4	86.2	166	-12.6	109.3	S38 W51 E52	S38-R44 WeakPolarHBondContact OG-CD 3.43Å; S38-R44 PolarHBondContact OG-NH1 2.88Å; R44-W51 WeakPolarHBondContact O-CA 3.49Å; R44-E52 PolarHBondContact N-O 2.87Å; R44-E52 VanDerWaalsContact N-O 3.12Å; R44-E52 PolarHBondContact O-N 3.46Å
45	F	51.8	Low	58.7	Low	131 Å²	131	89.1 Å²	89.1	58%	0.575	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	108.6	163.1	-172	-101.1	0	0	0	107.3	W51	F45-W51 HydrophobicContact CB-CE3 4.04Å; F45-W51 HydrophobicContact CB-CH2 4.46Å; F45-W51 HydrophobicContact CB-CZ3 4.03Å; F45-W51 AromaticContact CD2-CD2 3.73Å; F45-W51 HydrophobicContact CD2-CD2 3.73Å; F45-W51 AromaticContact CD2-CE2 3.6Å; F45-W51 HydrophobicContact CD2-CE3 4.08Å; F45-W51 HydrophobicContact CD2-CG 4.16Å; F45-W51 HydrophobicContact CD2-CH2 4.37Å; F45-W51 AromaticContact CD2-CZ2 3.95Å; F45-W51 HydrophobicContact CD2-CZ2 3.95Å; F45-W51 HydrophobicContact CD2-CZ3 4.42Å; F45-W51 AromaticContact CD2-NE1 3.85Å; F45-W51 AromaticContact CE2-NE1 3.96Å
46	H	52.2	Low	57.7	Low	80 Å²	80	86.9 Å²	86.9	37%	0.37	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.3	173.1	-163.2	-107.4	0	0	0	108.5	F48 S49 G50	H46-F48 PolarHBondContact O-N 3.21Å; H46-S49 VanDerWaalsContact CB-OG 3.23Å; H46-S49 WeakPolarHBondContact CB-OG 3.45Å; H46-S49 VanDerWaalsContact CG-OG 3.26Å; H46-S49 PolarHBondContact ND1-OG 3.4Å; H46-S49 PolarHBondContact O-N 2.85Å; H46-G50 PolarHBondContact N-O 3.12Å; H46-G50 PolarHBondContact O-N 3.34Å
47	P	50.3	Low	56.9	Low	118 Å²	118	85.4 Å²	85.4	77%	0.766	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.7	-174.3	-24.4	33	0	0	0	114.6
48	F	55.7	Low	57	Low	202 Å²	202	79.3 Å²	79.3	89%	0.886	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-25.7	-174.2	-148.5	-96.3	0	0	0	113.9	H46	H46-F48 PolarHBondContact O-N 3.21Å
49	S	54.4	Low	57.5	Low	64 Å²	64	80.1 Å²	80.1	45%	0.448	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	1.4	-175.1	49.3	0	0	0	0	114.1	H46 E52	H46-S49 VanDerWaalsContact CB-OG 3.23Å; H46-S49 WeakPolarHBondContact CB-OG 3.45Å; H46-S49 VanDerWaalsContact CG-OG 3.26Å; H46-S49 PolarHBondContact ND1-OG 3.4Å; H46-S49 PolarHBondContact O-N 2.85Å; S49-E52 VanDerWaalsContact CB-OE1 3.31Å; S49-E52 WeakPolarHBondContact CB-OE1 3.46Å; S49-E52 PolarHBondContact OG-OE1 3.15Å
50	G	59.1	Low	58.2	Low	26 Å²	26	82.3 Å²	82.3	27%	0.268	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	81.2	-151.6	177.3	0	0	0	0	0	113.4	H46 E52	H46-G50 PolarHBondContact N-O 3.12Å; H46-G50 PolarHBondContact O-N 3.34Å; G50-E52 PolarHBondContact O-N 2.89Å
51	W	50.5	Low	58.9	Low	178 Å²	178	86.2 Å²	86.2	67%	0.674	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	110.7	-179.1	-63.3	97.5	0	0	0	110.2	V43 R44 F45	V43-W51 HydrophobicContact CG1-CD2 4.26Å; V43-W51 HydrophobicContact CG1-CE3 3.14Å; V43-W51 HydrophobicContact CG1-CZ3 3.44Å; V43-W51 VanDerWaalsContact CG1-CZ3 3.44Å; R44-W51 WeakPolarHBondContact O-CA 3.49Å; F45-W51 HydrophobicContact CB-CE3 4.04Å; F45-W51 HydrophobicContact CB-CH2 4.46Å; F45-W51 HydrophobicContact CB-CZ3 4.03Å; F45-W51 AromaticContact CD2-CD2 3.73Å; F45-W51 HydrophobicContact CD2-CD2 3.73Å; F45-W51 AromaticContact CD2-CE2 3.6Å; F45-W51 HydrophobicContact CD2-CE3 4.08Å; F45-W51 HydrophobicContact CD2-CG 4.16Å; F45-W51 HydrophobicContact CD2-CH2 4.37Å; F45-W51 AromaticContact CD2-CZ2 3.95Å; F45-W51 HydrophobicContact CD2-CZ2 3.95Å; F45-W51 HydrophobicContact CD2-CZ3 4.42Å; F45-W51 AromaticContact CD2-NE1 3.85Å; F45-W51 AromaticContact CE2-NE1 3.96Å
52	E	54	Low	59.6	Low	98 Å²	98	88.3 Å²	88.3	46%	0.458	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.2	174.6	-78.8	174.2	-172.8	0	0	110.5	R44 S49 G50	R44-E52 PolarHBondContact N-O 2.87Å; R44-E52 VanDerWaalsContact N-O 3.12Å; R44-E52 PolarHBondContact O-N 3.46Å; S49-E52 VanDerWaalsContact CB-OE1 3.31Å; S49-E52 WeakPolarHBondContact CB-OE1 3.46Å; S49-E52 PolarHBondContact OG-OE1 3.15Å; G50-E52 PolarHBondContact O-N 2.89Å
53	W	45.6	Very low	60.9	Low	210 Å²	210	92 Å²	92	80%	0.795	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	118.7	173.3	-65.9	87.2	0	0	0	109.2	L42	L42-W53 HydrophobicContact CD2-CE3 3.3Å; L42-W53 HydrophobicContact CD2-CZ3 3.47Å; L42-W53 VanDerWaalsContact CD2-CZ3 3.47Å
54	G	48.9	Very low	62.4	Low	20 Å²	20	92.9 Å²	92.9	21%	0.206	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-94.9	135.9	175.8	0	0	0	0	0	111.5	L42 G56	L42-G54 PolarHBondContact O-N 3.4Å; G54-G56 PolarHBondContact O-N 3.31Å; G54-G56 VanDerWaalsContact O-N 3.11Å
55	T	49.2	Very low	64.1	Low	127 Å²	127	89.7 Å²	89.7	78%	0.779	46%	0.457	S	S	*	.	S	Bend	trans	-71.1	5.3	-174.9	39	0	0	0	0	116
56	G	52.1	Low	66	Low	13 Å²	13	87.3 Å²	87.3	13%	0.134	45%	0.453	C	S	.	.			trans	-117.7	114.8	179.1	0	0	0	0	0	113	G39 L41 G54	G39-G56 CarbonylContact C-O 3.51Å; G39-G56 CarbonylContact O-C 2.99Å; G39-G56 VanDerWaalsContact O-CA 3.29Å; G39-G56 WeakPolarHBondContact O-CA 3.48Å; L41-G56 CarbonylContact C-O 3.46Å; G54-G56 PolarHBondContact O-N 3.31Å; G54-G56 VanDerWaalsContact O-N 3.11Å
57	E	60.4	Low	67.9	Low	114 Å²	114	88.6 Å²	88.6	53%	0.533	46%	0.459	S	S	.	.			trans	-110.7	41.8	-156.2	-52.5	-165.6	141.2	0	0	114.8	L42 N61	L42-E57 HydrophobicContact CD1-CB 3.65Å; L42-E57 HydrophobicContact CD1-CG 3.45Å; L42-E57 VanDerWaalsContact CD1-CG 3.45Å; L42-E57 HydrophobicContact CG-CG 4.29Å; E57-N61 WeakPolarHBondContact O-CB 3.21Å
58	V	71.6	Confident	69.8	Low	45 Å²	45	89.1 Å²	89.1	27%	0.273	45%	0.446	S	S	.	.	H	α-helix	trans	-83.1	-46.9	-174.6	-172.5	0	0	0	0	112.4	L22 L35 C62	L22-V58 HydrophobicContact CD2-CG1 4.25Å; L35-V58 HydrophobicContact CD2-CG2 4.15Å; V58-C62 WeakPolarHBondContact O-CB 3.36Å; V58-C62 PolarHBondContact O-N 3.14Å
59	H	79.3	Confident	71.6	Confident	39 Å²	39	81 Å²	81	18%	0.181	41%	0.412	C	S	.	.	H	α-helix	trans	-73.9	-45.1	-175.4	-172.2	51.9	0	0	0	113.5	A17 L22 D40 L41 C62 L63	A17-H59 WeakPolarHBondContact CB-CD2 3.49Å; A17-H59 VanDerWaalsContact CB-NE2 3.29Å; A17-H59 WeakPolarHBondContact CB-NE2 3.33Å; L22-H59 HydrophobicContact CD1-CB 3.64Å; D40-H59 VanDerWaalsContact O-CB 3.23Å; D40-H59 WeakPolarHBondContact O-CB 3.42Å; D40-H59 PolarHBondContact O-N 2.97Å; L41-H59 HydrophobicContact CD2-CB 3.71Å; H59-C62 WeakPolarHBondContact O-CB 3.48Å; H59-C62 PolarHBondContact O-N 3.41Å; H59-L63 WeakPolarHBondContact O-CG 3.35Å; H59-L63 PolarHBondContact O-N 3.49Å
60	L	80.4	Confident	73.4	Confident	53 Å²	53	80.3 Å²	80.3	28%	0.277	41%	0.41	S	S	.	.	H	α-helix	trans	-66.7	-41.3	-178.7	-176.3	60.1	0	0	0	110.9	L42 C62 L63 L64	L42-L60 HydrophobicContact CB-CB 3.74Å; L42-L60 HydrophobicContact CB-CD2 4.06Å; L42-L60 HydrophobicContact CD1-CB 3.75Å; L42-L60 HydrophobicContact CD1-CD2 3.68Å; L42-L60 HydrophobicContact CD1-CG 4.2Å; L42-L60 HydrophobicContact CD2-CD2 3.73Å; L42-L60 HydrophobicContact CG-CB 4.31Å; L42-L60 HydrophobicContact CG-CD2 4.03Å; L60-C62 VanDerWaalsContact C-N 3.29Å; L60-C62 PolarHBondContact O-N 3.08Å; L60-L63 WeakPolarHBondContact O-CB 3.38Å; L60-L63 PolarHBondContact O-N 3.11Å; L60-L63 VanDerWaalsContact O-N 3.09Å; L60-L64 HydrophobicContact CD1-CG 4.27Å; L60-L64 HydrophobicContact CD2-CD1 4.47Å; L60-L64 HydrophobicContact CG-CD1 3.98Å; L60-L64 HydrophobicContact CG-CG 4.21Å; L60-L64 WeakPolarHBondContact O-CG 3.34Å; L60-L64 PolarHBondContact O-N 3.37Å
61	N	83.8	Confident	75	Confident	84 Å²	84	84.1 Å²	84.1	45%	0.449	42%	0.421	S	S	.	.	H	α-helix	trans	-60.7	-41.2	175.8	-166.8	-14.2	0	0	0	111.2	E57 L63 L64 F65	E57-N61 WeakPolarHBondContact O-CB 3.21Å; N61-L63 VanDerWaalsContact C-N 3.35Å; N61-L63 PolarHBondContact O-N 3.16Å; N61-L64 PolarHBondContact O-N 3.4Å; N61-F65 VanDerWaalsContact O-CB 3.27Å; N61-F65 WeakPolarHBondContact O-CB 3.32Å; N61-F65 PolarHBondContact O-N 3.05Å
62	C	83.6	Confident	77	Confident	63 Å²	63	78 Å²	78	43%	0.426	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-41.8	172.8	-173.2	0	0	0	0	112.7	V58 H59 L60 F65 V66	V58-C62 WeakPolarHBondContact O-CB 3.36Å; V58-C62 PolarHBondContact O-N 3.14Å; H59-C62 WeakPolarHBondContact O-CB 3.48Å; H59-C62 PolarHBondContact O-N 3.41Å; L60-C62 VanDerWaalsContact C-N 3.29Å; L60-C62 PolarHBondContact O-N 3.08Å; C62-F65 PolarHBondContact O-N 3.29Å; C62-V66 WeakPolarHBondContact O-CG2 3.4Å; C62-V66 PolarHBondContact O-N 3.42Å
63	L	85.9	Confident	78.8	Confident	92 Å²	92	73.5 Å²	73.5	48%	0.482	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-44	175.7	-69.5	174.5	0	0	0	112.3	H59 L60 N61 F65 V66 H67	H59-L63 WeakPolarHBondContact O-CG 3.35Å; H59-L63 PolarHBondContact O-N 3.49Å; L60-L63 WeakPolarHBondContact O-CB 3.38Å; L60-L63 PolarHBondContact O-N 3.11Å; L60-L63 VanDerWaalsContact O-N 3.09Å; N61-L63 VanDerWaalsContact C-N 3.35Å; N61-L63 PolarHBondContact O-N 3.16Å; L63-F65 VanDerWaalsContact C-N 3.31Å; L63-F65 PolarHBondContact O-N 2.93Å; L63-V66 PolarHBondContact O-N 2.96Å; L63-H67 WeakPolarHBondContact O-CB 3.35Å; L63-H67 PolarHBondContact O-N 3.48Å
64	L	87.8	Confident	81	Confident	80 Å²	80	72 Å²	72	42%	0.419	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-37.5	176.9	-68.9	173.7	0	0	0	111.6	L60 N61 H67 R68	L60-L64 HydrophobicContact CD1-CG 4.27Å; L60-L64 HydrophobicContact CD2-CD1 4.47Å; L60-L64 HydrophobicContact CG-CD1 3.98Å; L60-L64 HydrophobicContact CG-CG 4.21Å; L60-L64 WeakPolarHBondContact O-CG 3.34Å; L60-L64 PolarHBondContact O-N 3.37Å; N61-L64 PolarHBondContact O-N 3.4Å; L64-H67 PolarHBondContact O-N 2.98Å; L64-R68 WeakPolarHBondContact O-CB 3.27Å; L64-R68 WeakPolarHBondContact O-CG 3.28Å; L64-R68 PolarHBondContact O-N 3.37Å
65	F	90	Very high	83	Confident	46 Å²	46	74 Å²	74	20%	0.202	38%	0.382	C	S	.	.	H	α-helix	trans	-61.1	-49.6	173.6	176.5	-93.5	0	0	0	111.3	N61 C62 L63 H67 R68 L69 I97 L98 S101	N61-F65 VanDerWaalsContact O-CB 3.27Å; N61-F65 WeakPolarHBondContact O-CB 3.32Å; N61-F65 PolarHBondContact O-N 3.05Å; C62-F65 PolarHBondContact O-N 3.29Å; L63-F65 VanDerWaalsContact C-N 3.31Å; L63-F65 PolarHBondContact O-N 2.93Å; F65-H67 VanDerWaalsContact C-N 3.29Å; F65-H67 PolarHBondContact O-N 3.07Å; F65-R68 PolarHBondContact O-N 3.4Å; F65-L69 HydrophobicContact CE1-CD2 4.25Å; F65-L69 VanDerWaalsContact O-CB 3.28Å; F65-L69 WeakPolarHBondContact O-CB 3.4Å; F65-L69 PolarHBondContact O-N 3.02Å; F65-I97 HydrophobicContact CD2-CG2 3.65Å; F65-I97 HydrophobicContact CE2-CB 4.28Å; F65-I97 HydrophobicContact CE2-CG2 3.48Å; F65-I97 VanDerWaalsContact CE2-CG2 3.48Å; F65-I97 HydrophobicContact CZ-CG2 4.23Å; F65-L98 HydrophobicContact CE2-CD2 3.77Å; F65-L98 HydrophobicContact CE2-CG 4.23Å; F65-L98 HydrophobicContact CZ-CD2 3.58Å; F65-L98 HydrophobicContact CZ-CG 4Å; F65-S101 WeakPolarHBondContact CD2-OG 3.31Å
66	V	90.6	Very high	85	Confident	81 Å²	81	69.7 Å²	69.7	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-63.6	-37.2	178.2	173.3	0	0	0	0	111.2	C62 L63 L69 A70	C62-V66 WeakPolarHBondContact O-CG2 3.4Å; C62-V66 PolarHBondContact O-N 3.42Å; L63-V66 PolarHBondContact O-N 2.96Å; V66-L69 PolarHBondContact O-N 3.33Å; V66-A70 WeakPolarHBondContact O-CB 3.44Å; V66-A70 PolarHBondContact O-N 2.91Å
67	H	92	Very high	86.8	Confident	108 Å²	108	69.3 Å²	69.3	50%	0.5	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-53.8	175.5	-172.1	-86.5	0	0	0	111.8	L63 L64 F65 L69 A70 E71	L63-H67 WeakPolarHBondContact O-CB 3.35Å; L63-H67 PolarHBondContact O-N 3.48Å; L64-H67 PolarHBondContact O-N 2.98Å; F65-H67 VanDerWaalsContact C-N 3.29Å; F65-H67 PolarHBondContact O-N 3.07Å; H67-L69 VanDerWaalsContact C-N 3.27Å; H67-L69 PolarHBondContact O-N 3.44Å; H67-A70 WeakPolarHBondContact O-CB 3.41Å; H67-A70 PolarHBondContact O-N 3.08Å; H67-A70 VanDerWaalsContact O-N 3.08Å; H67-E71 IonicContact CE1-OE1 3.03Å; H67-E71 PolarHBondContact CE1-OE1 3.33Å; H67-E71 IonicContact CE1-OE2 3.41Å; H67-E71 PolarHBondContact CE1-OE2 3.39Å; H67-E71 VanDerWaalsContact ND1-CD 3.3Å; H67-E71 IonicContact ND1-OE1 3.57Å; H67-E71 IonicContact ND1-OE2 3.06Å; H67-E71 PolarHBondContact ND1-OE2 3.41Å; H67-E71 PolarHBondContact O-N 3.47Å
68	R	92	Very high	88.2	Confident	129 Å²	129	67.9 Å²	67.9	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-59.8	-39.2	178.1	-70.4	173.6	-178.2	-176.4	1.2	111.7	L64 F65 E71 E72 I97	L64-R68 WeakPolarHBondContact O-CB 3.27Å; L64-R68 WeakPolarHBondContact O-CG 3.28Å; L64-R68 PolarHBondContact O-N 3.37Å; F65-R68 PolarHBondContact O-N 3.4Å; R68-E71 PolarHBondContact O-N 2.89Å; R68-E72 WeakPolarHBondContact O-CB 3.45Å; R68-E72 PolarHBondContact O-N 2.92Å; R68-I97 HydrophobicContact CB-CD1 4.3Å; R68-I97 HydrophobicContact CB-CG2 4.24Å
69	L	93.1	Very high	89.2	Confident	31 Å²	31	73 Å²	73	16%	0.162	37%	0.372	C	S	.	.	H	α-helix	trans	-63.3	-41.8	175.2	-176	67.9	0	0	0	112.1	F65 V66 H67 S73 A93 A94 I97	F65-L69 HydrophobicContact CE1-CD2 4.25Å; F65-L69 VanDerWaalsContact O-CB 3.28Å; F65-L69 WeakPolarHBondContact O-CB 3.4Å; F65-L69 PolarHBondContact O-N 3.02Å; V66-L69 PolarHBondContact O-N 3.33Å; H67-L69 VanDerWaalsContact C-N 3.27Å; H67-L69 PolarHBondContact O-N 3.44Å; L69-S73 VanDerWaalsContact O-CB 3.22Å; L69-S73 WeakPolarHBondContact O-CB 3.43Å; L69-S73 PolarHBondContact O-N 3.45Å; L69-S73 PolarHBondContact O-OG 3.28Å; L69-A93 HydrophobicContact CD1-CB 3.88Å; L69-A94 VanDerWaalsContact CD1-CA 3.5Å; L69-A94 HydrophobicContact CD1-CB 4Å; L69-I97 HydrophobicContact CD1-CB 4.39Å; L69-I97 HydrophobicContact CD1-CG1 4.25Å
70	A	92.1	Very high	89.7	Confident	50 Å²	50	73.7 Å²	73.7	41%	0.413	38%	0.381	S	S	.	.	H	α-helix	trans	-67.3	-40.3	178.1	0	0	0	0	0	111.9	V66 H67 S73 R74	V66-A70 WeakPolarHBondContact O-CB 3.44Å; V66-A70 PolarHBondContact O-N 2.91Å; H67-A70 WeakPolarHBondContact O-CB 3.41Å; H67-A70 PolarHBondContact O-N 3.08Å; H67-A70 VanDerWaalsContact O-N 3.08Å; A70-S73 PolarHBondContact O-N 2.97Å; A70-R74 WeakPolarHBondContact O-CB 3.33Å; A70-R74 PolarHBondContact O-N 2.81Å
71	E	92.6	Very high	90.2	Very high	105 Å²	105	80.3 Å²	80.3	49%	0.491	41%	0.408	S	S	.	.	H	α-helix	trans	-61.7	-51.9	174.9	-72	177.1	136.8	0	0	111.3	H67 R68 S73 R74 T75	H67-E71 IonicContact CE1-OE1 3.03Å; H67-E71 PolarHBondContact CE1-OE1 3.33Å; H67-E71 IonicContact CE1-OE2 3.41Å; H67-E71 PolarHBondContact CE1-OE2 3.39Å; H67-E71 VanDerWaalsContact ND1-CD 3.3Å; H67-E71 IonicContact ND1-OE1 3.57Å; H67-E71 IonicContact ND1-OE2 3.06Å; H67-E71 PolarHBondContact ND1-OE2 3.41Å; H67-E71 PolarHBondContact O-N 3.47Å; R68-E71 PolarHBondContact O-N 2.89Å; E71-S73 VanDerWaalsContact C-N 3.3Å; E71-S73 PolarHBondContact O-N 3.33Å; E71-R74 WeakPolarHBondContact O-CB 3.22Å; E71-R74 PolarHBondContact O-N 3.16Å; E71-T75 PolarHBondContact O-N 3.44Å
72	E	91.7	Very high	90.3	Very high	50 Å²	50	78.6 Å²	78.6	23%	0.234	40%	0.402	C	S	.	.	H	α-helix	trans	-66.7	-32.7	-179.7	-154.2	93.9	141.7	0	0	111.9	R68 R74 T75 N76 A93 V96 I97 K100	R68-E72 WeakPolarHBondContact O-CB 3.45Å; R68-E72 PolarHBondContact O-N 2.92Å; E72-R74 VanDerWaalsContact C-N 3.31Å; E72-T75 WeakPolarHBondContact CA-OG1 3.46Å; E72-T75 PolarHBondContact O-OG1 3.39Å; E72-N76 WeakPolarHBondContact O-CB 3.44Å; E72-N76 PolarHBondContact O-N 3Å; E72-N76 VanDerWaalsContact O-N 3.15Å; E72-N76 PolarHBondContact O-ND2 3.12Å; E72-N76 PolarHBondContact O-OD1 2.94Å; E72-A93 HydrophobicContact CB-CB 3.93Å; E72-A93 HydrophobicContact CG-CB 4.17Å; E72-V96 WeakPolarHBondContact OE1-CG1 3.24Å; E72-I97 HydrophobicContact CB-CD1 4.03Å; E72-I97 HydrophobicContact CB-CG1 4.19Å; E72-I97 HydrophobicContact CG-CD1 4.17Å; E72-K100 IonicContact OE1-NZ 3.96Å; E72-K100 PolarHBondContact OE1-NZ 3Å; E72-K100 IonicContact OE2-NZ 2.85Å
73	S	91.5	Very high	90.5	Very high	4 Å²	4	88 Å²	88	3%	0.028	43%	0.428	C	S	.	.	H	α-helix	trans	-68.3	-34.4	173.7	-59.7	0	0	0	0	111.6	L69 A70 E71 A77 A93	L69-S73 VanDerWaalsContact O-CB 3.22Å; L69-S73 WeakPolarHBondContact O-CB 3.43Å; L69-S73 PolarHBondContact O-N 3.45Å; L69-S73 PolarHBondContact O-OG 3.28Å; A70-S73 PolarHBondContact O-N 2.97Å; E71-S73 VanDerWaalsContact C-N 3.3Å; E71-S73 PolarHBondContact O-N 3.33Å; S73-A77 WeakPolarHBondContact O-CB 2.94Å; S73-A77 PolarHBondContact O-N 2.97Å; S73-A93 WeakPolarHBondContact OG-CB 3.46Å
74	R	92.1	Very high	90.7	Very high	178 Å²	178	88.2 Å²	88.2	67%	0.672	43%	0.434	S	S	*	.	H	α-helix	trans	-71.5	-41.5	177.8	-174.6	179.9	178.4	-179.2	-1	111.4	A70 E71 E72 N76 A77 C78	A70-R74 WeakPolarHBondContact O-CB 3.33Å; A70-R74 PolarHBondContact O-N 2.81Å; E71-R74 WeakPolarHBondContact O-CB 3.22Å; E71-R74 PolarHBondContact O-N 3.16Å; E72-R74 VanDerWaalsContact C-N 3.31Å; R74-N76 VanDerWaalsContact C-N 3.35Å; R74-A77 PolarHBondContact O-N 2.85Å; R74-C78 PolarHBondContact O-N 3.44Å; R74-C78 PolarHBondContact O-SG 2.84Å
75	T	92.3	Very high	90.9	Very high	63 Å²	63	88.4 Å²	88.4	39%	0.387	43%	0.434	S	S	.	.	H	α-helix	trans	-61	-45.7	174.9	54.3	0	0	0	0	110.8	E71 E72 A77 C78 E79	E71-T75 PolarHBondContact O-N 3.44Å; E72-T75 WeakPolarHBondContact CA-OG1 3.46Å; E72-T75 PolarHBondContact O-OG1 3.39Å; T75-A77 VanDerWaalsContact C-N 3.32Å; T75-A77 PolarHBondContact O-N 3.49Å; T75-C78 WeakPolarHBondContact O-CB 3.4Å; T75-C78 PolarHBondContact O-N 3.11Å; T75-C78 VanDerWaalsContact O-N 3.12Å; T75-E79 WeakPolarHBondContact O-CG 3.29Å; T75-E79 PolarHBondContact O-N 3.24Å
76	N	89.6	Confident	91	Very high	35 Å²	35	89.7 Å²	89.7	19%	0.187	44%	0.443	C	S	.	.	H	α-helix	trans	-61.6	-38.1	177.2	-66.8	-11.9	0	0	0	112.8	E72 R74 S80 H89	E72-N76 WeakPolarHBondContact O-CB 3.44Å; E72-N76 PolarHBondContact O-N 3Å; E72-N76 VanDerWaalsContact O-N 3.15Å; E72-N76 PolarHBondContact O-ND2 3.12Å; E72-N76 PolarHBondContact O-OD1 2.94Å; R74-N76 VanDerWaalsContact C-N 3.35Å; N76-S80 WeakPolarHBondContact O-CB 3.35Å; N76-S80 PolarHBondContact O-N 3.17Å; N76-S80 VanDerWaalsContact O-N 3.16Å; N76-S80 PolarHBondContact O-OG 3.15Å; N76-H89 HydrophobicContact CB-CB 4.06Å; N76-H89 PolarHBondContact ND2-O 3.3Å
77	A	90.9	Very high	91.1	Very high	5 Å²	5	93.8 Å²	93.8	4%	0.041	45%	0.454	C	S	.	.	H	α-helix	trans	-68	-39.3	174.9	0	0	0	0	0	111.9	S73 R74 T75 S80 K81 C82 I85	S73-A77 WeakPolarHBondContact O-CB 2.94Å; S73-A77 PolarHBondContact O-N 2.97Å; R74-A77 PolarHBondContact O-N 2.85Å; T75-A77 VanDerWaalsContact C-N 3.32Å; T75-A77 PolarHBondContact O-N 3.49Å; A77-S80 WeakPolarHBondContact CA-OG 3.46Å; A77-S80 PolarHBondContact O-N 2.98Å; A77-S80 PolarHBondContact O-OG 3.24Å; A77-S80 VanDerWaalsContact O-OG 3.08Å; A77-K81 PolarHBondContact O-N 3.02Å; A77-C82 PolarHBondContact O-N 2.77Å; A77-I85 HydrophobicContact CB-CG1 4.43Å
78	C	89.9	Confident	91.1	Very high	84 Å²	84	95.9 Å²	95.9	57%	0.568	46%	0.464	S	S	*	.	H	α-helix	trans	-64.2	-44.3	175.1	-71	0	0	0	0	111.9	R74 T75 S80 K81	R74-C78 PolarHBondContact O-N 3.44Å; R74-C78 PolarHBondContact O-SG 2.84Å; T75-C78 WeakPolarHBondContact O-CB 3.4Å; T75-C78 PolarHBondContact O-N 3.11Å; T75-C78 VanDerWaalsContact O-N 3.12Å; C78-S80 VanDerWaalsContact C-N 3.31Å; C78-S80 PolarHBondContact O-N 2.86Å; C78-K81 PolarHBondContact O-N 2.77Å; C78-K81 VanDerWaalsContact O-N 3.07Å
79	E	91.8	Very high	91	Very high	152 Å²	152	90.6 Å²	90.6	71%	0.71	45%	0.445	S	S	*	.	H	α-helix	trans	-61.8	-38.8	178.3	-74.8	174.1	-169.5	0	0	112.1	T75 K81	T75-E79 WeakPolarHBondContact O-CG 3.29Å; T75-E79 PolarHBondContact O-N 3.24Å; E79-K81 VanDerWaalsContact C-N 3.25Å; E79-K81 PolarHBondContact O-N 2.73Å
80	S	89.5	Confident	90.9	Very high	54 Å²	54	91.8 Å²	91.8	38%	0.378	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	7.5	175.9	56.3	0	0	0	0	114.3	N76 A77 C78 C82 H89	N76-S80 WeakPolarHBondContact O-CB 3.35Å; N76-S80 PolarHBondContact O-N 3.17Å; N76-S80 VanDerWaalsContact O-N 3.16Å; N76-S80 PolarHBondContact O-OG 3.15Å; A77-S80 WeakPolarHBondContact CA-OG 3.46Å; A77-S80 PolarHBondContact O-N 2.98Å; A77-S80 PolarHBondContact O-OG 3.24Å; A77-S80 VanDerWaalsContact O-OG 3.08Å; C78-S80 VanDerWaalsContact C-N 3.31Å; C78-S80 PolarHBondContact O-N 2.86Å; S80-C82 PolarHBondContact O-N 2.85Å; S80-H89 PolarHBondContact OG-CE1 3.41Å; S80-H89 PolarHBondContact OG-NE2 3.09Å
81	K	91.3	Very high	91	Very high	192 Å²	192	93.9 Å²	93.9	84%	0.835	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	30.6	180	-55.7	176.4	-176.4	174	0	113.7	A77 C78 E79	A77-K81 PolarHBondContact O-N 3.02Å; C78-K81 PolarHBondContact O-N 2.77Å; C78-K81 VanDerWaalsContact O-N 3.07Å; E79-K81 VanDerWaalsContact C-N 3.25Å; E79-K81 PolarHBondContact O-N 2.73Å
82	C	86.1	Confident	91	Very high	49 Å²	49	91.1 Å²	91.1	33%	0.331	45%	0.452	S	S	.	.			trans	-93.3	132.6	179.1	-76.1	0	0	0	0	111.2	A77 S80 V84	A77-C82 PolarHBondContact O-N 2.77Å; S80-C82 PolarHBondContact O-N 2.85Å; C82-V84 VanDerWaalsContact C-N 3.33Å
83	R	88.1	Confident	91	Very high	259 Å²	259	88.7 Å²	88.7	98%	0.977	44%	0.441	S	S	*	.	S	Bend	trans	-75.9	-19.6	175.3	-86.6	-176.8	170	-178.2	-2.3	113.7
84	V	89.4	Confident	91.1	Very high	98 Å²	98	89.6 Å²	89.6	59%	0.594	45%	0.448	S	S	*	.	S	Bend	trans	-125.1	142.6	-175	-177.6	0	0	0	0	109.5	C82 N86	C82-V84 VanDerWaalsContact C-N 3.33Å; V84-N86 PolarHBondContact O-N 3.29Å; V84-N86 VanDerWaalsContact O-N 3.15Å
85	I	91.9	Very high	91.2	Very high	84 Å²	84	88.8 Å²	88.8	43%	0.431	45%	0.45	S	S	.	.			trans	-75.1	103.7	175	-59.1	176.8	0	0	0	108.7	A77 V90	A77-I85 HydrophobicContact CB-CG1 4.43Å; I85-V90 HydrophobicContact CG2-CG2 3.58Å
86	N	92	Very high	91.3	Very high	73 Å²	73	88.6 Å²	88.6	39%	0.39	45%	0.449	S	S	.	.			trans	-82.2	162.9	174.3	-64.6	-33.3	0	0	0	112.4	V84 E88 H89 V90	V84-N86 PolarHBondContact O-N 3.29Å; V84-N86 VanDerWaalsContact O-N 3.15Å; N86-E88 PolarHBondContact O-N 3.49Å; N86-H89 PolarHBondContact N-CD2 3Å; N86-H89 PolarHBondContact O-N 2.79Å; N86-V90 PolarHBondContact O-N 2.96Å
87	K	93.6	Very high	91.4	Very high	166 Å²	166	87.1 Å²	87.1	72%	0.722	44%	0.441	S	S	*	.	H	α-helix	trans	-55.3	-35.4	178	-173.9	-179.2	178.6	-175.2	0	112.5	V90 L91	K87-V90 PolarHBondContact O-N 3.2Å; K87-L91 HydrophobicContact CG-CD1 4.11Å; K87-L91 HydrophobicContact CG-CG 4.36Å; K87-L91 WeakPolarHBondContact O-CB 3.46Å; K87-L91 WeakPolarHBondContact O-CG 3.23Å; K87-L91 PolarHBondContact O-N 3.39Å
88	E	91.2	Very high	91.4	Very high	153 Å²	153	91.7 Å²	91.7	72%	0.715	46%	0.464	S	S	*	.	H	α-helix	trans	-64.2	-43.9	-179.5	-62.2	-179.9	-171.7	0	0	112.3	N86 V90 L91 A92	N86-E88 PolarHBondContact O-N 3.49Å; E88-V90 VanDerWaalsContact C-N 3.31Å; E88-V90 PolarHBondContact O-N 3.41Å; E88-L91 PolarHBondContact O-N 3.25Å; E88-A92 PolarHBondContact O-N 3.15Å
89	H	90.5	Very high	91.6	Very high	18 Å²	18	95.1 Å²	95.1	8%	0.083	47%	0.469	C	S	.	.	H	α-helix	trans	-64	-39.4	177.2	-50.7	-41.2	0	0	0	111.4	N76 S80 N86 A92 A93	N76-H89 HydrophobicContact CB-CB 4.06Å; N76-H89 PolarHBondContact ND2-O 3.3Å; S80-H89 PolarHBondContact OG-CE1 3.41Å; S80-H89 PolarHBondContact OG-NE2 3.09Å; N86-H89 PolarHBondContact N-CD2 3Å; N86-H89 PolarHBondContact O-N 2.79Å; H89-A92 PolarHBondContact O-N 2.92Å; H89-A93 VanDerWaalsContact O-CB 3.24Å; H89-A93 WeakPolarHBondContact O-CB 3.48Å; H89-A93 PolarHBondContact O-N 2.84Å
90	V	92.1	Very high	91.5	Very high	55 Å²	55	93.9 Å²	93.9	33%	0.333	46%	0.461	S	S	.	.	H	α-helix	trans	-66.5	-41.5	175.9	-179.3	0	0	0	0	111	I85 N86 K87 E88 A93 A94	I85-V90 HydrophobicContact CG2-CG2 3.58Å; N86-V90 PolarHBondContact O-N 2.96Å; K87-V90 PolarHBondContact O-N 3.2Å; E88-V90 VanDerWaalsContact C-N 3.31Å; E88-V90 PolarHBondContact O-N 3.41Å; V90-A93 PolarHBondContact O-N 3.06Å; V90-A94 WeakPolarHBondContact O-CB 3.38Å; V90-A94 PolarHBondContact O-N 3.03Å
91	L	93	Very high	91.4	Very high	94 Å²	94	93.5 Å²	93.5	49%	0.492	46%	0.458	S	S	.	.	H	α-helix	trans	-65.2	-41.2	177.8	-76	172.8	0	0	0	111.9	K87 E88 K95	K87-L91 HydrophobicContact CG-CD1 4.11Å; K87-L91 HydrophobicContact CG-CG 4.36Å; K87-L91 WeakPolarHBondContact O-CB 3.46Å; K87-L91 WeakPolarHBondContact O-CG 3.23Å; K87-L91 PolarHBondContact O-N 3.39Å; E88-L91 PolarHBondContact O-N 3.25Å; L91-K95 WeakPolarHBondContact O-CG 3.05Å; L91-K95 PolarHBondContact O-N 2.93Å
92	A	92.3	Very high	91.2	Very high	47 Å²	47	94 Å²	94	39%	0.388	46%	0.455	S	S	.	.	H	α-helix	trans	-63.6	-49.5	175.4	0	0	0	0	0	111.2	E88 H89 A94 K95	E88-A92 PolarHBondContact O-N 3.15Å; H89-A92 PolarHBondContact O-N 2.92Å; A92-A94 PolarHBondContact O-N 2.79Å; A92-K95 PolarHBondContact O-N 3.12Å
93	A	92.5	Very high	90.5	Very high	0 Å²	0	98.8 Å²	98.8	0%	0	51%	0.513	C	S	.	.	H	α-helix	trans	-61.2	-43	177.2	0	0	0	0	0	112.1	L69 E72 S73 H89 V90 K95 V96 I97	L69-A93 HydrophobicContact CD1-CB 3.88Å; E72-A93 HydrophobicContact CB-CB 3.93Å; E72-A93 HydrophobicContact CG-CB 4.17Å; S73-A93 WeakPolarHBondContact OG-CB 3.46Å; H89-A93 VanDerWaalsContact O-CB 3.24Å; H89-A93 WeakPolarHBondContact O-CB 3.48Å; H89-A93 PolarHBondContact O-N 2.84Å; V90-A93 PolarHBondContact O-N 3.06Å; A93-K95 VanDerWaalsContact C-N 3.32Å; A93-K95 PolarHBondContact O-N 3.28Å; A93-V96 PolarHBondContact O-N 2.97Å; A93-V96 VanDerWaalsContact O-N 3.12Å; A93-I97 WeakPolarHBondContact O-CG1 3.47Å; A93-I97 PolarHBondContact O-N 2.95Å
94	A	93.3	Very high	90.6	Very high	22 Å²	22	90.8 Å²	90.8	18%	0.182	49%	0.489	C	S	.	.	H	α-helix	trans	-59.6	-41.6	-178.7	0	0	0	0	0	112.1	L69 V90 A92 V96 L98	L69-A94 VanDerWaalsContact CD1-CA 3.5Å; L69-A94 HydrophobicContact CD1-CB 4Å; V90-A94 WeakPolarHBondContact O-CB 3.38Å; V90-A94 PolarHBondContact O-N 3.03Å; A92-A94 PolarHBondContact O-N 2.79Å; A94-V96 VanDerWaalsContact C-N 3.3Å; A94-V96 PolarHBondContact O-N 3.25Å; A94-L98 WeakPolarHBondContact O-CB 3.34Å; A94-L98 WeakPolarHBondContact O-CD1 3.4Å; A94-L98 WeakPolarHBondContact O-CG 3.29Å; A94-L98 PolarHBondContact O-N 3.13Å
95	K	94.1	Very high	90.7	Very high	161 Å²	161	90.4 Å²	90.4	70%	0.7	48%	0.484	S	S	*	.	H	α-helix	trans	-59.1	-43.2	176.7	-70.7	173.6	-176.9	180	0	111.8	L91 A92 A93 K99	L91-K95 WeakPolarHBondContact O-CG 3.05Å; L91-K95 PolarHBondContact O-N 2.93Å; A92-K95 PolarHBondContact O-N 3.12Å; A93-K95 VanDerWaalsContact C-N 3.32Å; A93-K95 PolarHBondContact O-N 3.28Å; K95-K99 WeakPolarHBondContact O-CB 3.32Å; K95-K99 PolarHBondContact O-N 3.49Å
96	V	93.6	Very high	90.6	Very high	60 Å²	60	90.7 Å²	90.7	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-70.5	-50.1	-179.3	179	0	0	0	0	110.9	E72 A93 A94 K99 K100	E72-V96 WeakPolarHBondContact OE1-CG1 3.24Å; A93-V96 PolarHBondContact O-N 2.97Å; A93-V96 VanDerWaalsContact O-N 3.12Å; A94-V96 VanDerWaalsContact C-N 3.3Å; A94-V96 PolarHBondContact O-N 3.25Å; V96-K99 WeakPolarHBondContact O-CB 3.5Å; V96-K99 PolarHBondContact O-N 3.11Å; V96-K100 HydrophobicContact CG1-CD 4.02Å; V96-K100 VanDerWaalsContact CG1-CE 3.49Å; V96-K100 WeakPolarHBondContact O-CG 3.44Å; V96-K100 PolarHBondContact O-N 2.93Å
97	I	92.7	Very high	90.5	Very high	4 Å²	4	91.8 Å²	91.8	2%	0.021	49%	0.492	C	S	.	.	H	α-helix	trans	-68.2	-41	-176.7	-58.5	-48.9	0	0	0	111.3	F65 R68 L69 E72 A93 K99 K100 S101	F65-I97 HydrophobicContact CD2-CG2 3.65Å; F65-I97 HydrophobicContact CE2-CB 4.28Å; F65-I97 HydrophobicContact CE2-CG2 3.48Å; F65-I97 VanDerWaalsContact CE2-CG2 3.48Å; F65-I97 HydrophobicContact CZ-CG2 4.23Å; R68-I97 HydrophobicContact CB-CD1 4.3Å; R68-I97 HydrophobicContact CB-CG2 4.24Å; L69-I97 HydrophobicContact CD1-CB 4.39Å; L69-I97 HydrophobicContact CD1-CG1 4.25Å; E72-I97 HydrophobicContact CB-CD1 4.03Å; E72-I97 HydrophobicContact CB-CG1 4.19Å; E72-I97 HydrophobicContact CG-CD1 4.17Å; A93-I97 WeakPolarHBondContact O-CG1 3.47Å; A93-I97 PolarHBondContact O-N 2.95Å; I97-K99 PolarHBondContact O-N 2.85Å; I97-K100 HydrophobicContact CD1-CD 4.05Å; I97-K100 CarbonylContact O-C 3.6Å; I97-K100 PolarHBondContact O-N 2.85Å; I97-K100 VanDerWaalsContact O-N 3.12Å; I97-S101 WeakPolarHBondContact O-CB 3.23Å; I97-S101 PolarHBondContact O-N 2.86Å; I97-S101 PolarHBondContact O-OG 3.4Å
98	L	91.4	Very high	90.3	Very high	100 Å²	100	87.1 Å²	87.1	52%	0.524	48%	0.478	S	S	.	.	H	α-helix	trans	-60.3	-31.5	174.2	-73	169.7	0	0	0	112.3	F65 A94 R102	F65-L98 HydrophobicContact CE2-CD2 3.77Å; F65-L98 HydrophobicContact CE2-CG 4.23Å; F65-L98 HydrophobicContact CZ-CD2 3.58Å; F65-L98 HydrophobicContact CZ-CG 4Å; A94-L98 WeakPolarHBondContact O-CB 3.34Å; A94-L98 WeakPolarHBondContact O-CD1 3.4Å; A94-L98 WeakPolarHBondContact O-CG 3.29Å; A94-L98 PolarHBondContact O-N 3.13Å; L98-R102 WeakPolarHBondContact O-CG 3.16Å
99	K	92.6	Very high	90.3	Very high	156 Å²	156	82.7 Å²	82.7	68%	0.678	46%	0.462	S	S	*	.	H	α-helix	trans	-72.7	-43.1	174.4	-168.3	175.6	-179.5	-177.5	0	111.5	K95 V96 I97 S101 R102	K95-K99 WeakPolarHBondContact O-CB 3.32Å; K95-K99 PolarHBondContact O-N 3.49Å; V96-K99 WeakPolarHBondContact O-CB 3.5Å; V96-K99 PolarHBondContact O-N 3.11Å; I97-K99 PolarHBondContact O-N 2.85Å; K99-S101 VanDerWaalsContact C-N 3.28Å; K99-S101 PolarHBondContact O-N 2.63Å; K99-R102 PolarHBondContact O-N 2.97Å
100	K	90.2	Very high	90.2	Very high	127 Å²	127	87.4 Å²	87.4	55%	0.552	49%	0.489	S	S	*	.	H	α-helix	trans	-66.4	-27	176.4	-70.1	173.1	178.5	169.3	0	113	E72 V96 I97	E72-K100 IonicContact OE1-NZ 3.96Å; E72-K100 PolarHBondContact OE1-NZ 3Å; E72-K100 IonicContact OE2-NZ 2.85Å; V96-K100 HydrophobicContact CG1-CD 4.02Å; V96-K100 VanDerWaalsContact CG1-CE 3.49Å; V96-K100 WeakPolarHBondContact O-CG 3.44Å; V96-K100 PolarHBondContact O-N 2.93Å; I97-K100 HydrophobicContact CD1-CD 4.05Å; I97-K100 CarbonylContact O-C 3.6Å; I97-K100 PolarHBondContact O-N 2.85Å; I97-K100 VanDerWaalsContact O-N 3.12Å
101	S	87.3	Confident	90.1	Very high	45 Å²	45	89.8 Å²	89.8	32%	0.315	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	4.7	-178.8	-68.7	0	0	0	0	114.5	F65 I97 K99 G103	F65-S101 WeakPolarHBondContact CD2-OG 3.31Å; I97-S101 WeakPolarHBondContact O-CB 3.23Å; I97-S101 PolarHBondContact O-N 2.86Å; I97-S101 PolarHBondContact O-OG 3.4Å; K99-S101 VanDerWaalsContact C-N 3.28Å; K99-S101 PolarHBondContact O-N 2.63Å; S101-G103 PolarHBondContact O-N 3.37Å
102	R	86.6	Confident	89.9	Confident	203 Å²	203	89.5 Å²	89.5	77%	0.766	50%	0.502	S	S	*	.			trans	-69.5	115	167.8	-64.2	179.9	-179.5	-172.2	-2.9	107.4	L98 K99	L98-R102 WeakPolarHBondContact O-CG 3.16Å; K99-R102 PolarHBondContact O-N 2.97Å
103	G	71.9	Confident	89.6	Confident	149 Å²	149	93.4 Å²	93.4	100%	1.536	51%	0.512	S	S	*	.			trans	-86.9	0	171.8	0	0	0	0	0	111.8	S101	S101-G103 PolarHBondContact O-N 3.37Å

Retrieved 103 of 103 residues in 75.5 ms (Link to these results)

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