A0A087X9W4_POEFO Loading...

Chromobox homolog 3a (HP1 gamma homolog, Drosophila)

AlphaFold DB , UniProt , Accession A0A087X9W4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 173 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.9	Very low	46.2	Very low	255 Å²	255	176 Å²	176	100%	1.256	89%	0.885	S	S	*	*				0	114.3	0	-78.5	175.7	-179.4	0	0	108.3
2	G	44.4	Very low	46.3	Very low	81 Å²	81	175.8 Å²	175.8	84%	0.835	88%	0.878	S	S	*	*			trans	-167	129.5	177.8	0	0	0	0	0	108.6
3	K	45.9	Very low	46.5	Very low	210 Å²	210	169.4 Å²	169.4	91%	0.913	87%	0.87	S	S	*	*			trans	-77.7	146.9	-152.7	-78.2	160.5	165.2	170.4	0	114.8
4	K	49.9	Very low	46.4	Very low	202 Å²	202	170.8 Å²	170.8	88%	0.878	87%	0.871	S	S	*	*			trans	-41.2	135.1	157	-97.5	163	166.7	165.8	0	112.4
5	Q	52.5	Low	46.2	Very low	194 Å²	194	167.6 Å²	167.6	91%	0.907	86%	0.863	S	S	*	*			trans	-132.8	126.3	144.7	-81.2	-173.9	-36.1	0	0	110.2
6	N	42.9	Very low	46.4	Very low	138 Å²	138	168.6 Å²	168.6	74%	0.738	86%	0.863	S	S	*	*			trans	-102.9	120.8	179.4	172.3	54	0	0	0	106.2
7	T	40	Very low	47	Very low	128 Å²	128	169.4 Å²	169.4	79%	0.785	86%	0.862	S	S	*	*			trans	-138.2	117.1	166	42.6	0	0	0	0	109	T9	T7-T9 PolarHBondContact O-N 3.37Å
8	K	50.6	Low	47.5	Very low	193 Å²	193	169.6 Å²	169.6	84%	0.839	86%	0.859	S	S	*	*			trans	-63.3	117.3	178.6	-72.4	168.7	170.3	175.4	0	109.4	K10	K8-K10 PolarHBondContact O-N 3.31Å
9	T	43.1	Very low	48.2	Very low	142 Å²	142	166.7 Å²	166.7	87%	0.871	85%	0.853	S	S	*	*			trans	-80.2	110.3	165.4	-44	0	0	0	0	108.5	T7 K11	T7-T9 PolarHBondContact O-N 3.37Å; T9-K11 PolarHBondContact O-N 3.11Å
10	K	45.2	Very low	48.9	Very low	185 Å²	185	165.8 Å²	165.8	80%	0.804	85%	0.845	S	S	*	*			trans	-66.1	116.9	175.4	-167.4	179.6	179.5	-170.4	0	107.9	K8 E12	K8-K10 PolarHBondContact O-N 3.31Å; K10-E12 PolarHBondContact O-N 3.37Å
11	K	46.7	Very low	50	Low	208 Å²	208	167 Å²	167	90%	0.904	85%	0.847	S	S	*	*			trans	-78.5	106.2	176.4	-161.8	178.9	-175.3	-175.4	0	107.4	T9 A13	T9-K11 PolarHBondContact O-N 3.11Å; K11-A13 PolarHBondContact O-N 3.22Å
12	E	48.1	Very low	51.3	Low	173 Å²	173	159.2 Å²	159.2	81%	0.808	81%	0.807	S	S	*	*			trans	-72.3	119.5	172.4	-68.6	177.1	160.8	0	0	108.1	K10 Q14	K10-E12 PolarHBondContact O-N 3.37Å; E12-Q14 PolarHBondContact O-N 3.27Å
13	A	48	Very low	52.8	Low	93 Å²	93	159.9 Å²	159.9	77%	0.769	80%	0.795	S	S	*	*			trans	-77	109.6	173.3	0	0	0	0	0	107.6	K11 T15	K11-A13 PolarHBondContact O-N 3.22Å; A13-T15 PolarHBondContact O-N 3.12Å
14	Q	45.2	Very low	54.4	Low	189 Å²	189	151.1 Å²	151.1	88%	0.883	76%	0.759	S	S	*	*			trans	-81.6	97.5	170.6	-161.6	172.2	13.9	0	0	106.7	E12 Q16	E12-Q14 PolarHBondContact O-N 3.27Å; Q14-Q16 PolarHBondContact O-N 3.5Å
15	T	44.1	Very low	55.8	Low	123 Å²	123	146.5 Å²	146.5	76%	0.755	74%	0.74	S	S	*	*			trans	-66.3	109.2	172.1	-42.4	0	0	0	0	107.2	A13 E17	A13-T15 PolarHBondContact O-N 3.12Å; T15-E17 PolarHBondContact O-N 3.26Å
16	Q	49	Very low	57	Low	183 Å²	183	143.1 Å²	143.1	86%	0.855	72%	0.722	S	S	*	*			trans	-72.7	105.2	165.1	-82.8	176.1	-27.2	0	0	106.6	Q14 E18	Q14-Q16 PolarHBondContact O-N 3.5Å; Q16-E18 PolarHBondContact O-N 3.44Å
17	E	55.8	Low	58.7	Low	183 Å²	183	136.8 Å²	136.8	86%	0.855	69%	0.689	S	S	*	*			trans	-68.4	120	163.9	-79	177.9	157.6	0	0	107.5	T15	T15-E17 PolarHBondContact O-N 3.26Å
18	E	57.6	Low	60.5	Low	172 Å²	172	134.9 Å²	134.9	80%	0.804	67%	0.672	S	S	*	*			trans	-65.6	144.2	168.7	-79.1	-162.3	147.6	0	0	109.3	Q16 E20	Q16-E18 PolarHBondContact O-N 3.44Å; E18-E20 PolarHBondContact O-N 3.45Å; E18-E20 VanDerWaalsContact O-N 3.09Å
19	P	59.4	Low	61.8	Low	116 Å²	116	129.5 Å²	129.5	75%	0.753	65%	0.652	S	S	*	*			trans	-64.4	112.2	175.8	26.5	-32.1	0	0	0	109.5
20	E	63.4	Low	63.7	Low	148 Å²	148	125.7 Å²	125.7	69%	0.692	63%	0.625	S	S	*	*			trans	-76.1	125.1	173.5	-71.9	-176.4	179.7	0	0	109.7	E18 F22	E18-E20 PolarHBondContact O-N 3.45Å; E18-E20 VanDerWaalsContact O-N 3.09Å; E20-F22 HydrophobicContact CB-CD2 4.31Å; E20-F22 HydrophobicContact CB-CE2 3.49Å; E20-F22 VanDerWaalsContact CB-CE2 3.49Å; E20-F22 HydrophobicContact CB-CZ 3.72Å; E20-F22 WeakPolarHBondContact O-CD2 3.25Å; E20-F22 WeakPolarHBondContact O-CE2 3.44Å; E20-F22 VanDerWaalsContact OE2-CZ 3.25Å; E20-F22 WeakPolarHBondContact OE2-CZ 3.36Å
21	E	70.6	Confident	65.3	Low	191 Å²	191	121.5 Å²	121.5	89%	0.893	60%	0.604	S	S	*	*			trans	-83	120.1	176.5	-65.9	177.9	-173.4	0	0	110.1
22	F	75.1	Confident	66.8	Low	91 Å²	91	117.7 Å²	117.7	40%	0.399	59%	0.592	S	S	.	*			trans	-111.2	145.4	176.9	-61.9	-87.6	0	0	0	111.2	E20 V24 W43 F46	E20-F22 HydrophobicContact CB-CD2 4.31Å; E20-F22 HydrophobicContact CB-CE2 3.49Å; E20-F22 VanDerWaalsContact CB-CE2 3.49Å; E20-F22 HydrophobicContact CB-CZ 3.72Å; E20-F22 WeakPolarHBondContact O-CD2 3.25Å; E20-F22 WeakPolarHBondContact O-CE2 3.44Å; E20-F22 VanDerWaalsContact OE2-CZ 3.25Å; E20-F22 WeakPolarHBondContact OE2-CZ 3.36Å; F22-V24 PolarHBondContact O-N 3.37Å; F22-W43 HydrophobicContact CB-CD2 4.13Å; F22-W43 HydrophobicContact CB-CE3 3.42Å; F22-W43 VanDerWaalsContact CB-CE3 3.42Å; F22-W43 HydrophobicContact CB-CH2 4.24Å; F22-W43 HydrophobicContact CB-CZ3 3.5Å; F22-W43 VanDerWaalsContact CB-CZ3 3.5Å; F22-W43 WeakPolarHBondContact O-CZ3 3.4Å; F22-F46 AromaticContact CD1-CE2 3.95Å; F22-F46 HydrophobicContact CD1-CE2 3.95Å; F22-F46 HydrophobicContact CD1-CZ 4.1Å; F22-F46 HydrophobicContact CE1-CE2 4.38Å; F22-F46 HydrophobicContact CE1-CZ 4.05Å
23	V	76.8	Confident	68.1	Low	96 Å²	96	111.9 Å²	111.9	58%	0.582	57%	0.568	S	S	*	*			trans	-80	121.7	179.4	179.5	0	0	0	0	110.1	K44	V23-K44 HydrophobicContact CB-CB 4.12Å; V23-K44 HydrophobicContact CG1-CB 3.99Å; V23-K44 HydrophobicContact CG1-CD 3.84Å; V23-K44 WeakPolarHBondContact O-CB 3.43Å; V23-K44 PolarHBondContact O-N 2.96Å
24	V	77.8	Confident	69.4	Low	26 Å²	26	115.2 Å²	115.2	16%	0.158	57%	0.573	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.8	124.8	174	-174.5	0	0	0	0	110	F22 L41 W43 L64	F22-V24 PolarHBondContact O-N 3.37Å; V24-L41 HydrophobicContact CB-CD1 4.48Å; V24-L41 HydrophobicContact CG1-CB 4.37Å; V24-L41 HydrophobicContact CG1-CD1 4.11Å; V24-L41 HydrophobicContact CG1-CD2 3.87Å; V24-L41 HydrophobicContact CG1-CG 4.34Å; V24-L41 HydrophobicContact CG2-CD1 3.54Å; V24-W43 HydrophobicContact CG2-CE3 4.14Å; V24-W43 HydrophobicContact CG2-CH2 4.48Å; V24-W43 HydrophobicContact CG2-CZ3 3.68Å; V24-L64 HydrophobicContact CB-CD1 4.17Å; V24-L64 HydrophobicContact CG1-CD1 3.85Å
25	E	79.8	Confident	70.9	Confident	104 Å²	104	109.6 Å²	109.6	49%	0.486	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.6	-45.4	172.1	-170.1	-178.1	129.9	0	0	111.1	K42 K44	E25-K42 WeakPolarHBondContact CA-O 3.46Å; E25-K42 HydrophobicContact CB-CB 4.45Å; E25-K42 HydrophobicContact CB-CG 4.04Å; E25-K42 VanDerWaalsContact CB-O 3.26Å; E25-K42 WeakPolarHBondContact CB-O 3.4Å; E25-K42 HydrophobicContact CG-CG 4.46Å; E25-K42 PolarHBondContact N-O 3.17Å; E25-K44 HydrophobicContact CB-CB 4.01Å
26	K	77.9	Confident	72.3	Confident	123 Å²	123	108.7 Å²	108.7	54%	0.535	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-159.4	142.9	-177	-167.7	-179.9	174.4	-168	0	112.5	M28 K42	K26-M28 HydrophobicContact CD-SD 4.27Å; K26-K42 HydrophobicContact CB-CB 4.22Å; K26-K42 PolarHBondContact N-O 2.9Å; K26-K42 PolarHBondContact O-N 2.92Å
27	V	79.6	Confident	73.6	Confident	6 Å²	6	101.5 Å²	101.5	4%	0.036	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	117.6	165	179.7	0	0	0	0	108.7	F39 L41 L64 I65 F68	V27-F39 HydrophobicContact CG1-CB 4.23Å; V27-F39 HydrophobicContact CG1-CD1 3.63Å; V27-F39 HydrophobicContact CG1-CE1 4.43Å; V27-F39 HydrophobicContact CG1-CG 4.33Å; V27-L41 HydrophobicContact CB-CD2 4.45Å; V27-L41 HydrophobicContact CG2-CD2 3.87Å; V27-L64 HydrophobicContact CG2-CB 3.94Å; V27-I65 HydrophobicContact CG2-CG1 4.11Å; V27-F68 HydrophobicContact CB-CB 4.19Å; V27-F68 HydrophobicContact CB-CD2 4.45Å; V27-F68 HydrophobicContact CB-CG 4.35Å; V27-F68 HydrophobicContact CG1-CB 4.03Å; V27-F68 HydrophobicContact CG1-CD1 4.12Å; V27-F68 HydrophobicContact CG1-CD2 3.96Å; V27-F68 HydrophobicContact CG1-CE2 4.49Å; V27-F68 HydrophobicContact CG1-CG 3.75Å
28	M	77.8	Confident	74.9	Confident	88 Å²	88	94.7 Å²	94.7	43%	0.433	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-40.9	-175.3	-66.1	-72.2	-76.8	0	0	111.8	K26 Y40 K42	K26-M28 HydrophobicContact CD-SD 4.27Å; M28-Y40 HydrophobicContact CB-CD1 3.61Å; M28-Y40 HydrophobicContact CB-CE1 4.37Å; M28-Y40 HydrophobicContact CB-CG 4.37Å; M28-Y40 WeakPolarHBondContact CB-O 3.46Å; M28-Y40 HydrophobicContact CG-CD1 4.34Å; M28-Y40 PolarHBondContact N-O 2.84Å; M28-K42 HydrophobicContact CG-CB 3.91Å; M28-K42 HydrophobicContact SD-CB 4.25Å
29	D	77.7	Confident	75.8	Confident	79 Å²	79	86.5 Å²	86.5	42%	0.422	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	168.2	-179	-153.5	-6.8	0	0	0	112.1	F39 Y40 W53	D29-F39 CarbonylContact O-C 3.59Å; D29-F39 VanDerWaalsContact O-CA 3.31Å; D29-F39 WeakPolarHBondContact O-CA 3.36Å; D29-Y40 PolarHBondContact N-O 3.11Å; D29-Y40 PolarHBondContact O-N 3.08Å; D29-W53 HydrophobicContact CB-CH2 3.94Å
30	Q	81.5	Confident	77	Confident	62 Å²	62	83.8 Å²	83.8	29%	0.29	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135.8	175.6	-176.6	-172.9	42.7	0	0	110.6	V37 E38 F39 F68	Q30-V37 HydrophobicContact CG-CG1 3.77Å; Q30-E38 WeakPolarHBondContact CA-O 3.32Å; Q30-F39 HydrophobicContact CB-CD1 3.77Å; Q30-F39 HydrophobicContact CB-CE1 3.81Å; Q30-F39 HydrophobicContact CG-CD1 3.83Å; Q30-F39 HydrophobicContact CG-CE1 3.55Å; Q30-F39 HydrophobicContact CG-CZ 4.07Å; Q30-F39 VanDerWaalsContact NE2-CE1 3.32Å; Q30-F68 HydrophobicContact CB-CD1 4.37Å; Q30-F68 HydrophobicContact CB-CE1 3.53Å; Q30-F68 HydrophobicContact CB-CZ 4.2Å
31	R	79.1	Confident	77.9	Confident	98 Å²	98	76.8 Å²	76.8	37%	0.37	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	161.5	172	73	-175.9	-175.9	-169	0.1	111.7	V33 E38 W53	R31-V33 HydrophobicContact CG-CG2 3.95Å; R31-E38 HydrophobicContact CG-CB 4.07Å; R31-E38 IonicContact CZ-OE2 2.8Å; R31-E38 PolarHBondContact N-O 3.12Å; R31-E38 IonicContact NE-OE2 3.09Å; R31-E38 PolarHBondContact NE-OE2 3.23Å; R31-E38 IonicContact NH2-OE2 3.15Å; R31-E38 PolarHBondContact NH2-OE2 3.22Å; R31-E38 PolarHBondContact O-N 3.33Å; R31-W53 HydrophobicContact CB-CH2 3.97Å; R31-W53 HydrophobicContact CB-CZ3 3.78Å; R31-W53 VanDerWaalsContact CD-CZ3 3.49Å; R31-W53 HydrophobicContact CG-CD2 4.36Å; R31-W53 HydrophobicContact CG-CE3 3.6Å; R31-W53 HydrophobicContact CG-CH2 3.83Å; R31-W53 HydrophobicContact CG-CZ3 3.32Å; R31-W53 VanDerWaalsContact CZ-CG 3.43Å
32	I	79.1	Confident	78.5	Confident	127 Å²	127	69.1 Å²	69.1	65%	0.651	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.9	172.3	-57.1	174.9	0	0	0	107.7	K36 V37	I32-K36 CarbonylContact C-O 3.56Å; I32-K36 WeakPolarHBondContact CA-O 3.49Å; I32-V37 HydrophobicContact CG1-CG2 4.38Å
33	V	75.7	Confident	78.9	Confident	52 Å²	52	66.1 Å²	66.1	32%	0.315	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	125.2	176.8	178.9	0	0	0	0	107.9	R31 G35 K36	R31-V33 HydrophobicContact CG-CG2 3.95Å; V33-G35 PolarHBondContact O-N 2.89Å; V33-G35 VanDerWaalsContact O-N 3.12Å; V33-K36 PolarHBondContact N-O 2.78Å; V33-K36 PolarHBondContact O-N 2.8Å
34	N	75.4	Confident	78.6	Confident	163 Å²	163	68.1 Å²	68.1	87%	0.872	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	32.5	-179.8	-58.9	-25.1	0	0	0	114.5	K36	N34-K36 PolarHBondContact O-N 2.92Å
35	G	75.9	Confident	78.3	Confident	70 Å²	70	70.6 Å²	70.6	72%	0.722	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	1	-178.2	0	0	0	0	0	114.6	V33	V33-G35 PolarHBondContact O-N 2.89Å; V33-G35 VanDerWaalsContact O-N 3.12Å
36	K	73.8	Confident	77.9	Confident	104 Å²	104	70.3 Å²	70.3	45%	0.452	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	140	171	-66.4	-165.5	169.8	-147.4	0	110.3	I32 V33 N34 E57	I32-K36 CarbonylContact C-O 3.56Å; I32-K36 WeakPolarHBondContact CA-O 3.49Å; V33-K36 PolarHBondContact N-O 2.78Å; V33-K36 PolarHBondContact O-N 2.8Å; N34-K36 PolarHBondContact O-N 2.92Å; K36-E57 IonicContact NZ-OE1 2.74Å; K36-E57 IonicContact NZ-OE2 2.77Å; K36-E57 PolarHBondContact NZ-OE2 2.66Å
37	V	75.8	Confident	77.6	Confident	32 Å²	32	68.2 Å²	68.2	19%	0.194	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127.1	174.9	179.7	0	0	0	0	108.1	Q30 I32 F39 P55 E56	Q30-V37 HydrophobicContact CG-CG1 3.77Å; I32-V37 HydrophobicContact CG1-CG2 4.38Å; V37-F39 HydrophobicContact CG1-CD2 4.12Å; V37-F39 HydrophobicContact CG1-CE1 4.48Å; V37-F39 HydrophobicContact CG1-CE2 3.49Å; V37-F39 VanDerWaalsContact CG1-CE2 3.49Å; V37-F39 HydrophobicContact CG1-CZ 3.7Å; V37-P55 WeakPolarHBondContact O-CA 3.28Å; V37-E56 HydrophobicContact CB-CB 4.28Å; V37-E56 PolarHBondContact O-N 3.34Å
38	E	82.6	Confident	77.2	Confident	40 Å²	40	73.4 Å²	73.4	19%	0.187	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	143	173.1	-64.6	177.1	166.2	0	0	109	Q30 R31 W53 E54	Q30-E38 WeakPolarHBondContact CA-O 3.32Å; R31-E38 HydrophobicContact CG-CB 4.07Å; R31-E38 IonicContact CZ-OE2 2.8Å; R31-E38 PolarHBondContact N-O 3.12Å; R31-E38 IonicContact NE-OE2 3.09Å; R31-E38 PolarHBondContact NE-OE2 3.23Å; R31-E38 IonicContact NH2-OE2 3.15Å; R31-E38 PolarHBondContact NH2-OE2 3.22Å; R31-E38 PolarHBondContact O-N 3.33Å; E38-W53 HydrophobicContact CB-CE3 4.02Å; E38-E54 CarbonylContact C-O 3.5Å; E38-E54 WeakPolarHBondContact CA-O 3.5Å
39	F	77.4	Confident	76.8	Confident	1 Å²	1	73.3 Å²	73.3	0%	0.004	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.1	176	-63.7	-90	0	0	0	110.3	V27 D29 Q30 V37 L41 W53 E54 E56 L59 I65 F68	V27-F39 HydrophobicContact CG1-CB 4.23Å; V27-F39 HydrophobicContact CG1-CD1 3.63Å; V27-F39 HydrophobicContact CG1-CE1 4.43Å; V27-F39 HydrophobicContact CG1-CG 4.33Å; D29-F39 CarbonylContact O-C 3.59Å; D29-F39 VanDerWaalsContact O-CA 3.31Å; D29-F39 WeakPolarHBondContact O-CA 3.36Å; Q30-F39 HydrophobicContact CB-CD1 3.77Å; Q30-F39 HydrophobicContact CB-CE1 3.81Å; Q30-F39 HydrophobicContact CG-CD1 3.83Å; Q30-F39 HydrophobicContact CG-CE1 3.55Å; Q30-F39 HydrophobicContact CG-CZ 4.07Å; Q30-F39 VanDerWaalsContact NE2-CE1 3.32Å; V37-F39 HydrophobicContact CG1-CD2 4.12Å; V37-F39 HydrophobicContact CG1-CE1 4.48Å; V37-F39 HydrophobicContact CG1-CE2 3.49Å; V37-F39 VanDerWaalsContact CG1-CE2 3.49Å; V37-F39 HydrophobicContact CG1-CZ 3.7Å; F39-L41 HydrophobicContact CB-CD2 4.05Å; F39-W53 WeakPolarHBondContact O-CA 3.25Å; F39-E54 PolarHBondContact N-O 3.44Å; F39-E54 PolarHBondContact O-N 3.39Å; F39-E56 HydrophobicContact CD2-CB 4.44Å; F39-E56 HydrophobicContact CE2-CB 3.96Å; F39-E56 HydrophobicContact CE2-CG 4.1Å; F39-L59 HydrophobicContact CB-CD1 3.7Å; F39-L59 HydrophobicContact CD2-CD1 3.44Å; F39-L59 VanDerWaalsContact CD2-CD1 3.44Å; F39-L59 HydrophobicContact CE2-CD1 4.34Å; F39-L59 HydrophobicContact CG-CD1 3.86Å; F39-I65 HydrophobicContact CE1-CG2 3.9Å; F39-I65 HydrophobicContact CE2-CD1 4.32Å; F39-I65 HydrophobicContact CE2-CG2 4.21Å; F39-I65 HydrophobicContact CZ-CG1 4.41Å; F39-I65 HydrophobicContact CZ-CG2 3.51Å; F39-F68 HydrophobicContact CE1-CD1 4.45Å
40	Y	84.1	Confident	76.4	Confident	59 Å²	59	73 Å²	73	23%	0.231	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.7	172.6	-170.6	-127.6	0	0	0	108.8	M28 D29 N51 T52 W53	M28-Y40 HydrophobicContact CB-CD1 3.61Å; M28-Y40 HydrophobicContact CB-CE1 4.37Å; M28-Y40 HydrophobicContact CB-CG 4.37Å; M28-Y40 WeakPolarHBondContact CB-O 3.46Å; M28-Y40 HydrophobicContact CG-CD1 4.34Å; M28-Y40 PolarHBondContact N-O 2.84Å; D29-Y40 PolarHBondContact N-O 3.11Å; D29-Y40 PolarHBondContact O-N 3.08Å; Y40-N51 HydrophobicContact CD2-CB 4.31Å; Y40-N51 HydrophobicContact CE1-CB 3.96Å; Y40-N51 HydrophobicContact CE2-CB 3.48Å; Y40-N51 VanDerWaalsContact CE2-CB 3.48Å; Y40-N51 WeakPolarHBondContact CE2-O 3.25Å; Y40-N51 WeakPolarHBondContact OH-CB 3.42Å; Y40-T52 WeakPolarHBondContact CA-O 3.41Å; Y40-T52 WeakPolarHBondContact CD2-O 3.42Å; Y40-W53 AromaticContact CD2-CD1 3.87Å; Y40-W53 HydrophobicContact CD2-CD2 4.11Å; Y40-W53 AromaticContact CD2-CE2 3.86Å; Y40-W53 HydrophobicContact CD2-CG 4.16Å; Y40-W53 HydrophobicContact CD2-CZ2 4.43Å; Y40-W53 AromaticContact CD2-NE1 3.68Å; Y40-W53 HydrophobicContact CG-CD2 4.43Å; Y40-W53 HydrophobicContact CG-CZ2 4.24Å
41	L	81.8	Confident	76.4	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	140.2	-172.3	-60.8	-172.9	0	0	0	112.8	V24 V27 F39 W43 N51 T52 E54 L59	V24-L41 HydrophobicContact CB-CD1 4.48Å; V24-L41 HydrophobicContact CG1-CB 4.37Å; V24-L41 HydrophobicContact CG1-CD1 4.11Å; V24-L41 HydrophobicContact CG1-CD2 3.87Å; V24-L41 HydrophobicContact CG1-CG 4.34Å; V24-L41 HydrophobicContact CG2-CD1 3.54Å; V27-L41 HydrophobicContact CB-CD2 4.45Å; V27-L41 HydrophobicContact CG2-CD2 3.87Å; F39-L41 HydrophobicContact CB-CD2 4.05Å; L41-W43 HydrophobicContact CB-CZ2 4.39Å; L41-W43 HydrophobicContact CD1-CH2 3.61Å; L41-W43 HydrophobicContact CD1-CZ2 3.92Å; L41-W43 HydrophobicContact CD1-CZ3 3.96Å; L41-N51 VanDerWaalsContact O-CA 3.23Å; L41-N51 WeakPolarHBondContact O-CA 3.35Å; L41-N51 WeakPolarHBondContact O-CB 3.47Å; L41-N51 PolarHBondContact O-OD1 3.34Å; L41-T52 PolarHBondContact N-O 3.38Å; L41-E54 HydrophobicContact CD1-CB 4.13Å; L41-E54 HydrophobicContact CD1-CG 3.98Å; L41-L59 HydrophobicContact CD1-CD1 4.47Å; L41-L59 HydrophobicContact CD1-CD2 3.24Å; L41-L59 HydrophobicContact CD1-CG 4.48Å; L41-L59 HydrophobicContact CD2-CD1 4.29Å; L41-L59 HydrophobicContact CD2-CD2 4.45Å; L41-L59 HydrophobicContact CG-CD2 4.21Å
42	K	84.3	Confident	76.4	Confident	31 Å²	31	68.8 Å²	68.8	14%	0.135	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	117	161.5	178.9	57.2	171.9	165.2	0	108.8	E25 K26 M28 F46 T47 N51	E25-K42 WeakPolarHBondContact CA-O 3.46Å; E25-K42 HydrophobicContact CB-CB 4.45Å; E25-K42 HydrophobicContact CB-CG 4.04Å; E25-K42 VanDerWaalsContact CB-O 3.26Å; E25-K42 WeakPolarHBondContact CB-O 3.4Å; E25-K42 HydrophobicContact CG-CG 4.46Å; E25-K42 PolarHBondContact N-O 3.17Å; K26-K42 HydrophobicContact CB-CB 4.22Å; K26-K42 PolarHBondContact N-O 2.9Å; K26-K42 PolarHBondContact O-N 2.92Å; M28-K42 HydrophobicContact CG-CB 3.91Å; M28-K42 HydrophobicContact SD-CB 4.25Å; K42-F46 PolarHBondContact NZ-O 3.24Å; K42-T47 PolarHBondContact NZ-O 2.88Å; K42-N51 WeakPolarHBondContact CA-OD1 3.48Å; K42-N51 WeakPolarHBondContact CD-OD1 3.3Å
43	W	83.1	Confident	76.9	Confident	27 Å²	27	66.3 Å²	66.3	10%	0.102	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	137	177.8	-58.4	110.6	0	0	0	111.3	F22 V24 L41 G45 F46 D50 T52 E54	F22-W43 HydrophobicContact CB-CD2 4.13Å; F22-W43 HydrophobicContact CB-CE3 3.42Å; F22-W43 VanDerWaalsContact CB-CE3 3.42Å; F22-W43 HydrophobicContact CB-CH2 4.24Å; F22-W43 HydrophobicContact CB-CZ3 3.5Å; F22-W43 VanDerWaalsContact CB-CZ3 3.5Å; F22-W43 WeakPolarHBondContact O-CZ3 3.4Å; V24-W43 HydrophobicContact CG2-CE3 4.14Å; V24-W43 HydrophobicContact CG2-CH2 4.48Å; V24-W43 HydrophobicContact CG2-CZ3 3.68Å; L41-W43 HydrophobicContact CB-CZ2 4.39Å; L41-W43 HydrophobicContact CD1-CH2 3.61Å; L41-W43 HydrophobicContact CD1-CZ2 3.92Å; L41-W43 HydrophobicContact CD1-CZ3 3.96Å; W43-G45 PolarHBondContact O-N 3.34Å; W43-F46 HydrophobicContact CB-CB 3.97Å; W43-F46 HydrophobicContact CB-CD2 3.81Å; W43-F46 HydrophobicContact CB-CG 4.2Å; W43-F46 PolarHBondContact O-N 3.28Å; W43-D50 PolarHBondContact NE1-O 3.14Å; W43-T52 WeakPolarHBondContact CZ2-OG1 3.39Å; W43-T52 PolarHBondContact NE1-OG1 3.25Å; W43-T52 VanDerWaalsContact NE1-OG1 3.12Å; W43-E54 HydrophobicContact CH2-CG 3.94Å; W43-E54 HydrophobicContact CZ2-CG 3.61Å
44	K	70.9	Confident	77.3	Confident	138 Å²	138	65.6 Å²	65.6	60%	0.6	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	124.3	-177.8	-173.2	178.1	-178.2	176.4	0	110.4	V23 E25 F46	V23-K44 HydrophobicContact CB-CB 4.12Å; V23-K44 HydrophobicContact CG1-CB 3.99Å; V23-K44 HydrophobicContact CG1-CD 3.84Å; V23-K44 WeakPolarHBondContact O-CB 3.43Å; V23-K44 PolarHBondContact O-N 2.96Å; E25-K44 HydrophobicContact CB-CB 4.01Å; K44-F46 VanDerWaalsContact C-N 3.28Å
45	G	71.6	Confident	77.4	Confident	79 Å²	79	59.7 Å²	59.7	81%	0.814	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	2.1	179.7	0	0	0	0	0	114.4	W43	W43-G45 PolarHBondContact O-N 3.34Å
46	F	70.4	Confident	77.6	Confident	98 Å²	98	61.4 Å²	61.4	43%	0.43	33%	0.332	S	S	.	.	S	Bend	trans	-109.7	161.9	172.7	-67.5	-90.2	0	0	0	110.7	F22 K42 W43 K44 D50	F22-F46 AromaticContact CD1-CE2 3.95Å; F22-F46 HydrophobicContact CD1-CE2 3.95Å; F22-F46 HydrophobicContact CD1-CZ 4.1Å; F22-F46 HydrophobicContact CE1-CE2 4.38Å; F22-F46 HydrophobicContact CE1-CZ 4.05Å; K42-F46 PolarHBondContact NZ-O 3.24Å; W43-F46 HydrophobicContact CB-CB 3.97Å; W43-F46 HydrophobicContact CB-CD2 3.81Å; W43-F46 HydrophobicContact CB-CG 4.2Å; W43-F46 PolarHBondContact O-N 3.28Å; K44-F46 VanDerWaalsContact C-N 3.28Å; F46-D50 HydrophobicContact CB-CB 3.87Å; F46-D50 HydrophobicContact CD1-CB 4.4Å; F46-D50 HydrophobicContact CG-CB 4.48Å
47	T	71.3	Confident	77.8	Confident	78 Å²	78	63.7 Å²	63.7	48%	0.479	34%	0.344	S	S	.	.			trans	-78.6	164.7	178	64.1	0	0	0	0	110.5	K42 A49 D50 N51	K42-T47 PolarHBondContact NZ-O 2.88Å; T47-A49 PolarHBondContact O-N 3.2Å; T47-D50 PolarHBondContact N-OD2 3.14Å; T47-D50 PolarHBondContact O-N 3.38Å; T47-D50 VanDerWaalsContact O-N 3.11Å; T47-D50 PolarHBondContact OG1-OD2 3.02Å; T47-N51 PolarHBondContact O-OD1 3.14Å
48	D	71.4	Confident	77.9	Confident	115 Å²	115	66.5 Å²	66.5	62%	0.615	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-64.8	-17.7	175.4	47.3	-18	0	0	0	112.9	D50 N51	D48-D50 VanDerWaalsContact C-N 3.26Å; D48-D50 PolarHBondContact O-N 2.88Å; D48-N51 WeakPolarHBondContact CA-OD1 3.42Å; D48-N51 WeakPolarHBondContact O-CB 3.31Å; D48-N51 PolarHBondContact O-N 3.08Å; D48-N51 PolarHBondContact O-ND2 3.21Å
49	A	70.1	Confident	77.7	Confident	87 Å²	87	65.4 Å²	65.4	72%	0.719	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-67.2	-24.9	169.3	0	0	0	0	0	113.4	T47 N51	T47-A49 PolarHBondContact O-N 3.2Å; A49-N51 VanDerWaalsContact C-N 3.32Å
50	D	69.4	Low	77.5	Confident	73 Å²	73	73 Å²	73	39%	0.39	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-89.1	-0.3	-178.5	-54.9	-65.1	0	0	0	112.6	W43 F46 T47 D48 T52	W43-D50 PolarHBondContact NE1-O 3.14Å; F46-D50 HydrophobicContact CB-CB 3.87Å; F46-D50 HydrophobicContact CD1-CB 4.4Å; F46-D50 HydrophobicContact CG-CB 4.48Å; T47-D50 PolarHBondContact N-OD2 3.14Å; T47-D50 PolarHBondContact O-N 3.38Å; T47-D50 VanDerWaalsContact O-N 3.11Å; T47-D50 PolarHBondContact OG1-OD2 3.02Å; D48-D50 VanDerWaalsContact C-N 3.26Å; D48-D50 PolarHBondContact O-N 2.88Å; D50-T52 PolarHBondContact O-N 2.87Å
51	N	81.1	Confident	77.1	Confident	16 Å²	16	71.2 Å²	71.2	9%	0.086	39%	0.39	C	S	.	.			trans	-64.9	131.1	-179.8	-66.9	-2.4	0	0	0	110.9	Y40 L41 K42 T47 D48 A49	Y40-N51 HydrophobicContact CD2-CB 4.31Å; Y40-N51 HydrophobicContact CE1-CB 3.96Å; Y40-N51 HydrophobicContact CE2-CB 3.48Å; Y40-N51 VanDerWaalsContact CE2-CB 3.48Å; Y40-N51 WeakPolarHBondContact CE2-O 3.25Å; Y40-N51 WeakPolarHBondContact OH-CB 3.42Å; L41-N51 VanDerWaalsContact O-CA 3.23Å; L41-N51 WeakPolarHBondContact O-CA 3.35Å; L41-N51 WeakPolarHBondContact O-CB 3.47Å; L41-N51 PolarHBondContact O-OD1 3.34Å; K42-N51 WeakPolarHBondContact CA-OD1 3.48Å; K42-N51 WeakPolarHBondContact CD-OD1 3.3Å; T47-N51 PolarHBondContact O-OD1 3.14Å; D48-N51 WeakPolarHBondContact CA-OD1 3.42Å; D48-N51 WeakPolarHBondContact O-CB 3.31Å; D48-N51 PolarHBondContact O-N 3.08Å; D48-N51 PolarHBondContact O-ND2 3.21Å; A49-N51 VanDerWaalsContact C-N 3.32Å
52	T	80.3	Confident	76.8	Confident	54 Å²	54	75.9 Å²	75.9	33%	0.331	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	162.3	-178.4	57	0	0	0	0	111.8	Y40 L41 W43 D50 E54	Y40-T52 WeakPolarHBondContact CA-O 3.41Å; Y40-T52 WeakPolarHBondContact CD2-O 3.42Å; L41-T52 PolarHBondContact N-O 3.38Å; W43-T52 WeakPolarHBondContact CZ2-OG1 3.39Å; W43-T52 PolarHBondContact NE1-OG1 3.25Å; W43-T52 VanDerWaalsContact NE1-OG1 3.12Å; D50-T52 PolarHBondContact O-N 2.87Å; T52-E54 WeakPolarHBondContact CB-OE1 3.13Å; T52-E54 PolarHBondContact OG1-OE1 2.86Å
53	W	88.1	Confident	76.2	Confident	76 Å²	76	82.3 Å²	82.3	29%	0.288	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	110.8	170.6	-73.4	91.9	0	0	0	108.7	D29 R31 E38 F39 Y40	D29-W53 HydrophobicContact CB-CH2 3.94Å; R31-W53 HydrophobicContact CB-CH2 3.97Å; R31-W53 HydrophobicContact CB-CZ3 3.78Å; R31-W53 VanDerWaalsContact CD-CZ3 3.49Å; R31-W53 HydrophobicContact CG-CD2 4.36Å; R31-W53 HydrophobicContact CG-CE3 3.6Å; R31-W53 HydrophobicContact CG-CH2 3.83Å; R31-W53 HydrophobicContact CG-CZ3 3.32Å; R31-W53 VanDerWaalsContact CZ-CG 3.43Å; E38-W53 HydrophobicContact CB-CE3 4.02Å; F39-W53 WeakPolarHBondContact O-CA 3.25Å; Y40-W53 AromaticContact CD2-CD1 3.87Å; Y40-W53 HydrophobicContact CD2-CD2 4.11Å; Y40-W53 AromaticContact CD2-CE2 3.86Å; Y40-W53 HydrophobicContact CD2-CG 4.16Å; Y40-W53 HydrophobicContact CD2-CZ2 4.43Å; Y40-W53 AromaticContact CD2-NE1 3.68Å; Y40-W53 HydrophobicContact CG-CD2 4.43Å; Y40-W53 HydrophobicContact CG-CZ2 4.24Å
54	E	83.8	Confident	75.7	Confident	37 Å²	37	83.9 Å²	83.9	17%	0.173	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134	-179.3	-64.9	-54.2	138.9	0	0	110.4	E38 F39 L41 W43 T52 N58 L59	E38-E54 CarbonylContact C-O 3.5Å; E38-E54 WeakPolarHBondContact CA-O 3.5Å; F39-E54 PolarHBondContact N-O 3.44Å; F39-E54 PolarHBondContact O-N 3.39Å; L41-E54 HydrophobicContact CD1-CB 4.13Å; L41-E54 HydrophobicContact CD1-CG 3.98Å; W43-E54 HydrophobicContact CH2-CG 3.94Å; W43-E54 HydrophobicContact CZ2-CG 3.61Å; T52-E54 WeakPolarHBondContact CB-OE1 3.13Å; T52-E54 PolarHBondContact OG1-OE1 2.86Å; E54-N58 PolarHBondContact OE2-ND2 2.98Å; E54-L59 HydrophobicContact CB-CD2 3.7Å; E54-L59 HydrophobicContact CB-CG 4.28Å; E54-L59 HydrophobicContact CG-CD2 4.4Å
55	P	78.6	Confident	75.8	Confident	38 Å²	38	78.1 Å²	78.1	25%	0.247	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	149.1	176.2	28.2	-32.5	0	0	0	110.2	V37 E57 N58	V37-P55 WeakPolarHBondContact O-CA 3.28Å; P55-E57 PolarHBondContact O-N 3.24Å; P55-N58 HydrophobicContact CG-CB 3.85Å; P55-N58 WeakPolarHBondContact O-CB 3.2Å; P55-N58 PolarHBondContact O-N 3.49Å
56	E	79.4	Confident	76.1	Confident	106 Å²	106	76.8 Å²	76.8	50%	0.495	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-51.3	-33.9	176.3	-175.5	179.2	169.4	0	0	112.5	V37 F39 N58 L59	V37-E56 HydrophobicContact CB-CB 4.28Å; V37-E56 PolarHBondContact O-N 3.34Å; F39-E56 HydrophobicContact CD2-CB 4.44Å; F39-E56 HydrophobicContact CE2-CB 3.96Å; F39-E56 HydrophobicContact CE2-CG 4.1Å; E56-N58 PolarHBondContact O-N 3.1Å; E56-L59 PolarHBondContact O-N 3.36Å
57	E	79.4	Confident	76.2	Confident	152 Å²	152	74.8 Å²	74.8	71%	0.71	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-62.6	-22.4	176.9	-62.1	172.8	168	0	0	113.5	K36 P55	K36-E57 IonicContact NZ-OE1 2.74Å; K36-E57 IonicContact NZ-OE2 2.77Å; K36-E57 PolarHBondContact NZ-OE2 2.66Å; P55-E57 PolarHBondContact O-N 3.24Å
58	N	77.4	Confident	76.4	Confident	91 Å²	91	72.3 Å²	72.3	49%	0.487	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-98.3	3.4	179.9	-160.6	46.5	0	0	0	112.7	E54 P55 E56	E54-N58 PolarHBondContact OE2-ND2 2.98Å; P55-N58 HydrophobicContact CG-CB 3.85Å; P55-N58 WeakPolarHBondContact O-CB 3.2Å; P55-N58 PolarHBondContact O-N 3.49Å; E56-N58 PolarHBondContact O-N 3.1Å
59	L	77.9	Confident	76.5	Confident	17 Å²	17	69.4 Å²	69.4	9%	0.089	38%	0.383	C	S	.	.			trans	-111.7	105.2	-172.4	-60.9	-176.2	0	0	0	113.3	F39 L41 E54 E56 C61 I65	F39-L59 HydrophobicContact CB-CD1 3.7Å; F39-L59 HydrophobicContact CD2-CD1 3.44Å; F39-L59 VanDerWaalsContact CD2-CD1 3.44Å; F39-L59 HydrophobicContact CE2-CD1 4.34Å; F39-L59 HydrophobicContact CG-CD1 3.86Å; L41-L59 HydrophobicContact CD1-CD1 4.47Å; L41-L59 HydrophobicContact CD1-CD2 3.24Å; L41-L59 HydrophobicContact CD1-CG 4.48Å; L41-L59 HydrophobicContact CD2-CD1 4.29Å; L41-L59 HydrophobicContact CD2-CD2 4.45Å; L41-L59 HydrophobicContact CG-CD2 4.21Å; E54-L59 HydrophobicContact CB-CD2 3.7Å; E54-L59 HydrophobicContact CB-CG 4.28Å; E54-L59 HydrophobicContact CG-CD2 4.4Å; E56-L59 PolarHBondContact O-N 3.36Å; L59-C61 VanDerWaalsContact C-N 3.29Å; L59-C61 PolarHBondContact O-N 3.15Å; L59-I65 HydrophobicContact CB-CD1 3.89Å; L59-I65 HydrophobicContact CD1-CD1 3.98Å
60	D	73.6	Confident	76.6	Confident	162 Å²	162	71.8 Å²	71.8	87%	0.866	38%	0.38	S	S	*	.			trans	-91.9	47	172.9	-72	-52	0	0	0	112.6
61	C	75.3	Confident	76.6	Confident	21 Å²	21	71.2 Å²	71.2	14%	0.142	38%	0.381	C	S	.	.			trans	-136.6	64.6	179.5	58.6	0	0	0	0	113.9	L59 E63 L64 I65	L59-C61 VanDerWaalsContact C-N 3.29Å; L59-C61 PolarHBondContact O-N 3.15Å; C61-E63 VanDerWaalsContact C-N 3.26Å; C61-E63 PolarHBondContact O-N 2.93Å; C61-L64 HydrophobicContact CB-CD1 4.35Å; C61-L64 PolarHBondContact O-N 2.74Å; C61-I65 PolarHBondContact O-N 2.87Å
62	P	75.1	Confident	75.9	Confident	97 Å²	97	73.9 Å²	73.9	63%	0.63	39%	0.393	S	S	*	.	H	α-helix	trans	-62	-28.1	-174.1	25.1	-35	0	0	0	114.1	S66	P62-S66 VanDerWaalsContact O-CB 3.28Å; P62-S66 WeakPolarHBondContact O-CB 3.03Å; P62-S66 PolarHBondContact O-N 3.41Å; P62-S66 PolarHBondContact O-OG 2.77Å; P62-S66 VanDerWaalsContact O-OG 3.13Å
63	E	71.9	Confident	75	Confident	166 Å²	166	78 Å²	78	78%	0.776	41%	0.407	S	S	*	.	H	α-helix	trans	-69.4	-36.3	179.2	-66	-168.2	120.6	0	0	113.2	C61 S66 A67	C61-E63 VanDerWaalsContact C-N 3.26Å; C61-E63 PolarHBondContact O-N 2.93Å; E63-S66 PolarHBondContact O-OG 3.4Å; E63-A67 WeakPolarHBondContact O-CB 3.35Å; E63-A67 PolarHBondContact O-N 3.07Å
64	L	72.5	Confident	73.4	Confident	61 Å²	61	80.7 Å²	80.7	32%	0.319	43%	0.426	S	S	.	.	H	α-helix	trans	-75.4	-37.6	177.8	-65.1	179.1	0	0	0	110.9	V24 V27 C61 F68	V24-L64 HydrophobicContact CB-CD1 4.17Å; V24-L64 HydrophobicContact CG1-CD1 3.85Å; V27-L64 HydrophobicContact CG2-CB 3.94Å; C61-L64 HydrophobicContact CB-CD1 4.35Å; C61-L64 PolarHBondContact O-N 2.74Å; L64-F68 WeakPolarHBondContact O-CB 3.43Å; L64-F68 PolarHBondContact O-N 3.15Å; L64-F68 VanDerWaalsContact O-N 3.14Å
65	I	74.4	Confident	72	Confident	16 Å²	16	84.8 Å²	84.8	8%	0.082	45%	0.448	C	S	.	.	H	α-helix	trans	-66.8	-45.1	176.7	-65	169.2	0	0	0	110.5	V27 F39 L59 C61 F68 L69	V27-I65 HydrophobicContact CG2-CG1 4.11Å; F39-I65 HydrophobicContact CE1-CG2 3.9Å; F39-I65 HydrophobicContact CE2-CD1 4.32Å; F39-I65 HydrophobicContact CE2-CG2 4.21Å; F39-I65 HydrophobicContact CZ-CG1 4.41Å; F39-I65 HydrophobicContact CZ-CG2 3.51Å; L59-I65 HydrophobicContact CB-CD1 3.89Å; L59-I65 HydrophobicContact CD1-CD1 3.98Å; C61-I65 PolarHBondContact O-N 2.87Å; I65-F68 PolarHBondContact O-N 3.37Å; I65-L69 HydrophobicContact CG2-CD1 3.81Å; I65-L69 HydrophobicContact CG2-CG 4.29Å; I65-L69 WeakPolarHBondContact O-CB 3.16Å; I65-L69 VanDerWaalsContact O-CG 3.32Å; I65-L69 WeakPolarHBondContact O-CG 3.38Å; I65-L69 PolarHBondContact O-N 2.87Å
66	S	76.7	Confident	70.5	Confident	52 Å²	52	91.3 Å²	91.3	36%	0.364	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-45.8	179.4	65	0	0	0	0	111.7	P62 E63 F68 L69 E70	P62-S66 VanDerWaalsContact O-CB 3.28Å; P62-S66 WeakPolarHBondContact O-CB 3.03Å; P62-S66 PolarHBondContact O-N 3.41Å; P62-S66 PolarHBondContact O-OG 2.77Å; P62-S66 VanDerWaalsContact O-OG 3.13Å; E63-S66 PolarHBondContact O-OG 3.4Å; S66-F68 VanDerWaalsContact C-N 3.28Å; S66-F68 PolarHBondContact O-N 3.23Å; S66-L69 PolarHBondContact O-N 2.85Å; S66-E70 WeakPolarHBondContact O-CB 2.78Å; S66-E70 WeakPolarHBondContact O-CG 3.36Å; S66-E70 PolarHBondContact O-N 3.45Å
67	A	73.1	Confident	68.9	Low	56 Å²	56	94 Å²	94	46%	0.463	49%	0.485	S	S	.	.	H	α-helix	trans	-59.1	-40.4	176.7	0	0	0	0	0	111.9	E63 S71	E63-A67 WeakPolarHBondContact O-CB 3.35Å; E63-A67 PolarHBondContact O-N 3.07Å; A67-S71 PolarHBondContact O-N 2.91Å
68	F	74.9	Confident	66.9	Low	25 Å²	25	95.7 Å²	95.7	11%	0.11	49%	0.49	C	S	.	.	H	α-helix	trans	-64.5	-48.9	174.5	-179.8	-92.5	0	0	0	111.6	V27 Q30 F39 L64 I65 S66 E70 S71 Q72	V27-F68 HydrophobicContact CB-CB 4.19Å; V27-F68 HydrophobicContact CB-CD2 4.45Å; V27-F68 HydrophobicContact CB-CG 4.35Å; V27-F68 HydrophobicContact CG1-CB 4.03Å; V27-F68 HydrophobicContact CG1-CD1 4.12Å; V27-F68 HydrophobicContact CG1-CD2 3.96Å; V27-F68 HydrophobicContact CG1-CE2 4.49Å; V27-F68 HydrophobicContact CG1-CG 3.75Å; Q30-F68 HydrophobicContact CB-CD1 4.37Å; Q30-F68 HydrophobicContact CB-CE1 3.53Å; Q30-F68 HydrophobicContact CB-CZ 4.2Å; F39-F68 HydrophobicContact CE1-CD1 4.45Å; L64-F68 WeakPolarHBondContact O-CB 3.43Å; L64-F68 PolarHBondContact O-N 3.15Å; L64-F68 VanDerWaalsContact O-N 3.14Å; I65-F68 PolarHBondContact O-N 3.37Å; S66-F68 VanDerWaalsContact C-N 3.28Å; S66-F68 PolarHBondContact O-N 3.23Å; F68-E70 PolarHBondContact O-N 2.82Å; F68-S71 PolarHBondContact O-N 3.05Å; F68-S71 PolarHBondContact O-OG 3.18Å; F68-Q72 HydrophobicContact CD1-CG 4.27Å; F68-Q72 HydrophobicContact CE1-CG 3.79Å; F68-Q72 HydrophobicContact CZ-CG 3.99Å; F68-Q72 PolarHBondContact O-N 3.31Å; F68-Q72 VanDerWaalsContact O-N 3.12Å
69	L	73.8	Confident	65.1	Low	54 Å²	54	97.1 Å²	97.1	28%	0.283	51%	0.505	S	S	.	.	H	α-helix	trans	-63.9	-38.8	-179.7	-71.6	173.7	0	0	0	113.1	I65 S66 S71 Q72 K73	I65-L69 HydrophobicContact CG2-CD1 3.81Å; I65-L69 HydrophobicContact CG2-CG 4.29Å; I65-L69 WeakPolarHBondContact O-CB 3.16Å; I65-L69 VanDerWaalsContact O-CG 3.32Å; I65-L69 WeakPolarHBondContact O-CG 3.38Å; I65-L69 PolarHBondContact O-N 2.87Å; S66-L69 PolarHBondContact O-N 2.85Å; L69-S71 VanDerWaalsContact C-N 3.32Å; L69-Q72 PolarHBondContact O-N 3.23Å; L69-K73 WeakPolarHBondContact O-CG 3.42Å; L69-K73 PolarHBondContact O-N 3.46Å
70	E	73	Confident	64.2	Low	137 Å²	137	102 Å²	102	64%	0.64	54%	0.54	S	S	*	.	H	α-helix	trans	-62	-41.3	175.3	-76.7	177.9	171.8	0	0	111.3	S66 F68 Q72 K73 N74	S66-E70 WeakPolarHBondContact O-CB 2.78Å; S66-E70 WeakPolarHBondContact O-CG 3.36Å; S66-E70 PolarHBondContact O-N 3.45Å; F68-E70 PolarHBondContact O-N 2.82Å; E70-Q72 VanDerWaalsContact C-N 3.32Å; E70-Q72 PolarHBondContact O-N 3.13Å; E70-K73 PolarHBondContact O-N 2.92Å; E70-N74 PolarHBondContact O-N 3.23Å
71	S	68.1	Low	62.6	Low	61 Å²	61	98.7 Å²	98.7	43%	0.427	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-37.6	175.3	79.6	0	0	0	0	112.5	A67 F68 L69	A67-S71 PolarHBondContact O-N 2.91Å; F68-S71 PolarHBondContact O-N 3.05Å; F68-S71 PolarHBondContact O-OG 3.18Å; L69-S71 VanDerWaalsContact C-N 3.32Å
72	Q	66.6	Low	60.9	Low	73 Å²	73	104 Å²	104	34%	0.341	57%	0.567	S	S	.	*	H	α-helix	trans	-73.4	-36.4	179.2	-72	-65.7	-48.7	0	0	113.1	F68 L69 E70 N74 I75 K76	F68-Q72 HydrophobicContact CD1-CG 4.27Å; F68-Q72 HydrophobicContact CE1-CG 3.79Å; F68-Q72 HydrophobicContact CZ-CG 3.99Å; F68-Q72 PolarHBondContact O-N 3.31Å; F68-Q72 VanDerWaalsContact O-N 3.12Å; L69-Q72 PolarHBondContact O-N 3.23Å; E70-Q72 VanDerWaalsContact C-N 3.32Å; E70-Q72 PolarHBondContact O-N 3.13Å; Q72-N74 VanDerWaalsContact C-N 3.35Å; Q72-N74 PolarHBondContact O-N 3.17Å; Q72-I75 PolarHBondContact O-N 3.11Å; Q72-K76 PolarHBondContact O-N 3.45Å
73	K	60.9	Low	59.2	Low	141 Å²	141	107.2 Å²	107.2	61%	0.613	57%	0.571	S	S	*	*	H	α-helix	trans	-65.4	-37.5	178.7	-77.5	-179.3	-179.1	177.6	0	112.3	L69 E70 I75 K76 E77	L69-K73 WeakPolarHBondContact O-CG 3.42Å; L69-K73 PolarHBondContact O-N 3.46Å; E70-K73 PolarHBondContact O-N 2.92Å; K73-I75 PolarHBondContact O-N 3.24Å; K73-K76 PolarHBondContact O-N 3.5Å; K73-K76 VanDerWaalsContact O-N 3.11Å; K73-E77 PolarHBondContact O-N 3.09Å
74	N	54.8	Low	57.5	Low	131 Å²	131	109.4 Å²	109.4	70%	0.701	57%	0.572	S	S	*	*	H	α-helix	trans	-62.6	-26.6	177.8	-157.9	-14.4	0	0	0	112.5	E70 Q72	E70-N74 PolarHBondContact O-N 3.23Å; Q72-N74 VanDerWaalsContact C-N 3.35Å; Q72-N74 PolarHBondContact O-N 3.17Å
75	I	55.2	Low	55.8	Low	123 Å²	123	116 Å²	116	63%	0.631	60%	0.599	S	S	*	*	H	α-helix	trans	-81.2	-30.4	176.9	-58.5	174.5	0	0	0	111.8	Q72 K73	Q72-I75 PolarHBondContact O-N 3.11Å; K73-I75 PolarHBondContact O-N 3.24Å
76	K	47.4	Very low	54	Low	175 Å²	175	119.4 Å²	119.4	76%	0.761	63%	0.629	S	S	*	*	H	α-helix	trans	-86.8	-16.6	-175.8	-83.9	179.2	177	169.6	0	115.5	Q72 K73 K78	Q72-K76 PolarHBondContact O-N 3.45Å; K73-K76 PolarHBondContact O-N 3.5Å; K73-K76 VanDerWaalsContact O-N 3.11Å; K76-K78 VanDerWaalsContact C-N 3.34Å; K76-K78 PolarHBondContact O-N 3.21Å
77	E	44.6	Very low	52.4	Low	163 Å²	163	122.1 Å²	122.1	76%	0.762	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	5.4	-175.8	-72.9	-160.5	164.5	0	0	116.1	K73 P79	K73-E77 PolarHBondContact O-N 3.09Å; E77-P79 VanDerWaalsContact O-CD 3.25Å; E77-P79 WeakPolarHBondContact O-CD 3.46Å
78	K	37.2	Very low	50.5	Low	187 Å²	187	125.6 Å²	125.6	81%	0.813	66%	0.663	S	S	*	*	S	Bend	trans	-100	99.8	169.1	-69.6	-175.6	-179.6	174.6	0	110.4	K76	K76-K78 VanDerWaalsContact C-N 3.34Å; K76-K78 PolarHBondContact O-N 3.21Å
79	P	40.2	Very low	48.6	Very low	122 Å²	122	132.5 Å²	132.5	79%	0.792	70%	0.696	S	S	*	*			trans	-81.4	147.7	-176.5	33.3	-33.5	0	0	0	112.8	E77	E77-P79 VanDerWaalsContact O-CD 3.25Å; E77-P79 WeakPolarHBondContact O-CD 3.46Å
80	S	58.3	Low	46.8	Very low	118 Å²	118	139.1 Å²	139.1	83%	0.825	73%	0.725	S	S	*	*			trans	-55.1	147.8	177.7	54.7	0	0	0	0	118
81	A	39.9	Very low	44.9	Very low	94 Å²	94	135.8 Å²	135.8	78%	0.777	73%	0.728	S	S	*	*			trans	-159.2	111.8	148.2	0	0	0	0	0	114.6
82	V	41	Very low	43.4	Very low	132 Å²	132	141.7 Å²	141.7	80%	0.8	75%	0.749	S	S	*	*			trans	80.6	102.2	138	-169.6	0	0	0	0	121.1
83	K	37.9	Very low	42	Very low	165 Å²	165	144.8 Å²	144.8	72%	0.717	77%	0.773	S	S	*	*				41.6	123.8	126.3	-74.1	174.6	176.9	167.7	0	121.6
84	R	37.3	Very low	40.7	Very low	212 Å²	212	145.3 Å²	145.3	80%	0.8	78%	0.782	S	S	*	*				85.3	120.5	129.2	-71.9	178.6	-173.2	-179.5	1.8	119.8
85	K	36.7	Very low	39.9	Very low	200 Å²	200	143.6 Å²	143.6	87%	0.87	78%	0.781	S	S	*	*			trans	66	104.1	146.1	-71.6	-164.1	177.7	-171.2	0	117
86	A	36.7	Very low	39.1	Very low	87 Å²	87	142.1 Å²	142.1	72%	0.719	79%	0.787	S	S	*	*				146.3	123.6	99.7	0	0	0	0	0	109.9
87	S	42.5	Very low	38.9	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	79%	0.789	S	S	*	*			trans	74.7	143.2	150.5	-36.4	0	0	0	0	118.4
88	T	33.8	Very low	38.5	Very low	129 Å²	129	144.2 Å²	144.2	79%	0.791	79%	0.794	S	S	*	*			trans	82.6	99	154.4	9.9	0	0	0	0	117.1
89	E	35.3	Very low	38.5	Very low	170 Å²	170	141.2 Å²	141.2	79%	0.794	79%	0.791	S	S	*	*			trans	31.1	136.4	135.6	-59.4	-156.2	140.1	0	0	121.7
90	E	35.4	Very low	38.4	Very low	193 Å²	193	143.6 Å²	143.6	90%	0.902	79%	0.792	S	S	*	*			trans	66.7	133.5	156.8	-61.9	177.5	158.5	0	0	116.7
91	G	33	Very low	37.5	Very low	68 Å²	68	145 Å²	145	70%	0.701	80%	0.795	S	S	*	*			cis	179.4	176.5	7	0	0	0	0	0	109.6
92	E	36.3	Very low	37.8	Very low	185 Å²	185	146.6 Å²	146.6	86%	0.864	79%	0.787	S	S	*	*			trans	70.4	103.6	163.7	-65.6	177.1	100.3	0	0	118.3
93	T	37.6	Very low	38.2	Very low	138 Å²	138	146.5 Å²	146.5	85%	0.847	78%	0.778	S	S	*	*				60	97.2	56.7	74	0	0	0	0	115
94	D	33.4	Very low	39.1	Very low	151 Å²	151	142.4 Å²	142.4	81%	0.807	77%	0.768	S	S	*	*			trans	-118.7	132	169.4	-169.8	-66.9	0	0	0	105.3
95	S	37.9	Very low	40.5	Very low	95 Å²	95	138.8 Å²	138.8	66%	0.664	75%	0.754	S	S	*	*			cis	-159.1	150.5	-0.2	-87.8	0	0	0	0	108.7
96	A	39.5	Very low	42.3	Very low	93 Å²	93	129.6 Å²	129.6	77%	0.769	72%	0.716	S	S	*	*			trans	-52.1	153.1	168	0	0	0	0	0	112.6
97	K	42	Very low	43.9	Very low	185 Å²	185	126.1 Å²	126.1	80%	0.804	69%	0.685	S	S	*	*				-175.2	141.1	68.1	-140.5	167.3	-178.7	175.2	0	108.2
98	K	37.2	Very low	45.1	Very low	197 Å²	197	124.1 Å²	124.1	86%	0.857	67%	0.674	S	S	*	*				-160.3	136.2	68.1	-94.5	177.1	174.2	178.7	0	112.2
99	T	37.4	Very low	46.8	Very low	123 Å²	123	120 Å²	120	76%	0.755	64%	0.644	S	S	*	*			trans	-61.9	133.3	168.4	43.1	0	0	0	0	112.5
100	E	37.1	Very low	48.6	Very low	173 Å²	173	118.5 Å²	118.5	81%	0.808	64%	0.642	S	S	*	*	S	Bend		-165.9	112.9	113.2	-104.7	174.8	172.6	0	0	111.1
101	T	38.8	Very low	50.5	Low	147 Å²	147	111.3 Å²	111.3	90%	0.902	61%	0.61	S	S	*	*	S	Bend	trans	69.7	20.3	164.4	62.7	0	0	0	0	121.3
102	E	47.3	Very low	52.7	Low	128 Å²	128	113.1 Å²	113.1	60%	0.598	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-100.9	121	169.6	-62.3	-132.5	136.5	0	0	110.3	R105	E102-R105 IonicContact OE1-CZ 2.78Å; E102-R105 IonicContact OE1-NH1 3.56Å; E102-R105 IonicContact OE1-NH2 2.78Å; E102-R105 PolarHBondContact OE1-NH2 2.89Å; E102-R105 IonicContact OE2-CZ 2.88Å; E102-R105 IonicContact OE2-NE 2.73Å; E102-R105 IonicContact OE2-NH1 2.77Å; E102-R105 PolarHBondContact OE2-NH1 3.42Å; E102-R105 IonicContact OE2-NH2 2.78Å; E102-R105 PolarHBondContact OE2-NH2 2.81Å
103	Q	49.1	Very low	55.1	Low	129 Å²	129	105.5 Å²	105.5	60%	0.603	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-48	146.1	168	-62.9	179.3	25.8	0	0	108.8	R105	Q103-R105 PolarHBondContact O-N 3.39Å; Q103-R105 VanDerWaalsContact O-N 3.15Å
104	P	57.8	Low	57.5	Low	79 Å²	79	103 Å²	103	51%	0.513	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-48.8	130.4	172.6	20.7	-30.8	0	0	0	108.1	A108 R109	P104-A108 HydrophobicContact CB-CB 4.18Å; P104-R109 VanDerWaalsContact C-CG 3.47Å; P104-R109 HydrophobicContact CB-CG 4.09Å; P104-R109 HydrophobicContact CG-CG 4.22Å; P104-R109 WeakPolarHBondContact O-CD 3.33Å; P104-R109 WeakPolarHBondContact O-CG 3.49Å
105	R	65.8	Low	60.2	Low	137 Å²	137	99.9 Å²	99.9	52%	0.517	53%	0.528	S	S	.	.			trans	-106.9	150.9	179.4	-76.4	-169.5	178	153.2	11.7	110.6	E102 Q103 A108	E102-R105 IonicContact OE1-CZ 2.78Å; E102-R105 IonicContact OE1-NH1 3.56Å; E102-R105 IonicContact OE1-NH2 2.78Å; E102-R105 PolarHBondContact OE1-NH2 2.89Å; E102-R105 IonicContact OE2-CZ 2.88Å; E102-R105 IonicContact OE2-NE 2.73Å; E102-R105 IonicContact OE2-NH1 2.77Å; E102-R105 PolarHBondContact OE2-NH1 3.42Å; E102-R105 IonicContact OE2-NH2 2.78Å; E102-R105 PolarHBondContact OE2-NH2 2.81Å; Q103-R105 PolarHBondContact O-N 3.39Å; Q103-R105 VanDerWaalsContact O-N 3.15Å; R105-A108 WeakPolarHBondContact O-CB 3.35Å; R105-A108 PolarHBondContact O-N 3.36Å
106	G	74.6	Confident	62.6	Low	6 Å²	6	95.4 Å²	95.4	6%	0.062	50%	0.496	C	S	.	.	G	3₁₀ helix	trans	64.2	-140	176.2	0	0	0	0	0	113	A108 R109 D139	G106-A108 PolarHBondContact O-N 2.94Å; G106-A108 VanDerWaalsContact O-N 3.15Å; G106-R109 WeakPolarHBondContact O-CB 3.41Å; G106-R109 WeakPolarHBondContact O-CG 3.37Å; G106-R109 PolarHBondContact O-N 2.87Å; G106-R109 VanDerWaalsContact O-N 3.13Å; G106-D139 PolarHBondContact N-OD2 2.79Å
107	F	70.1	Confident	64.9	Low	15 Å²	15	95 Å²	95	7%	0.066	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-65.4	-15.7	180	-71	-69.6	0	0	0	114.3	R109 N110 P113 M130 W132 V141 E145 R149	F107-R109 PolarHBondContact O-N 2.82Å; F107-N110 PolarHBondContact O-N 2.76Å; F107-N110 VanDerWaalsContact O-N 3.07Å; F107-P113 HydrophobicContact CE1-CG 4.22Å; F107-M130 HydrophobicContact CZ-CE 4.34Å; F107-W132 HydrophobicContact CB-CH2 4.33Å; F107-W132 AromaticContact CD1-CH2 3.34Å; F107-W132 HydrophobicContact CD1-CH2 3.34Å; F107-W132 AromaticContact CD1-CZ3 3.46Å; F107-W132 HydrophobicContact CD1-CZ3 3.46Å; F107-W132 VanDerWaalsContact CD1-CZ3 3.46Å; F107-W132 HydrophobicContact CD2-CH2 4.08Å; F107-W132 AromaticContact CE1-CH2 3.51Å; F107-W132 HydrophobicContact CE1-CH2 3.51Å; F107-W132 AromaticContact CE1-CZ3 3.56Å; F107-W132 HydrophobicContact CE1-CZ3 3.56Å; F107-W132 HydrophobicContact CE2-CH2 4.28Å; F107-W132 AromaticContact CG-CH2 3.63Å; F107-W132 HydrophobicContact CG-CH2 3.63Å; F107-W132 HydrophobicContact CG-CZ3 4.2Å; F107-W132 AromaticContact CZ-CH2 3.99Å; F107-W132 HydrophobicContact CZ-CH2 3.99Å; F107-W132 HydrophobicContact CZ-CZ3 4.4Å; F107-V141 HydrophobicContact CD2-CG1 3.69Å; F107-V141 HydrophobicContact CD2-CG2 4.48Å; F107-V141 HydrophobicContact CE2-CB 4.44Å; F107-V141 HydrophobicContact CE2-CG1 3.2Å; F107-V141 HydrophobicContact CE2-CG2 4.44Å; F107-V141 HydrophobicContact CZ-CG1 4.14Å; F107-E145 VanDerWaalsContact CD2-CD 3.44Å; F107-E145 HydrophobicContact CD2-CG 3.74Å; F107-E145 HydrophobicContact CE2-CB 4.36Å; F107-E145 HydrophobicContact CE2-CG 3.82Å; F107-R149 HydrophobicContact CD1-CB 4.47Å; F107-R149 VanDerWaalsContact CD1-CD 3.48Å; F107-R149 HydrophobicContact CE1-CB 3.93Å; F107-R149 HydrophobicContact CE2-CB 4.39Å; F107-R149 VanDerWaalsContact CG-CD 3.45Å; F107-R149 HydrophobicContact CZ-CB 3.89Å; F107-R149 HydrophobicContact CZ-CG 4.48Å
108	A	67.7	Low	66.9	Low	65 Å²	65	87.3 Å²	87.3	54%	0.537	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-66.8	-16.1	174.8	0	0	0	0	0	112.7	P104 R105 G106 N110	P104-A108 HydrophobicContact CB-CB 4.18Å; R105-A108 WeakPolarHBondContact O-CB 3.35Å; R105-A108 PolarHBondContact O-N 3.36Å; G106-A108 PolarHBondContact O-N 2.94Å; G106-A108 VanDerWaalsContact O-N 3.15Å; A108-N110 PolarHBondContact O-N 3.15Å; A108-N110 PolarHBondContact O-ND2 3.13Å
109	R	68.9	Low	69.4	Low	42 Å²	42	80.3 Å²	80.3	16%	0.158	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-72.7	-13.2	173	-61.7	172.6	76.7	156.2	13.1	113.1	P104 G106 F107 L111 S135 E137 D139	P104-R109 VanDerWaalsContact C-CG 3.47Å; P104-R109 HydrophobicContact CB-CG 4.09Å; P104-R109 HydrophobicContact CG-CG 4.22Å; P104-R109 WeakPolarHBondContact O-CD 3.33Å; P104-R109 WeakPolarHBondContact O-CG 3.49Å; G106-R109 WeakPolarHBondContact O-CB 3.41Å; G106-R109 WeakPolarHBondContact O-CG 3.37Å; G106-R109 PolarHBondContact O-N 2.87Å; G106-R109 VanDerWaalsContact O-N 3.13Å; F107-R109 PolarHBondContact O-N 2.82Å; R109-L111 HydrophobicContact CB-CB 4.31Å; R109-L111 HydrophobicContact CB-CD1 3.93Å; R109-L111 HydrophobicContact CB-CG 3.73Å; R109-L111 PolarHBondContact O-N 2.93Å; R109-L111 VanDerWaalsContact O-N 3.15Å; R109-S135 PolarHBondContact NH2-OG 3.4Å; R109-S135 VanDerWaalsContact NH2-OG 3.08Å; R109-E137 IonicContact CZ-OE2 3.55Å; R109-E137 IonicContact NH1-OE2 3.05Å; R109-E137 PolarHBondContact NH1-OE2 3.35Å; R109-E137 IonicContact NH2-OE2 2.87Å; R109-E137 PolarHBondContact NH2-OE2 3.42Å; R109-D139 WeakPolarHBondContact CD-OD2 3.3Å; R109-D139 IonicContact NH1-OD2 2.96Å; R109-D139 PolarHBondContact NH1-OD2 2.83Å; R109-D139 VanDerWaalsContact NH1-OD2 3.09Å
110	N	73	Confident	71.6	Confident	140 Å²	140	77.7 Å²	77.7	75%	0.749	42%	0.416	S	S	*	.			trans	54.7	26	-170.8	-54.9	-66.8	0	0	0	112.9	F107 A108	F107-N110 PolarHBondContact O-N 2.76Å; F107-N110 VanDerWaalsContact O-N 3.07Å; A108-N110 PolarHBondContact O-N 3.15Å; A108-N110 PolarHBondContact O-ND2 3.13Å
111	L	76.6	Confident	73.5	Confident	42 Å²	42	75.3 Å²	75.3	22%	0.22	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-81.9	149.1	173.6	-63.5	174.9	0	0	0	109.8	R109 W132	R109-L111 HydrophobicContact CB-CB 4.31Å; R109-L111 HydrophobicContact CB-CD1 3.93Å; R109-L111 HydrophobicContact CB-CG 3.73Å; R109-L111 PolarHBondContact O-N 2.93Å; R109-L111 VanDerWaalsContact O-N 3.15Å; L111-W132 HydrophobicContact CB-CB 3.78Å; L111-W132 HydrophobicContact CB-CD2 4.08Å; L111-W132 HydrophobicContact CB-CE3 3.84Å; L111-W132 HydrophobicContact CB-CG 4.05Å; L111-W132 HydrophobicContact CD1-CB 3.72Å; L111-W132 HydrophobicContact CD1-CG 4.03Å; L111-W132 HydrophobicContact CG-CB 4.4Å; L111-W132 VanDerWaalsContact O-CE3 3.26Å; L111-W132 WeakPolarHBondContact O-CZ3 3.48Å
112	N	77.8	Confident	74.9	Confident	105 Å²	105	70.6 Å²	70.6	56%	0.561	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-77.4	131.2	175.9	-72.5	-41	0	0	0	109.4	E114 W132 K133	N112-E114 PolarHBondContact O-N 3.01Å; N112-W132 CarbonylContact O-C 3.22Å; N112-K133 HydrophobicContact CB-CB 4.22Å; N112-K133 HydrophobicContact CB-CD 3.97Å; N112-K133 HydrophobicContact CB-CG 4.23Å; N112-K133 PolarHBondContact O-N 3.15Å
113	P	87.5	Confident	76	Confident	26 Å²	26	70.2 Å²	70.2	17%	0.169	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	131	175.1	24.8	-29.8	0	0	0	110	F107 M130 W132 C150 V153	F107-P113 HydrophobicContact CE1-CG 4.22Å; P113-M130 HydrophobicContact CB-CE 4.11Å; P113-M130 HydrophobicContact CB-CG 4.14Å; P113-M130 HydrophobicContact CB-SD 3.53Å; P113-M130 VanDerWaalsContact CB-SD 3.53Å; P113-W132 HydrophobicContact CB-CE3 4.35Å; P113-W132 HydrophobicContact CB-CZ3 4.12Å; P113-C150 HydrophobicContact CB-CB 4.22Å; P113-C150 HydrophobicContact CG-CB 3.37Å; P113-V153 HydrophobicContact CB-CG2 4.5Å
114	E	88.3	Confident	77.3	Confident	86 Å²	86	67.4 Å²	67.4	40%	0.402	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-57	177.7	-170	-170.6	142.5	0	0	110.6	N112 K131 K133	N112-E114 PolarHBondContact O-N 3.01Å; E114-K131 HydrophobicContact CB-CG 4.49Å; E114-K131 PolarHBondContact N-O 2.88Å; E114-K131 IonicContact OE1-NZ 3.59Å; E114-K131 PolarHBondContact OE1-NZ 2.84Å; E114-K131 WeakPolarHBondContact OE2-CE 3.31Å; E114-K131 IonicContact OE2-NZ 2.99Å; E114-K131 PolarHBondContact OE2-NZ 3.25Å; E114-K133 HydrophobicContact CB-CG 3.77Å; E114-K133 HydrophobicContact CG-CG 4.14Å
115	K	89.2	Confident	78.2	Confident	85 Å²	85	67.4 Å²	67.4	37%	0.37	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	146.6	-175.7	-174.8	161.8	179.7	158.4	0	110.8	K131 E160	K115-K131 PolarHBondContact N-O 2.86Å; K115-K131 VanDerWaalsContact O-CB 3.25Å; K115-K131 WeakPolarHBondContact O-CB 3.4Å; K115-K131 PolarHBondContact O-N 2.86Å; K115-E160 VanDerWaalsContact CE-OE2 3.3Å; K115-E160 WeakPolarHBondContact CE-OE2 3.24Å; K115-E160 IonicContact NZ-OE1 3.83Å; K115-E160 PolarHBondContact NZ-OE1 3.27Å; K115-E160 IonicContact NZ-OE2 3.19Å; K115-E160 PolarHBondContact NZ-OE2 2.79Å
116	I	89.8	Confident	78.9	Confident	0 Å²	0	64 Å²	64	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	122.5	167.7	-63.3	160.6	0	0	0	108.3	G118 F128 M130 V153 V154 F157	I116-G118 VanDerWaalsContact CG2-O 3.24Å; I116-G118 WeakPolarHBondContact CG2-O 3.47Å; I116-F128 HydrophobicContact CD1-CB 4.28Å; I116-F128 HydrophobicContact CD1-CD1 4.26Å; I116-F128 HydrophobicContact CD1-CD2 3.8Å; I116-F128 HydrophobicContact CD1-CE2 4.14Å; I116-F128 HydrophobicContact CD1-CG 3.87Å; I116-F128 HydrophobicContact CG1-CB 4.19Å; I116-F128 HydrophobicContact CG1-CG 4.3Å; I116-F128 HydrophobicContact CG2-CB 3.82Å; I116-F128 HydrophobicContact CG2-CD1 3.83Å; I116-F128 HydrophobicContact CG2-CG 3.98Å; I116-M130 HydrophobicContact CD1-CE 4.22Å; I116-M130 HydrophobicContact CG1-CE 3.71Å; I116-M130 HydrophobicContact CG1-SD 3.82Å; I116-V153 HydrophobicContact CD1-CG1 4.3Å; I116-V153 HydrophobicContact CG1-CG1 4.06Å; I116-V154 HydrophobicContact CD1-CB 4.21Å; I116-V154 HydrophobicContact CD1-CG2 3.76Å; I116-F157 HydrophobicContact CB-CB 4.02Å; I116-F157 HydrophobicContact CB-CD2 3.57Å; I116-F157 HydrophobicContact CB-CE2 4.19Å; I116-F157 HydrophobicContact CB-CG 3.88Å; I116-F157 HydrophobicContact CD1-CB 4.14Å; I116-F157 HydrophobicContact CD1-CG 4.4Å; I116-F157 HydrophobicContact CG2-CD1 4.36Å; I116-F157 HydrophobicContact CG2-CD2 3.4Å; I116-F157 HydrophobicContact CG2-CE1 4.47Å; I116-F157 HydrophobicContact CG2-CE2 3.5Å; I116-F157 VanDerWaalsContact CG2-CE2 3.5Å; I116-F157 HydrophobicContact CG2-CG 3.85Å; I116-F157 HydrophobicContact CG2-CZ 4.07Å; I116-F157 VanDerWaalsContact O-CD2 3.31Å; I116-F157 WeakPolarHBondContact O-CD2 3.25Å
117	I	87.2	Confident	79.4	Confident	86 Å²	86	64.9 Å²	64.9	44%	0.441	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-44.1	-179	-56.2	179.6	0	0	0	109.5	L129 K131 A138 R161	I117-L129 HydrophobicContact CB-CD2 4.16Å; I117-L129 HydrophobicContact CB-CG 4.3Å; I117-L129 HydrophobicContact CD1-CD2 4.48Å; I117-L129 HydrophobicContact CG2-CD2 4.29Å; I117-L129 PolarHBondContact N-O 2.85Å; I117-K131 HydrophobicContact CD1-CB 4.02Å; I117-K131 HydrophobicContact CG1-CB 4.01Å; I117-A138 HydrophobicContact CD1-CB 3.97Å; I117-R161 PolarHBondContact O-NH2 3.36Å
118	G	84.6	Confident	80.2	Confident	22 Å²	22	64.2 Å²	64.2	23%	0.227	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	170.1	-176.2	0	0	0	0	0	112.3	I116 L129	I116-G118 VanDerWaalsContact CG2-O 3.24Å; I116-G118 WeakPolarHBondContact CG2-O 3.47Å; G118-L129 PolarHBondContact O-N 3.24Å
119	A	89	Confident	81.1	Confident	51 Å²	51	64 Å²	64	42%	0.421	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	140	171.1	0	0	0	0	0	108.6	L126 M127 F128 F157	A119-L126 HydrophobicContact CB-CD1 3.92Å; A119-M127 CarbonylContact C-O 3.58Å; A119-M127 VanDerWaalsContact CA-O 3.25Å; A119-M127 WeakPolarHBondContact CA-O 3.15Å; A119-F128 HydrophobicContact CB-CD1 3.79Å; A119-F128 HydrophobicContact CB-CE1 3.97Å; A119-F157 HydrophobicContact CB-CE1 4.03Å; A119-F157 HydrophobicContact CB-CZ 3.81Å
120	T	82.4	Confident	81.9	Confident	67 Å²	67	62 Å²	62	41%	0.411	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	150.3	172.1	-170.1	0	0	0	0	108.3	M127 L140	T120-M127 HydrophobicContact CG2-CB 3.84Å; T120-M127 PolarHBondContact N-O 3.13Å; T120-M127 PolarHBondContact O-N 3Å; T120-L140 HydrophobicContact CG2-CD2 4.05Å
121	D	78.7	Confident	82.5	Confident	123 Å²	123	58.3 Å²	58.3	66%	0.658	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	137.9	156.8	88.4	50.1	0	0	0	107.9	E125	D121-E125 WeakPolarHBondContact CA-O 3.25Å
122	S	67.5	Low	83	Confident	48 Å²	48	56.3 Å²	56.3	34%	0.336	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	122.5	162.8	64.2	0	0	0	0	106.2	G124 E125 M127	S122-G124 PolarHBondContact O-N 3.07Å; S122-G124 VanDerWaalsContact O-N 3.07Å; S122-E125 PolarHBondContact N-O 2.97Å; S122-E125 PolarHBondContact O-N 3.38Å; S122-M127 WeakPolarHBondContact OG-CG 3.4Å
123	S	71.4	Confident	83.1	Confident	120 Å²	120	56 Å²	56	84%	0.839	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	29.7	-177.1	59.3	0	0	0	0	115	E125	S123-E125 PolarHBondContact O-N 3.31Å
124	G	75.8	Confident	82.4	Confident	71 Å²	71	62.2 Å²	62.2	73%	0.732	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	3.1	-177.3	0	0	0	0	0	114.4	S122	S122-G124 PolarHBondContact O-N 3.07Å; S122-G124 VanDerWaalsContact O-N 3.07Å
125	E	76.3	Confident	81.8	Confident	78 Å²	78	59 Å²	59	36%	0.364	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	132.6	168.6	-173.9	159.1	-157.8	0	0	110.2	D121 S122 S123 M127	D121-E125 WeakPolarHBondContact CA-O 3.25Å; S122-E125 PolarHBondContact N-O 2.97Å; S122-E125 PolarHBondContact O-N 3.38Å; S123-E125 PolarHBondContact O-N 3.31Å; E125-M127 HydrophobicContact CG-SD 4.39Å; E125-M127 PolarHBondContact O-N 2.77Å
126	L	80.3	Confident	81.2	Confident	65 Å²	65	62.9 Å²	62.9	34%	0.34	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	118.6	176.4	-178.2	68.1	0	0	0	109.7	A119 F128 A143 Y158	A119-L126 HydrophobicContact CB-CD1 3.92Å; L126-F128 HydrophobicContact CD2-CE1 3.94Å; L126-F128 HydrophobicContact CD2-CZ 3.92Å; L126-F128 HydrophobicContact CG-CE1 4.22Å; L126-A143 HydrophobicContact CB-CB 3.92Å; L126-A143 HydrophobicContact CD2-CB 3.71Å; L126-A143 HydrophobicContact CG-CB 3.81Å; L126-A143 WeakPolarHBondContact O-CB 3.21Å; L126-A143 PolarHBondContact O-N 3.24Å; L126-Y158 WeakPolarHBondContact CD2-OH 3.39Å
127	M	86.2	Confident	80.2	Confident	26 Å²	26	66.4 Å²	66.4	13%	0.128	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.6	176.4	-59.7	-63.7	-79.1	0	0	110.2	A119 T120 S122 E125 L140 P142	A119-M127 CarbonylContact C-O 3.58Å; A119-M127 VanDerWaalsContact CA-O 3.25Å; A119-M127 WeakPolarHBondContact CA-O 3.15Å; T120-M127 HydrophobicContact CG2-CB 3.84Å; T120-M127 PolarHBondContact N-O 3.13Å; T120-M127 PolarHBondContact O-N 3Å; S122-M127 WeakPolarHBondContact OG-CG 3.4Å; E125-M127 HydrophobicContact CG-SD 4.39Å; E125-M127 PolarHBondContact O-N 2.77Å; M127-L140 HydrophobicContact CB-CD2 4.33Å; M127-L140 HydrophobicContact CE-CB 4.15Å; M127-P142 HydrophobicContact CE-CG 4.06Å; M127-P142 VanDerWaalsContact SD-CA 3.57Å; M127-P142 HydrophobicContact SD-CB 4.09Å; M127-P142 HydrophobicContact SD-CG 4.04Å
128	F	85.6	Confident	79.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.5	172.6	-66.3	-43.5	0	0	0	110.6	I116 A119 L126 M130 L140 V141 A143 A146 V154 F157 Y158	I116-F128 HydrophobicContact CD1-CB 4.28Å; I116-F128 HydrophobicContact CD1-CD1 4.26Å; I116-F128 HydrophobicContact CD1-CD2 3.8Å; I116-F128 HydrophobicContact CD1-CE2 4.14Å; I116-F128 HydrophobicContact CD1-CG 3.87Å; I116-F128 HydrophobicContact CG1-CB 4.19Å; I116-F128 HydrophobicContact CG1-CG 4.3Å; I116-F128 HydrophobicContact CG2-CB 3.82Å; I116-F128 HydrophobicContact CG2-CD1 3.83Å; I116-F128 HydrophobicContact CG2-CG 3.98Å; A119-F128 HydrophobicContact CB-CD1 3.79Å; A119-F128 HydrophobicContact CB-CE1 3.97Å; L126-F128 HydrophobicContact CD2-CE1 3.94Å; L126-F128 HydrophobicContact CD2-CZ 3.92Å; L126-F128 HydrophobicContact CG-CE1 4.22Å; F128-M130 PolarHBondContact O-N 3.05Å; F128-L140 CarbonylContact O-C 3.56Å; F128-L140 WeakPolarHBondContact O-CA 3.22Å; F128-V141 PolarHBondContact N-O 3.07Å; F128-V141 PolarHBondContact O-N 2.73Å; F128-A143 HydrophobicContact CD2-CB 3.93Å; F128-A143 HydrophobicContact CE1-CB 4.5Å; F128-A143 HydrophobicContact CE2-CB 3.43Å; F128-A143 VanDerWaalsContact CE2-CB 3.43Å; F128-A143 HydrophobicContact CZ-CB 3.75Å; F128-A146 HydrophobicContact CD2-CB 3.65Å; F128-A146 HydrophobicContact CE2-CB 4.07Å; F128-V154 HydrophobicContact CD2-CG2 4.4Å; F128-V154 HydrophobicContact CE2-CG1 3.83Å; F128-V154 HydrophobicContact CE2-CG2 3.9Å; F128-V154 HydrophobicContact CZ-CG1 3.85Å; F128-F157 HydrophobicContact CE1-CD1 4.31Å; F128-F157 HydrophobicContact CE1-CE1 4.11Å; F128-Y158 HydrophobicContact CE1-CE2 4.5Å; F128-Y158 AromaticContact CZ-CE2 3.98Å; F128-Y158 HydrophobicContact CZ-CE2 3.98Å
129	L	87.6	Confident	79.7	Confident	60 Å²	60	63.5 Å²	63.5	31%	0.314	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	101.3	165.2	-176.2	63.7	0	0	0	108.2	I117 G118 A138 L140	I117-L129 HydrophobicContact CB-CD2 4.16Å; I117-L129 HydrophobicContact CB-CG 4.3Å; I117-L129 HydrophobicContact CD1-CD2 4.48Å; I117-L129 HydrophobicContact CG2-CD2 4.29Å; I117-L129 PolarHBondContact N-O 2.85Å; G118-L129 PolarHBondContact O-N 3.24Å; L129-A138 HydrophobicContact CD1-CB 3.68Å; L129-A138 HydrophobicContact CG-CB 3.98Å; L129-L140 HydrophobicContact CB-CD2 4.3Å; L129-L140 HydrophobicContact CD1-CD2 4.26Å
130	M	84.6	Confident	79.3	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.8	-173.8	-171.4	65.8	73.5	0	0	111	F107 P113 I116 F128 W132 A138 D139 V141 A146 V153	F107-M130 HydrophobicContact CZ-CE 4.34Å; P113-M130 HydrophobicContact CB-CE 4.11Å; P113-M130 HydrophobicContact CB-CG 4.14Å; P113-M130 HydrophobicContact CB-SD 3.53Å; P113-M130 VanDerWaalsContact CB-SD 3.53Å; I116-M130 HydrophobicContact CD1-CE 4.22Å; I116-M130 HydrophobicContact CG1-CE 3.71Å; I116-M130 HydrophobicContact CG1-SD 3.82Å; F128-M130 PolarHBondContact O-N 3.05Å; M130-W132 HydrophobicContact CB-CH2 4.45Å; M130-W132 HydrophobicContact CB-CZ2 3.89Å; M130-W132 HydrophobicContact CG-CD2 4.15Å; M130-W132 HydrophobicContact CG-CE3 4.27Å; M130-W132 HydrophobicContact CG-CH2 3.8Å; M130-W132 HydrophobicContact CG-CZ2 3.63Å; M130-W132 HydrophobicContact CG-CZ3 4.13Å; M130-A138 VanDerWaalsContact O-CA 3.22Å; M130-A138 WeakPolarHBondContact O-CA 3.48Å; M130-D139 PolarHBondContact N-O 2.85Å; M130-D139 PolarHBondContact O-N 2.81Å; M130-V141 HydrophobicContact CB-CB 4.46Å; M130-V141 HydrophobicContact CB-CG2 3.85Å; M130-A146 HydrophobicContact CE-CB 4.17Å; M130-V153 HydrophobicContact SD-CG1 4.42Å
131	K	85.9	Confident	79.5	Confident	64 Å²	64	62.8 Å²	62.8	28%	0.278	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	134.1	164.6	-168	-172.9	175.9	-153.5	0	109.3	E114 K115 I117	E114-K131 HydrophobicContact CB-CG 4.49Å; E114-K131 PolarHBondContact N-O 2.88Å; E114-K131 IonicContact OE1-NZ 3.59Å; E114-K131 PolarHBondContact OE1-NZ 2.84Å; E114-K131 WeakPolarHBondContact OE2-CE 3.31Å; E114-K131 IonicContact OE2-NZ 2.99Å; E114-K131 PolarHBondContact OE2-NZ 3.25Å; K115-K131 PolarHBondContact N-O 2.86Å; K115-K131 VanDerWaalsContact O-CB 3.25Å; K115-K131 WeakPolarHBondContact O-CB 3.4Å; K115-K131 PolarHBondContact O-N 2.86Å; I117-K131 HydrophobicContact CD1-CB 4.02Å; I117-K131 HydrophobicContact CG1-CB 4.01Å
132	W	87.2	Confident	79.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	151.5	178.4	-55.2	103.2	0	0	0	111.5	F107 L111 N112 P113 M130 D139 V141	F107-W132 HydrophobicContact CB-CH2 4.33Å; F107-W132 AromaticContact CD1-CH2 3.34Å; F107-W132 HydrophobicContact CD1-CH2 3.34Å; F107-W132 AromaticContact CD1-CZ3 3.46Å; F107-W132 HydrophobicContact CD1-CZ3 3.46Å; F107-W132 VanDerWaalsContact CD1-CZ3 3.46Å; F107-W132 HydrophobicContact CD2-CH2 4.08Å; F107-W132 AromaticContact CE1-CH2 3.51Å; F107-W132 HydrophobicContact CE1-CH2 3.51Å; F107-W132 AromaticContact CE1-CZ3 3.56Å; F107-W132 HydrophobicContact CE1-CZ3 3.56Å; F107-W132 HydrophobicContact CE2-CH2 4.28Å; F107-W132 AromaticContact CG-CH2 3.63Å; F107-W132 HydrophobicContact CG-CH2 3.63Å; F107-W132 HydrophobicContact CG-CZ3 4.2Å; F107-W132 AromaticContact CZ-CH2 3.99Å; F107-W132 HydrophobicContact CZ-CH2 3.99Å; F107-W132 HydrophobicContact CZ-CZ3 4.4Å; L111-W132 HydrophobicContact CB-CB 3.78Å; L111-W132 HydrophobicContact CB-CD2 4.08Å; L111-W132 HydrophobicContact CB-CE3 3.84Å; L111-W132 HydrophobicContact CB-CG 4.05Å; L111-W132 HydrophobicContact CD1-CB 3.72Å; L111-W132 HydrophobicContact CD1-CG 4.03Å; L111-W132 HydrophobicContact CG-CB 4.4Å; L111-W132 VanDerWaalsContact O-CE3 3.26Å; L111-W132 WeakPolarHBondContact O-CZ3 3.48Å; N112-W132 CarbonylContact O-C 3.22Å; P113-W132 HydrophobicContact CB-CE3 4.35Å; P113-W132 HydrophobicContact CB-CZ3 4.12Å; M130-W132 HydrophobicContact CB-CH2 4.45Å; M130-W132 HydrophobicContact CB-CZ2 3.89Å; M130-W132 HydrophobicContact CG-CD2 4.15Å; M130-W132 HydrophobicContact CG-CE3 4.27Å; M130-W132 HydrophobicContact CG-CH2 3.8Å; M130-W132 HydrophobicContact CG-CZ2 3.63Å; M130-W132 HydrophobicContact CG-CZ3 4.13Å; W132-D139 HydrophobicContact CZ2-CB 4.38Å; W132-D139 PolarHBondContact NE1-OD2 2.88Å; W132-V141 HydrophobicContact CH2-CG2 4.25Å; W132-V141 HydrophobicContact CZ2-CG2 3.8Å
133	K	80.3	Confident	80.7	Confident	97 Å²	97	56.8 Å²	56.8	42%	0.422	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	140	167.1	-64.4	-172	-179.6	-178.4	0	108.6	N112 E114 S135	N112-K133 HydrophobicContact CB-CB 4.22Å; N112-K133 HydrophobicContact CB-CD 3.97Å; N112-K133 HydrophobicContact CB-CG 4.23Å; N112-K133 PolarHBondContact O-N 3.15Å; E114-K133 HydrophobicContact CB-CG 3.77Å; E114-K133 HydrophobicContact CG-CG 4.14Å; K133-S135 PolarHBondContact O-N 2.78Å
134	D	73.4	Confident	81.3	Confident	158 Å²	158	60.6 Å²	60.6	85%	0.845	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	16.4	178.5	-45.1	-57.3	0	0	0	114.4
135	S	75.8	Confident	81.6	Confident	19 Å²	19	60.3 Å²	60.3	13%	0.133	30%	0.301	C	S	.	.			trans	-144.3	133.5	170.3	-179.4	0	0	0	0	111.3	R109 K133 E137	R109-S135 PolarHBondContact NH2-OG 3.4Å; R109-S135 VanDerWaalsContact NH2-OG 3.08Å; K133-S135 PolarHBondContact O-N 2.78Å; S135-E137 WeakPolarHBondContact OG-CB 3.49Å; S135-E137 PolarHBondContact OG-N 2.84Å
136	D	75.3	Confident	82.2	Confident	165 Å²	165	56.6 Å²	56.6	88%	0.882	28%	0.284	S	S	*	.			trans	-84.1	-3.1	174.3	-66.5	-37.6	0	0	0	112.6
137	E	70.4	Confident	82.6	Confident	74 Å²	74	57.3 Å²	57.3	35%	0.346	29%	0.288	S	S	.	.			trans	-85.3	130.6	178.6	-170.2	177.5	-162.2	0	0	110.1	R109 S135	R109-E137 IonicContact CZ-OE2 3.55Å; R109-E137 IonicContact NH1-OE2 3.05Å; R109-E137 PolarHBondContact NH1-OE2 3.35Å; R109-E137 IonicContact NH2-OE2 2.87Å; R109-E137 PolarHBondContact NH2-OE2 3.42Å; S135-E137 WeakPolarHBondContact OG-CB 3.49Å; S135-E137 PolarHBondContact OG-N 2.84Å
138	A	79.2	Confident	82.5	Confident	39 Å²	39	61.8 Å²	61.8	32%	0.322	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.1	178.2	0	0	0	0	0	110.5	I117 L129 M130	I117-A138 HydrophobicContact CD1-CB 3.97Å; L129-A138 HydrophobicContact CD1-CB 3.68Å; L129-A138 HydrophobicContact CG-CB 3.98Å; M130-A138 VanDerWaalsContact O-CA 3.22Å; M130-A138 WeakPolarHBondContact O-CA 3.48Å
139	D	80.6	Confident	82.4	Confident	9 Å²	9	68.7 Å²	68.7	5%	0.048	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.9	-176.3	-69.7	-57	0	0	0	111.4	G106 R109 M130 W132	G106-D139 PolarHBondContact N-OD2 2.79Å; R109-D139 WeakPolarHBondContact CD-OD2 3.3Å; R109-D139 IonicContact NH1-OD2 2.96Å; R109-D139 PolarHBondContact NH1-OD2 2.83Å; R109-D139 VanDerWaalsContact NH1-OD2 3.09Å; M130-D139 PolarHBondContact N-O 2.85Å; M130-D139 PolarHBondContact O-N 2.81Å; W132-D139 HydrophobicContact CZ2-CB 4.38Å; W132-D139 PolarHBondContact NE1-OD2 2.88Å
140	L	81.8	Confident	82.1	Confident	100 Å²	100	66.4 Å²	66.4	52%	0.524	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126.4	169.9	-73.3	174.7	0	0	0	110.2	T120 M127 F128 L129	T120-L140 HydrophobicContact CG2-CD2 4.05Å; M127-L140 HydrophobicContact CB-CD2 4.33Å; M127-L140 HydrophobicContact CE-CB 4.15Å; F128-L140 CarbonylContact O-C 3.56Å; F128-L140 WeakPolarHBondContact O-CA 3.22Å; L129-L140 HydrophobicContact CB-CD2 4.3Å; L129-L140 HydrophobicContact CD1-CD2 4.26Å
141	V	85.5	Confident	82.4	Confident	2 Å²	2	69 Å²	69	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.8	-174	174.8	0	0	0	0	109.4	F107 F128 M130 W132 A143 A146	F107-V141 HydrophobicContact CD2-CG1 3.69Å; F107-V141 HydrophobicContact CD2-CG2 4.48Å; F107-V141 HydrophobicContact CE2-CB 4.44Å; F107-V141 HydrophobicContact CE2-CG1 3.2Å; F107-V141 HydrophobicContact CE2-CG2 4.44Å; F107-V141 HydrophobicContact CZ-CG1 4.14Å; F128-V141 PolarHBondContact N-O 3.07Å; F128-V141 PolarHBondContact O-N 2.73Å; M130-V141 HydrophobicContact CB-CB 4.46Å; M130-V141 HydrophobicContact CB-CG2 3.85Å; W132-V141 HydrophobicContact CH2-CG2 4.25Å; W132-V141 HydrophobicContact CZ2-CG2 3.8Å; V141-A143 PolarHBondContact O-N 3.04Å; V141-A146 HydrophobicContact CG1-CB 4.24Å
142	P	85.3	Confident	82.7	Confident	39 Å²	39	72.8 Å²	72.8	25%	0.253	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	134	175.3	-22.7	33	0	0	0	111.9	M127 R144 E145 A146	M127-P142 HydrophobicContact CE-CG 4.06Å; M127-P142 VanDerWaalsContact SD-CA 3.57Å; M127-P142 HydrophobicContact SD-CB 4.09Å; M127-P142 HydrophobicContact SD-CG 4.04Å; P142-R144 PolarHBondContact O-N 3.09Å; P142-R144 VanDerWaalsContact O-N 3.15Å; P142-E145 PolarHBondContact O-N 2.8Å; P142-A146 PolarHBondContact O-N 2.99Å; P142-A146 VanDerWaalsContact O-N 3.1Å
143	A	85.7	Confident	82.8	Confident	7 Å²	7	74.1 Å²	74.1	6%	0.058	38%	0.376	C	S	.	.	H	α-helix	trans	-57.1	-34.8	178.8	0	0	0	0	0	112	L126 F128 V141 E145 A146 N147	L126-A143 HydrophobicContact CB-CB 3.92Å; L126-A143 HydrophobicContact CD2-CB 3.71Å; L126-A143 HydrophobicContact CG-CB 3.81Å; L126-A143 WeakPolarHBondContact O-CB 3.21Å; L126-A143 PolarHBondContact O-N 3.24Å; F128-A143 HydrophobicContact CD2-CB 3.93Å; F128-A143 HydrophobicContact CE1-CB 4.5Å; F128-A143 HydrophobicContact CE2-CB 3.43Å; F128-A143 VanDerWaalsContact CE2-CB 3.43Å; F128-A143 HydrophobicContact CZ-CB 3.75Å; V141-A143 PolarHBondContact O-N 3.04Å; A143-E145 VanDerWaalsContact C-N 3.3Å; A143-E145 PolarHBondContact O-N 2.84Å; A143-A146 PolarHBondContact O-N 3.08Å; A143-N147 VanDerWaalsContact O-CB 3.3Å; A143-N147 WeakPolarHBondContact O-CB 3.12Å; A143-N147 PolarHBondContact O-N 2.74Å; A143-N147 PolarHBondContact O-ND2 2.78Å; A143-N147 PolarHBondContact O-OD1 3.45Å
144	R	85.4	Confident	83.3	Confident	199 Å²	199	69.8 Å²	69.8	75%	0.751	36%	0.357	S	S	*	.	H	α-helix	trans	-56.3	-42.4	175.1	-71.9	179.8	163.3	-170	-1.4	112.8	P142 T148	P142-R144 PolarHBondContact O-N 3.09Å; P142-R144 VanDerWaalsContact O-N 3.15Å; R144-T148 PolarHBondContact O-OG1 3.05Å; R144-T148 VanDerWaalsContact O-OG1 3.11Å
145	E	82	Confident	84.2	Confident	65 Å²	65	65.8 Å²	65.8	30%	0.304	34%	0.335	S	S	.	.	H	α-helix	trans	-73.9	-45	179.4	-170.1	174	-172.7	0	0	111.1	F107 P142 A143 N147 T148 R149	F107-E145 VanDerWaalsContact CD2-CD 3.44Å; F107-E145 HydrophobicContact CD2-CG 3.74Å; F107-E145 HydrophobicContact CE2-CB 4.36Å; F107-E145 HydrophobicContact CE2-CG 3.82Å; P142-E145 PolarHBondContact O-N 2.8Å; A143-E145 VanDerWaalsContact C-N 3.3Å; A143-E145 PolarHBondContact O-N 2.84Å; E145-N147 VanDerWaalsContact C-N 3.32Å; E145-N147 PolarHBondContact O-N 3.12Å; E145-T148 PolarHBondContact O-N 2.82Å; E145-T148 VanDerWaalsContact O-N 3.08Å; E145-R149 HydrophobicContact CG-CG 4.25Å; E145-R149 PolarHBondContact O-N 3.33Å; E145-R149 IonicContact OE1-CZ 3.14Å; E145-R149 IonicContact OE1-NE 2.78Å; E145-R149 PolarHBondContact OE1-NE 3.48Å; E145-R149 IonicContact OE1-NH2 2.8Å; E145-R149 PolarHBondContact OE1-NH2 2.76Å
146	A	87.4	Confident	84.9	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-38.6	178	0	0	0	0	0	112.7	F128 M130 V141 P142 A143 T148 R149 C150 V154	F128-A146 HydrophobicContact CD2-CB 3.65Å; F128-A146 HydrophobicContact CE2-CB 4.07Å; M130-A146 HydrophobicContact CE-CB 4.17Å; V141-A146 HydrophobicContact CG1-CB 4.24Å; P142-A146 PolarHBondContact O-N 2.99Å; P142-A146 VanDerWaalsContact O-N 3.1Å; A143-A146 PolarHBondContact O-N 3.08Å; A146-T148 PolarHBondContact O-N 3.29Å; A146-R149 PolarHBondContact O-N 3.47Å; A146-C150 CarbonylContact O-C 3.59Å; A146-C150 WeakPolarHBondContact O-CA 3.42Å; A146-C150 PolarHBondContact O-N 3.45Å; A146-C150 PolarHBondContact O-SG 3.43Å; A146-C150 VanDerWaalsContact O-SG 3.39Å; A146-V154 HydrophobicContact CB-CG2 3.81Å
147	N	89.1	Confident	85.7	Confident	81 Å²	81	59.4 Å²	59.4	43%	0.433	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-30.6	176.2	-69.1	-10.2	0	0	0	112.4	A143 E145 P151 V154	A143-N147 VanDerWaalsContact O-CB 3.3Å; A143-N147 WeakPolarHBondContact O-CB 3.12Å; A143-N147 PolarHBondContact O-N 2.74Å; A143-N147 PolarHBondContact O-ND2 2.78Å; A143-N147 PolarHBondContact O-OD1 3.45Å; E145-N147 VanDerWaalsContact C-N 3.32Å; E145-N147 PolarHBondContact O-N 3.12Å; N147-P151 WeakPolarHBondContact O-CB 3.43Å; N147-V154 WeakPolarHBondContact OD1-CG1 3.23Å
148	T	84.8	Confident	86.6	Confident	119 Å²	119	60.7 Å²	60.7	73%	0.73	31%	0.307	S	S	*	.	H	α-helix	trans	-88.2	-44.9	-178.5	-52.6	0	0	0	0	111.1	R144 E145 A146	R144-T148 PolarHBondContact O-OG1 3.05Å; R144-T148 VanDerWaalsContact O-OG1 3.11Å; E145-T148 PolarHBondContact O-N 2.82Å; E145-T148 VanDerWaalsContact O-N 3.08Å; A146-T148 PolarHBondContact O-N 3.29Å
149	R	82.3	Confident	87.1	Confident	146 Å²	146	65.2 Å²	65.2	55%	0.551	32%	0.321	S	S	*	.	H	α-helix	trans	-81.6	-39.5	-174.8	-67.1	-168.4	-174.2	-129.1	11	113.6	F107 E145 A146	F107-R149 HydrophobicContact CD1-CB 4.47Å; F107-R149 VanDerWaalsContact CD1-CD 3.48Å; F107-R149 HydrophobicContact CE1-CB 3.93Å; F107-R149 HydrophobicContact CE2-CB 4.39Å; F107-R149 VanDerWaalsContact CG-CD 3.45Å; F107-R149 HydrophobicContact CZ-CB 3.89Å; F107-R149 HydrophobicContact CZ-CG 4.48Å; E145-R149 HydrophobicContact CG-CG 4.25Å; E145-R149 PolarHBondContact O-N 3.33Å; E145-R149 IonicContact OE1-CZ 3.14Å; E145-R149 IonicContact OE1-NE 2.78Å; E145-R149 PolarHBondContact OE1-NE 3.48Å; E145-R149 IonicContact OE1-NH2 2.8Å; E145-R149 PolarHBondContact OE1-NH2 2.76Å; A146-R149 PolarHBondContact O-N 3.47Å
150	C	83	Confident	87.4	Confident	11 Å²	11	70.2 Å²	70.2	7%	0.074	34%	0.344	C	S	.	.			trans	-140.6	60.6	-174.6	60.7	0	0	0	0	113	P113 A146 Q152 V153 V154	P113-C150 HydrophobicContact CB-CB 4.22Å; P113-C150 HydrophobicContact CG-CB 3.37Å; A146-C150 CarbonylContact O-C 3.59Å; A146-C150 WeakPolarHBondContact O-CA 3.42Å; A146-C150 PolarHBondContact O-N 3.45Å; A146-C150 PolarHBondContact O-SG 3.43Å; A146-C150 VanDerWaalsContact O-SG 3.39Å; C150-Q152 VanDerWaalsContact C-N 3.27Å; C150-Q152 PolarHBondContact O-N 3.24Å; C150-V153 HydrophobicContact CB-CB 4.35Å; C150-V153 HydrophobicContact CB-CG2 4.15Å; C150-V153 PolarHBondContact O-N 2.94Å; C150-V153 VanDerWaalsContact O-N 3.14Å; C150-V154 PolarHBondContact O-N 3.26Å
151	P	90.5	Very high	87.5	Confident	54 Å²	54	70.4 Å²	70.4	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-58.4	-35.7	-176.3	21.1	-32.7	0	0	0	113.4	N147 V153 V154 I155	N147-P151 WeakPolarHBondContact O-CB 3.43Å; P151-V153 VanDerWaalsContact C-N 3.3Å; P151-V153 PolarHBondContact O-N 3.45Å; P151-V154 PolarHBondContact O-N 2.84Å; P151-I155 WeakPolarHBondContact O-CD1 3.42Å; P151-I155 VanDerWaalsContact O-CG1 3.25Å; P151-I155 WeakPolarHBondContact O-CG1 3.26Å; P151-I155 PolarHBondContact O-N 3.11Å
152	Q	91.4	Very high	87.5	Confident	145 Å²	145	75 Å²	75	68%	0.678	36%	0.362	S	S	*	.	H	α-helix	trans	-63.1	-36.9	-179.5	-61.7	-59	-34.4	0	0	112.5	C150 A156	C150-Q152 VanDerWaalsContact C-N 3.27Å; C150-Q152 PolarHBondContact O-N 3.24Å; Q152-A156 WeakPolarHBondContact O-CB 3.16Å; Q152-A156 PolarHBondContact O-N 3.37Å; Q152-A156 VanDerWaalsContact O-N 3.08Å
153	V	90.1	Very high	87.3	Confident	28 Å²	28	78 Å²	78	17%	0.17	38%	0.38	C	S	.	.	H	α-helix	trans	-69.6	-39	177.4	-177.8	0	0	0	0	110.4	P113 I116 M130 C150 P151 F157	P113-V153 HydrophobicContact CB-CG2 4.5Å; I116-V153 HydrophobicContact CD1-CG1 4.3Å; I116-V153 HydrophobicContact CG1-CG1 4.06Å; M130-V153 HydrophobicContact SD-CG1 4.42Å; C150-V153 HydrophobicContact CB-CB 4.35Å; C150-V153 HydrophobicContact CB-CG2 4.15Å; C150-V153 PolarHBondContact O-N 2.94Å; C150-V153 VanDerWaalsContact O-N 3.14Å; P151-V153 VanDerWaalsContact C-N 3.3Å; P151-V153 PolarHBondContact O-N 3.45Å; V153-F157 PolarHBondContact O-N 3.09Å; V153-F157 VanDerWaalsContact O-N 3.11Å
154	V	90.9	Very high	87.1	Confident	5 Å²	5	88.3 Å²	88.3	3%	0.03	42%	0.417	C	S	.	.	H	α-helix	trans	-65.8	-45.8	176.5	-179	0	0	0	0	111.5	I116 F128 A146 N147 C150 P151 A156 F157 Y158	I116-V154 HydrophobicContact CD1-CB 4.21Å; I116-V154 HydrophobicContact CD1-CG2 3.76Å; F128-V154 HydrophobicContact CD2-CG2 4.4Å; F128-V154 HydrophobicContact CE2-CG1 3.83Å; F128-V154 HydrophobicContact CE2-CG2 3.9Å; F128-V154 HydrophobicContact CZ-CG1 3.85Å; A146-V154 HydrophobicContact CB-CG2 3.81Å; N147-V154 WeakPolarHBondContact OD1-CG1 3.23Å; C150-V154 PolarHBondContact O-N 3.26Å; P151-V154 PolarHBondContact O-N 2.84Å; V154-A156 PolarHBondContact O-N 2.75Å; V154-F157 WeakPolarHBondContact O-CB 3.47Å; V154-F157 PolarHBondContact O-N 2.78Å; V154-Y158 HydrophobicContact CG1-CD2 3.78Å; V154-Y158 HydrophobicContact CG1-CE2 3.52Å; V154-Y158 VanDerWaalsContact O-CD2 3.25Å; V154-Y158 WeakPolarHBondContact O-CD2 3.4Å; V154-Y158 PolarHBondContact O-N 3.21Å
155	I	91.7	Very high	86.8	Confident	75 Å²	75	87.2 Å²	87.2	39%	0.385	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-49.9	178.9	-68.7	163	0	0	0	109.9	P151 F157 Y158 E159	P151-I155 WeakPolarHBondContact O-CD1 3.42Å; P151-I155 VanDerWaalsContact O-CG1 3.25Å; P151-I155 WeakPolarHBondContact O-CG1 3.26Å; P151-I155 PolarHBondContact O-N 3.11Å; I155-F157 VanDerWaalsContact C-N 3.25Å; I155-F157 PolarHBondContact O-N 3.31Å; I155-Y158 PolarHBondContact O-N 3.32Å; I155-Y158 VanDerWaalsContact O-N 3.09Å; I155-E159 HydrophobicContact CG2-CG 4.12Å; I155-E159 WeakPolarHBondContact O-CG 3.25Å; I155-E159 PolarHBondContact O-N 2.68Å
156	A	89.6	Confident	86.2	Confident	40 Å²	40	89.4 Å²	89.4	33%	0.331	44%	0.443	S	S	.	.	H	α-helix	trans	-56.5	-39.4	177.8	0	0	0	0	0	112.5	Q152 V154 Y158 E159 E160	Q152-A156 WeakPolarHBondContact O-CB 3.16Å; Q152-A156 PolarHBondContact O-N 3.37Å; Q152-A156 VanDerWaalsContact O-N 3.08Å; V154-A156 PolarHBondContact O-N 2.75Å; A156-Y158 PolarHBondContact O-N 2.9Å; A156-E159 PolarHBondContact O-N 3.33Å; A156-E160 WeakPolarHBondContact O-CG 3.39Å; A156-E160 PolarHBondContact O-N 3.31Å; A156-E160 VanDerWaalsContact O-N 3.07Å
157	F	92.7	Very high	84.7	Confident	10 Å²	10	94.3 Å²	94.3	4%	0.044	48%	0.476	C	S	.	.	H	α-helix	trans	-60.1	-42.9	177	170.1	-94.7	0	0	0	113	I116 A119 F128 V153 V154 I155 R161	I116-F157 HydrophobicContact CB-CB 4.02Å; I116-F157 HydrophobicContact CB-CD2 3.57Å; I116-F157 HydrophobicContact CB-CE2 4.19Å; I116-F157 HydrophobicContact CB-CG 3.88Å; I116-F157 HydrophobicContact CD1-CB 4.14Å; I116-F157 HydrophobicContact CD1-CG 4.4Å; I116-F157 HydrophobicContact CG2-CD1 4.36Å; I116-F157 HydrophobicContact CG2-CD2 3.4Å; I116-F157 HydrophobicContact CG2-CE1 4.47Å; I116-F157 HydrophobicContact CG2-CE2 3.5Å; I116-F157 VanDerWaalsContact CG2-CE2 3.5Å; I116-F157 HydrophobicContact CG2-CG 3.85Å; I116-F157 HydrophobicContact CG2-CZ 4.07Å; I116-F157 VanDerWaalsContact O-CD2 3.31Å; I116-F157 WeakPolarHBondContact O-CD2 3.25Å; A119-F157 HydrophobicContact CB-CE1 4.03Å; A119-F157 HydrophobicContact CB-CZ 3.81Å; F128-F157 HydrophobicContact CE1-CD1 4.31Å; F128-F157 HydrophobicContact CE1-CE1 4.11Å; V153-F157 PolarHBondContact O-N 3.09Å; V153-F157 VanDerWaalsContact O-N 3.11Å; V154-F157 WeakPolarHBondContact O-CB 3.47Å; V154-F157 PolarHBondContact O-N 2.78Å; I155-F157 VanDerWaalsContact C-N 3.25Å; I155-F157 PolarHBondContact O-N 3.31Å; F157-R161 VanDerWaalsContact CE2-NH2 3.32Å; F157-R161 WeakPolarHBondContact O-CD 3.22Å; F157-R161 PolarHBondContact O-NH1 3.36Å
158	Y	90.1	Very high	83.3	Confident	101 Å²	101	96.6 Å²	96.6	40%	0.396	50%	0.496	S	S	.	.	H	α-helix	trans	-73.9	-41.9	178.1	-76.3	-66.8	0	0	0	112.3	L126 F128 V154 I155 A156 E160 R161 L162	L126-Y158 WeakPolarHBondContact CD2-OH 3.39Å; F128-Y158 HydrophobicContact CE1-CE2 4.5Å; F128-Y158 AromaticContact CZ-CE2 3.98Å; F128-Y158 HydrophobicContact CZ-CE2 3.98Å; V154-Y158 HydrophobicContact CG1-CD2 3.78Å; V154-Y158 HydrophobicContact CG1-CE2 3.52Å; V154-Y158 VanDerWaalsContact O-CD2 3.25Å; V154-Y158 WeakPolarHBondContact O-CD2 3.4Å; V154-Y158 PolarHBondContact O-N 3.21Å; I155-Y158 PolarHBondContact O-N 3.32Å; I155-Y158 VanDerWaalsContact O-N 3.09Å; A156-Y158 PolarHBondContact O-N 2.9Å; Y158-E160 VanDerWaalsContact C-N 3.29Å; Y158-E160 PolarHBondContact O-N 3.19Å; Y158-R161 CarbonylContact O-C 3.53Å; Y158-R161 PolarHBondContact O-N 3.43Å; Y158-L162 PolarHBondContact O-N 3.37Å
159	E	89.1	Confident	82.1	Confident	133 Å²	133	98.8 Å²	98.8	62%	0.621	50%	0.497	S	S	*	.	H	α-helix	trans	-58.3	-41.4	177.7	-73.3	-179	160.6	0	0	112	I155 A156 R161	I155-E159 HydrophobicContact CG2-CG 4.12Å; I155-E159 WeakPolarHBondContact O-CG 3.25Å; I155-E159 PolarHBondContact O-N 2.68Å; A156-E159 PolarHBondContact O-N 3.33Å; E159-R161 PolarHBondContact O-N 3.38Å
160	E	86.8	Confident	80.9	Confident	115 Å²	115	99.6 Å²	99.6	54%	0.537	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.7	175.4	-73.9	178.8	-175.7	0	0	113.7	K115 A156 Y158	K115-E160 VanDerWaalsContact CE-OE2 3.3Å; K115-E160 WeakPolarHBondContact CE-OE2 3.24Å; K115-E160 IonicContact NZ-OE1 3.83Å; K115-E160 PolarHBondContact NZ-OE1 3.27Å; K115-E160 IonicContact NZ-OE2 3.19Å; K115-E160 PolarHBondContact NZ-OE2 2.79Å; A156-E160 WeakPolarHBondContact O-CG 3.39Å; A156-E160 PolarHBondContact O-N 3.31Å; A156-E160 VanDerWaalsContact O-N 3.07Å; Y158-E160 VanDerWaalsContact C-N 3.29Å; Y158-E160 PolarHBondContact O-N 3.19Å
161	R	84.1	Confident	79.5	Confident	104 Å²	104	108.9 Å²	108.9	39%	0.392	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108	0.5	-173.8	-72.6	169.4	-179	69.9	-2	113.5	I117 F157 Y158 E159 T163	I117-R161 PolarHBondContact O-NH2 3.36Å; F157-R161 VanDerWaalsContact CE2-NH2 3.32Å; F157-R161 WeakPolarHBondContact O-CD 3.22Å; F157-R161 PolarHBondContact O-NH1 3.36Å; Y158-R161 CarbonylContact O-C 3.53Å; Y158-R161 PolarHBondContact O-N 3.43Å; E159-R161 PolarHBondContact O-N 3.38Å; R161-T163 PolarHBondContact O-N 3.39Å; R161-T163 VanDerWaalsContact O-N 3.13Å
162	L	86.4	Confident	77.9	Confident	97 Å²	97	110.7 Å²	110.7	51%	0.508	58%	0.575	S	S	.	*			trans	-71	105.8	-179.5	-111	141.3	0	0	0	110	Y158 W164	Y158-L162 PolarHBondContact O-N 3.37Å; L162-W164 HydrophobicContact CD2-CZ2 4Å
163	T	80.1	Confident	76	Confident	104 Å²	104	116.8 Å²	116.8	64%	0.638	60%	0.603	S	S	*	*			trans	-101.7	121.9	173.1	54.7	0	0	0	0	110.4	R161	R161-T163 PolarHBondContact O-N 3.39Å; R161-T163 VanDerWaalsContact O-N 3.13Å
164	W	82.6	Confident	75.3	Confident	222 Å²	222	121.3 Å²	121.3	84%	0.841	63%	0.625	S	S	*	*			trans	-88.7	112.9	174	-58.7	91.9	0	0	0	109.2	L162 S166	L162-W164 HydrophobicContact CD2-CZ2 4Å; W164-S166 PolarHBondContact O-N 3.4Å
165	H	78.1	Confident	74.4	Confident	177 Å²	177	127.4 Å²	127.4	82%	0.819	66%	0.656	S	S	*	*			trans	-84.5	100.3	169.4	-66	-76.3	0	0	0	109
166	S	68.8	Low	73.5	Confident	111 Å²	111	130.3 Å²	130.3	78%	0.776	67%	0.671	S	S	*	*			trans	-80.6	111.8	163.1	44.7	0	0	0	0	108.4	W164	W164-S166 PolarHBondContact O-N 3.4Å
167	C	55.9	Low	72.5	Confident	103 Å²	103	135.6 Å²	135.6	70%	0.696	69%	0.691	S	S	*	*			trans	-56.2	126.3	176.3	-164.3	0	0	0	0	110.1	E169	C167-E169 PolarHBondContact O-N 3.45Å
168	P	60.3	Low	71.3	Confident	129 Å²	129	143.4 Å²	143.4	84%	0.838	73%	0.732	S	S	*	*			trans	-84	91.8	169.8	31.7	-27	0	0	0	108.5
169	E	60.6	Low	70	Confident	164 Å²	164	146.3 Å²	146.3	77%	0.766	75%	0.754	S	S	*	*			trans	-130.8	74.3	169.7	-154.4	162.8	-148.4	0	0	108	C167	C167-E169 PolarHBondContact O-N 3.45Å
170	D	56.4	Low	68.7	Low	164 Å²	164	147.2 Å²	147.2	88%	0.877	76%	0.764	S	S	*	*			trans	-167.8	43.6	161.5	-97.3	-25.4	0	0	0	111.7
171	E	53.5	Low	67.3	Low	205 Å²	205	149.7 Å²	149.7	96%	0.958	78%	0.781	S	S	*	*			trans	-111.5	64.5	158.2	-78.2	-162	136	0	0	109.4
172	A	57.5	Low	65.9	Low	93 Å²	93	153.5 Å²	153.5	77%	0.769	81%	0.813	S	S	*	*			trans	-133.8	73.3	162.8	0	0	0	0	0	109.1
173	Q	50.3	Low	64	Low	273 Å²	273	158.6 Å²	158.6	100%	1.276	84%	0.841	S	S	*	*			trans	-141.7	0	157.7	-93.9	-171.5	-32.1	0	0	111.1

Retrieved 173 of 173 residues in 168.7 ms (Link to these results)

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