A0A087X1X4_HUMAN Loading...

Zinc finger protein 714

AlphaFold DB , UniProt , Accession A0A087X1X4, Species HUMAN (Homo sapiens, Human), Gene ZNF714, Length 148 aa.

						>A0A087X1X4_HUMAN|A0A087X1X4|ZNF714
MPEPCSAEFIYECDVRELQKPGLLGDLWPEQDIKDSFQQVILRRHGKCEHENLQLRKGSANVVECKVYKKGYNELNQCLTTTQSKIFPCDKYIKVFHKIFNSNRHKTRHTGEKPFKCKKCDESFCMLLHLHQHKRIHIRENSYQCEEC
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.3	Very low	31.4	Very low	241 Å²	241	156 Å²	156	100%	1.187	84%	0.84	S	S	*	*				0	116	0	-69.4	-166.4	133.7	0	0	106.8
2	P	24.7	Very low	30.8	Very low	129 Å²	129	156.8 Å²	156.8	84%	0.838	83%	0.834	S	S	*	*				-151.4	165.6	95.5	37.3	-17.8	0	0	0	115.4
3	E	30.1	Very low	30.6	Very low	177 Å²	177	154.4 Å²	154.4	83%	0.827	84%	0.835	S	S	*	*			trans	-87.6	-171.9	155.6	-59	-151.3	160.7	0	0	110.4
4	P	47.9	Very low	30.1	Very low	108 Å²	108	150.9 Å²	150.9	70%	0.701	82%	0.816	S	S	*	*			cis	-124.4	165.1	-33.6	21.3	0.3	0	0	0	111.6
5	C	23.8	Very low	30.4	Very low	128 Å²	128	148.8 Å²	148.8	87%	0.865	81%	0.81	S	S	*	*			trans	-138.6	99.1	157.2	-100.7	0	0	0	0	110.4
6	S	34.3	Very low	30.4	Very low	112 Å²	112	151.9 Å²	151.9	78%	0.783	81%	0.806	S	S	*	*			trans	-12.7	129.7	149.4	47	0	0	0	0	117.8
7	A	28.9	Very low	30.3	Very low	98 Å²	98	150.7 Å²	150.7	81%	0.81	80%	0.795	S	S	*	*			trans	-159.6	93.9	134.3	0	0	0	0	0	109.1
8	E	33.9	Very low	30.4	Very low	176 Å²	176	151 Å²	151	82%	0.822	80%	0.796	S	S	*	*			trans	-62.2	125.7	155.7	-69.8	175	144.3	0	0	108.5
9	F	24.7	Very low	30.4	Very low	193 Å²	193	152.2 Å²	152.2	85%	0.846	80%	0.797	S	S	*	*			trans	-153.8	87.5	138.7	-90.5	-71.3	0	0	0	107	Y11	F9-Y11 PolarHBondContact O-N 3.01Å
10	I	28	Very low	30.3	Very low	139 Å²	139	152.4 Å²	152.4	71%	0.713	79%	0.791	S	S	*	*			trans	-72.4	106	165.5	-54.9	175.6	0	0	0	105.6	E12	I10-E12 VanDerWaalsContact C-N 3.26Å; I10-E12 HydrophobicContact CG2-CB 4.47Å; I10-E12 HydrophobicContact CG2-CG 3.54Å; I10-E12 PolarHBondContact O-N 3.47Å; I10-E12 VanDerWaalsContact O-N 3.15Å
11	Y	24.2	Very low	30.7	Very low	215 Å²	215	151.6 Å²	151.6	84%	0.843	80%	0.795	S	S	*	*			trans	-76.9	91.8	155.1	-89.9	-84.9	0	0	0	106.5	F9 C13	F9-Y11 PolarHBondContact O-N 3.01Å; Y11-C13 PolarHBondContact O-N 3.29Å
12	E	24.7	Very low	30	Very low	166 Å²	166	143.7 Å²	143.7	78%	0.776	78%	0.776	S	S	*	*			trans	-62.1	106	164.4	-73.4	-165.5	142.9	0	0	107.1	I10 D14	I10-E12 VanDerWaalsContact C-N 3.26Å; I10-E12 HydrophobicContact CG2-CB 4.47Å; I10-E12 HydrophobicContact CG2-CG 3.54Å; I10-E12 PolarHBondContact O-N 3.47Å; I10-E12 VanDerWaalsContact O-N 3.15Å; E12-D14 VanDerWaalsContact C-N 3.26Å; E12-D14 PolarHBondContact O-N 3.35Å
13	C	28.1	Very low	30.1	Very low	125 Å²	125	146 Å²	146	85%	0.845	78%	0.78	S	S	*	*			trans	-77.7	88.1	171.3	-148.2	0	0	0	0	106.7	Y11 V15	Y11-C13 PolarHBondContact O-N 3.29Å; C13-V15 PolarHBondContact O-N 3.1Å
14	D	23.6	Very low	30	Very low	105 Å²	105	145 Å²	145	56%	0.561	78%	0.779	S	S	*	*			trans	-62.6	119.4	-180	-154.6	-16.2	0	0	0	108.9	E12 R16 E17	E12-D14 VanDerWaalsContact C-N 3.26Å; E12-D14 PolarHBondContact O-N 3.35Å; D14-R16 PolarHBondContact O-N 3.35Å; D14-R16 IonicContact OD1-NE 3.66Å; D14-E17 PolarHBondContact O-N 2.9Å
15	V	34.6	Very low	29.1	Very low	120 Å²	120	143 Å²	143	73%	0.727	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-64.3	-3.2	-169.5	177.8	0	0	0	0	112.4	C13	C13-V15 PolarHBondContact O-N 3.1Å
16	R	30.7	Very low	29.3	Very low	198 Å²	198	144.6 Å²	144.6	75%	0.747	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-86	-10.5	-176.7	-55.9	-173.8	-155.4	-158.4	3.5	114.9	D14 L18	D14-R16 PolarHBondContact O-N 3.35Å; D14-R16 IonicContact OD1-NE 3.66Å; R16-L18 VanDerWaalsContact C-N 3.3Å; R16-L18 PolarHBondContact O-N 2.94Å
17	E	27.6	Very low	28.9	Very low	132 Å²	132	145.4 Å²	145.4	62%	0.617	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-83.1	-1.8	176.2	-74	-62.8	143.3	0	0	113.9	D14 Q19 K20	D14-E17 PolarHBondContact O-N 2.9Å; E17-Q19 PolarHBondContact O-N 2.84Å; E17-K20 IonicContact OE1-NZ 2.85Å; E17-K20 IonicContact OE2-NZ 2.7Å; E17-K20 PolarHBondContact OE2-NZ 3Å
18	L	32	Very low	28.8	Very low	156 Å²	156	150.2 Å²	150.2	82%	0.817	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-80.7	13.1	176.5	-68.6	172.3	0	0	0	114.2	R16	R16-L18 VanDerWaalsContact C-N 3.3Å; R16-L18 PolarHBondContact O-N 2.94Å
19	Q	32.2	Very low	28.5	Very low	173 Å²	173	146.2 Å²	146.2	81%	0.808	76%	0.76	S	S	*	*			trans	-123.1	44.3	-175.7	-88.5	-177.6	-37.5	0	0	114.3	E17	E17-Q19 PolarHBondContact O-N 2.84Å
20	K	27.9	Very low	28.7	Very low	157 Å²	157	142.8 Å²	142.8	68%	0.683	75%	0.747	S	S	*	*			trans	-120.8	114.1	164.9	-73	173.5	-171.8	142.9	0	110.9	E17	E17-K20 IonicContact OE1-NZ 2.85Å; E17-K20 IonicContact OE2-NZ 2.7Å; E17-K20 PolarHBondContact OE2-NZ 3Å
21	P	37.3	Very low	28.9	Very low	136 Å²	136	141.9 Å²	141.9	88%	0.883	74%	0.739	S	S	*	*			trans	-85.8	120.9	173.2	30.9	-25.9	0	0	0	109.3
22	G	31.5	Very low	29.2	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	71%	0.711	S	S	*	*	S	Bend	trans	163.9	-4	171.7	0	0	0	0	0	119
23	L	26.5	Very low	29.6	Very low	178 Å²	178	131 Å²	131	93%	0.932	70%	0.7	S	S	*	*	S	Bend	trans	-139.6	37.5	-173.7	-137	98.2	0	0	0	114.8
24	L	27.9	Very low	29.9	Very low	154 Å²	154	131.8 Å²	131.8	81%	0.806	69%	0.689	S	S	*	*			trans	-125.4	41.3	178.3	-160.7	71.1	0	0	0	111.4
25	G	28.6	Very low	30.4	Very low	67 Å²	67	129.8 Å²	129.8	69%	0.691	68%	0.678	S	S	*	*	S	Bend	trans	-83	-25.7	-177.9	0	0	0	0	0	115
26	D	28.1	Very low	30.5	Very low	162 Å²	162	127.7 Å²	127.7	87%	0.866	67%	0.669	S	S	*	*	S	Bend	trans	-122.6	15.3	-158	-62.4	-41	0	0	0	116.1
27	L	25.9	Very low	30.6	Very low	129 Å²	129	124.5 Å²	124.5	68%	0.675	66%	0.661	S	S	*	*			trans	-125.2	0.2	-165.6	-119.3	141.1	0	0	0	118.3	P29	L27-P29 WeakPolarHBondContact O-CD 3.22Å
28	W	26.6	Very low	31	Very low	198 Å²	198	122.6 Å²	122.6	75%	0.75	65%	0.652	S	S	*	*			trans	-117.8	68.1	-176.5	-85	33.2	0	0	0	114.2	D32	W28-D32 HydrophobicContact CD2-CB 4.17Å; W28-D32 VanDerWaalsContact CE2-OD1 3.3Å; W28-D32 VanDerWaalsContact CE2-OD2 3.3Å; W28-D32 HydrophobicContact CE3-CB 4.09Å; W28-D32 HydrophobicContact CH2-CB 4.25Å; W28-D32 HydrophobicContact CZ2-CB 4.3Å; W28-D32 WeakPolarHBondContact CZ2-OD1 3.29Å; W28-D32 HydrophobicContact CZ3-CB 4.14Å; W28-D32 PolarHBondContact NE1-OD1 2.85Å; W28-D32 PolarHBondContact NE1-OD2 3.28Å
29	P	27.9	Very low	31.1	Very low	92 Å²	92	119.8 Å²	119.8	60%	0.597	64%	0.635	S	S	*	*	S	Bend	trans	-84.3	113.5	160.6	33.1	-25.6	0	0	0	109.6	L27 Q31	L27-P29 WeakPolarHBondContact O-CD 3.22Å; P29-Q31 PolarHBondContact O-N 3.28Å
30	E	29.7	Very low	31.3	Very low	121 Å²	121	115.7 Å²	115.7	57%	0.565	62%	0.621	S	S	*	*	S	Bend	trans	59.1	-20.2	147	-63.8	-123	159.4	0	0	122.6	K118	E30-K118 HydrophobicContact CG-CD 4.13Å; E30-K118 PolarHBondContact O-NZ 3.05Å; E30-K118 VanDerWaalsContact OE1-CB 3.24Å; E30-K118 WeakPolarHBondContact OE1-CB 3.18Å; E30-K118 WeakPolarHBondContact OE1-CD 2.86Å; E30-K118 VanDerWaalsContact OE1-CE 3.24Å; E30-K118 WeakPolarHBondContact OE1-CE 3.29Å; E30-K118 WeakPolarHBondContact OE1-CG 3.42Å; E30-K118 IonicContact OE1-NZ 3.59Å; E30-K118 WeakPolarHBondContact OE2-CD 2.95Å; E30-K118 WeakPolarHBondContact OE2-CE 3.38Å; E30-K118 IonicContact OE2-NZ 2.75Å; E30-K118 PolarHBondContact OE2-NZ 3.35Å
31	Q	31.5	Very low	31.6	Very low	121 Å²	121	112.2 Å²	112.2	57%	0.565	61%	0.609	S	S	*	*			trans	-92	-27	-170	-155.6	74.4	8.7	0	0	112.6	P29 I33 K34 D35	P29-Q31 PolarHBondContact O-N 3.28Å; Q31-I33 VanDerWaalsContact C-N 3.3Å; Q31-I33 PolarHBondContact O-N 3.26Å; Q31-I33 VanDerWaalsContact O-N 3.12Å; Q31-K34 PolarHBondContact O-N 3.19Å; Q31-D35 WeakPolarHBondContact CG-OD2 3.15Å; Q31-D35 PolarHBondContact O-N 3.3Å
32	D	31	Very low	31.4	Very low	47 Å²	47	111.3 Å²	111.3	25%	0.251	60%	0.596	S	S	.	*	H	α-helix	trans	-62.2	-27	-169.6	-73.6	-65.4	0	0	0	115.6	W28 S36	W28-D32 HydrophobicContact CD2-CB 4.17Å; W28-D32 VanDerWaalsContact CE2-OD1 3.3Å; W28-D32 VanDerWaalsContact CE2-OD2 3.3Å; W28-D32 HydrophobicContact CE3-CB 4.09Å; W28-D32 HydrophobicContact CH2-CB 4.25Å; W28-D32 HydrophobicContact CZ2-CB 4.3Å; W28-D32 WeakPolarHBondContact CZ2-OD1 3.29Å; W28-D32 HydrophobicContact CZ3-CB 4.14Å; W28-D32 PolarHBondContact NE1-OD1 2.85Å; W28-D32 PolarHBondContact NE1-OD2 3.28Å; D32-S36 WeakPolarHBondContact O-CB 3.41Å; D32-S36 PolarHBondContact O-N 2.7Å
33	I	32.9	Very low	31.4	Very low	104 Å²	104	116.6 Å²	116.6	53%	0.533	59%	0.593	S	S	.	*	H	α-helix	trans	-79.8	-37	-174.7	-59.8	175.7	0	0	0	111.1	Q31 F37	Q31-I33 VanDerWaalsContact C-N 3.3Å; Q31-I33 PolarHBondContact O-N 3.26Å; Q31-I33 VanDerWaalsContact O-N 3.12Å; I33-F37 PolarHBondContact O-N 3.13Å
34	K	34.4	Very low	31.6	Very low	143 Å²	143	115 Å²	115	62%	0.622	57%	0.574	S	S	*	*	H	α-helix	trans	-72.4	-39.9	175.7	-166.7	178.3	177.2	-174.9	0	109.7	Q31 F37 Q38	Q31-K34 PolarHBondContact O-N 3.19Å; K34-F37 PolarHBondContact O-N 3.42Å; K34-Q38 WeakPolarHBondContact O-CB 3.25Å; K34-Q38 WeakPolarHBondContact O-CG 3.37Å; K34-Q38 PolarHBondContact O-N 2.76Å
35	D	34.6	Very low	31.7	Very low	63 Å²	63	113.2 Å²	113.2	34%	0.337	56%	0.562	S	S	.	*	H	α-helix	trans	-66.4	-38.2	174.1	-73.7	-18.4	0	0	0	111.4	Q31 F37 Q38 Q39	Q31-D35 WeakPolarHBondContact CG-OD2 3.15Å; Q31-D35 PolarHBondContact O-N 3.3Å; D35-F37 PolarHBondContact O-N 3.4Å; D35-Q38 PolarHBondContact O-N 3.03Å; D35-Q39 WeakPolarHBondContact O-CA 2.97Å; D35-Q39 WeakPolarHBondContact O-CB 3.36Å; D35-Q39 WeakPolarHBondContact O-CG 3.45Å; D35-Q39 PolarHBondContact O-N 3.15Å
36	S	34.9	Very low	31.8	Very low	75 Å²	75	113.5 Å²	113.5	52%	0.524	57%	0.565	S	S	.	*	H	α-helix	trans	-65.8	-40.7	177.8	-148.7	0	0	0	0	112.6	D32 V40	D32-S36 WeakPolarHBondContact O-CB 3.41Å; D32-S36 PolarHBondContact O-N 2.7Å; S36-V40 WeakPolarHBondContact O-CB 3.11Å; S36-V40 WeakPolarHBondContact O-CG2 3.44Å; S36-V40 PolarHBondContact O-N 3.31Å
37	F	32.9	Very low	32	Very low	131 Å²	131	114.7 Å²	114.7	58%	0.575	56%	0.562	S	S	*	*	H	α-helix	trans	-70.2	-42.7	175.8	-125.7	-94.7	0	0	0	111.9	I33 K34 D35 I41	I33-F37 PolarHBondContact O-N 3.13Å; K34-F37 PolarHBondContact O-N 3.42Å; D35-F37 PolarHBondContact O-N 3.4Å; F37-I41 HydrophobicContact CD1-CD1 4.14Å; F37-I41 WeakPolarHBondContact O-CD1 3.3Å; F37-I41 WeakPolarHBondContact O-CG1 3.36Å; F37-I41 PolarHBondContact O-N 2.76Å
38	Q	35.8	Very low	32.3	Very low	92 Å²	92	111.7 Å²	111.7	43%	0.43	55%	0.551	S	S	.	*	H	α-helix	trans	-69.3	-35.7	175.6	-71.5	-169.5	-72.4	0	0	112.3	K34 D35 I41 L42	K34-Q38 WeakPolarHBondContact O-CB 3.25Å; K34-Q38 WeakPolarHBondContact O-CG 3.37Å; K34-Q38 PolarHBondContact O-N 2.76Å; D35-Q38 PolarHBondContact O-N 3.03Å; Q38-I41 PolarHBondContact O-N 2.98Å; Q38-L42 HydrophobicContact CB-CD1 4.43Å; Q38-L42 WeakPolarHBondContact O-CB 3.29Å; Q38-L42 WeakPolarHBondContact O-CD1 3.22Å; Q38-L42 WeakPolarHBondContact O-CG 3.44Å; Q38-L42 PolarHBondContact O-N 3.32Å
39	Q	34.5	Very low	32.4	Very low	98 Å²	98	111.4 Å²	111.4	46%	0.458	56%	0.558	S	S	.	*	H	α-helix	trans	-68.6	-37.5	177.2	-75.1	-92.8	-5.5	0	0	111.9	D35 I41 R43	D35-Q39 WeakPolarHBondContact O-CA 2.97Å; D35-Q39 WeakPolarHBondContact O-CB 3.36Å; D35-Q39 WeakPolarHBondContact O-CG 3.45Å; D35-Q39 PolarHBondContact O-N 3.15Å; Q39-I41 VanDerWaalsContact C-N 3.34Å; Q39-R43 VanDerWaalsContact O-CB 3.22Å; Q39-R43 WeakPolarHBondContact O-CB 3.32Å; Q39-R43 WeakPolarHBondContact O-CG 3.2Å; Q39-R43 PolarHBondContact O-N 2.95Å
40	V	36.7	Very low	32.7	Very low	87 Å²	87	114.2 Å²	114.2	53%	0.527	56%	0.563	S	S	.	*	H	α-helix	trans	-70.6	-33.3	175.3	171	0	0	0	0	111.4	S36	S36-V40 WeakPolarHBondContact O-CB 3.11Å; S36-V40 WeakPolarHBondContact O-CG2 3.44Å; S36-V40 PolarHBondContact O-N 3.31Å
41	I	34.6	Very low	32.6	Very low	84 Å²	84	116.7 Å²	116.7	43%	0.431	57%	0.574	S	S	.	*	H	α-helix	trans	-73.1	-48.2	174.2	-68.7	169.1	0	0	0	110.7	F37 Q38 Q39 R44 H45	F37-I41 HydrophobicContact CD1-CD1 4.14Å; F37-I41 WeakPolarHBondContact O-CD1 3.3Å; F37-I41 WeakPolarHBondContact O-CG1 3.36Å; F37-I41 PolarHBondContact O-N 2.76Å; Q38-I41 PolarHBondContact O-N 2.98Å; Q39-I41 VanDerWaalsContact C-N 3.34Å; I41-R44 PolarHBondContact O-N 2.91Å; I41-H45 PolarHBondContact O-CD2 2.97Å; I41-H45 PolarHBondContact O-N 3.46Å
42	L	34.1	Very low	32.6	Very low	116 Å²	116	117.2 Å²	117.2	61%	0.607	58%	0.581	S	S	*	*	H	α-helix	trans	-67.6	-39	-179.1	-72	166.9	0	0	0	112.8	Q38 R44 H45 G46	Q38-L42 HydrophobicContact CB-CD1 4.43Å; Q38-L42 WeakPolarHBondContact O-CB 3.29Å; Q38-L42 WeakPolarHBondContact O-CD1 3.22Å; Q38-L42 WeakPolarHBondContact O-CG 3.44Å; Q38-L42 PolarHBondContact O-N 3.32Å; L42-R44 PolarHBondContact O-N 2.96Å; L42-R44 VanDerWaalsContact O-N 3.14Å; L42-H45 PolarHBondContact O-N 3.37Å; L42-G46 PolarHBondContact O-N 3.36Å
43	R	30.2	Very low	32.6	Very low	187 Å²	187	123 Å²	123	71%	0.706	61%	0.611	S	S	*	*	H	α-helix	trans	-61.3	-19.9	173.4	-82.3	-163.1	-120.4	-157	-0.3	113.7	Q39	Q39-R43 VanDerWaalsContact O-CB 3.22Å; Q39-R43 WeakPolarHBondContact O-CB 3.32Å; Q39-R43 WeakPolarHBondContact O-CG 3.2Å; Q39-R43 PolarHBondContact O-N 2.95Å
44	R	31.1	Very low	32.3	Very low	144 Å²	144	126.7 Å²	126.7	54%	0.543	63%	0.626	S	S	.	*	H	α-helix	trans	-102.7	-27.3	178.8	-100.7	-178.4	178.1	150.9	5.3	114.3	I41 L42 G46 K47 C48	I41-R44 PolarHBondContact O-N 2.91Å; L42-R44 PolarHBondContact O-N 2.96Å; L42-R44 VanDerWaalsContact O-N 3.14Å; R44-G46 VanDerWaalsContact C-N 3.25Å; R44-G46 PolarHBondContact O-N 3.11Å; R44-K47 PolarHBondContact O-N 3.23Å; R44-C48 PolarHBondContact O-N 3.4Å
45	H	29.5	Very low	32	Very low	117 Å²	117	127.5 Å²	127.5	54%	0.542	64%	0.636	S	S	.	*	H	α-helix	trans	-66.5	-27.3	169.2	-86.7	-79	0	0	0	112.6	I41 L42 K47 C48	I41-H45 PolarHBondContact O-CD2 2.97Å; I41-H45 PolarHBondContact O-N 3.46Å; L42-H45 PolarHBondContact O-N 3.37Å; H45-K47 PolarHBondContact O-N 3.46Å; H45-K47 VanDerWaalsContact O-N 3.12Å; H45-C48 PolarHBondContact O-N 2.86Å; H45-C48 VanDerWaalsContact O-O 3.1Å
46	G	30.5	Very low	31.5	Very low	73 Å²	73	136 Å²	136	75%	0.753	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-3.1	168.1	0	0	0	0	0	115.2	L42 R44	L42-G46 PolarHBondContact O-N 3.36Å; R44-G46 VanDerWaalsContact C-N 3.25Å; R44-G46 PolarHBondContact O-N 3.11Å
47	K	33.1	Very low	31.6	Very low	187 Å²	187	142.1 Å²	142.1	81%	0.813	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	8.1	176.3	-70.7	-170.5	176.3	-171.6	0	113.4	R44 H45	R44-K47 PolarHBondContact O-N 3.23Å; H45-K47 PolarHBondContact O-N 3.46Å; H45-K47 VanDerWaalsContact O-N 3.12Å
48	C	32.2	Very low	31.4	Very low	65 Å²	65	139.6 Å²	139.6	44%	0.439	69%	0.692	S	S	.	*	S	Bend	trans	-124.9	105.4	174.7	-162.8	0	0	0	0	105.6	R44 H45 H50	R44-C48 PolarHBondContact O-N 3.4Å; H45-C48 PolarHBondContact O-N 2.86Å; H45-C48 VanDerWaalsContact O-O 3.1Å; C48-H50 PolarHBondContact O-N 2.77Å
49	E	29	Very low	30.8	Very low	192 Å²	192	140.9 Å²	140.9	90%	0.897	71%	0.711	S	S	*	*			trans	-60.7	79.2	174.7	-68.7	176	157.7	0	0	109.8
50	H	32.8	Very low	31	Very low	152 Å²	152	139.9 Å²	139.9	70%	0.704	72%	0.719	S	S	*	*			trans	-109.8	95.6	159	-76.8	127.3	0	0	0	106.5	C48	C48-H50 PolarHBondContact O-N 2.77Å
51	E	28.9	Very low	30.4	Very low	172 Å²	172	143.4 Å²	143.4	80%	0.804	74%	0.735	S	S	*	*			trans	-57.3	140.4	172	-63.1	-179.8	156.9	0	0	110.1
52	N	30.4	Very low	30.4	Very low	132 Å²	132	145.8 Å²	145.8	71%	0.706	75%	0.754	S	S	*	*			trans	86.1	85.4	167.6	-55.8	-64.5	0	0	0	118.1
53	L	31.5	Very low	30.4	Very low	169 Å²	169	146.3 Å²	146.3	89%	0.885	76%	0.761	S	S	*	*			trans	-142.8	82.9	139.8	-106.5	134.2	0	0	0	109	L55	L53-L55 PolarHBondContact O-N 3.41Å; L53-L55 VanDerWaalsContact O-N 3.13Å
54	Q	27.4	Very low	30.1	Very low	182 Å²	182	145.6 Å²	145.6	85%	0.85	77%	0.766	S	S	*	*			trans	-66.1	102.4	173.6	-73.9	-87.9	14.5	0	0	109.9	R56	Q54-R56 PolarHBondContact O-N 3.33Å
55	L	27.5	Very low	30.1	Very low	159 Å²	159	144.3 Å²	144.3	83%	0.832	78%	0.778	S	S	*	*			trans	-85.4	96.9	169.4	-93	153.1	0	0	0	109.3	L53 K57	L53-L55 PolarHBondContact O-N 3.41Å; L53-L55 VanDerWaalsContact O-N 3.13Å; L55-K57 PolarHBondContact O-N 2.85Å
56	R	24.6	Very low	29.9	Very low	242 Å²	242	148 Å²	148	91%	0.913	79%	0.792	S	S	*	*			trans	-72.4	124.4	172	-167.5	179.6	-175.7	-157.3	1.3	109.8	Q54	Q54-R56 PolarHBondContact O-N 3.33Å
57	K	36.3	Very low	29.7	Very low	204 Å²	204	149.9 Å²	149.9	89%	0.887	79%	0.789	S	S	*	*			trans	-75.9	143.6	176.6	-79.4	179.7	175	177.2	0	112.3	L55	L55-K57 PolarHBondContact O-N 2.85Å
58	G	29.7	Very low	29.3	Very low	78 Å²	78	149.7 Å²	149.7	80%	0.804	78%	0.784	S	S	*	*			trans	116.3	110.9	149.3	0	0	0	0	0	115.4
59	S	22.8	Very low	28.9	Very low	119 Å²	119	155.2 Å²	155.2	83%	0.832	80%	0.801	S	S	*	*				164.2	131.6	126.7	-174	0	0	0	0	110.4
60	A	37.5	Very low	28.7	Very low	76 Å²	76	153.1 Å²	153.1	63%	0.628	79%	0.789	S	S	*	*			trans	-64.6	135.4	164.3	0	0	0	0	0	110.2
61	N	24.2	Very low	28.4	Very low	161 Å²	161	147.1 Å²	147.1	86%	0.861	77%	0.768	S	S	*	*				166.6	149.2	126.2	-87.5	-41.3	0	0	0	111.8
62	V	35.1	Very low	28.4	Very low	135 Å²	135	145.3 Å²	145.3	82%	0.818	76%	0.755	S	S	*	*	S	Bend	trans	-58.2	148.8	176.1	175	0	0	0	0	110.2
63	V	33.4	Very low	28.2	Very low	126 Å²	126	144.4 Å²	144.4	76%	0.764	75%	0.75	S	S	*	*			trans	90.5	79.2	178.6	-161.5	0	0	0	0	115.2
64	E	25.3	Very low	28	Very low	173 Å²	173	141 Å²	141	81%	0.808	73%	0.729	S	S	*	*			trans	-151.3	52.2	132.7	-114.6	174.8	-164.5	0	0	110.9	K66	E64-K66 VanDerWaalsContact C-N 3.26Å; E64-K66 PolarHBondContact O-N 3.41Å
65	C	29.8	Very low	28.2	Very low	117 Å²	117	138 Å²	138	79%	0.791	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	81.1	167.5	-164.2	0	0	0	0	108.7
66	K	25.7	Very low	28.3	Very low	194 Å²	194	134.2 Å²	134.2	84%	0.843	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.8	-19.7	162.9	-103.8	156.3	-168.2	-174.3	0	114	E64	E64-K66 VanDerWaalsContact C-N 3.26Å; E64-K66 PolarHBondContact O-N 3.41Å
67	V	26.1	Very low	28.5	Very low	112 Å²	112	128.9 Å²	128.9	68%	0.679	69%	0.685	S	S	*	*	S	Bend	trans	-79.9	-21.2	175	-176.6	0	0	0	0	112.4	K69	V67-K69 VanDerWaalsContact C-N 3.33Å; V67-K69 PolarHBondContact O-N 3.13Å
68	Y	24.5	Very low	28.1	Very low	184 Å²	184	122.7 Å²	122.7	72%	0.722	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-21.1	-172.3	-153.9	-96.6	0	0	0	115	Y72	Y68-Y72 HydrophobicContact CE1-CD2 4.31Å; Y68-Y72 HydrophobicContact CE1-CE2 4.44Å
69	K	24.3	Very low	28.3	Very low	180 Å²	180	122.6 Å²	122.6	78%	0.783	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-32.2	-174.8	-124.7	172.6	-177.1	175.8	0	113.5	V67	V67-K69 VanDerWaalsContact C-N 3.33Å; V67-K69 PolarHBondContact O-N 3.13Å
70	K	24.8	Very low	28.6	Very low	149 Å²	149	120.8 Å²	120.8	65%	0.648	63%	0.631	S	S	*	*	H	α-helix	trans	-76.9	-42.9	179.7	-161.1	178.4	179	-175.4	0	111.4	Y72 N73 E74	K70-Y72 PolarHBondContact O-N 3.29Å; K70-N73 PolarHBondContact O-N 3.32Å; K70-E74 WeakPolarHBondContact CE-OE1 3.44Å; K70-E74 WeakPolarHBondContact O-CG 3.29Å; K70-E74 PolarHBondContact O-N 3.34Å; K70-E74 VanDerWaalsContact O-N 3.08Å
71	G	26.5	Very low	28.2	Very low	26 Å²	26	120.8 Å²	120.8	27%	0.268	62%	0.623	S	S	.	*	H	α-helix	trans	-63.6	-26.4	174.7	0	0	0	0	0	113.8	L75	G71-L75 WeakPolarHBondContact O-CA 3.28Å; G71-L75 WeakPolarHBondContact O-CB 3.41Å; G71-L75 WeakPolarHBondContact O-CD1 2.97Å; G71-L75 WeakPolarHBondContact O-CG 3.25Å; G71-L75 PolarHBondContact O-N 3.29Å
72	Y	28.3	Very low	28.4	Very low	134 Å²	134	116.3 Å²	116.3	53%	0.525	60%	0.601	S	S	.	*	H	α-helix	trans	-74.9	-35.2	178.4	-139.3	-86.9	0	0	0	112.8	Y68 K70 N76	Y68-Y72 HydrophobicContact CE1-CD2 4.31Å; Y68-Y72 HydrophobicContact CE1-CE2 4.44Å; K70-Y72 PolarHBondContact O-N 3.29Å; Y72-N76 WeakPolarHBondContact O-CB 3.43Å; Y72-N76 PolarHBondContact O-N 3.23Å
73	N	27.9	Very low	28.4	Very low	112 Å²	112	114.8 Å²	114.8	60%	0.599	59%	0.585	S	S	*	*	H	α-helix	trans	-75.6	-38.3	175.3	-74	-13.4	0	0	0	111	K70 N76 Q77	K70-N73 PolarHBondContact O-N 3.32Å; N73-N76 PolarHBondContact O-N 3.34Å; N73-Q77 VanDerWaalsContact O-CB 3.29Å; N73-Q77 WeakPolarHBondContact O-CB 3.48Å; N73-Q77 PolarHBondContact O-N 3Å
74	E	27.2	Very low	28.3	Very low	99 Å²	99	113.5 Å²	113.5	46%	0.463	58%	0.582	S	S	.	*	H	α-helix	trans	-68.9	-36.7	172.8	-70.3	167.5	-176.4	0	0	111.6	K70 Q77 C78	K70-E74 WeakPolarHBondContact CE-OE1 3.44Å; K70-E74 WeakPolarHBondContact O-CG 3.29Å; K70-E74 PolarHBondContact O-N 3.34Å; K70-E74 VanDerWaalsContact O-N 3.08Å; E74-Q77 PolarHBondContact O-N 2.92Å; E74-C78 WeakPolarHBondContact O-CB 3.41Å; E74-C78 PolarHBondContact O-N 3.24Å; E74-C78 PolarHBondContact O-SG 3Å
75	L	31	Very low	28.7	Very low	119 Å²	119	113 Å²	113	62%	0.623	58%	0.577	S	S	*	*	H	α-helix	trans	-67.9	-36.2	170.9	-83.3	165.3	0	0	0	111.7	G71 C78 L79	G71-L75 WeakPolarHBondContact O-CA 3.28Å; G71-L75 WeakPolarHBondContact O-CB 3.41Å; G71-L75 WeakPolarHBondContact O-CD1 2.97Å; G71-L75 WeakPolarHBondContact O-CG 3.25Å; G71-L75 PolarHBondContact O-N 3.29Å; L75-C78 CarbonylContact O-C 3.51Å; L75-L79 WeakPolarHBondContact O-CA 3.24Å; L75-L79 WeakPolarHBondContact O-CB 3.47Å; L75-L79 PolarHBondContact O-N 3.04Å
76	N	29.1	Very low	29	Very low	79 Å²	79	110.8 Å²	110.8	42%	0.422	56%	0.557	S	S	.	*	H	α-helix	trans	-70.4	-36.4	173.4	-93.8	-20.9	0	0	0	112.1	Y72 N73 L79 T80	Y72-N76 WeakPolarHBondContact O-CB 3.43Å; Y72-N76 PolarHBondContact O-N 3.23Å; N73-N76 PolarHBondContact O-N 3.34Å; N76-L79 PolarHBondContact O-N 3Å; N76-T80 WeakPolarHBondContact O-CG2 3.24Å; N76-T80 PolarHBondContact O-N 3.37Å; N76-T80 PolarHBondContact O-OG1 3.49Å; N76-T80 VanDerWaalsContact O-OG1 3.07Å
77	Q	28.6	Very low	29.5	Very low	130 Å²	130	108.8 Å²	108.8	61%	0.607	55%	0.548	S	S	*	.	H	α-helix	trans	-70.8	-38.1	175.1	-166.9	171.7	18.5	0	0	111.5	N73 E74 T80 T81	N73-Q77 VanDerWaalsContact O-CB 3.29Å; N73-Q77 WeakPolarHBondContact O-CB 3.48Å; N73-Q77 PolarHBondContact O-N 3Å; E74-Q77 PolarHBondContact O-N 2.92Å; Q77-T80 WeakPolarHBondContact CA-OG1 3.01Å; Q77-T80 PolarHBondContact O-OG1 3.2Å; Q77-T81 WeakPolarHBondContact O-CB 3.42Å; Q77-T81 PolarHBondContact O-N 3.22Å; Q77-T81 PolarHBondContact O-OG1 3.41Å
78	C	29	Very low	30	Very low	73 Å²	73	108.6 Å²	108.6	49%	0.493	55%	0.549	S	S	.	.	H	α-helix	trans	-69.6	-32.7	167.9	-82.7	0	0	0	0	111.3	E74 L75 T81 T82	E74-C78 WeakPolarHBondContact O-CB 3.41Å; E74-C78 PolarHBondContact O-N 3.24Å; E74-C78 PolarHBondContact O-SG 3Å; L75-C78 CarbonylContact O-C 3.51Å; C78-T81 PolarHBondContact O-N 3.17Å; C78-T82 WeakPolarHBondContact O-CA 3.43Å; C78-T82 WeakPolarHBondContact O-CB 3.14Å; C78-T82 PolarHBondContact O-N 3Å; C78-T82 PolarHBondContact O-OG1 2.7Å
79	L	34.3	Very low	30.6	Very low	77 Å²	77	103.1 Å²	103.1	40%	0.403	54%	0.537	S	S	.	.	H	α-helix	trans	-74	-33.7	178.7	-171.2	72.5	0	0	0	110.7	L75 N76 T82 Q83	L75-L79 WeakPolarHBondContact O-CA 3.24Å; L75-L79 WeakPolarHBondContact O-CB 3.47Å; L75-L79 PolarHBondContact O-N 3.04Å; N76-L79 PolarHBondContact O-N 3Å; L79-T82 CarbonylContact O-C 3.24Å; L79-Q83 HydrophobicContact CG-CG 4.35Å; L79-Q83 WeakPolarHBondContact O-CA 3.23Å; L79-Q83 WeakPolarHBondContact O-CB 3.14Å; L79-Q83 VanDerWaalsContact O-CD 3.28Å; L79-Q83 WeakPolarHBondContact O-CG 3.14Å; L79-Q83 PolarHBondContact O-N 3.37Å
80	T	29.1	Very low	31.2	Very low	81 Å²	81	99.9 Å²	99.9	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-71.6	-41.2	171.3	46.7	0	0	0	0	111.4	N76 Q77 T82 Q83 S84	N76-T80 WeakPolarHBondContact O-CG2 3.24Å; N76-T80 PolarHBondContact O-N 3.37Å; N76-T80 PolarHBondContact O-OG1 3.49Å; N76-T80 VanDerWaalsContact O-OG1 3.07Å; Q77-T80 WeakPolarHBondContact CA-OG1 3.01Å; Q77-T80 PolarHBondContact O-OG1 3.2Å; T80-T82 VanDerWaalsContact C-N 3.32Å; T80-T82 PolarHBondContact O-N 3.29Å; T80-Q83 PolarHBondContact O-N 2.93Å; T80-S84 PolarHBondContact O-N 3.29Å; T80-S84 VanDerWaalsContact O-N 3.16Å
81	T	27.6	Very low	31.7	Very low	76 Å²	76	99 Å²	99	47%	0.466	53%	0.525	S	S	.	.	H	α-helix	trans	-67.7	-34.2	174.9	-47.5	0	0	0	0	111.8	Q77 C78 K85	Q77-T81 WeakPolarHBondContact O-CB 3.42Å; Q77-T81 PolarHBondContact O-N 3.22Å; Q77-T81 PolarHBondContact O-OG1 3.41Å; C78-T81 PolarHBondContact O-N 3.17Å; T81-K85 PolarHBondContact O-N 2.95Å
82	T	28.5	Very low	32.3	Very low	66 Å²	66	103.8 Å²	103.8	41%	0.405	54%	0.535	S	S	.	.	H	α-helix	trans	-81.6	-31.3	176.3	-58.2	0	0	0	0	111.3	C78 L79 T80 S84 K85 I86	C78-T82 WeakPolarHBondContact O-CA 3.43Å; C78-T82 WeakPolarHBondContact O-CB 3.14Å; C78-T82 PolarHBondContact O-N 3Å; C78-T82 PolarHBondContact O-OG1 2.7Å; L79-T82 CarbonylContact O-C 3.24Å; T80-T82 VanDerWaalsContact C-N 3.32Å; T80-T82 PolarHBondContact O-N 3.29Å; T82-S84 PolarHBondContact O-N 2.81Å; T82-K85 CarbonylContact O-C 3.54Å; T82-K85 PolarHBondContact O-N 3.15Å; T82-I86 HydrophobicContact CG2-CD1 3.66Å; T82-I86 HydrophobicContact CG2-CG1 3.72Å; T82-I86 VanDerWaalsContact O-CB 3.31Å; T82-I86 WeakPolarHBondContact O-CB 3.24Å; T82-I86 WeakPolarHBondContact O-CD1 3.45Å; T82-I86 WeakPolarHBondContact O-CG1 3.37Å; T82-I86 PolarHBondContact O-N 3.24Å
83	Q	35.5	Very low	32.9	Very low	104 Å²	104	99.7 Å²	99.7	49%	0.486	52%	0.522	S	S	.	.	H	α-helix	trans	-61.3	-34.8	170.1	-84.6	162.3	-2.9	0	0	110.8	L79 T80 K85	L79-Q83 HydrophobicContact CG-CG 4.35Å; L79-Q83 WeakPolarHBondContact O-CA 3.23Å; L79-Q83 WeakPolarHBondContact O-CB 3.14Å; L79-Q83 VanDerWaalsContact O-CD 3.28Å; L79-Q83 WeakPolarHBondContact O-CG 3.14Å; L79-Q83 PolarHBondContact O-N 3.37Å; T80-Q83 PolarHBondContact O-N 2.93Å; Q83-K85 VanDerWaalsContact C-N 3.34Å
84	S	30.5	Very low	33.4	Very low	98 Å²	98	101.3 Å²	101.3	69%	0.685	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-20.5	172.1	-160.9	0	0	0	0	113.8	T80 T82	T80-S84 PolarHBondContact O-N 3.29Å; T80-S84 VanDerWaalsContact O-N 3.16Å; T82-S84 PolarHBondContact O-N 2.81Å
85	K	34.6	Very low	34.1	Very low	163 Å²	163	100 Å²	100	71%	0.709	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-12.4	179.3	-73.4	-178.9	177.9	179.1	0	115.1	T81 T82 Q83 F87 P88	T81-K85 PolarHBondContact O-N 2.95Å; T82-K85 CarbonylContact O-C 3.54Å; T82-K85 PolarHBondContact O-N 3.15Å; Q83-K85 VanDerWaalsContact C-N 3.34Å; K85-F87 PolarHBondContact O-N 3.37Å; K85-P88 WeakPolarHBondContact O-CD 3.47Å
86	I	35.7	Very low	34.6	Very low	71 Å²	71	99.8 Å²	99.8	36%	0.364	52%	0.517	S	S	.	.	S	Bend	trans	-68.1	-13.5	171	-78.5	163.5	0	0	0	110.3	T82 P88 Y92	T82-I86 HydrophobicContact CG2-CD1 3.66Å; T82-I86 HydrophobicContact CG2-CG1 3.72Å; T82-I86 VanDerWaalsContact O-CB 3.31Å; T82-I86 WeakPolarHBondContact O-CB 3.24Å; T82-I86 WeakPolarHBondContact O-CD1 3.45Å; T82-I86 WeakPolarHBondContact O-CG1 3.37Å; T82-I86 PolarHBondContact O-N 3.24Å; I86-P88 VanDerWaalsContact C-N 3.33Å; I86-Y92 HydrophobicContact CG2-CD1 4.2Å; I86-Y92 HydrophobicContact CG2-CE1 3.9Å
87	F	37.4	Very low	35.5	Very low	151 Å²	151	100.7 Å²	100.7	66%	0.662	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	7.8	-172.2	-108.9	-76.4	0	0	0	118.6	K85 I93	K85-F87 PolarHBondContact O-N 3.37Å; F87-I93 HydrophobicContact CD1-CD1 4.19Å; F87-I93 HydrophobicContact CE1-CD1 4.36Å
88	P	36.3	Very low	36.4	Very low	109 Å²	109	102.3 Å²	102.3	71%	0.708	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.6	72.3	160.6	37.4	-19.6	0	0	0	112	K85 I86	K85-P88 WeakPolarHBondContact O-CD 3.47Å; I86-P88 VanDerWaalsContact C-N 3.33Å
89	C	37.4	Very low	37.3	Very low	68 Å²	68	103.5 Å²	103.5	46%	0.459	52%	0.524	S	S	.	.			trans	-119.8	104.6	140.8	-171.2	0	0	0	0	108.5	K91 Y92 I93	C89-K91 PolarHBondContact O-N 3.3Å; C89-Y92 WeakPolarHBondContact O-CB 3.28Å; C89-Y92 PolarHBondContact O-N 3.32Å; C89-I93 PolarHBondContact O-N 3.08Å
90	D	36.8	Very low	37.9	Very low	112 Å²	112	103 Å²	103	60%	0.599	52%	0.519	S	S	*	.	H	α-helix	trans	-48.1	-31.2	176.5	-85.2	3.1	0	0	0	113.2	K94	D90-K94 WeakPolarHBondContact O-CB 3.36Å; D90-K94 WeakPolarHBondContact O-CD 3.3Å; D90-K94 WeakPolarHBondContact O-CG 3.27Å; D90-K94 PolarHBondContact O-N 3.12Å; D90-K94 VanDerWaalsContact O-N 3.1Å
91	K	34.6	Very low	39	Very low	131 Å²	131	103 Å²	103	57%	0.57	52%	0.515	S	S	*	.	H	α-helix	trans	-72.2	-33.8	179.1	-162.9	171.2	-174.8	169.9	0	112.6	C89 V95	C89-K91 PolarHBondContact O-N 3.3Å; K91-V95 VanDerWaalsContact O-CG2 3.29Å; K91-V95 WeakPolarHBondContact O-CG2 3.41Å; K91-V95 PolarHBondContact O-N 3.43Å
92	Y	39.4	Very low	40	Very low	127 Å²	127	101.9 Å²	101.9	50%	0.498	51%	0.51	S	S	.	.	H	α-helix	trans	-70	-46.5	176.5	174.1	-100.4	0	0	0	110.9	I86 C89 K94 V95 F96	I86-Y92 HydrophobicContact CG2-CD1 4.2Å; I86-Y92 HydrophobicContact CG2-CE1 3.9Å; C89-Y92 WeakPolarHBondContact O-CB 3.28Å; C89-Y92 PolarHBondContact O-N 3.32Å; Y92-K94 PolarHBondContact O-N 2.89Å; Y92-V95 PolarHBondContact O-N 3.41Å; Y92-F96 WeakPolarHBondContact O-CB 3.35Å; Y92-F96 PolarHBondContact O-N 3.39Å
93	I	39.8	Very low	40.8	Very low	48 Å²	48	100.2 Å²	100.2	25%	0.246	50%	0.499	C	S	.	.	H	α-helix	trans	-59.3	-49.4	177.5	-62.9	175.5	0	0	0	109.6	F87 C89 V95 F96 H97	F87-I93 HydrophobicContact CD1-CD1 4.19Å; F87-I93 HydrophobicContact CE1-CD1 4.36Å; C89-I93 PolarHBondContact O-N 3.08Å; I93-V95 VanDerWaalsContact C-N 3.32Å; I93-V95 PolarHBondContact O-N 3.38Å; I93-F96 PolarHBondContact O-N 3.14Å; I93-H97 VanDerWaalsContact CG2-CD2 3.44Å; I93-H97 WeakPolarHBondContact CG2-CD2 3.31Å; I93-H97 PolarHBondContact O-CD2 3.28Å; I93-H97 PolarHBondContact O-N 3.27Å
94	K	39.8	Very low	41.5	Very low	145 Å²	145	102.8 Å²	102.8	63%	0.63	50%	0.504	S	S	*	.	H	α-helix	trans	-57.3	-40.6	179.4	-74.4	169.4	-174.2	176	0	113.6	D90 Y92 K98	D90-K94 WeakPolarHBondContact O-CB 3.36Å; D90-K94 WeakPolarHBondContact O-CD 3.3Å; D90-K94 WeakPolarHBondContact O-CG 3.27Å; D90-K94 PolarHBondContact O-N 3.12Å; D90-K94 VanDerWaalsContact O-N 3.1Å; Y92-K94 PolarHBondContact O-N 2.89Å; K94-K98 WeakPolarHBondContact O-CB 3.35Å; K94-K98 PolarHBondContact O-N 3.05Å; K94-K98 VanDerWaalsContact O-N 3.14Å
95	V	40.8	Very low	42.6	Very low	72 Å²	72	103.1 Å²	103.1	44%	0.436	50%	0.495	S	S	.	.	H	α-helix	trans	-71.9	-41.9	178.9	173.8	0	0	0	0	111.2	K91 Y92 I93 H97 K98 I99	K91-V95 VanDerWaalsContact O-CG2 3.29Å; K91-V95 WeakPolarHBondContact O-CG2 3.41Å; K91-V95 PolarHBondContact O-N 3.43Å; Y92-V95 PolarHBondContact O-N 3.41Å; I93-V95 VanDerWaalsContact C-N 3.32Å; I93-V95 PolarHBondContact O-N 3.38Å; V95-H97 PolarHBondContact O-N 2.99Å; V95-K98 PolarHBondContact O-N 3.43Å; V95-I99 HydrophobicContact CG1-CD1 4.09Å; V95-I99 PolarHBondContact O-N 3.04Å; V95-I99 VanDerWaalsContact O-N 3.13Å
96	F	42.6	Very low	43.1	Very low	114 Å²	114	100.8 Å²	100.8	50%	0.5	49%	0.485	S	S	.	.	H	α-helix	trans	-59.1	-48.8	176.8	-176.2	-95.4	0	0	0	111.5	Y92 I93 K98 I99 F100	Y92-F96 WeakPolarHBondContact O-CB 3.35Å; Y92-F96 PolarHBondContact O-N 3.39Å; I93-F96 PolarHBondContact O-N 3.14Å; F96-K98 VanDerWaalsContact C-N 3.31Å; F96-K98 PolarHBondContact O-N 3.36Å; F96-I99 PolarHBondContact O-N 3.34Å; F96-F100 WeakPolarHBondContact O-CB 3.5Å; F96-F100 PolarHBondContact O-N 2.9Å
97	H	47.2	Very low	43.6	Very low	99 Å²	99	98.4 Å²	98.4	46%	0.458	47%	0.473	S	S	.	.	H	α-helix	trans	-61.4	-38	177.2	-82.3	-89.7	0	0	0	112.5	I93 V95 F100 N101	I93-H97 VanDerWaalsContact CG2-CD2 3.44Å; I93-H97 WeakPolarHBondContact CG2-CD2 3.31Å; I93-H97 PolarHBondContact O-CD2 3.28Å; I93-H97 PolarHBondContact O-N 3.27Å; V95-H97 PolarHBondContact O-N 2.99Å; H97-F100 PolarHBondContact O-N 2.92Å; H97-N101 VanDerWaalsContact O-CB 3.24Å; H97-N101 WeakPolarHBondContact O-CB 3.48Å; H97-N101 PolarHBondContact O-N 3Å; H97-N101 PolarHBondContact O-ND2 3.5Å
98	K	46.8	Very low	44.2	Very low	164 Å²	164	100.5 Å²	100.5	71%	0.713	48%	0.477	S	S	*	.	H	α-helix	trans	-64.1	-45.1	178.6	-173.4	174.5	-178.5	177.3	0	112.3	K94 V95 F96 S102	K94-K98 WeakPolarHBondContact O-CB 3.35Å; K94-K98 PolarHBondContact O-N 3.05Å; K94-K98 VanDerWaalsContact O-N 3.14Å; V95-K98 PolarHBondContact O-N 3.43Å; F96-K98 VanDerWaalsContact C-N 3.31Å; F96-K98 PolarHBondContact O-N 3.36Å; K98-S102 VanDerWaalsContact O-CB 3.23Å; K98-S102 WeakPolarHBondContact O-CB 3.47Å; K98-S102 PolarHBondContact O-N 3.35Å
99	I	47.6	Very low	44.7	Very low	98 Å²	98	101 Å²	101	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-68	-43.4	179.5	-65.7	172.3	0	0	0	110.3	V95 F96 S102 N103	V95-I99 HydrophobicContact CG1-CD1 4.09Å; V95-I99 PolarHBondContact O-N 3.04Å; V95-I99 VanDerWaalsContact O-N 3.13Å; F96-I99 PolarHBondContact O-N 3.34Å; I99-S102 PolarHBondContact O-N 3.13Å; I99-N103 PolarHBondContact O-N 3.37Å; I99-N103 PolarHBondContact O-ND2 3.5Å
100	F	48.8	Very low	45	Very low	67 Å²	67	101.5 Å²	101.5	29%	0.294	47%	0.471	S	S	.	.	H	α-helix	trans	-61	-47.2	178.8	-168.7	-93.9	0	0	0	112	F96 H97 R104 M126	F96-F100 WeakPolarHBondContact O-CB 3.5Å; F96-F100 PolarHBondContact O-N 2.9Å; H97-F100 PolarHBondContact O-N 2.92Å; F100-R104 WeakPolarHBondContact O-CB 3.45Å; F100-R104 PolarHBondContact O-N 3.24Å; F100-M126 HydrophobicContact CD2-SD 4.14Å; F100-M126 HydrophobicContact CE1-SD 4.15Å; F100-M126 HydrophobicContact CE2-CE 4.37Å; F100-M126 HydrophobicContact CE2-CG 4.41Å; F100-M126 HydrophobicContact CE2-SD 3.28Å; F100-M126 WeakPolarHBondContact CE2-SD 3.46Å; F100-M126 HydrophobicContact CZ-CE 4.22Å; F100-M126 HydrophobicContact CZ-SD 3.29Å; F100-M126 WeakPolarHBondContact CZ-SD 3.5Å
101	N	50.3	Low	45.5	Very low	80 Å²	80	98.6 Å²	98.6	43%	0.428	47%	0.467	S	S	.	.	H	α-helix	trans	-66.7	-39.5	178.8	-71.6	-18.2	0	0	0	112.2	H97 H105	H97-N101 VanDerWaalsContact O-CB 3.24Å; H97-N101 WeakPolarHBondContact O-CB 3.48Å; H97-N101 PolarHBondContact O-N 3Å; H97-N101 PolarHBondContact O-ND2 3.5Å; N101-H105 VanDerWaalsContact O-CB 3.3Å; N101-H105 WeakPolarHBondContact O-CB 3.44Å; N101-H105 PolarHBondContact O-N 3.14Å
102	S	48.7	Very low	46.4	Very low	52 Å²	52	97.8 Å²	97.8	36%	0.364	47%	0.465	S	S	.	.	H	α-helix	trans	-63.2	-46.6	178	-175.8	0	0	0	0	111.8	K98 I99 H105 K106	K98-S102 VanDerWaalsContact O-CB 3.23Å; K98-S102 WeakPolarHBondContact O-CB 3.47Å; K98-S102 PolarHBondContact O-N 3.35Å; I99-S102 PolarHBondContact O-N 3.13Å; S102-H105 PolarHBondContact O-N 2.75Å; S102-K106 WeakPolarHBondContact O-CG 3.18Å; S102-K106 PolarHBondContact O-N 3.12Å
103	N	47.3	Very low	47.3	Very low	32 Å²	32	96.8 Å²	96.8	17%	0.171	46%	0.464	C	S	.	.	H	α-helix	trans	-67.2	-43.1	179.3	-68.3	-22.5	0	0	0	111.4	I99 H105 K106 T107	I99-N103 PolarHBondContact O-N 3.37Å; I99-N103 PolarHBondContact O-ND2 3.5Å; N103-H105 VanDerWaalsContact C-N 3.3Å; N103-H105 PolarHBondContact O-N 2.94Å; N103-K106 PolarHBondContact O-N 3.17Å; N103-T107 PolarHBondContact O-N 2.68Å; N103-T107 PolarHBondContact O-OG1 3.15Å
104	R	48.8	Very low	48.1	Very low	157 Å²	157	98.4 Å²	98.4	59%	0.592	48%	0.477	S	S	*	.	H	α-helix	trans	-60.7	-40	175.9	-167.4	179.8	81.8	178.9	4.7	112.4	F100 R108	F100-R104 WeakPolarHBondContact O-CB 3.45Å; F100-R104 PolarHBondContact O-N 3.24Å; R104-R108 PolarHBondContact O-N 3.26Å
105	H	53.7	Low	48.8	Very low	106 Å²	106	93.4 Å²	93.4	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-65.6	-49.7	177.1	177.5	76.4	0	0	0	111.3	N101 S102 N103 T107 R108 H109	N101-H105 VanDerWaalsContact O-CB 3.3Å; N101-H105 WeakPolarHBondContact O-CB 3.44Å; N101-H105 PolarHBondContact O-N 3.14Å; S102-H105 PolarHBondContact O-N 2.75Å; N103-H105 VanDerWaalsContact C-N 3.3Å; N103-H105 PolarHBondContact O-N 2.94Å; H105-T107 PolarHBondContact O-N 3.46Å; H105-R108 PolarHBondContact O-N 3.16Å; H105-H109 AromaticContact CE1-CD2 3.28Å; H105-H109 PolarHBondContact CE1-CD2 3.47Å; H105-H109 AromaticContact CE1-NE2 3.29Å; H105-H109 PolarHBondContact CE1-NE2 3.26Å; H105-H109 VanDerWaalsContact CE1-NE2 3.29Å; H105-H109 AromaticContact ND1-CD2 3.63Å; H105-H109 AromaticContact ND1-NE2 3.72Å; H105-H109 AromaticContact NE2-CD2 3.64Å; H105-H109 PolarHBondContact O-CD2 3.3Å; H105-H109 VanDerWaalsContact O-CD2 3.3Å; H105-H109 PolarHBondContact O-N 2.97Å
106	K	46.4	Very low	49.4	Very low	113 Å²	113	95.2 Å²	95.2	49%	0.491	46%	0.458	S	S	.	.	H	α-helix	trans	-57.4	-50.7	178.7	-73.8	-176.9	178	-166.4	0	111.4	S102 N103 R108 H109 T110	S102-K106 WeakPolarHBondContact O-CG 3.18Å; S102-K106 PolarHBondContact O-N 3.12Å; N103-K106 PolarHBondContact O-N 3.17Å; K106-R108 VanDerWaalsContact C-N 3.25Å; K106-R108 PolarHBondContact O-N 2.93Å; K106-H109 PolarHBondContact O-N 3.18Å; K106-T110 PolarHBondContact O-N 3.3Å; K106-T110 PolarHBondContact O-OG1 3.1Å
107	T	45.5	Very low	50.2	Low	21 Å²	21	90 Å²	90	13%	0.129	44%	0.435	C	S	.	.	H	α-helix	trans	-63.4	-30.4	-177.7	-45.3	0	0	0	0	113.6	N103 H105 H109 G111 E112 C125	N103-T107 PolarHBondContact O-N 2.68Å; N103-T107 PolarHBondContact O-OG1 3.15Å; H105-T107 PolarHBondContact O-N 3.46Å; T107-H109 VanDerWaalsContact C-N 3.29Å; T107-H109 PolarHBondContact O-N 2.8Å; T107-G111 VanDerWaalsContact O-CA 3.29Å; T107-G111 WeakPolarHBondContact O-CA 3.43Å; T107-G111 PolarHBondContact O-N 3.04Å; T107-E112 WeakPolarHBondContact CB-O 3.17Å; T107-E112 WeakPolarHBondContact CG2-O 3.29Å; T107-E112 PolarHBondContact OG1-O 3.45Å; T107-C125 HydrophobicContact CG2-CB 3.56Å; T107-C125 WeakPolarHBondContact CG2-SG 3.22Å
108	R	48.8	Very low	50.8	Low	196 Å²	196	89.8 Å²	89.8	74%	0.74	43%	0.433	S	S	*	.	H	α-helix	trans	-70.6	-26.4	176.5	-168.4	175.3	67.6	151.1	4.2	112.8	R104 H105 K106	R104-R108 PolarHBondContact O-N 3.26Å; H105-R108 PolarHBondContact O-N 3.16Å; K106-R108 VanDerWaalsContact C-N 3.25Å; K106-R108 PolarHBondContact O-N 2.93Å
109	H	47.4	Very low	51.3	Low	120 Å²	120	87.8 Å²	87.8	56%	0.556	42%	0.424	S	S	*	.	H	α-helix	trans	-97.5	-36.7	-179.1	-75.5	-70.4	0	0	0	113.2	H105 K106 T107	H105-H109 AromaticContact CE1-CD2 3.28Å; H105-H109 PolarHBondContact CE1-CD2 3.47Å; H105-H109 AromaticContact CE1-NE2 3.29Å; H105-H109 PolarHBondContact CE1-NE2 3.26Å; H105-H109 VanDerWaalsContact CE1-NE2 3.29Å; H105-H109 AromaticContact ND1-CD2 3.63Å; H105-H109 AromaticContact ND1-NE2 3.72Å; H105-H109 AromaticContact NE2-CD2 3.64Å; H105-H109 PolarHBondContact O-CD2 3.3Å; H105-H109 VanDerWaalsContact O-CD2 3.3Å; H105-H109 PolarHBondContact O-N 2.97Å; K106-H109 PolarHBondContact O-N 3.18Å; T107-H109 VanDerWaalsContact C-N 3.29Å; T107-H109 PolarHBondContact O-N 2.8Å
110	T	44.6	Very low	52.2	Low	78 Å²	78	84.9 Å²	84.9	48%	0.479	41%	0.412	S	S	.	.	H	α-helix	trans	-108.2	-11.6	-172.7	62.1	0	0	0	0	113.4	K106 E112	K106-T110 PolarHBondContact O-N 3.3Å; K106-T110 PolarHBondContact O-OG1 3.1Å; T110-E112 PolarHBondContact O-N 3.46Å; T110-E112 VanDerWaalsContact O-N 3.1Å; T110-E112 VanDerWaalsContact OG1-CB 3.29Å; T110-E112 WeakPolarHBondContact OG1-CB 3.42Å; T110-E112 VanDerWaalsContact OG1-CD 3.26Å; T110-E112 WeakPolarHBondContact OG1-CG 3.39Å; T110-E112 PolarHBondContact OG1-N 3.25Å; T110-E112 PolarHBondContact OG1-OE2 2.9Å
111	G	47.9	Very low	53.2	Low	51 Å²	51	88 Å²	88	53%	0.526	43%	0.432	S	S	.	.			trans	66.4	3.8	-171.2	0	0	0	0	0	113.5	T107 K113	T107-G111 VanDerWaalsContact O-CA 3.29Å; T107-G111 WeakPolarHBondContact O-CA 3.43Å; T107-G111 PolarHBondContact O-N 3.04Å; G111-K113 PolarHBondContact O-N 3.41Å
112	E	51.5	Low	53.8	Low	113 Å²	113	89.1 Å²	89.1	53%	0.528	44%	0.435	S	S	.	.			trans	-68.4	126.3	-176.1	-71.6	169.4	160.1	0	0	110.7	T107 T110 P114	T107-E112 WeakPolarHBondContact CB-O 3.17Å; T107-E112 WeakPolarHBondContact CG2-O 3.29Å; T107-E112 PolarHBondContact OG1-O 3.45Å; T110-E112 PolarHBondContact O-N 3.46Å; T110-E112 VanDerWaalsContact O-N 3.1Å; T110-E112 VanDerWaalsContact OG1-CB 3.29Å; T110-E112 WeakPolarHBondContact OG1-CB 3.42Å; T110-E112 VanDerWaalsContact OG1-CD 3.26Å; T110-E112 WeakPolarHBondContact OG1-CG 3.39Å; T110-E112 PolarHBondContact OG1-N 3.25Å; T110-E112 PolarHBondContact OG1-OE2 2.9Å; E112-P114 WeakPolarHBondContact O-CD 3.35Å
113	K	60	Low	54.4	Low	107 Å²	107	88 Å²	88	47%	0.465	43%	0.427	S	S	.	.			trans	-110	82.8	175.8	-58	-164.6	-166.2	170.8	0	108.7	G111 F115 S123 F124	G111-K113 PolarHBondContact O-N 3.41Å; K113-F115 PolarHBondContact O-N 3.33Å; K113-F115 VanDerWaalsContact O-N 3.11Å; K113-S123 WeakPolarHBondContact CD-O 3.37Å; K113-F124 CarbonylContact C-O 3.6Å; K113-F124 WeakPolarHBondContact CA-O 3.46Å
114	P	55.9	Low	55	Low	82 Å²	82	88.2 Å²	88.2	53%	0.532	43%	0.426	S	S	.	.			trans	-68.8	-13.6	-169.7	27	-35	0	0	0	113.5	E112	E112-P114 WeakPolarHBondContact O-CD 3.35Å
115	F	54.4	Low	55.3	Low	40 Å²	40	82.6 Å²	82.6	18%	0.175	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	84.5	-176.4	-55.8	-73.4	0	0	0	110.8	K113 S123 F124 C125 L127 L130	K113-F115 PolarHBondContact O-N 3.33Å; K113-F115 VanDerWaalsContact O-N 3.11Å; F115-S123 CarbonylContact O-C 3.59Å; F115-F124 HydrophobicContact CB-CB 4.21Å; F115-F124 WeakPolarHBondContact CB-O 3.15Å; F115-F124 WeakPolarHBondContact CD2-O 3.21Å; F115-F124 PolarHBondContact N-O 3.35Å; F115-F124 PolarHBondContact O-N 3.2Å; F115-C125 WeakPolarHBondContact CE2-O 3.32Å; F115-L127 HydrophobicContact CD1-CB 4.31Å; F115-L127 HydrophobicContact CD1-CD1 3.83Å; F115-L127 HydrophobicContact CE1-CB 4.11Å; F115-L127 HydrophobicContact CE1-CD1 4Å; F115-L127 HydrophobicContact CZ-CB 4.29Å; F115-L130 HydrophobicContact CB-CB 4.16Å; F115-L130 HydrophobicContact CB-CD2 3.92Å
116	K	53.6	Low	55.3	Low	109 Å²	109	79.1 Å²	79.1	47%	0.474	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	138.7	178	-169.7	169.4	-179.9	-171.2	0	112	D121 S123	K116-D121 WeakPolarHBondContact CE-OD1 2.97Å; K116-D121 IonicContact NZ-OD1 3.91Å; K116-D121 PolarHBondContact NZ-OD1 2.85Å; K116-S123 WeakPolarHBondContact CG-OG 3.2Å
117	C	58.4	Low	55.6	Low	5 Å²	5	77.5 Å²	77.5	3%	0.034	39%	0.392	C	S	.	.			trans	-73.9	146.6	167.8	-167	0	0	0	0	109.6	C120 E122 L130 H133 H137	C117-C120 CarbonylContact C-O 3.32Å; C117-C120 VanDerWaalsContact C-O 3.24Å; C117-C120 WeakPolarHBondContact CB-O 3.33Å; C117-E122 WeakPolarHBondContact CB-O 3.37Å; C117-E122 PolarHBondContact N-O 3.39Å; C117-L130 HydrophobicContact CB-CD1 3.87Å; C117-H133 WeakPolarHBondContact CB-NE2 3Å; C117-H133 VanDerWaalsContact SG-CD2 3.56Å; C117-H133 PolarHBondContact SG-NE2 3.16Å; C117-H137 VanDerWaalsContact SG-CD2 3.58Å; C117-H137 PolarHBondContact SG-NE2 2.9Å
118	K	59.7	Low	56	Low	94 Å²	94	81.2 Å²	81.2	41%	0.409	41%	0.41	S	S	.	.	S	Bend	trans	-95.5	-22	-179.9	-71.2	151.8	151.3	-160.8	0	112.5	E30	E30-K118 HydrophobicContact CG-CD 4.13Å; E30-K118 PolarHBondContact O-NZ 3.05Å; E30-K118 VanDerWaalsContact OE1-CB 3.24Å; E30-K118 WeakPolarHBondContact OE1-CB 3.18Å; E30-K118 WeakPolarHBondContact OE1-CD 2.86Å; E30-K118 VanDerWaalsContact OE1-CE 3.24Å; E30-K118 WeakPolarHBondContact OE1-CE 3.29Å; E30-K118 WeakPolarHBondContact OE1-CG 3.42Å; E30-K118 IonicContact OE1-NZ 3.59Å; E30-K118 WeakPolarHBondContact OE2-CD 2.95Å; E30-K118 WeakPolarHBondContact OE2-CE 3.38Å; E30-K118 IonicContact OE2-NZ 2.75Å; E30-K118 PolarHBondContact OE2-NZ 3.35Å
119	K	57.5	Low	56.5	Low	123 Å²	123	75.5 Å²	75.5	54%	0.535	39%	0.392	S	S	.	.	S	Bend	trans	-86.1	-21.1	178	-75.2	-169.6	168.4	-159.6	0	112.6	H137 N141	K119-H137 HydrophobicContact CD-CB 3.44Å; K119-H137 VanDerWaalsContact CD-CB 3.44Å; K119-N141 PolarHBondContact NZ-OD1 2.73Å
120	C	66.4	Low	57	Low	37 Å²	37	70.1 Å²	70.1	25%	0.25	37%	0.367	C	S	.	.	S	Bend	trans	-147.2	166.3	172.8	65.9	0	0	0	0	109.4	C117 E122 H133 H137	C117-C120 CarbonylContact C-O 3.32Å; C117-C120 VanDerWaalsContact C-O 3.24Å; C117-C120 WeakPolarHBondContact CB-O 3.33Å; C120-E122 PolarHBondContact O-N 2.96Å; C120-E122 VanDerWaalsContact O-N 3.15Å; C120-H133 PolarHBondContact SG-CE1 3.05Å; C120-H133 PolarHBondContact SG-NE2 2.68Å; C120-H137 PolarHBondContact SG-NE2 3.29Å
121	D	71	Confident	57.5	Low	131 Å²	131	72.3 Å²	72.3	70%	0.701	37%	0.372	S	S	*	.	S	Bend	trans	-76.9	5.4	-178.2	-75.7	-51.6	0	0	0	114.6	K116 S123	K116-D121 WeakPolarHBondContact CE-OD1 2.97Å; K116-D121 IonicContact NZ-OD1 3.91Å; K116-D121 PolarHBondContact NZ-OD1 2.85Å; D121-S123 PolarHBondContact O-N 3.01Å; D121-S123 PolarHBondContact O-OG 3.19Å
122	E	62	Low	57.8	Low	104 Å²	104	74.9 Å²	74.9	49%	0.486	37%	0.37	S	S	.	.			trans	-64.8	131.5	177.8	-77.5	-61.7	150.6	0	0	111.9	C117 C120 F124	C117-E122 WeakPolarHBondContact CB-O 3.37Å; C117-E122 PolarHBondContact N-O 3.39Å; C120-E122 PolarHBondContact O-N 2.96Å; C120-E122 VanDerWaalsContact O-N 3.15Å; E122-F124 HydrophobicContact CB-CE2 3.87Å; E122-F124 HydrophobicContact CB-CZ 3.93Å
123	S	62.5	Low	58.4	Low	30 Å²	30	70.7 Å²	70.7	21%	0.21	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143	-179.1	-57.9	0	0	0	0	110	K113 F115 K116 D121	K113-S123 WeakPolarHBondContact CD-O 3.37Å; F115-S123 CarbonylContact O-C 3.59Å; K116-S123 WeakPolarHBondContact CG-OG 3.2Å; D121-S123 PolarHBondContact O-N 3.01Å; D121-S123 PolarHBondContact O-OG 3.19Å
124	F	60.1	Low	58.2	Low	35 Å²	35	69.6 Å²	69.6	15%	0.154	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	148.4	-174.4	-59.2	-86.2	0	0	0	111.4	K113 F115 E122 M126 H129 L130 H133	K113-F124 CarbonylContact C-O 3.6Å; K113-F124 WeakPolarHBondContact CA-O 3.46Å; F115-F124 HydrophobicContact CB-CB 4.21Å; F115-F124 WeakPolarHBondContact CB-O 3.15Å; F115-F124 WeakPolarHBondContact CD2-O 3.21Å; F115-F124 PolarHBondContact N-O 3.35Å; F115-F124 PolarHBondContact O-N 3.2Å; E122-F124 HydrophobicContact CB-CE2 3.87Å; E122-F124 HydrophobicContact CB-CZ 3.93Å; F124-M126 VanDerWaalsContact C-N 3.3Å; F124-H129 HydrophobicContact CB-CB 4.21Å; F124-H129 HydrophobicContact CD1-CB 3.72Å; F124-H129 HydrophobicContact CG-CB 4.2Å; F124-L130 HydrophobicContact CB-CB 4.24Å; F124-L130 HydrophobicContact CD2-CB 3.87Å; F124-L130 HydrophobicContact CD2-CD1 3.73Å; F124-L130 HydrophobicContact CD2-CG 4.41Å; F124-L130 HydrophobicContact CE2-CD1 4.01Å; F124-L130 HydrophobicContact CG-CB 4.21Å; F124-H133 HydrophobicContact CE1-CB 3.96Å; F124-H133 HydrophobicContact CE2-CB 3.76Å; F124-H133 AromaticContact CE2-CD2 3.43Å; F124-H133 VanDerWaalsContact CE2-CD2 3.43Å; F124-H133 WeakPolarHBondContact CE2-CD2 3.34Å; F124-H133 AromaticContact CE2-CG 3.46Å; F124-H133 VanDerWaalsContact CE2-CG 3.46Å; F124-H133 AromaticContact CE2-NE2 3.95Å; F124-H133 HydrophobicContact CZ-CB 3.38Å; F124-H133 AromaticContact CZ-CD2 3.67Å; F124-H133 AromaticContact CZ-CE1 3.98Å; F124-H133 AromaticContact CZ-CG 3.19Å; F124-H133 AromaticContact CZ-ND1 3.44Å; F124-H133 WeakPolarHBondContact CZ-ND1 3.17Å
125	C	54.3	Low	58.1	Low	39 Å²	39	74.1 Å²	74.1	26%	0.264	35%	0.352	S	S	.	.	S	Bend	trans	-79.1	-20.2	176.7	-38.4	0	0	0	0	111.8	T107 F115	T107-C125 HydrophobicContact CG2-CB 3.56Å; T107-C125 WeakPolarHBondContact CG2-SG 3.22Å; F115-C125 WeakPolarHBondContact CE2-O 3.32Å
126	M	53	Low	58.2	Low	33 Å²	33	76.5 Å²	76.5	16%	0.163	37%	0.365	C	S	.	.	S	Bend	trans	-137.4	140.1	-173.6	-60.9	-169.9	-63	0	0	111.6	F100 F124 L128 H129 L130	F100-M126 HydrophobicContact CD2-SD 4.14Å; F100-M126 HydrophobicContact CE1-SD 4.15Å; F100-M126 HydrophobicContact CE2-CE 4.37Å; F100-M126 HydrophobicContact CE2-CG 4.41Å; F100-M126 HydrophobicContact CE2-SD 3.28Å; F100-M126 WeakPolarHBondContact CE2-SD 3.46Å; F100-M126 HydrophobicContact CZ-CE 4.22Å; F100-M126 HydrophobicContact CZ-SD 3.29Å; F100-M126 WeakPolarHBondContact CZ-SD 3.5Å; F124-M126 VanDerWaalsContact C-N 3.3Å; M126-L128 VanDerWaalsContact C-N 3.28Å; M126-L128 PolarHBondContact O-N 2.91Å; M126-H129 WeakPolarHBondContact CE-CE1 3.06Å; M126-H129 WeakPolarHBondContact CE-ND1 3.35Å; M126-H129 VanDerWaalsContact CE-NE2 3.29Å; M126-H129 WeakPolarHBondContact CE-NE2 3.39Å; M126-H129 PolarHBondContact O-N 3.4Å; M126-H129 VanDerWaalsContact O-N 3.14Å; M126-L130 PolarHBondContact O-N 3.4Å
127	L	52.9	Low	58.1	Low	80 Å²	80	72 Å²	72	42%	0.419	35%	0.346	S	S	.	.	H	α-helix	trans	-60.7	-36.2	179.7	-171.2	70.9	0	0	0	112.6	F115 H129 L130 H131	F115-L127 HydrophobicContact CD1-CB 4.31Å; F115-L127 HydrophobicContact CD1-CD1 3.83Å; F115-L127 HydrophobicContact CE1-CB 4.11Å; F115-L127 HydrophobicContact CE1-CD1 4Å; F115-L127 HydrophobicContact CZ-CB 4.29Å; L127-H129 VanDerWaalsContact C-N 3.28Å; L127-H129 PolarHBondContact O-N 3.14Å; L127-L130 PolarHBondContact O-N 2.84Å; L127-H131 WeakPolarHBondContact O-CB 3.49Å; L127-H131 PolarHBondContact O-N 3.27Å
128	L	54.7	Low	57.7	Low	98 Å²	98	77.4 Å²	77.4	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-58.4	-42.2	176.6	-178.9	67.2	0	0	0	111.5	M126 H131 Q132	M126-L128 VanDerWaalsContact C-N 3.28Å; M126-L128 PolarHBondContact O-N 2.91Å; L128-H131 PolarHBondContact O-N 3.3Å; L128-Q132 WeakPolarHBondContact O-CG 3.13Å; L128-Q132 PolarHBondContact O-N 3.48Å
129	H	58.2	Low	57	Low	77 Å²	77	80.5 Å²	80.5	36%	0.356	38%	0.382	S	S	.	.	H	α-helix	trans	-70.3	-41.5	180	-65	178.3	0	0	0	111.4	F124 M126 L127 H131 Q132 H133	F124-H129 HydrophobicContact CB-CB 4.21Å; F124-H129 HydrophobicContact CD1-CB 3.72Å; F124-H129 HydrophobicContact CG-CB 4.2Å; M126-H129 WeakPolarHBondContact CE-CE1 3.06Å; M126-H129 WeakPolarHBondContact CE-ND1 3.35Å; M126-H129 VanDerWaalsContact CE-NE2 3.29Å; M126-H129 WeakPolarHBondContact CE-NE2 3.39Å; M126-H129 PolarHBondContact O-N 3.4Å; M126-H129 VanDerWaalsContact O-N 3.14Å; L127-H129 VanDerWaalsContact C-N 3.28Å; L127-H129 PolarHBondContact O-N 3.14Å; H129-H131 VanDerWaalsContact C-N 3.3Å; H129-H131 PolarHBondContact O-N 2.76Å; H129-Q132 PolarHBondContact O-N 3.07Å; H129-H133 VanDerWaalsContact O-CB 3.25Å; H129-H133 WeakPolarHBondContact O-CB 3.31Å; H129-H133 PolarHBondContact O-N 2.94Å
130	L	59.2	Low	56.4	Low	6 Å²	6	80.2 Å²	80.2	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-59.7	-41.5	172.5	175.3	63.9	0	0	0	111.4	F115 C117 F124 M126 L127 H133 K134	F115-L130 HydrophobicContact CB-CB 4.16Å; F115-L130 HydrophobicContact CB-CD2 3.92Å; C117-L130 HydrophobicContact CB-CD1 3.87Å; F124-L130 HydrophobicContact CB-CB 4.24Å; F124-L130 HydrophobicContact CD2-CB 3.87Å; F124-L130 HydrophobicContact CD2-CD1 3.73Å; F124-L130 HydrophobicContact CD2-CG 4.41Å; F124-L130 HydrophobicContact CE2-CD1 4.01Å; F124-L130 HydrophobicContact CG-CB 4.21Å; M126-L130 PolarHBondContact O-N 3.4Å; L127-L130 PolarHBondContact O-N 2.84Å; L130-H133 PolarHBondContact O-N 3.49Å; L130-K134 HydrophobicContact CD1-CG 4.34Å; L130-K134 HydrophobicContact CG-CD 4.46Å; L130-K134 WeakPolarHBondContact O-CG 3.09Å; L130-K134 PolarHBondContact O-N 3.41Å
131	H	54.7	Low	55.3	Low	125 Å²	125	84.3 Å²	84.3	58%	0.579	40%	0.402	S	S	*	.	H	α-helix	trans	-64.9	-44	178.7	-177.3	-90.5	0	0	0	112	L127 L128 H129 K134	L127-H131 WeakPolarHBondContact O-CB 3.49Å; L127-H131 PolarHBondContact O-N 3.27Å; L128-H131 PolarHBondContact O-N 3.3Å; H129-H131 VanDerWaalsContact C-N 3.3Å; H129-H131 PolarHBondContact O-N 2.76Å; H131-K134 PolarHBondContact O-N 2.86Å
132	Q	54	Low	53.9	Low	104 Å²	104	81.8 Å²	81.8	49%	0.486	40%	0.395	S	S	.	.	H	α-helix	trans	-62.4	-44.2	174	-73.2	175.1	-7.7	0	0	111.4	L128 H129 K134 R135	L128-Q132 WeakPolarHBondContact O-CG 3.13Å; L128-Q132 PolarHBondContact O-N 3.48Å; H129-Q132 PolarHBondContact O-N 3.07Å; Q132-K134 PolarHBondContact O-N 2.68Å; Q132-R135 VanDerWaalsContact O-CB 3.3Å; Q132-R135 WeakPolarHBondContact O-CB 3.47Å; Q132-R135 PolarHBondContact O-N 2.66Å; Q132-R135 VanDerWaalsContact O-N 3.12Å
133	H	64.4	Low	52.9	Low	25 Å²	25	84.5 Å²	84.5	12%	0.116	40%	0.402	C	S	.	.	H	α-helix	trans	-60.8	-41	177.4	166.8	81.6	0	0	0	112.6	C117 C120 F124 H129 L130 R135 I136 H137	C117-H133 WeakPolarHBondContact CB-NE2 3Å; C117-H133 VanDerWaalsContact SG-CD2 3.56Å; C117-H133 PolarHBondContact SG-NE2 3.16Å; C120-H133 PolarHBondContact SG-CE1 3.05Å; C120-H133 PolarHBondContact SG-NE2 2.68Å; F124-H133 HydrophobicContact CE1-CB 3.96Å; F124-H133 HydrophobicContact CE2-CB 3.76Å; F124-H133 AromaticContact CE2-CD2 3.43Å; F124-H133 VanDerWaalsContact CE2-CD2 3.43Å; F124-H133 WeakPolarHBondContact CE2-CD2 3.34Å; F124-H133 AromaticContact CE2-CG 3.46Å; F124-H133 VanDerWaalsContact CE2-CG 3.46Å; F124-H133 AromaticContact CE2-NE2 3.95Å; F124-H133 HydrophobicContact CZ-CB 3.38Å; F124-H133 AromaticContact CZ-CD2 3.67Å; F124-H133 AromaticContact CZ-CE1 3.98Å; F124-H133 AromaticContact CZ-CG 3.19Å; F124-H133 AromaticContact CZ-ND1 3.44Å; F124-H133 WeakPolarHBondContact CZ-ND1 3.17Å; H129-H133 VanDerWaalsContact O-CB 3.25Å; H129-H133 WeakPolarHBondContact O-CB 3.31Å; H129-H133 PolarHBondContact O-N 2.94Å; L130-H133 PolarHBondContact O-N 3.49Å; H133-R135 PolarHBondContact O-N 2.65Å; H133-R135 VanDerWaalsContact O-N 3.08Å; H133-I136 WeakPolarHBondContact O-CB 2.92Å; H133-I136 WeakPolarHBondContact O-CG1 3.29Å; H133-I136 PolarHBondContact O-N 3.36Å; H133-H137 AromaticContact CD2-NE2 3.99Å; H133-H137 AromaticContact CE1-NE2 3.68Å; H133-H137 AromaticContact NE2-CD2 3.82Å; H133-H137 AromaticContact NE2-NE2 3.13Å; H133-H137 PolarHBondContact NE2-NE2 3.27Å; H133-H137 VanDerWaalsContact NE2-NE2 3.13Å
134	K	54.6	Low	52	Low	85 Å²	85	91.5 Å²	91.5	37%	0.37	43%	0.432	S	S	.	.	H	α-helix	trans	-59.2	-24.2	176.2	-78	179.4	179.1	-175.8	0	113.7	L130 H131 Q132 I136 H137 I138	L130-K134 HydrophobicContact CD1-CG 4.34Å; L130-K134 HydrophobicContact CG-CD 4.46Å; L130-K134 WeakPolarHBondContact O-CG 3.09Å; L130-K134 PolarHBondContact O-N 3.41Å; H131-K134 PolarHBondContact O-N 2.86Å; Q132-K134 PolarHBondContact O-N 2.68Å; K134-I136 PolarHBondContact O-N 3.35Å; K134-H137 PolarHBondContact O-N 3.28Å; K134-I138 WeakPolarHBondContact O-CG1 3.37Å; K134-I138 PolarHBondContact O-N 2.67Å
135	R	55.3	Low	51.1	Low	176 Å²	176	94.5 Å²	94.5	66%	0.664	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-26.3	174	-60.5	-178.7	66	-171.1	-0.4	112.4	Q132 H133 I138 R139	Q132-R135 VanDerWaalsContact O-CB 3.3Å; Q132-R135 WeakPolarHBondContact O-CB 3.47Å; Q132-R135 PolarHBondContact O-N 2.66Å; Q132-R135 VanDerWaalsContact O-N 3.12Å; H133-R135 PolarHBondContact O-N 2.65Å; H133-R135 VanDerWaalsContact O-N 3.08Å; R135-I138 PolarHBondContact O-N 2.97Å; R135-R139 PolarHBondContact O-N 3.28Å; R135-R139 VanDerWaalsContact O-N 3.15Å
136	I	55	Low	50.6	Low	90 Å²	90	101.5 Å²	101.5	46%	0.462	49%	0.485	S	S	.	.	H	α-helix	trans	-66.4	-44.3	176.6	-56.8	171.2	0	0	0	109.6	H133 K134 I138 R139 E140	H133-I136 WeakPolarHBondContact O-CB 2.92Å; H133-I136 WeakPolarHBondContact O-CG1 3.29Å; H133-I136 PolarHBondContact O-N 3.36Å; K134-I136 PolarHBondContact O-N 3.35Å; I136-I138 VanDerWaalsContact C-N 3.26Å; I136-I138 PolarHBondContact O-N 3.27Å; I136-R139 CarbonylContact O-C 3.55Å; I136-R139 WeakPolarHBondContact O-CA 3.36Å; I136-R139 VanDerWaalsContact O-CB 3.28Å; I136-R139 WeakPolarHBondContact O-CB 3.42Å; I136-R139 PolarHBondContact O-N 3.42Å; I136-E140 HydrophobicContact CG2-CG 4.49Å; I136-E140 PolarHBondContact O-N 3.04Å
137	H	52.7	Low	50	Low	15 Å²	15	107.7 Å²	107.7	7%	0.069	51%	0.513	C	S	.	.	H	α-helix	trans	-67.5	-24	175.8	-63.8	-49	0	0	0	114.6	C117 K119 C120 H133 K134 R139 E140 N141	C117-H137 VanDerWaalsContact SG-CD2 3.58Å; C117-H137 PolarHBondContact SG-NE2 2.9Å; K119-H137 HydrophobicContact CD-CB 3.44Å; K119-H137 VanDerWaalsContact CD-CB 3.44Å; C120-H137 PolarHBondContact SG-NE2 3.29Å; H133-H137 AromaticContact CD2-NE2 3.99Å; H133-H137 AromaticContact CE1-NE2 3.68Å; H133-H137 AromaticContact NE2-CD2 3.82Å; H133-H137 AromaticContact NE2-NE2 3.13Å; H133-H137 PolarHBondContact NE2-NE2 3.27Å; H133-H137 VanDerWaalsContact NE2-NE2 3.13Å; K134-H137 PolarHBondContact O-N 3.28Å; H137-R139 VanDerWaalsContact C-N 3.3Å; H137-E140 IonicContact CE1-OE2 3.63Å; H137-E140 IonicContact CG-OE2 3.78Å; H137-E140 IonicContact ND1-OE2 2.77Å; H137-E140 PolarHBondContact ND1-OE2 3.46Å; H137-N141 VanDerWaalsContact O-CB 3.31Å; H137-N141 WeakPolarHBondContact O-CB 3.17Å; H137-N141 PolarHBondContact O-N 3.33Å; H137-N141 PolarHBondContact O-OD1 2.66Å
138	I	49.1	Very low	49.7	Very low	118 Å²	118	113.3 Å²	113.3	61%	0.605	56%	0.557	S	S	*	*	H	α-helix	trans	-71.2	-35.1	171.2	-63.9	169.8	0	0	0	109.3	K134 R135 I136 S142	K134-I138 WeakPolarHBondContact O-CG1 3.37Å; K134-I138 PolarHBondContact O-N 2.67Å; R135-I138 PolarHBondContact O-N 2.97Å; I136-I138 VanDerWaalsContact C-N 3.26Å; I136-I138 PolarHBondContact O-N 3.27Å; I138-S142 PolarHBondContact O-N 3.08Å; I138-S142 PolarHBondContact O-OG 3.27Å
139	R	44.7	Very low	49.5	Very low	159 Å²	159	114.1 Å²	114.1	60%	0.6	56%	0.559	S	S	*	*	H	α-helix	trans	-72.3	-42.4	175.2	-148.8	-171	-177.1	172.4	0.1	112.1	R135 I136 H137 S142 Y143	R135-R139 PolarHBondContact O-N 3.28Å; R135-R139 VanDerWaalsContact O-N 3.15Å; I136-R139 CarbonylContact O-C 3.55Å; I136-R139 WeakPolarHBondContact O-CA 3.36Å; I136-R139 VanDerWaalsContact O-CB 3.28Å; I136-R139 WeakPolarHBondContact O-CB 3.42Å; I136-R139 PolarHBondContact O-N 3.42Å; H137-R139 VanDerWaalsContact C-N 3.3Å; R139-S142 VanDerWaalsContact CA-OG 3.27Å; R139-S142 WeakPolarHBondContact CA-OG 3.48Å; R139-S142 CarbonylContact O-C 3.39Å; R139-S142 WeakPolarHBondContact O-CA 3.17Å; R139-S142 PolarHBondContact O-N 2.77Å; R139-S142 PolarHBondContact O-OG 3.12Å; R139-Y143 HydrophobicContact CG-CD2 4.24Å; R139-Y143 HydrophobicContact CG-CE2 3.68Å; R139-Y143 WeakPolarHBondContact O-CD2 3.39Å; R139-Y143 PolarHBondContact O-N 2.59Å
140	E	45.3	Very low	49	Very low	117 Å²	117	116 Å²	116	55%	0.547	57%	0.57	S	S	.	*	H	α-helix	trans	-61.7	-43	173.7	-73.5	171.7	160.4	0	0	111.8	I136 H137 S142 Y143	I136-E140 HydrophobicContact CG2-CG 4.49Å; I136-E140 PolarHBondContact O-N 3.04Å; H137-E140 IonicContact CE1-OE2 3.63Å; H137-E140 IonicContact CG-OE2 3.78Å; H137-E140 IonicContact ND1-OE2 2.77Å; H137-E140 PolarHBondContact ND1-OE2 3.46Å; E140-S142 PolarHBondContact O-N 3.49Å; E140-S142 VanDerWaalsContact O-N 3.17Å; E140-Y143 PolarHBondContact O-N 2.96Å
141	N	44	Very low	48.4	Very low	123 Å²	123	122.1 Å²	122.1	66%	0.658	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-9.2	172	-91.2	67.8	0	0	0	113.9	K119 H137	K119-N141 PolarHBondContact NZ-OD1 2.73Å; H137-N141 VanDerWaalsContact O-CB 3.31Å; H137-N141 WeakPolarHBondContact O-CB 3.17Å; H137-N141 PolarHBondContact O-N 3.33Å; H137-N141 PolarHBondContact O-OD1 2.66Å
142	S	42.1	Very low	48.1	Very low	79 Å²	79	121.9 Å²	121.9	55%	0.552	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-0.2	175.2	61.3	0	0	0	0	113.9	I138 R139 E140	I138-S142 PolarHBondContact O-N 3.08Å; I138-S142 PolarHBondContact O-OG 3.27Å; R139-S142 VanDerWaalsContact CA-OG 3.27Å; R139-S142 WeakPolarHBondContact CA-OG 3.48Å; R139-S142 CarbonylContact O-C 3.39Å; R139-S142 WeakPolarHBondContact O-CA 3.17Å; R139-S142 PolarHBondContact O-N 2.77Å; R139-S142 PolarHBondContact O-OG 3.12Å; E140-S142 PolarHBondContact O-N 3.49Å; E140-S142 VanDerWaalsContact O-N 3.17Å
143	Y	41.1	Very low	47.7	Very low	161 Å²	161	123.1 Å²	123.1	63%	0.631	61%	0.608	S	S	*	*			trans	-107.6	48.3	169.3	-71.1	-75.2	0	0	0	110.8	R139 E140 C145	R139-Y143 HydrophobicContact CG-CD2 4.24Å; R139-Y143 HydrophobicContact CG-CE2 3.68Å; R139-Y143 WeakPolarHBondContact O-CD2 3.39Å; R139-Y143 PolarHBondContact O-N 2.59Å; E140-Y143 PolarHBondContact O-N 2.96Å; Y143-C145 VanDerWaalsContact C-N 3.29Å; Y143-C145 PolarHBondContact O-N 3.13Å
144	Q	41.9	Very low	46.6	Very low	177 Å²	177	129.6 Å²	129.6	83%	0.827	64%	0.641	S	S	*	*			trans	-86.1	88.2	141.8	-94.7	-173.3	-45.9	0	0	105.8	E146	Q144-E146 PolarHBondContact O-N 2.74Å
145	C	41.1	Very low	46	Very low	98 Å²	98	132.8 Å²	132.8	66%	0.662	66%	0.66	S	S	*	*			trans	-67.9	109.9	149.4	-164.9	0	0	0	0	104.2	Y143 E147	Y143-C145 VanDerWaalsContact C-N 3.29Å; Y143-C145 PolarHBondContact O-N 3.13Å; C145-E147 HydrophobicContact CB-CG 4.49Å; C145-E147 PolarHBondContact O-N 3.41Å
146	E	44.3	Very low	45.3	Very low	185 Å²	185	129.5 Å²	129.5	86%	0.864	66%	0.66	S	S	*	*			trans	-62.3	91.4	149.5	-72	179.5	166.7	0	0	104.4	Q144 C148	Q144-E146 PolarHBondContact O-N 2.74Å; E146-C148 PolarHBondContact O-N 3.5Å
147	E	41.6	Very low	44.5	Very low	163 Å²	163	132.8 Å²	132.8	76%	0.762	68%	0.676	S	S	*	*			trans	-64.4	125.8	170.9	-98.5	-174.7	165.3	0	0	108.8	C145	C145-E147 HydrophobicContact CB-CG 4.49Å; C145-E147 PolarHBondContact O-N 3.41Å
148	C	46	Very low	43.8	Very low	198 Å²	198	143.5 Å²	143.5	100%	1.338	73%	0.732	S	S	*	*			trans	75	0	147.9	-71.3	0	0	0	0	119.5	E146	E146-C148 PolarHBondContact O-N 3.5Å

Retrieved 148 of 148 residues in 76.1 ms (Link to these results)

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