A0A060Y1E9_ONCMY Loading...

HESX homeobox 1

AlphaFold DB , UniProt , Accession A0A060Y1E9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene hesx1, Length 176 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	42.1	Very low	45.1	Very low	243 Å²	243	146.9 Å²	146.9	100%	1.197	82%	0.818	S	S	*	*				0	103.3	0	-67.2	175.3	-172	0	0	106.9
2	A	39.8	Very low	44.9	Very low	100 Å²	100	149.9 Å²	149.9	83%	0.826	82%	0.821	S	S	*	*			trans	-82.7	127.4	-179.7	0	0	0	0	0	108.9	S4	A2-S4 PolarHBondContact O-N 3.17Å
3	I	48.4	Very low	45.2	Very low	164 Å²	164	147.7 Å²	147.7	84%	0.841	81%	0.814	S	S	*	*			trans	-84	103.9	176.9	-41.5	173.9	0	0	0	106.2	T5	I3-T5 PolarHBondContact O-N 2.66Å
4	S	42.1	Very low	45.6	Very low	109 Å²	109	147.9 Å²	147.9	76%	0.762	81%	0.814	S	S	*	*			trans	-71.7	107	176.3	-63.2	0	0	0	0	109.8	A2 V6	A2-S4 PolarHBondContact O-N 3.17Å; S4-V6 PolarHBondContact O-N 3.49Å
5	T	53.3	Low	46.5	Very low	135 Å²	135	144.3 Å²	144.3	83%	0.828	81%	0.811	S	S	*	*			trans	-70.1	108.3	168.9	-57	0	0	0	0	109	I3 S7	I3-T5 PolarHBondContact O-N 2.66Å; T5-S7 PolarHBondContact O-N 3.05Å
6	V	51.2	Low	47.4	Very low	137 Å²	137	143.6 Å²	143.6	83%	0.83	79%	0.791	S	S	*	*			trans	-71.7	103	167.4	-84.6	0	0	0	0	109	S4 C8	S4-V6 PolarHBondContact O-N 3.49Å; V6-C8 PolarHBondContact O-N 3.43Å; V6-C8 VanDerWaalsContact O-N 3.16Å
7	S	49	Very low	48.6	Very low	93 Å²	93	140.2 Å²	140.2	65%	0.65	78%	0.778	S	S	*	*			trans	-68.1	106	168.4	-176.3	0	0	0	0	108.8	T5 Q9	T5-S7 PolarHBondContact O-N 3.05Å; S7-Q9 PolarHBondContact O-N 3.46Å; S7-Q9 PolarHBondContact OG-OE1 3.46Å; S7-Q9 VanDerWaalsContact OG-OE1 3.07Å
8	C	40.2	Very low	49.5	Very low	111 Å²	111	137.7 Å²	137.7	75%	0.75	77%	0.767	S	S	*	*			trans	-78.4	100.1	171.1	-173.3	0	0	0	0	108.3	V6 I10	V6-C8 PolarHBondContact O-N 3.43Å; V6-C8 VanDerWaalsContact O-N 3.16Å; C8-I10 VanDerWaalsContact C-N 3.33Å; C8-I10 PolarHBondContact O-N 3.02Å
9	Q	45.7	Very low	50.1	Low	152 Å²	152	139.3 Å²	139.3	71%	0.71	77%	0.765	S	S	*	*			trans	-67.5	92	169.8	-116.4	75	-2.5	0	0	109	S7 R11	S7-Q9 PolarHBondContact O-N 3.46Å; S7-Q9 PolarHBondContact OG-OE1 3.46Å; S7-Q9 VanDerWaalsContact OG-OE1 3.07Å; Q9-R11 PolarHBondContact O-N 3Å
10	I	42.3	Very low	51.5	Low	146 Å²	146	134.5 Å²	134.5	75%	0.749	74%	0.74	S	S	*	*			trans	-65.3	106.1	164.4	-65.4	173	0	0	0	106.4	C8 Q12	C8-I10 VanDerWaalsContact C-N 3.33Å; C8-I10 PolarHBondContact O-N 3.02Å; I10-Q12 PolarHBondContact O-N 3.32Å
11	R	42.3	Very low	52.6	Low	226 Å²	226	133.9 Å²	133.9	85%	0.853	74%	0.735	S	S	*	*			trans	-61.8	107.4	166.6	-69.6	-176.7	174.2	-174.3	-2.2	107.1	Q9 V13	Q9-R11 PolarHBondContact O-N 3Å; R11-V13 VanDerWaalsContact C-N 3.25Å; R11-V13 HydrophobicContact CB-CG2 4.46Å; R11-V13 PolarHBondContact O-N 3.43Å
12	Q	42.8	Very low	54.2	Low	183 Å²	183	126.3 Å²	126.3	86%	0.855	70%	0.699	S	S	*	*			trans	-61.8	94.6	161.7	-82.1	179.1	-37.9	0	0	107.1	I10	I10-Q12 PolarHBondContact O-N 3.32Å
13	V	48.1	Very low	55.8	Low	121 Å²	121	127.6 Å²	127.6	73%	0.733	68%	0.683	S	S	*	*			trans	-87	116.4	159.5	-153.4	0	0	0	0	104	R11 A15	R11-V13 VanDerWaalsContact C-N 3.25Å; R11-V13 HydrophobicContact CB-CG2 4.46Å; R11-V13 PolarHBondContact O-N 3.43Å; V13-A15 PolarHBondContact O-N 3.27Å
14	D	51	Low	57.1	Low	151 Å²	151	125.4 Å²	125.4	81%	0.807	67%	0.671	S	S	*	*			trans	-57.1	86.7	177.9	-70.2	-48.2	0	0	0	110.1	R16	D14-R16 PolarHBondContact O-N 3.02Å
15	A	59	Low	58.7	Low	93 Å²	93	125 Å²	125	77%	0.769	66%	0.66	S	S	*	*			trans	-78.1	75.3	178.4	0	0	0	0	0	108.2	V13	V13-A15 PolarHBondContact O-N 3.27Å
16	R	60.9	Low	59.4	Low	133 Å²	133	121.6 Å²	121.6	50%	0.502	65%	0.652	S	S	.	*			trans	-57.9	125.2	165	-70.3	-160.1	-177.5	170.1	13.5	107.6	D14 V18 D28 D30	D14-R16 PolarHBondContact O-N 3.02Å; R16-V18 PolarHBondContact O-N 3.37Å; R16-D28 IonicContact NH1-OD1 3.85Å; R16-D28 PolarHBondContact NH1-OD1 3.35Å; R16-D30 IonicContact CZ-OD2 2.76Å; R16-D30 VanDerWaalsContact CZ-OD2 3.3Å; R16-D30 IonicContact NH1-OD2 3.91Å; R16-D30 PolarHBondContact NH1-OD2 3.33Å; R16-D30 IonicContact NH2-OD2 3.14Å; R16-D30 PolarHBondContact NH2-OD2 3.08Å
17	P	67.2	Low	60.2	Low	87 Å²	87	118 Å²	118	57%	0.565	63%	0.628	S	S	*	*			trans	-56.8	126	-174.5	11.2	-19.9	0	0	0	110.3	F19 T20	P17-F19 PolarHBondContact O-N 3.21Å; P17-T20 HydrophobicContact CB-CG2 4.39Å; P17-T20 HydrophobicContact CG-CG2 3.84Å; P17-T20 PolarHBondContact O-N 3.43Å
18	V	65.8	Low	61.1	Low	95 Å²	95	116.7 Å²	116.7	58%	0.576	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-20.1	-174.9	173.6	0	0	0	0	112.7	R16	R16-V18 PolarHBondContact O-N 3.37Å
19	F	59.8	Low	62.1	Low	168 Å²	168	117 Å²	117	74%	0.737	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	38.7	-173.7	-62.7	-78.4	0	0	0	113.4	P17	P17-F19 PolarHBondContact O-N 3.21Å
20	T	79.1	Confident	62.6	Low	42 Å²	42	115.7 Å²	115.7	26%	0.258	61%	0.605	S	S	.	*			trans	-69.8	143.4	165.2	51.1	0	0	0	0	109.8	P17 D22 R23 I24	P17-T20 HydrophobicContact CB-CG2 4.39Å; P17-T20 HydrophobicContact CG-CG2 3.84Å; P17-T20 PolarHBondContact O-N 3.43Å; T20-D22 PolarHBondContact O-N 3.38Å; T20-R23 PolarHBondContact O-N 2.91Å; T20-R23 VanDerWaalsContact O-N 3.09Å; T20-R23 WeakPolarHBondContact OG1-CB 3.44Å; T20-R23 PolarHBondContact OG1-N 3.48Å; T20-I24 WeakPolarHBondContact O-CG1 3.42Å; T20-I24 PolarHBondContact O-N 3.32Å; T20-I24 VanDerWaalsContact O-N 3.07Å
21	I	74.2	Confident	62.9	Low	123 Å²	123	118.9 Å²	118.9	63%	0.631	61%	0.608	S	S	*	*	H	α-helix	trans	-55.4	-39.8	175.6	-65.3	172	0	0	0	109.2	R23 I24 L25	I21-R23 VanDerWaalsContact C-N 3.35Å; I21-R23 PolarHBondContact O-N 3.04Å; I21-I24 PolarHBondContact O-N 3.35Å; I21-L25 HydrophobicContact CG2-CD1 3.54Å; I21-L25 HydrophobicContact CG2-CG 4.11Å; I21-L25 VanDerWaalsContact O-CB 3.3Å; I21-L25 WeakPolarHBondContact O-CB 3.33Å; I21-L25 VanDerWaalsContact O-CG 3.22Å; I21-L25 WeakPolarHBondContact O-CG 3.42Å; I21-L25 PolarHBondContact O-N 2.68Å
22	D	76.6	Confident	63.1	Low	83 Å²	83	116.4 Å²	116.4	44%	0.444	61%	0.606	S	S	.	*	H	α-helix	trans	-63.2	-37.6	178.7	-55.4	-53.7	0	0	0	112.8	T20 L25 G26 L27	T20-D22 PolarHBondContact O-N 3.38Å; D22-L25 CarbonylContact O-C 3.52Å; D22-L25 PolarHBondContact O-N 3.5Å; D22-G26 CarbonylContact O-C 3.47Å; D22-G26 PolarHBondContact O-N 2.81Å; D22-L27 HydrophobicContact CB-CB 4.07Å; D22-L27 PolarHBondContact O-N 3.09Å
23	R	73.3	Confident	63.3	Low	128 Å²	128	114.2 Å²	114.2	48%	0.483	60%	0.596	S	S	.	*	H	α-helix	trans	-74.3	-34.9	177.7	-167.2	164.5	-176.7	167.9	1.9	112.9	T20 I21 L25 G26	T20-R23 PolarHBondContact O-N 2.91Å; T20-R23 VanDerWaalsContact O-N 3.09Å; T20-R23 WeakPolarHBondContact OG1-CB 3.44Å; T20-R23 PolarHBondContact OG1-N 3.48Å; I21-R23 VanDerWaalsContact C-N 3.35Å; I21-R23 PolarHBondContact O-N 3.04Å; R23-L25 VanDerWaalsContact C-N 3.35Å; R23-G26 PolarHBondContact O-N 3.46Å
24	I	74.7	Confident	63.5	Low	117 Å²	117	114.1 Å²	114.1	60%	0.6	59%	0.59	S	S	*	*	H	α-helix	trans	-68.7	-37.2	174	-63.6	166.8	0	0	0	110.7	T20 I21	T20-I24 WeakPolarHBondContact O-CG1 3.42Å; T20-I24 PolarHBondContact O-N 3.32Å; T20-I24 VanDerWaalsContact O-N 3.07Å; I21-I24 PolarHBondContact O-N 3.35Å
25	L	75.9	Confident	63.5	Low	100 Å²	100	116 Å²	116	52%	0.524	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.7	-2.9	178.4	-63	-179.1	0	0	0	113.5	I21 D22 R23 L27	I21-L25 HydrophobicContact CG2-CD1 3.54Å; I21-L25 HydrophobicContact CG2-CG 4.11Å; I21-L25 VanDerWaalsContact O-CB 3.3Å; I21-L25 WeakPolarHBondContact O-CB 3.33Å; I21-L25 VanDerWaalsContact O-CG 3.22Å; I21-L25 WeakPolarHBondContact O-CG 3.42Å; I21-L25 PolarHBondContact O-N 2.68Å; D22-L25 CarbonylContact O-C 3.52Å; D22-L25 PolarHBondContact O-N 3.5Å; R23-L25 VanDerWaalsContact C-N 3.35Å; L25-L27 VanDerWaalsContact C-N 3.31Å; L25-L27 HydrophobicContact CB-CD1 3.99Å; L25-L27 HydrophobicContact CB-CG 3.9Å; L25-L27 HydrophobicContact CD1-CD1 4.16Å; L25-L27 PolarHBondContact O-N 3.17Å
26	G	68.5	Low	63.1	Low	65 Å²	65	118.6 Å²	118.6	67%	0.67	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.5	23.2	-179.3	0	0	0	0	0	114.8	D22 R23	D22-G26 CarbonylContact O-C 3.47Å; D22-G26 PolarHBondContact O-N 2.81Å; R23-G26 PolarHBondContact O-N 3.46Å
27	L	68.6	Low	62.7	Low	60 Å²	60	116.4 Å²	116.4	31%	0.314	59%	0.588	S	S	.	*			trans	-88.6	-2.2	179.5	-56.4	176.8	0	0	0	113.6	D22 L25 L29	D22-L27 HydrophobicContact CB-CB 4.07Å; D22-L27 PolarHBondContact O-N 3.09Å; L25-L27 VanDerWaalsContact C-N 3.31Å; L25-L27 HydrophobicContact CB-CD1 3.99Å; L25-L27 HydrophobicContact CB-CG 3.9Å; L25-L27 HydrophobicContact CD1-CD1 4.16Å; L25-L27 PolarHBondContact O-N 3.17Å; L27-L29 VanDerWaalsContact C-N 3.28Å; L27-L29 PolarHBondContact O-N 2.88Å
28	D	65.9	Low	61.9	Low	67 Å²	67	117.6 Å²	117.6	36%	0.358	60%	0.599	S	S	.	*			trans	-70	83.5	177.1	-129.8	-22.1	0	0	0	109.5	R16 D30	R16-D28 IonicContact NH1-OD1 3.85Å; R16-D28 PolarHBondContact NH1-OD1 3.35Å; D28-D30 VanDerWaalsContact C-N 3.29Å; D28-D30 PolarHBondContact O-N 2.84Å
29	L	62.2	Low	61.3	Low	116 Å²	116	118.8 Å²	118.8	61%	0.607	60%	0.601	S	S	*	*			trans	-81.3	63.1	-177.2	-79.5	148.4	0	0	0	111.4	L27 R31	L27-L29 VanDerWaalsContact C-N 3.28Å; L27-L29 PolarHBondContact O-N 2.88Å; L29-R31 PolarHBondContact O-N 3.47Å
30	D	56.3	Low	61.2	Low	126 Å²	126	120.1 Å²	120.1	67%	0.674	61%	0.606	S	S	*	*			trans	-87.6	50.8	163.5	-97.2	-30.7	0	0	0	111.2	R16 D28	R16-D30 IonicContact CZ-OD2 2.76Å; R16-D30 VanDerWaalsContact CZ-OD2 3.3Å; R16-D30 IonicContact NH1-OD2 3.91Å; R16-D30 PolarHBondContact NH1-OD2 3.33Å; R16-D30 IonicContact NH2-OD2 3.14Å; R16-D30 PolarHBondContact NH2-OD2 3.08Å; D28-D30 VanDerWaalsContact C-N 3.29Å; D28-D30 PolarHBondContact O-N 2.84Å
31	R	47.9	Very low	60.1	Low	212 Å²	212	122.5 Å²	122.5	80%	0.8	62%	0.617	S	S	*	*	S	Bend	trans	-131.9	101.8	160.7	-171.4	175.6	-78.2	-106.9	1.7	107.9	L29 E33	L29-R31 PolarHBondContact O-N 3.47Å; R31-E33 PolarHBondContact O-N 3.23Å
32	Q	47.5	Very low	59.2	Low	175 Å²	175	125 Å²	125	82%	0.818	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	61.9	178.6	-170	171.4	27.7	0	0	112.1
33	E	47.7	Very low	58.9	Low	137 Å²	137	127 Å²	127	64%	0.64	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.5	24.6	172.4	-92.7	-41.5	115.3	0	0	114.3	R31 R35	R31-E33 PolarHBondContact O-N 3.23Å; E33-R35 IonicContact OE1-NH1 3.53Å; E33-R35 PolarHBondContact OE1-NH1 3.33Å; E33-R35 VanDerWaalsContact OE1-NH1 3.14Å
34	L	52.3	Low	58.3	Low	118 Å²	118	123.8 Å²	123.8	62%	0.618	62%	0.617	S	S	*	*			trans	-136.7	33.5	171.1	-72.8	175.4	0	0	0	113.8	N36 V37	L34-N36 PolarHBondContact O-N 3.46Å; L34-V37 HydrophobicContact CD2-CG2 4.18Å; L34-V37 PolarHBondContact O-N 2.86Å
35	R	49.9	Very low	57.1	Low	192 Å²	192	127.3 Å²	127.3	73%	0.725	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	4.4	179.4	51.7	-162.5	-157.9	-98.7	-0.8	115.7	E33	E33-R35 IonicContact OE1-NH1 3.53Å; E33-R35 PolarHBondContact OE1-NH1 3.33Å; E33-R35 VanDerWaalsContact OE1-NH1 3.14Å
36	N	51	Low	56.5	Low	147 Å²	147	127 Å²	127	79%	0.786	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.6	10.7	-173.4	-55.8	7.3	0	0	0	114.7	L34	L34-N36 PolarHBondContact O-N 3.46Å
37	V	51.5	Low	55.6	Low	87 Å²	87	130.2 Å²	130.2	53%	0.527	62%	0.623	S	S	.	*			trans	-109.2	101.8	176.1	-174.8	0	0	0	0	109.3	L34 L39	L34-V37 HydrophobicContact CD2-CG2 4.18Å; L34-V37 PolarHBondContact O-N 2.86Å; V37-L39 VanDerWaalsContact C-N 3.28Å; V37-L39 HydrophobicContact CG1-CD2 3.95Å; V37-L39 HydrophobicContact CG1-CG 4.36Å; V37-L39 PolarHBondContact O-N 2.97Å
38	S	51.8	Low	54.7	Low	112 Å²	112	134.8 Å²	134.8	78%	0.783	65%	0.647	S	S	*	*			trans	-66.1	91.8	168	-173.5	0	0	0	0	108.4	K40	S38-K40 VanDerWaalsContact C-N 3.33Å; S38-K40 PolarHBondContact O-N 3.02Å
39	L	53.4	Low	53.6	Low	120 Å²	120	139.7 Å²	139.7	63%	0.628	67%	0.668	S	S	*	*			trans	-67.7	95.6	171.2	-67.3	175.4	0	0	0	107.3	V37 L41	V37-L39 VanDerWaalsContact C-N 3.28Å; V37-L39 HydrophobicContact CG1-CD2 3.95Å; V37-L39 HydrophobicContact CG1-CG 4.36Å; V37-L39 PolarHBondContact O-N 2.97Å; L39-L41 VanDerWaalsContact C-N 3.34Å; L39-L41 PolarHBondContact O-N 2.87Å
40	K	57.3	Low	52.4	Low	195 Å²	195	139.6 Å²	139.6	85%	0.848	67%	0.672	S	S	*	*			trans	-61.3	98.4	169.1	-75.9	-173.4	176.3	176.1	0	108.1	S38 Y42	S38-K40 VanDerWaalsContact C-N 3.33Å; S38-K40 PolarHBondContact O-N 3.02Å; K40-Y42 PolarHBondContact O-N 2.69Å
41	L	54.7	Low	51.3	Low	92 Å²	92	139.8 Å²	139.8	48%	0.482	68%	0.678	S	S	.	*			trans	-61	110.2	169.2	-94.1	84.4	0	0	0	108.2	L39 R43	L39-L41 VanDerWaalsContact C-N 3.34Å; L39-L41 PolarHBondContact O-N 2.87Å; L41-R43 PolarHBondContact O-N 3.49Å; L41-R43 VanDerWaalsContact O-N 3.1Å
42	Y	56.6	Low	51.1	Low	177 Å²	177	137.4 Å²	137.4	69%	0.694	67%	0.674	S	S	*	*			trans	-65.2	110.4	173.5	-175.9	-115.1	0	0	0	109.5	K40 P44	K40-Y42 PolarHBondContact O-N 2.69Å; Y42-P44 HydrophobicContact CD1-CG 4.03Å; Y42-P44 HydrophobicContact CE1-CB 3.77Å; Y42-P44 HydrophobicContact CE1-CG 3.57Å; Y42-P44 HydrophobicContact CE2-CB 4.37Å
43	R	69.9	Low	50.3	Low	123 Å²	123	137.9 Å²	137.9	46%	0.464	68%	0.676	S	S	.	*			trans	-120.9	83.6	175.3	-68.6	-172.6	-177.8	-110.5	0.8	108.7	L41 W45 T46	L41-R43 PolarHBondContact O-N 3.49Å; L41-R43 VanDerWaalsContact O-N 3.1Å; R43-W45 HydrophobicContact CG-CZ2 4.37Å; R43-W45 PolarHBondContact O-N 2.77Å; R43-T46 WeakPolarHBondContact CB-OG1 3.41Å; R43-T46 PolarHBondContact O-N 2.87Å; R43-T46 VanDerWaalsContact O-N 3.11Å; R43-T46 PolarHBondContact O-OG1 3.02Å
44	P	60.3	Low	49.5	Very low	62 Å²	62	139.9 Å²	139.9	40%	0.403	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.3	-9.8	-171.5	19.1	-28.4	0	0	0	114.9	Y42	Y42-P44 HydrophobicContact CD1-CG 4.03Å; Y42-P44 HydrophobicContact CE1-CB 3.77Å; Y42-P44 HydrophobicContact CE1-CG 3.57Å; Y42-P44 HydrophobicContact CE2-CB 4.37Å
45	W	49.2	Very low	48.7	Very low	190 Å²	190	139.7 Å²	139.7	72%	0.72	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	5.7	177.8	58.4	80.2	0	0	0	113.9	R43	R43-W45 HydrophobicContact CG-CZ2 4.37Å; R43-W45 PolarHBondContact O-N 2.77Å
46	T	63.4	Low	47.6	Very low	94 Å²	94	136.2 Å²	136.2	58%	0.577	68%	0.678	S	S	*	*	S	Bend	trans	-112.2	0.5	178.9	30	0	0	0	0	114.4	R43 L48	R43-T46 WeakPolarHBondContact CB-OG1 3.41Å; R43-T46 PolarHBondContact O-N 2.87Å; R43-T46 VanDerWaalsContact O-N 3.11Å; R43-T46 PolarHBondContact O-OG1 3.02Å; T46-L48 PolarHBondContact O-N 3.23Å; T46-L48 VanDerWaalsContact O-N 3.14Å
47	E	50.7	Low	46.6	Very low	133 Å²	133	137.2 Å²	137.2	62%	0.621	68%	0.681	S	S	*	*			trans	-78.2	99.8	179	-77.1	176.4	178.1	0	0	111.2
48	L	48.8	Very low	45.6	Very low	156 Å²	156	138 Å²	138	82%	0.817	69%	0.686	S	S	*	*			trans	-85.9	99.1	158	-160	81	0	0	0	106.7	T46 T50	T46-L48 PolarHBondContact O-N 3.23Å; T46-L48 VanDerWaalsContact O-N 3.14Å; L48-T50 PolarHBondContact O-N 2.83Å
49	E	43.2	Very low	44.7	Very low	169 Å²	169	139.3 Å²	139.3	79%	0.79	69%	0.689	S	S	*	*			trans	-57.3	104.6	178.2	-76.1	-91.8	169.4	0	0	111.5
50	T	37.2	Very low	43.6	Very low	115 Å²	115	143.2 Å²	143.2	71%	0.706	70%	0.701	S	S	*	*			trans	-107.5	112.7	165.2	55.8	0	0	0	0	110.6	L48	L48-T50 PolarHBondContact O-N 2.83Å
51	T	32.3	Very low	42.3	Very low	130 Å²	130	137.7 Å²	137.7	80%	0.798	70%	0.7	S	S	*	*			trans	74.6	94.4	148.2	-64.8	0	0	0	0	120.1
52	K	43.4	Very low	41	Very low	162 Å²	162	139 Å²	139	70%	0.704	72%	0.716	S	S	*	*				40.1	115.1	114.4	-166.7	178	-173.8	177.6	0	121.3
53	Q	32	Very low	40.2	Very low	184 Å²	184	135.3 Å²	135.3	86%	0.86	71%	0.714	S	S	*	*			trans	-153.9	90.2	136.9	-74.1	-61	-70.7	0	0	108.8
54	R	30.6	Very low	38.1	Very low	180 Å²	180	138.8 Å²	138.8	68%	0.679	73%	0.733	S	S	*	*				48.1	112.1	103.4	-166.7	159	-163.9	157.1	5.9	119	H56	R54-H56 PolarHBondContact NH2-CD2 2.93Å; R54-H56 PolarHBondContact NH2-NE2 3.35Å
55	S	35	Very low	36.4	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	75%	0.751	S	S	*	*				-173.2	103.1	124.8	50.6	0	0	0	0	110.1
56	H	27.6	Very low	35.3	Very low	120 Å²	120	137.3 Å²	137.3	56%	0.556	75%	0.752	S	S	*	*				59	105	100.9	-105.9	-89.9	0	0	0	117	R54	R54-H56 PolarHBondContact NH2-CD2 2.93Å; R54-H56 PolarHBondContact NH2-NE2 3.35Å
57	I	30.3	Very low	33.5	Very low	168 Å²	168	137.7 Å²	137.7	86%	0.862	76%	0.759	S	S	*	*				-140.5	120.8	128.8	-56.9	-176.6	0	0	0	108.4
58	T	30.8	Very low	32.6	Very low	103 Å²	103	139.7 Å²	139.7	63%	0.632	77%	0.768	S	S	*	*			trans	-93.7	131.1	174.3	5	0	0	0	0	109.1
59	V	32.5	Very low	31.8	Very low	139 Å²	139	139.9 Å²	139.9	84%	0.842	77%	0.769	S	S	*	*			trans	-142.5	126	147.3	-175.1	0	0	0	0	108.7
60	K	30.8	Very low	31.3	Very low	203 Å²	203	140.9 Å²	140.9	88%	0.883	77%	0.77	S	S	*	*			trans	-79.6	156	178.9	-65.1	-164.3	176.1	-173.6	0	111.5
61	G	28.4	Very low	30.9	Very low	79 Å²	79	146 Å²	146	81%	0.814	78%	0.777	S	S	*	*			trans	143.9	107.4	150.2	0	0	0	0	0	115.4
62	S	29	Very low	30.7	Very low	118 Å²	118	148.8 Å²	148.8	83%	0.825	78%	0.778	S	S	*	*			trans	-115	169.5	153.5	-134	0	0	0	0	106
63	P	39.7	Very low	30.5	Very low	101 Å²	101	150.3 Å²	150.3	66%	0.656	79%	0.788	S	S	*	*			cis	-145.8	-175.3	5.2	34.1	-9.5	0	0	0	115.7
64	K	25.1	Very low	30.6	Very low	196 Å²	196	150.4 Å²	150.4	85%	0.852	79%	0.788	S	S	*	*			trans	98.6	118.4	148.9	-65.4	-177.9	-175.2	177.9	0	122.1
65	S	24.8	Very low	31	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	79%	0.79	S	S	*	*				88.2	120.8	121.3	-157.7	0	0	0	0	122.6
66	S	25.7	Very low	31	Very low	107 Å²	107	151.6 Å²	151.6	75%	0.748	79%	0.789	S	S	*	*			trans	87.5	144.5	138.5	-147.4	0	0	0	0	122.4
67	S	26.6	Very low	31.7	Very low	103 Å²	103	153.7 Å²	153.7	72%	0.72	80%	0.796	S	S	*	*			trans	89.3	118.1	153.1	59.1	0	0	0	0	120.6
68	E	31.2	Very low	32.1	Very low	174 Å²	174	151.9 Å²	151.9	81%	0.813	79%	0.787	S	S	*	*			trans	-19.4	143.5	154.9	-103.9	90.1	174.4	0	0	116.7
69	I	32.4	Very low	32.7	Very low	161 Å²	161	152.2 Å²	152.2	83%	0.826	79%	0.785	S	S	*	*				-168.5	123.7	115.7	-87.5	147.2	0	0	0	110.2
70	K	31.5	Very low	33.3	Very low	189 Å²	189	151.4 Å²	151.4	82%	0.822	78%	0.784	S	S	*	*			trans	-31.6	134.8	164.3	-156.5	171.3	-168.7	171	0	115.2
71	R	30.3	Very low	34.2	Very low	223 Å²	223	149.6 Å²	149.6	84%	0.842	78%	0.776	S	S	*	*				168.9	131.5	129.7	-91	154.9	-170	169.2	4.2	114.7
72	K	27.5	Very low	34.9	Very low	188 Å²	188	154.2 Å²	154.2	82%	0.817	78%	0.777	S	S	*	*			trans	73.4	120.6	146.8	-67.5	-174.4	173.8	-172.4	0	120.1
73	E	39.4	Very low	35.6	Very low	195 Å²	195	154.9 Å²	154.9	91%	0.911	77%	0.765	S	S	*	*			trans	-57.1	123.4	161.4	-65.7	165.9	139.7	0	0	110.6
74	E	34.3	Very low	36.4	Very low	185 Å²	185	153.5 Å²	153.5	86%	0.864	75%	0.754	S	S	*	*			trans	-141.8	133.9	157.6	-72.1	-167.6	172.7	0	0	110.3	H76	E74-H76 PolarHBondContact O-N 3.25Å
75	E	38.8	Very low	37.8	Very low	155 Å²	155	149.5 Å²	149.5	72%	0.724	74%	0.739	S	S	*	*			trans	-57.4	119	-173.4	-61.6	-175.3	114.9	0	0	113.2	K77	E75-K77 VanDerWaalsContact C-N 3.33Å; E75-K77 PolarHBondContact O-N 3.05Å; E75-K77 IonicContact OE1-NZ 2.98Å; E75-K77 PolarHBondContact OE1-NZ 3.4Å; E75-K77 VanDerWaalsContact OE1-NZ 3.1Å; E75-K77 IonicContact OE2-NZ 3.54Å
76	H	34.7	Very low	39.1	Very low	164 Å²	164	147.8 Å²	147.8	76%	0.759	73%	0.727	S	S	*	*			trans	-92.6	66.3	164	-149	-109.7	0	0	0	110.6	E74 L78	E74-H76 PolarHBondContact O-N 3.25Å; H76-L78 WeakPolarHBondContact CE1-CD1 3.28Å; H76-L78 VanDerWaalsContact CE1-CG 3.46Å; H76-L78 WeakPolarHBondContact CE1-CG 3.45Å; H76-L78 PolarHBondContact O-N 3.49Å
77	K	41.2	Very low	40.6	Very low	163 Å²	163	147.1 Å²	147.1	71%	0.709	71%	0.712	S	S	*	*			trans	-71.2	82.6	162.7	-89.8	175	-177.5	148.7	0	108.6	E75 N79	E75-K77 VanDerWaalsContact C-N 3.33Å; E75-K77 PolarHBondContact O-N 3.05Å; E75-K77 IonicContact OE1-NZ 2.98Å; E75-K77 PolarHBondContact OE1-NZ 3.4Å; E75-K77 VanDerWaalsContact OE1-NZ 3.1Å; E75-K77 IonicContact OE2-NZ 3.54Å; K77-N79 PolarHBondContact O-N 3.37Å
78	L	40.2	Very low	41.8	Very low	131 Å²	131	150 Å²	150	69%	0.686	71%	0.707	S	S	*	*			trans	-69.6	85.4	161.6	-91.6	169.4	0	0	0	109.4	H76 C80	H76-L78 WeakPolarHBondContact CE1-CD1 3.28Å; H76-L78 VanDerWaalsContact CE1-CG 3.46Å; H76-L78 WeakPolarHBondContact CE1-CG 3.45Å; H76-L78 PolarHBondContact O-N 3.49Å; L78-C80 PolarHBondContact O-N 3.09Å; L78-C80 VanDerWaalsContact O-N 3.1Å
79	N	43.7	Very low	42.9	Very low	109 Å²	109	150.5 Å²	150.5	58%	0.583	70%	0.701	S	S	*	*			trans	6.4	89.1	132.1	-169.2	38.6	0	0	0	115.6	K77 K81	K77-N79 PolarHBondContact O-N 3.37Å; N79-K81 WeakPolarHBondContact OD1-CB 3.44Å; N79-K81 WeakPolarHBondContact OD1-CD 3.31Å; N79-K81 WeakPolarHBondContact OD1-CG 3.36Å
80	C	44.4	Very low	44.3	Very low	122 Å²	122	146.8 Å²	146.8	82%	0.824	69%	0.686	S	S	*	*			trans	-105.7	65.8	153.5	-86.9	0	0	0	0	108.7	L78	L78-C80 PolarHBondContact O-N 3.09Å; L78-C80 VanDerWaalsContact O-N 3.1Å
81	K	49.8	Very low	45.7	Very low	165 Å²	165	141.5 Å²	141.5	72%	0.717	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	120	167.6	-71.9	176.3	-170.5	177	0	107.6	N79	N79-K81 WeakPolarHBondContact OD1-CB 3.44Å; N79-K81 WeakPolarHBondContact OD1-CD 3.31Å; N79-K81 WeakPolarHBondContact OD1-CG 3.36Å
82	H	43.3	Very low	47.1	Very low	177 Å²	177	136 Å²	136	82%	0.819	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.1	45.1	176.5	-49.4	-78.1	0	0	0	118.1	T84	H82-T84 PolarHBondContact O-N 3.11Å
83	F	42	Very low	48.8	Very low	131 Å²	131	133.1 Å²	133.1	58%	0.575	64%	0.638	S	S	*	*			trans	-75.4	99.8	149.3	-169.5	-103.8	0	0	0	107.6	E85 H87 R88 L91	F83-E85 PolarHBondContact O-N 2.98Å; F83-H87 HydrophobicContact CD1-CB 4.07Å; F83-H87 HydrophobicContact CD2-CB 4.45Å; F83-H87 HydrophobicContact CE1-CB 3.4Å; F83-H87 HydrophobicContact CE2-CB 3.83Å; F83-H87 HydrophobicContact CZ-CB 3.27Å; F83-H87 AromaticContact CZ-CG 3.97Å; F83-R88 HydrophobicContact CD1-CG 4.32Å; F83-R88 HydrophobicContact CE1-CG 4.19Å; F83-L91 HydrophobicContact CZ-CD1 4.49Å
84	T	57.9	Low	50.1	Low	72 Å²	72	130.3 Å²	130.3	44%	0.442	62%	0.62	S	S	.	*			trans	-56.2	138.3	-172	54.8	0	0	0	0	111.6	H82 S86 H87	H82-T84 PolarHBondContact O-N 3.11Å; T84-S86 PolarHBondContact O-N 3.26Å; T84-H87 PolarHBondContact O-N 3.39Å; T84-H87 PolarHBondContact OG1-ND1 2.81Å
85	E	54.5	Low	51.9	Low	113 Å²	113	127.4 Å²	127.4	53%	0.528	61%	0.609	S	S	.	*	H	α-helix	trans	-47.9	-25.7	174.1	-178.2	60.3	-164.6	0	0	113.2	F83 R88 R89	F83-E85 PolarHBondContact O-N 2.98Å; E85-R88 PolarHBondContact O-N 3.15Å; E85-R89 PolarHBondContact O-N 2.93Å
86	S	52.4	Low	53.4	Low	76 Å²	76	123.3 Å²	123.3	53%	0.531	61%	0.608	S	S	.	*	H	α-helix	trans	-59.3	-40.9	172.8	-168.4	0	0	0	0	113.6	T84 R88 R89 T90	T84-S86 PolarHBondContact O-N 3.26Å; S86-R88 VanDerWaalsContact C-N 3.33Å; S86-R88 PolarHBondContact O-N 3.09Å; S86-R89 PolarHBondContact O-N 3.21Å; S86-T90 PolarHBondContact O-N 3.24Å; S86-T90 VanDerWaalsContact O-N 3.17Å; S86-T90 PolarHBondContact O-OG1 2.79Å
87	H	56.4	Low	55.6	Low	93 Å²	93	123.3 Å²	123.3	43%	0.431	60%	0.602	S	S	.	*	H	α-helix	trans	-70.5	-27.9	178.2	-74.9	83.5	0	0	0	112.9	F83 T84 T90 L91	F83-H87 HydrophobicContact CD1-CB 4.07Å; F83-H87 HydrophobicContact CD2-CB 4.45Å; F83-H87 HydrophobicContact CE1-CB 3.4Å; F83-H87 HydrophobicContact CE2-CB 3.83Å; F83-H87 HydrophobicContact CZ-CB 3.27Å; F83-H87 AromaticContact CZ-CG 3.97Å; T84-H87 PolarHBondContact O-N 3.39Å; T84-H87 PolarHBondContact OG1-ND1 2.81Å; H87-T90 WeakPolarHBondContact CA-OG1 3.42Å; H87-T90 PolarHBondContact O-OG1 3.07Å; H87-T90 VanDerWaalsContact O-OG1 3.07Å; H87-L91 PolarHBondContact O-N 3.42Å
88	R	52.1	Low	57.4	Low	165 Å²	165	123.3 Å²	123.3	62%	0.623	60%	0.597	S	S	*	*	H	α-helix	trans	-68.6	-36.8	173	-67.5	-175.2	69.7	126.3	-0.1	111.4	F83 E85 S86 N92	F83-R88 HydrophobicContact CD1-CG 4.32Å; F83-R88 HydrophobicContact CE1-CG 4.19Å; E85-R88 PolarHBondContact O-N 3.15Å; S86-R88 VanDerWaalsContact C-N 3.33Å; S86-R88 PolarHBondContact O-N 3.09Å; R88-N92 PolarHBondContact O-N 3Å
89	R	54.4	Low	59.5	Low	183 Å²	183	121.9 Å²	121.9	69%	0.691	60%	0.596	S	S	*	*	H	α-helix	trans	-68.2	-40.2	176.1	-75.1	-177.8	157.8	122.5	-4.1	112.8	E85 S86 N92	E85-R89 PolarHBondContact O-N 2.93Å; S86-R89 PolarHBondContact O-N 3.21Å; R89-N92 WeakPolarHBondContact O-CB 3.49Å; R89-N92 PolarHBondContact O-N 3.4Å
90	T	62	Low	61.6	Low	83 Å²	83	128 Å²	128	51%	0.509	61%	0.611	S	S	.	*	H	α-helix	trans	-72	-27.7	-179.9	51.7	0	0	0	0	113.5	S86 H87	S86-T90 PolarHBondContact O-N 3.24Å; S86-T90 VanDerWaalsContact O-N 3.17Å; S86-T90 PolarHBondContact O-OG1 2.79Å; H87-T90 WeakPolarHBondContact CA-OG1 3.42Å; H87-T90 PolarHBondContact O-OG1 3.07Å; H87-T90 VanDerWaalsContact O-OG1 3.07Å
91	L	59.7	Low	63.8	Low	79 Å²	79	124.6 Å²	124.6	41%	0.414	59%	0.586	S	S	.	*	H	α-helix	trans	-85.2	-8.9	173.6	-68	172.9	0	0	0	113.7	F83 H87 W93 Y94 I95	F83-L91 HydrophobicContact CZ-CD1 4.49Å; H87-L91 PolarHBondContact O-N 3.42Å; L91-W93 PolarHBondContact O-N 3.34Å; L91-W93 VanDerWaalsContact O-N 3.15Å; L91-Y94 HydrophobicContact CD2-CD2 4.11Å; L91-Y94 WeakPolarHBondContact O-CB 3.41Å; L91-Y94 PolarHBondContact O-N 3.29Å; L91-I95 HydrophobicContact CB-CD1 3.99Å; L91-I95 WeakPolarHBondContact O-CG1 3.41Å; L91-I95 PolarHBondContact O-N 3.4Å; L91-I95 VanDerWaalsContact O-N 3.12Å
92	N	60.7	Low	65.9	Low	108 Å²	108	121.2 Å²	121.2	58%	0.578	59%	0.589	S	S	*	*	H	α-helix	trans	-64.1	-24.5	-175.6	-153.8	22.7	0	0	0	113	R88 R89 Y94	R88-N92 PolarHBondContact O-N 3Å; R89-N92 WeakPolarHBondContact O-CB 3.49Å; R89-N92 PolarHBondContact O-N 3.4Å; N92-Y94 VanDerWaalsContact C-N 3.27Å; N92-Y94 PolarHBondContact O-N 2.97Å
93	W	63.3	Low	68.4	Low	126 Å²	126	115.4 Å²	115.4	48%	0.477	56%	0.561	S	S	.	*	H	α-helix	trans	-67.1	-30.9	173.3	84.7	-106	0	0	0	112.6	L91 R97	L91-W93 PolarHBondContact O-N 3.34Å; L91-W93 VanDerWaalsContact O-N 3.15Å; W93-R97 VanDerWaalsContact CE3-NE 3.3Å; W93-R97 VanDerWaalsContact CZ3-CZ 3.48Å; W93-R97 VanDerWaalsContact CZ3-NE 3.33Å
94	Y	66.4	Low	71.1	Confident	137 Å²	137	112 Å²	112	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-82	-35.7	178	-73.2	-77.8	0	0	0	112.1	L91 N92 G96 R97	L91-Y94 HydrophobicContact CD2-CD2 4.11Å; L91-Y94 WeakPolarHBondContact O-CB 3.41Å; L91-Y94 PolarHBondContact O-N 3.29Å; N92-Y94 VanDerWaalsContact C-N 3.27Å; N92-Y94 PolarHBondContact O-N 2.97Å; Y94-G96 PolarHBondContact O-N 3.43Å; Y94-R97 PolarHBondContact O-N 2.91Å
95	I	71.4	Confident	73	Confident	123 Å²	123	112.4 Å²	112.4	63%	0.631	56%	0.56	S	S	*	*	H	α-helix	trans	-67.3	-23	-171.6	-67.5	162.5	0	0	0	112.6	L91	L91-I95 HydrophobicContact CB-CD1 3.99Å; L91-I95 WeakPolarHBondContact O-CG1 3.41Å; L91-I95 PolarHBondContact O-N 3.4Å; L91-I95 VanDerWaalsContact O-N 3.12Å
96	G	71.4	Confident	75	Confident	69 Å²	69	109.9 Å²	109.9	71%	0.711	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-0.3	177.7	0	0	0	0	0	115.8	Y94	Y94-G96 PolarHBondContact O-N 3.43Å
97	R	79.6	Confident	77.2	Confident	164 Å²	164	108 Å²	108	62%	0.619	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-83.3	127.9	-178	-80.2	-174.2	-177.1	-142.7	8.5	110.8	W93 Y94	W93-R97 VanDerWaalsContact CE3-NE 3.3Å; W93-R97 VanDerWaalsContact CZ3-CZ 3.48Å; W93-R97 VanDerWaalsContact CZ3-NE 3.33Å; Y94-R97 PolarHBondContact O-N 2.91Å
98	R	79.8	Confident	79.2	Confident	164 Å²	164	106.3 Å²	106.3	62%	0.619	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-55.4	139.5	168	-68.2	-172.1	-179.6	115	9.7	109.4	D138	R98-D138 IonicContact CZ-OD2 3.3Å; R98-D138 IonicContact NE-OD2 3.47Å; R98-D138 IonicContact NH1-OD1 3.1Å; R98-D138 IonicContact NH1-OD2 2.88Å; R98-D138 PolarHBondContact NH1-OD2 2.87Å
99	P	83.7	Confident	81.4	Confident	101 Å²	101	103.9 Å²	103.9	66%	0.656	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-57.2	147.2	176.4	23.7	-32.9	0	0	0	110.2	T101 R139	P99-T101 PolarHBondContact O-N 3.39Å; P99-R139 PolarHBondContact O-NH1 3.17Å; P99-R139 PolarHBondContact O-NH2 3.07Å; P99-R139 VanDerWaalsContact O-NH2 3.15Å
100	R	87.4	Confident	83.4	Confident	237 Å²	237	97.9 Å²	97.9	89%	0.894	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-66.9	130.5	177	-76.8	-169.6	168.3	94.6	-3.6	109.4
101	T	90.7	Very high	85.2	Confident	50 Å²	50	93.9 Å²	93.9	31%	0.307	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-92.7	129.6	171	-52.3	0	0	0	0	108.5	P99 F103 L135 R139	P99-T101 PolarHBondContact O-N 3.39Å; T101-F103 HydrophobicContact CG2-CD1 4.39Å; T101-F103 HydrophobicContact CG2-CE1 4.04Å; T101-F103 HydrophobicContact CG2-CZ 4.33Å; T101-L135 HydrophobicContact CG2-CD2 4.2Å; T101-R139 WeakPolarHBondContact OG1-CD 3.37Å; T101-R139 PolarHBondContact OG1-NE 3Å; T101-R139 PolarHBondContact OG1-NH1 3.15Å
102	A	94.1	Very high	87	Confident	94 Å²	94	94 Å²	94	78%	0.777	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-96.8	130.7	166.5	0	0	0	0	0	108.3
103	F	96.4	Very high	88.8	Confident	55 Å²	55	91.7 Å²	91.7	24%	0.241	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-94.9	143.5	176	-56.1	-76	0	0	0	109.4	T101 Q107 I108 L135 R139 W143	T101-F103 HydrophobicContact CG2-CD1 4.39Å; T101-F103 HydrophobicContact CG2-CE1 4.04Å; T101-F103 HydrophobicContact CG2-CZ 4.33Å; F103-Q107 HydrophobicContact CB-CB 4.42Å; F103-I108 HydrophobicContact CB-CD1 4.2Å; F103-I108 HydrophobicContact CB-CG1 3.8Å; F103-L135 HydrophobicContact CD1-CD1 3.71Å; F103-L135 HydrophobicContact CD1-CD2 4.21Å; F103-L135 HydrophobicContact CE1-CD1 3.69Å; F103-L135 HydrophobicContact CE1-CD2 4.12Å; F103-R139 HydrophobicContact CE1-CB 4.27Å; F103-R139 HydrophobicContact CZ-CB 4.26Å; F103-W143 AromaticContact CD2-CD1 3.76Å; F103-W143 HydrophobicContact CE2-CB 4.42Å; F103-W143 AromaticContact CE2-CD1 3.57Å; F103-W143 HydrophobicContact CE2-CG 4.39Å; F103-W143 HydrophobicContact CZ-CB 4.25Å
104	S	98.1	Very high	90.4	Very high	60 Å²	60	87.1 Å²	87.1	42%	0.42	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-72.6	162.8	170.7	82.2	0	0	0	0	111.2	A106 Q107 I108	S104-A106 VanDerWaalsContact C-N 3.34Å; S104-A106 PolarHBondContact O-N 2.91Å; S104-Q107 PolarHBondContact O-N 2.76Å; S104-Q107 WeakPolarHBondContact OG-CG 3.24Å; S104-Q107 PolarHBondContact OG-N 2.88Å; S104-I108 WeakPolarHBondContact O-CG1 3.42Å; S104-I108 PolarHBondContact O-N 3.03Å
105	S	97.6	Very high	92	Very high	81 Å²	81	81.2 Å²	81.2	57%	0.566	44%	0.443	S	S	*	.	H	α-helix	trans	-56.6	-48.2	175.7	-166.3	0	0	0	0	111.6	Q107 I108 E109	S105-Q107 VanDerWaalsContact C-N 3.29Å; S105-Q107 PolarHBondContact O-N 3.37Å; S105-I108 WeakPolarHBondContact O-CB 3.34Å; S105-I108 PolarHBondContact O-N 2.96Å; S105-E109 WeakPolarHBondContact O-CG 3.36Å; S105-E109 PolarHBondContact O-N 3.29Å; S105-E109 PolarHBondContact OG-OE1 3Å
106	A	97.6	Very high	93.2	Very high	60 Å²	60	82.6 Å²	82.6	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-59.6	-38.6	179.6	0	0	0	0	0	112.5	S104 E109 V110	S104-A106 VanDerWaalsContact C-N 3.34Å; S104-A106 PolarHBondContact O-N 2.91Å; A106-E109 PolarHBondContact O-N 3.21Å; A106-V110 WeakPolarHBondContact O-CG2 3.46Å; A106-V110 PolarHBondContact O-N 3.41Å
107	Q	98	Very high	94.5	Very high	36 Å²	36	86.6 Å²	86.6	17%	0.168	46%	0.455	C	S	.	.	H	α-helix	trans	-64.9	-42.4	174.9	-71.7	171.4	-29.3	0	0	111.5	F103 S104 S105 L111 L133	F103-Q107 HydrophobicContact CB-CB 4.42Å; S104-Q107 PolarHBondContact O-N 2.76Å; S104-Q107 WeakPolarHBondContact OG-CG 3.24Å; S104-Q107 PolarHBondContact OG-N 2.88Å; S105-Q107 VanDerWaalsContact C-N 3.29Å; S105-Q107 PolarHBondContact O-N 3.37Å; Q107-L111 WeakPolarHBondContact O-CD1 3.27Å; Q107-L111 WeakPolarHBondContact O-CG 3.46Å; Q107-L111 PolarHBondContact O-N 2.91Å; Q107-L111 VanDerWaalsContact O-N 3.09Å; Q107-L133 HydrophobicContact CG-CB 4.34Å; Q107-L133 HydrophobicContact CG-CD2 4.2Å; Q107-L133 PolarHBondContact NE2-O 2.91Å
108	I	98.2	Very high	95.3	Very high	57 Å²	57	81.6 Å²	81.6	29%	0.292	44%	0.44	S	S	.	.	H	α-helix	trans	-63.2	-44.9	178.1	-66.1	166.5	0	0	0	110.6	F103 S104 S105 V110 L111 E112 W143	F103-I108 HydrophobicContact CB-CD1 4.2Å; F103-I108 HydrophobicContact CB-CG1 3.8Å; S104-I108 WeakPolarHBondContact O-CG1 3.42Å; S104-I108 PolarHBondContact O-N 3.03Å; S105-I108 WeakPolarHBondContact O-CB 3.34Å; S105-I108 PolarHBondContact O-N 2.96Å; I108-V110 VanDerWaalsContact C-N 3.35Å; I108-V110 PolarHBondContact O-N 3.24Å; I108-L111 PolarHBondContact O-N 3.46Å; I108-L111 VanDerWaalsContact O-N 3.15Å; I108-E112 HydrophobicContact CG2-CG 4.08Å; I108-E112 WeakPolarHBondContact O-CB 3.36Å; I108-E112 WeakPolarHBondContact O-CG 3.41Å; I108-E112 PolarHBondContact O-N 2.89Å; I108-W143 HydrophobicContact CG2-CZ2 4.48Å
109	E	98.3	Very high	96.1	Very high	115 Å²	115	75.5 Å²	75.5	54%	0.537	42%	0.423	S	S	.	.	H	α-helix	trans	-57.8	-45.6	179.9	-72.9	162.2	-143.8	0	0	112	S105 A106 E112 S113	S105-E109 WeakPolarHBondContact O-CG 3.36Å; S105-E109 PolarHBondContact O-N 3.29Å; S105-E109 PolarHBondContact OG-OE1 3Å; A106-E109 PolarHBondContact O-N 3.21Å; E109-E112 PolarHBondContact O-N 3.43Å; E109-S113 PolarHBondContact O-N 3.05Å
110	V	98.1	Very high	96.8	Very high	56 Å²	56	78.6 Å²	78.6	34%	0.339	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-46.8	175.1	175.6	0	0	0	0	111	A106 I108 E112 S113 V114 L129 L133	A106-V110 WeakPolarHBondContact O-CG2 3.46Å; A106-V110 PolarHBondContact O-N 3.41Å; I108-V110 VanDerWaalsContact C-N 3.35Å; I108-V110 PolarHBondContact O-N 3.24Å; V110-E112 VanDerWaalsContact C-N 3.3Å; V110-E112 PolarHBondContact O-N 3.34Å; V110-S113 PolarHBondContact O-N 2.85Å; V110-S113 PolarHBondContact O-OG 3.43Å; V110-V114 PolarHBondContact O-N 2.79Å; V110-L129 HydrophobicContact CG1-CD2 4.06Å; V110-L133 HydrophobicContact CB-CD2 4.07Å; V110-L133 HydrophobicContact CG1-CD1 4.41Å; V110-L133 HydrophobicContact CG1-CD2 4.11Å; V110-L133 HydrophobicContact CG2-CD2 4.25Å
111	L	98.3	Very high	97.3	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-61.8	-38.6	178.7	-68.9	168.4	0	0	0	112.4	Q107 I108 V114 F115 L129 L133 I140 W143 F144	Q107-L111 WeakPolarHBondContact O-CD1 3.27Å; Q107-L111 WeakPolarHBondContact O-CG 3.46Å; Q107-L111 PolarHBondContact O-N 2.91Å; Q107-L111 VanDerWaalsContact O-N 3.09Å; I108-L111 PolarHBondContact O-N 3.46Å; I108-L111 VanDerWaalsContact O-N 3.15Å; L111-V114 PolarHBondContact O-N 3.34Å; L111-F115 WeakPolarHBondContact O-CB 3.49Å; L111-F115 PolarHBondContact O-N 3.24Å; L111-L129 HydrophobicContact CD2-CD1 4.33Å; L111-L133 HydrophobicContact CD1-CD1 4.27Å; L111-L133 HydrophobicContact CD2-CD1 3.81Å; L111-L133 HydrophobicContact CG-CD1 3.77Å; L111-I140 HydrophobicContact CD2-CD1 4.02Å; L111-I140 HydrophobicContact CD2-CG2 4.13Å; L111-W143 HydrophobicContact CB-CD2 4.08Å; L111-W143 HydrophobicContact CB-CE3 3.94Å; L111-W143 HydrophobicContact CB-CH2 3.59Å; L111-W143 HydrophobicContact CB-CZ2 3.71Å; L111-W143 HydrophobicContact CB-CZ3 3.71Å; L111-W143 HydrophobicContact CD1-CD2 3.87Å; L111-W143 HydrophobicContact CD1-CE3 4.38Å; L111-W143 HydrophobicContact CD1-CG 3.95Å; L111-W143 HydrophobicContact CG-CD2 4.46Å; L111-F144 HydrophobicContact CD2-CE2 3.86Å
112	E	98.4	Very high	97.6	Very high	80 Å²	80	67.1 Å²	67.1	37%	0.374	39%	0.387	S	S	.	.	H	α-helix	trans	-67.5	-41.7	176.2	-73.3	-166.6	156.5	0	0	112	I108 E109 V110 V114 F115 L116 W143 R147	I108-E112 HydrophobicContact CG2-CG 4.08Å; I108-E112 WeakPolarHBondContact O-CB 3.36Å; I108-E112 WeakPolarHBondContact O-CG 3.41Å; I108-E112 PolarHBondContact O-N 2.89Å; E109-E112 PolarHBondContact O-N 3.43Å; V110-E112 VanDerWaalsContact C-N 3.3Å; V110-E112 PolarHBondContact O-N 3.34Å; E112-V114 VanDerWaalsContact C-N 3.3Å; E112-V114 PolarHBondContact O-N 3.22Å; E112-F115 WeakPolarHBondContact O-CB 3.22Å; E112-F115 PolarHBondContact O-N 3.06Å; E112-F115 VanDerWaalsContact O-N 3.11Å; E112-L116 WeakPolarHBondContact O-CG 3.39Å; E112-L116 PolarHBondContact O-N 2.77Å; E112-W143 HydrophobicContact CG-CH2 3.82Å; E112-W143 HydrophobicContact CG-CZ2 3.91Å; E112-R147 IonicContact OE1-NE 2.83Å
113	S	98	Very high	97.8	Very high	60 Å²	60	66.9 Å²	66.9	42%	0.42	37%	0.371	S	S	.	.	H	α-helix	trans	-57.1	-43.3	175.6	76.8	0	0	0	0	112.1	E109 V110	E109-S113 PolarHBondContact O-N 3.05Å; V110-S113 PolarHBondContact O-N 2.85Å; V110-S113 PolarHBondContact O-OG 3.43Å
114	V	97.9	Very high	97.9	Very high	30 Å²	30	66.2 Å²	66.2	18%	0.182	38%	0.381	C	S	.	.	H	α-helix	trans	-69.5	-39.4	176.8	176.4	0	0	0	0	110.9	V110 L111 E112 L116 I117 N118 I125 L129 F144	V110-V114 PolarHBondContact O-N 2.79Å; L111-V114 PolarHBondContact O-N 3.34Å; E112-V114 VanDerWaalsContact C-N 3.3Å; E112-V114 PolarHBondContact O-N 3.22Å; V114-L116 VanDerWaalsContact C-N 3.27Å; V114-L116 PolarHBondContact O-N 2.88Å; V114-I117 PolarHBondContact O-N 3.37Å; V114-I117 VanDerWaalsContact O-N 3.09Å; V114-N118 PolarHBondContact O-N 3.4Å; V114-I125 HydrophobicContact CG1-CG2 4.41Å; V114-L129 HydrophobicContact CB-CD1 4.5Å; V114-L129 HydrophobicContact CG1-CD1 4.23Å; V114-L129 HydrophobicContact CG2-CD1 4.33Å; V114-L129 HydrophobicContact CG2-CD2 4.07Å; V114-F144 HydrophobicContact CB-CZ 4.28Å; V114-F144 HydrophobicContact CG1-CZ 4.01Å
115	F	98.3	Very high	97.9	Very high	13 Å²	13	66.8 Å²	66.8	6%	0.057	38%	0.378	C	S	.	.	H	α-helix	trans	-60.1	-36.3	179.8	-176	-91.5	0	0	0	113.2	L111 E112 I117 N118 S119 W143 F144 R147 R148 L151	L111-F115 WeakPolarHBondContact O-CB 3.49Å; L111-F115 PolarHBondContact O-N 3.24Å; E112-F115 WeakPolarHBondContact O-CB 3.22Å; E112-F115 PolarHBondContact O-N 3.06Å; E112-F115 VanDerWaalsContact O-N 3.11Å; F115-I117 VanDerWaalsContact C-N 3.27Å; F115-I117 PolarHBondContact O-N 3.34Å; F115-N118 CarbonylContact O-C 3.5Å; F115-S119 WeakPolarHBondContact CZ-OG 3.32Å; F115-S119 PolarHBondContact O-N 2.87Å; F115-S119 PolarHBondContact O-OG 3.15Å; F115-S119 VanDerWaalsContact O-OG 3.09Å; F115-W143 HydrophobicContact CB-CH2 4.45Å; F115-W143 HydrophobicContact CB-CZ3 4.27Å; F115-W143 HydrophobicContact CD2-CZ3 4.39Å; F115-F144 HydrophobicContact CB-CE1 4Å; F115-F144 AromaticContact CD2-CD1 3.73Å; F115-F144 HydrophobicContact CD2-CD1 3.73Å; F115-F144 AromaticContact CD2-CE1 3.86Å; F115-F144 HydrophobicContact CD2-CE1 3.86Å; F115-F144 HydrophobicContact CE2-CD1 4.46Å; F115-F144 HydrophobicContact CG-CE1 4.45Å; F115-R147 HydrophobicContact CD1-CG 4.11Å; F115-R147 HydrophobicContact CD2-CB 4.21Å; F115-R147 HydrophobicContact CD2-CG 3.71Å; F115-R147 HydrophobicContact CE1-CG 4.05Å; F115-R147 HydrophobicContact CE2-CB 4.02Å; F115-R147 HydrophobicContact CE2-CG 3.64Å; F115-R147 HydrophobicContact CG-CG 3.95Å; F115-R147 HydrophobicContact CZ-CG 3.83Å; F115-R148 HydrophobicContact CE2-CG 3.73Å; F115-R148 HydrophobicContact CZ-CG 4.08Å; F115-L151 HydrophobicContact CZ-CD2 4.32Å
116	L	97.5	Very high	98	Very high	152 Å²	152	64.9 Å²	64.9	80%	0.796	36%	0.358	S	S	*	.	H	α-helix	trans	-63.2	-34.1	176.1	-69	172.8	0	0	0	112.3	E112 V114	E112-L116 WeakPolarHBondContact O-CG 3.39Å; E112-L116 PolarHBondContact O-N 2.77Å; V114-L116 VanDerWaalsContact C-N 3.27Å; V114-L116 PolarHBondContact O-N 2.88Å
117	I	97.5	Very high	98	Very high	153 Å²	153	66.7 Å²	66.7	79%	0.785	36%	0.357	S	S	*	.	H	α-helix	trans	-83.9	-46.9	179.3	-57.3	166.6	0	0	0	110.4	V114 F115	V114-I117 PolarHBondContact O-N 3.37Å; V114-I117 VanDerWaalsContact O-N 3.09Å; F115-I117 VanDerWaalsContact C-N 3.27Å; F115-I117 PolarHBondContact O-N 3.34Å
118	N	96.9	Very high	98	Very high	60 Å²	60	69.1 Å²	69.1	32%	0.321	37%	0.368	S	S	.	.			trans	-143.2	106.4	-178.8	-176.6	-0.6	0	0	0	111.2	V114 F115 Y120	V114-N118 PolarHBondContact O-N 3.4Å; F115-N118 CarbonylContact O-C 3.5Å; N118-Y120 PolarHBondContact ND2-O 3.44Å; N118-Y120 PolarHBondContact O-N 2.94Å; N118-Y120 WeakPolarHBondContact OD1-CA 3.46Å; N118-Y120 PolarHBondContact OD1-N 3.27Å; N118-Y120 PolarHBondContact OD1-O 3.24Å
119	S	97.6	Very high	98	Very high	36 Å²	36	66.7 Å²	66.7	25%	0.252	36%	0.356	S	S	.	.	S	Bend	trans	-75.1	-8.9	177.6	-57.1	0	0	0	0	114.5	F115 R148	F115-S119 WeakPolarHBondContact CZ-OG 3.32Å; F115-S119 PolarHBondContact O-N 2.87Å; F115-S119 PolarHBondContact O-OG 3.15Å; F115-S119 VanDerWaalsContact O-OG 3.09Å; S119-R148 WeakPolarHBondContact O-CD 3.37Å; S119-R148 PolarHBondContact O-NH1 2.97Å
120	Y	98.2	Very high	98	Very high	166 Å²	166	61.7 Å²	61.7	65%	0.651	33%	0.334	S	S	*	.	S	Bend	trans	-130.2	66.2	179	-66.9	-95.9	0	0	0	110.9	N118 G122 R148	N118-Y120 PolarHBondContact ND2-O 3.44Å; N118-Y120 PolarHBondContact O-N 2.94Å; N118-Y120 WeakPolarHBondContact OD1-CA 3.46Å; N118-Y120 PolarHBondContact OD1-N 3.27Å; N118-Y120 PolarHBondContact OD1-O 3.24Å; Y120-G122 PolarHBondContact O-N 2.88Å; Y120-R148 VanDerWaalsContact CE1-NE 3.3Å
121	P	97.6	Very high	98	Very high	6 Å²	6	66.4 Å²	66.4	4%	0.039	35%	0.352	C	S	.	.			trans	-63.7	135	179.2	28.3	-35.8	0	0	0	111	I125 R126 F144	P121-I125 HydrophobicContact CB-CB 4.09Å; P121-I125 HydrophobicContact CB-CG2 3.88Å; P121-R126 HydrophobicContact CB-CG 4Å; P121-R126 HydrophobicContact CG-CG 3.88Å; P121-R126 PolarHBondContact O-NH1 3.44Å; P121-F144 HydrophobicContact CG-CD1 3.57Å; P121-F144 HydrophobicContact CG-CD2 3.9Å; P121-F144 HydrophobicContact CG-CE1 3.55Å; P121-F144 HydrophobicContact CG-CE2 3.89Å; P121-F144 HydrophobicContact CG-CG 3.78Å; P121-F144 HydrophobicContact CG-CZ 3.74Å
122	G	98.1	Very high	98	Very high	40 Å²	40	74.2 Å²	74.2	41%	0.412	38%	0.382	S	S	.	.			trans	-70.3	173.9	172.5	0	0	0	0	0	112.4	Y120 G124 I125 R126	Y120-G122 PolarHBondContact O-N 2.88Å; G122-G124 PolarHBondContact O-N 3.4Å; G122-I125 PolarHBondContact O-N 3.44Å; G122-R126 WeakPolarHBondContact O-CG 3.48Å; G122-R126 PolarHBondContact O-N 3.43Å
123	I	97.9	Very high	97.9	Very high	88 Å²	88	71.1 Å²	71.1	45%	0.451	37%	0.367	S	S	.	.	H	α-helix	trans	-56.3	-47.3	-174.8	-174.1	61.5	0	0	0	112.9	I125 R126 E127 E137	I123-I125 PolarHBondContact O-N 3.24Å; I123-R126 PolarHBondContact O-N 3.24Å; I123-E127 HydrophobicContact CD1-CG 4.23Å; I123-E127 HydrophobicContact CG1-CG 4.3Å; I123-E127 WeakPolarHBondContact O-CG 3.48Å; I123-E127 PolarHBondContact O-N 3.41Å; I123-E137 HydrophobicContact CD1-CG 3.91Å; I123-E137 VanDerWaalsContact CD1-OE1 3.28Å; I123-E137 WeakPolarHBondContact CD1-OE1 3.41Å
124	G	98.2	Very high	97.9	Very high	42 Å²	42	75.6 Å²	75.6	43%	0.433	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-39.5	-177.3	0	0	0	0	0	114	G122 R126 E127 E128	G122-G124 PolarHBondContact O-N 3.4Å; G124-R126 VanDerWaalsContact C-N 3.32Å; G124-R126 PolarHBondContact O-N 3.1Å; G124-E127 PolarHBondContact O-N 2.91Å; G124-E128 PolarHBondContact O-N 3.43Å
125	I	98.1	Very high	97.8	Very high	71 Å²	71	75.5 Å²	75.5	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-66.3	-38.9	175.9	-62.2	174.9	0	0	0	110.3	V114 P121 G122 I123 E128 L129	V114-I125 HydrophobicContact CG1-CG2 4.41Å; P121-I125 HydrophobicContact CB-CB 4.09Å; P121-I125 HydrophobicContact CB-CG2 3.88Å; G122-I125 PolarHBondContact O-N 3.44Å; I123-I125 PolarHBondContact O-N 3.24Å; I125-E128 PolarHBondContact O-N 2.92Å; I125-L129 HydrophobicContact CG2-CD1 4.21Å; I125-L129 WeakPolarHBondContact O-CG 3.37Å; I125-L129 PolarHBondContact O-N 3.12Å
126	R	98.5	Very high	97.7	Very high	41 Å²	41	80.7 Å²	80.7	16%	0.155	41%	0.405	C	S	.	.	H	α-helix	trans	-69	-36.5	178.8	-63.4	-170.6	-48.8	-108.1	6	111.7	P121 G122 I123 G124 L129 A130 E137 I140	P121-R126 HydrophobicContact CB-CG 4Å; P121-R126 HydrophobicContact CG-CG 3.88Å; P121-R126 PolarHBondContact O-NH1 3.44Å; G122-R126 WeakPolarHBondContact O-CG 3.48Å; G122-R126 PolarHBondContact O-N 3.43Å; I123-R126 PolarHBondContact O-N 3.24Å; G124-R126 VanDerWaalsContact C-N 3.32Å; G124-R126 PolarHBondContact O-N 3.1Å; R126-L129 PolarHBondContact O-N 3.3Å; R126-A130 VanDerWaalsContact O-CB 3.27Å; R126-A130 WeakPolarHBondContact O-CB 3.33Å; R126-A130 PolarHBondContact O-N 3.35Å; R126-E137 HydrophobicContact CB-CG 3.94Å; R126-E137 IonicContact CZ-OE1 2.69Å; R126-E137 IonicContact NE-OE1 3.73Å; R126-E137 PolarHBondContact NE-OE1 3.36Å; R126-E137 IonicContact NH2-OE1 3.21Å; R126-E137 PolarHBondContact NH2-OE1 2.95Å; R126-I140 HydrophobicContact CB-CG2 4.14Å; R126-I140 HydrophobicContact CG-CG2 4.1Å
127	E	98.5	Very high	97.7	Very high	99 Å²	99	75.6 Å²	75.6	46%	0.463	38%	0.377	S	S	.	.	H	α-helix	trans	-65.3	-42.5	173.9	-71.3	175	156.6	0	0	112	I123 G124 L129 A130 Q131 E137	I123-E127 HydrophobicContact CD1-CG 4.23Å; I123-E127 HydrophobicContact CG1-CG 4.3Å; I123-E127 WeakPolarHBondContact O-CG 3.48Å; I123-E127 PolarHBondContact O-N 3.41Å; G124-E127 PolarHBondContact O-N 2.91Å; E127-L129 VanDerWaalsContact C-N 3.34Å; E127-L129 PolarHBondContact O-N 3.3Å; E127-A130 WeakPolarHBondContact O-CB 3.5Å; E127-A130 PolarHBondContact O-N 3.43Å; E127-Q131 WeakPolarHBondContact O-CG 3.5Å; E127-Q131 PolarHBondContact O-N 3.08Å; E127-E137 HydrophobicContact CG-CG 4.18Å
128	E	98.3	Very high	97.7	Very high	87 Å²	87	70 Å²	70	41%	0.407	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-43.4	174.6	-173.4	-175.3	163.6	0	0	111.5	G124 I125 Q131 R132	G124-E128 PolarHBondContact O-N 3.43Å; I125-E128 PolarHBondContact O-N 2.92Å; E128-Q131 PolarHBondContact O-N 3.15Å; E128-R132 WeakPolarHBondContact O-CB 3.41Å; E128-R132 WeakPolarHBondContact O-CG 3.46Å; E128-R132 PolarHBondContact O-N 3.35Å; E128-R132 IonicContact OE1-CZ 2.96Å; E128-R132 IonicContact OE1-NE 4Å; E128-R132 IonicContact OE1-NH1 3.17Å; E128-R132 PolarHBondContact OE1-NH1 3.32Å; E128-R132 VanDerWaalsContact OE1-NH1 3.17Å; E128-R132 IonicContact OE1-NH2 2.66Å; E128-R132 PolarHBondContact OE1-NH2 2.96Å
129	L	98.1	Very high	97.7	Very high	6 Å²	6	68.8 Å²	68.8	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-65.3	-40.5	175.6	-72.9	171.4	0	0	0	112.6	V110 L111 V114 I125 R126 E127 Q131 R132 L133 I140 F144	V110-L129 HydrophobicContact CG1-CD2 4.06Å; L111-L129 HydrophobicContact CD2-CD1 4.33Å; V114-L129 HydrophobicContact CB-CD1 4.5Å; V114-L129 HydrophobicContact CG1-CD1 4.23Å; V114-L129 HydrophobicContact CG2-CD1 4.33Å; V114-L129 HydrophobicContact CG2-CD2 4.07Å; I125-L129 HydrophobicContact CG2-CD1 4.21Å; I125-L129 WeakPolarHBondContact O-CG 3.37Å; I125-L129 PolarHBondContact O-N 3.12Å; R126-L129 PolarHBondContact O-N 3.3Å; E127-L129 VanDerWaalsContact C-N 3.34Å; E127-L129 PolarHBondContact O-N 3.3Å; L129-Q131 VanDerWaalsContact C-N 3.32Å; L129-Q131 PolarHBondContact O-N 2.97Å; L129-R132 PolarHBondContact O-N 2.95Å; L129-L133 VanDerWaalsContact O-CB 3.31Å; L129-L133 WeakPolarHBondContact O-CB 3.35Å; L129-L133 WeakPolarHBondContact O-CG 3.48Å; L129-L133 PolarHBondContact O-N 2.96Å; L129-I140 HydrophobicContact CB-CG2 4.34Å; L129-I140 HydrophobicContact CD1-CG2 4.22Å; L129-F144 HydrophobicContact CD1-CE2 4.15Å; L129-F144 HydrophobicContact CD1-CZ 4.36Å
130	A	98.2	Very high	97.8	Very high	10 Å²	10	67.1 Å²	67.1	8%	0.083	33%	0.328	C	S	.	.	H	α-helix	trans	-58.2	-46	176.8	0	0	0	0	0	110.9	R126 E127 Q134 L135 E137 I140	R126-A130 VanDerWaalsContact O-CB 3.27Å; R126-A130 WeakPolarHBondContact O-CB 3.33Å; R126-A130 PolarHBondContact O-N 3.35Å; E127-A130 WeakPolarHBondContact O-CB 3.5Å; E127-A130 PolarHBondContact O-N 3.43Å; A130-Q134 WeakPolarHBondContact O-CA 3.45Å; A130-Q134 PolarHBondContact O-N 3.2Å; A130-L135 CarbonylContact C-O 3.56Å; A130-L135 WeakPolarHBondContact CA-O 3.23Å; A130-L135 VanDerWaalsContact CB-O 3.24Å; A130-L135 WeakPolarHBondContact CB-O 3.35Å; A130-L135 PolarHBondContact O-N 3.21Å; A130-E137 HydrophobicContact CB-CB 4.28Å; A130-I140 HydrophobicContact CB-CG1 4.19Å
131	Q	98.1	Very high	97.7	Very high	154 Å²	154	62.1 Å²	62.1	72%	0.72	31%	0.31	S	S	*	.	H	α-helix	trans	-64.4	-46.7	175.9	-68.8	178.5	6.2	0	0	112.2	E127 E128 L129 L133 Q134	E127-Q131 WeakPolarHBondContact O-CG 3.5Å; E127-Q131 PolarHBondContact O-N 3.08Å; E128-Q131 PolarHBondContact O-N 3.15Å; L129-Q131 VanDerWaalsContact C-N 3.32Å; L129-Q131 PolarHBondContact O-N 2.97Å; Q131-L133 PolarHBondContact O-N 3.44Å; Q131-Q134 PolarHBondContact O-N 3.43Å; Q131-Q134 PolarHBondContact O-NE2 3.28Å; Q131-Q134 VanDerWaalsContact O-NE2 3.08Å
132	R	97.7	Very high	97.7	Very high	164 Å²	164	64.6 Å²	64.6	62%	0.619	32%	0.323	S	S	*	.	H	α-helix	trans	-65.7	-36.3	-178.5	-78.7	-172.6	176.1	158.4	11.5	113.9	E128 L129 Q134	E128-R132 WeakPolarHBondContact O-CB 3.41Å; E128-R132 WeakPolarHBondContact O-CG 3.46Å; E128-R132 PolarHBondContact O-N 3.35Å; E128-R132 IonicContact OE1-CZ 2.96Å; E128-R132 IonicContact OE1-NE 4Å; E128-R132 IonicContact OE1-NH1 3.17Å; E128-R132 PolarHBondContact OE1-NH1 3.32Å; E128-R132 VanDerWaalsContact OE1-NH1 3.17Å; E128-R132 IonicContact OE1-NH2 2.66Å; E128-R132 PolarHBondContact OE1-NH2 2.96Å; L129-R132 PolarHBondContact O-N 2.95Å; R132-Q134 PolarHBondContact O-NE2 3.29Å
133	L	97.3	Very high	97.7	Very high	15 Å²	15	63.9 Å²	63.9	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-97.4	-0.8	-176.2	-59.5	179.4	0	0	0	113.3	Q107 V110 L111 L129 Q131 L135 I140	Q107-L133 HydrophobicContact CG-CB 4.34Å; Q107-L133 HydrophobicContact CG-CD2 4.2Å; Q107-L133 PolarHBondContact NE2-O 2.91Å; V110-L133 HydrophobicContact CB-CD2 4.07Å; V110-L133 HydrophobicContact CG1-CD1 4.41Å; V110-L133 HydrophobicContact CG1-CD2 4.11Å; V110-L133 HydrophobicContact CG2-CD2 4.25Å; L111-L133 HydrophobicContact CD1-CD1 4.27Å; L111-L133 HydrophobicContact CD2-CD1 3.81Å; L111-L133 HydrophobicContact CG-CD1 3.77Å; L129-L133 VanDerWaalsContact O-CB 3.31Å; L129-L133 WeakPolarHBondContact O-CB 3.35Å; L129-L133 WeakPolarHBondContact O-CG 3.48Å; L129-L133 PolarHBondContact O-N 2.96Å; Q131-L133 PolarHBondContact O-N 3.44Å; L133-L135 HydrophobicContact CB-CD1 3.78Å; L133-L135 HydrophobicContact CB-CG 4.16Å; L133-L135 HydrophobicContact CD1-CD1 4.34Å; L133-I140 HydrophobicContact CD1-CD1 4.36Å
134	Q	97.3	Very high	97.8	Very high	154 Å²	154	59.8 Å²	59.8	72%	0.72	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	50.5	-175.4	-60.5	76.8	48.4	0	0	112.2	A130 Q131 R132	A130-Q134 WeakPolarHBondContact O-CA 3.45Å; A130-Q134 PolarHBondContact O-N 3.2Å; Q131-Q134 PolarHBondContact O-N 3.43Å; Q131-Q134 PolarHBondContact O-NE2 3.28Å; Q131-Q134 VanDerWaalsContact O-NE2 3.08Å; R132-Q134 PolarHBondContact O-NE2 3.29Å
135	L	96.4	Very high	97.8	Very high	29 Å²	29	62.1 Å²	62.1	15%	0.152	29%	0.286	C	S	.	.			trans	-125.9	159.6	179.5	-65.8	167	0	0	0	109.8	T101 F103 A130 L133 I140	T101-L135 HydrophobicContact CG2-CD2 4.2Å; F103-L135 HydrophobicContact CD1-CD1 3.71Å; F103-L135 HydrophobicContact CD1-CD2 4.21Å; F103-L135 HydrophobicContact CE1-CD1 3.69Å; F103-L135 HydrophobicContact CE1-CD2 4.12Å; A130-L135 CarbonylContact C-O 3.56Å; A130-L135 WeakPolarHBondContact CA-O 3.23Å; A130-L135 VanDerWaalsContact CB-O 3.24Å; A130-L135 WeakPolarHBondContact CB-O 3.35Å; A130-L135 PolarHBondContact O-N 3.21Å; L133-L135 HydrophobicContact CB-CD1 3.78Å; L133-L135 HydrophobicContact CB-CG 4.16Å; L133-L135 HydrophobicContact CD1-CD1 4.34Å; L135-I140 HydrophobicContact CB-CD1 4.01Å; L135-I140 HydrophobicContact CD1-CD1 3.72Å
136	E	96.8	Very high	97.7	Very high	122 Å²	122	63.6 Å²	63.6	57%	0.57	30%	0.295	S	S	*	.			trans	-73.9	145.2	168.3	-55.7	173.2	144.9	0	0	110.1	D138 R139 I140	E136-D138 PolarHBondContact O-N 2.86Å; E136-R139 HydrophobicContact CB-CG 4.14Å; E136-R139 WeakPolarHBondContact O-CA 3.37Å; E136-R139 WeakPolarHBondContact O-CB 3.48Å; E136-R139 PolarHBondContact O-N 3.26Å; E136-R139 IonicContact OE2-NE 3.88Å; E136-I140 PolarHBondContact O-N 3.42Å
137	E	97.6	Very high	97.7	Very high	45 Å²	45	64.8 Å²	64.8	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-54.2	-38.5	177.3	-176.2	-80	160.9	0	0	112.3	I123 R126 E127 A130 R139 I140 Q141	I123-E137 HydrophobicContact CD1-CG 3.91Å; I123-E137 VanDerWaalsContact CD1-OE1 3.28Å; I123-E137 WeakPolarHBondContact CD1-OE1 3.41Å; R126-E137 HydrophobicContact CB-CG 3.94Å; R126-E137 IonicContact CZ-OE1 2.69Å; R126-E137 IonicContact NE-OE1 3.73Å; R126-E137 PolarHBondContact NE-OE1 3.36Å; R126-E137 IonicContact NH2-OE1 3.21Å; R126-E137 PolarHBondContact NH2-OE1 2.95Å; E127-E137 HydrophobicContact CG-CG 4.18Å; A130-E137 HydrophobicContact CB-CB 4.28Å; E137-R139 PolarHBondContact O-N 2.86Å; E137-I140 WeakPolarHBondContact O-CA 3.45Å; E137-I140 WeakPolarHBondContact O-CB 3.33Å; E137-I140 PolarHBondContact O-N 3.48Å; E137-Q141 PolarHBondContact O-N 3.32Å
138	D	96.9	Very high	97.7	Very high	36 Å²	36	62.9 Å²	62.9	19%	0.193	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-35.1	176.5	-174.2	53.1	0	0	0	111.7	R98 E136 Q141 I142	R98-D138 IonicContact CZ-OD2 3.3Å; R98-D138 IonicContact NE-OD2 3.47Å; R98-D138 IonicContact NH1-OD1 3.1Å; R98-D138 IonicContact NH1-OD2 2.88Å; R98-D138 PolarHBondContact NH1-OD2 2.87Å; E136-D138 PolarHBondContact O-N 2.86Å; D138-Q141 PolarHBondContact O-N 3.3Å; D138-I142 WeakPolarHBondContact O-CB 3.47Å; D138-I142 WeakPolarHBondContact O-CD1 3.43Å; D138-I142 VanDerWaalsContact O-CG1 3.23Å; D138-I142 WeakPolarHBondContact O-CG1 3.46Å; D138-I142 PolarHBondContact O-N 3.3Å; D138-I142 WeakPolarHBondContact OD2-CD1 3.37Å
139	R	97.4	Very high	97.6	Very high	34 Å²	34	61 Å²	61	13%	0.128	29%	0.287	C	S	.	.	H	α-helix	trans	-68.8	-38.8	176.9	-56.2	-53.9	179.1	151.2	8.3	111.4	P99 T101 F103 E136 E137 W143	P99-R139 PolarHBondContact O-NH1 3.17Å; P99-R139 PolarHBondContact O-NH2 3.07Å; P99-R139 VanDerWaalsContact O-NH2 3.15Å; T101-R139 WeakPolarHBondContact OG1-CD 3.37Å; T101-R139 PolarHBondContact OG1-NE 3Å; T101-R139 PolarHBondContact OG1-NH1 3.15Å; F103-R139 HydrophobicContact CE1-CB 4.27Å; F103-R139 HydrophobicContact CZ-CB 4.26Å; E136-R139 HydrophobicContact CB-CG 4.14Å; E136-R139 WeakPolarHBondContact O-CA 3.37Å; E136-R139 WeakPolarHBondContact O-CB 3.48Å; E136-R139 PolarHBondContact O-N 3.26Å; E136-R139 IonicContact OE2-NE 3.88Å; E137-R139 PolarHBondContact O-N 2.86Å; R139-W143 WeakPolarHBondContact O-CB 3.37Å; R139-W143 PolarHBondContact O-N 3.39Å
140	I	97.9	Very high	97.5	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-49.5	173.5	-50.7	-57.4	0	0	0	109.2	L111 R126 L129 A130 L133 L135 E136 E137 I142 W143 F144	L111-I140 HydrophobicContact CD2-CD1 4.02Å; L111-I140 HydrophobicContact CD2-CG2 4.13Å; R126-I140 HydrophobicContact CB-CG2 4.14Å; R126-I140 HydrophobicContact CG-CG2 4.1Å; L129-I140 HydrophobicContact CB-CG2 4.34Å; L129-I140 HydrophobicContact CD1-CG2 4.22Å; A130-I140 HydrophobicContact CB-CG1 4.19Å; L133-I140 HydrophobicContact CD1-CD1 4.36Å; L135-I140 HydrophobicContact CB-CD1 4.01Å; L135-I140 HydrophobicContact CD1-CD1 3.72Å; E136-I140 PolarHBondContact O-N 3.42Å; E137-I140 WeakPolarHBondContact O-CA 3.45Å; E137-I140 WeakPolarHBondContact O-CB 3.33Å; E137-I140 PolarHBondContact O-N 3.48Å; I140-I142 PolarHBondContact O-N 2.86Å; I140-W143 WeakPolarHBondContact O-CB 3.5Å; I140-W143 PolarHBondContact O-N 3.25Å; I140-W143 VanDerWaalsContact O-N 3.15Å; I140-F144 HydrophobicContact CG2-CD2 3.77Å; I140-F144 HydrophobicContact CG2-CE2 3.71Å; I140-F144 WeakPolarHBondContact O-CD2 3.39Å; I140-F144 PolarHBondContact O-N 3.1Å
141	Q	97.9	Very high	97.2	Very high	62 Å²	62	70.9 Å²	70.9	29%	0.29	33%	0.331	S	S	.	.	H	α-helix	trans	-54.3	-52	177.6	178.4	176.3	-84.4	0	0	112.3	E137 D138 W143 F144 Q145	E137-Q141 PolarHBondContact O-N 3.32Å; D138-Q141 PolarHBondContact O-N 3.3Å; Q141-W143 VanDerWaalsContact C-N 3.3Å; Q141-W143 PolarHBondContact O-N 3.45Å; Q141-F144 PolarHBondContact O-N 3.19Å; Q141-Q145 WeakPolarHBondContact O-CG 3.36Å; Q141-Q145 PolarHBondContact O-N 3.17Å
142	I	97.4	Very high	97	Very high	58 Å²	58	69.7 Å²	69.7	30%	0.297	32%	0.323	S	S	.	.	H	α-helix	trans	-61.7	-40.1	179.2	-68.4	164.9	0	0	0	110.6	D138 I140 Q145 N146	D138-I142 WeakPolarHBondContact O-CB 3.47Å; D138-I142 WeakPolarHBondContact O-CD1 3.43Å; D138-I142 VanDerWaalsContact O-CG1 3.23Å; D138-I142 WeakPolarHBondContact O-CG1 3.46Å; D138-I142 PolarHBondContact O-N 3.3Å; D138-I142 WeakPolarHBondContact OD2-CD1 3.37Å; I140-I142 PolarHBondContact O-N 2.86Å; I142-Q145 PolarHBondContact O-N 3.25Å; I142-N146 WeakPolarHBondContact CG2-ND2 3.37Å; I142-N146 WeakPolarHBondContact O-CB 3.33Å; I142-N146 VanDerWaalsContact O-CG 3.31Å; I142-N146 PolarHBondContact O-N 3.06Å; I142-N146 PolarHBondContact O-ND2 3.32Å
143	W	97.9	Very high	96.7	Very high	25 Å²	25	70.1 Å²	70.1	10%	0.095	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-48.7	176.6	-173	100.2	0	0	0	111.4	F103 I108 L111 E112 F115 R139 I140 Q141 Q145 N146 R147	F103-W143 AromaticContact CD2-CD1 3.76Å; F103-W143 HydrophobicContact CE2-CB 4.42Å; F103-W143 AromaticContact CE2-CD1 3.57Å; F103-W143 HydrophobicContact CE2-CG 4.39Å; F103-W143 HydrophobicContact CZ-CB 4.25Å; I108-W143 HydrophobicContact CG2-CZ2 4.48Å; L111-W143 HydrophobicContact CB-CD2 4.08Å; L111-W143 HydrophobicContact CB-CE3 3.94Å; L111-W143 HydrophobicContact CB-CH2 3.59Å; L111-W143 HydrophobicContact CB-CZ2 3.71Å; L111-W143 HydrophobicContact CB-CZ3 3.71Å; L111-W143 HydrophobicContact CD1-CD2 3.87Å; L111-W143 HydrophobicContact CD1-CE3 4.38Å; L111-W143 HydrophobicContact CD1-CG 3.95Å; L111-W143 HydrophobicContact CG-CD2 4.46Å; E112-W143 HydrophobicContact CG-CH2 3.82Å; E112-W143 HydrophobicContact CG-CZ2 3.91Å; F115-W143 HydrophobicContact CB-CH2 4.45Å; F115-W143 HydrophobicContact CB-CZ3 4.27Å; F115-W143 HydrophobicContact CD2-CZ3 4.39Å; R139-W143 WeakPolarHBondContact O-CB 3.37Å; R139-W143 PolarHBondContact O-N 3.39Å; I140-W143 WeakPolarHBondContact O-CB 3.5Å; I140-W143 PolarHBondContact O-N 3.25Å; I140-W143 VanDerWaalsContact O-N 3.15Å; Q141-W143 VanDerWaalsContact C-N 3.3Å; Q141-W143 PolarHBondContact O-N 3.45Å; W143-Q145 VanDerWaalsContact C-N 3.33Å; W143-Q145 PolarHBondContact O-N 3.16Å; W143-N146 PolarHBondContact O-N 3.07Å; W143-R147 HydrophobicContact CE3-CB 4.11Å; W143-R147 HydrophobicContact CH2-CB 4.16Å; W143-R147 HydrophobicContact CH2-CG 3.83Å; W143-R147 HydrophobicContact CZ2-CG 4.45Å; W143-R147 HydrophobicContact CZ3-CB 3.89Å; W143-R147 HydrophobicContact CZ3-CG 3.93Å; W143-R147 WeakPolarHBondContact O-CB 3.39Å; W143-R147 PolarHBondContact O-N 3.45Å
144	F	98.5	Very high	96.1	Very high	2 Å²	2	72.8 Å²	72.8	1%	0.009	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-38.7	178.4	-86.7	-90.6	0	0	0	112	L111 V114 F115 P121 L129 I140 Q141 R147 R148	L111-F144 HydrophobicContact CD2-CE2 3.86Å; V114-F144 HydrophobicContact CB-CZ 4.28Å; V114-F144 HydrophobicContact CG1-CZ 4.01Å; F115-F144 HydrophobicContact CB-CE1 4Å; F115-F144 AromaticContact CD2-CD1 3.73Å; F115-F144 HydrophobicContact CD2-CD1 3.73Å; F115-F144 AromaticContact CD2-CE1 3.86Å; F115-F144 HydrophobicContact CD2-CE1 3.86Å; F115-F144 HydrophobicContact CE2-CD1 4.46Å; F115-F144 HydrophobicContact CG-CE1 4.45Å; P121-F144 HydrophobicContact CG-CD1 3.57Å; P121-F144 HydrophobicContact CG-CD2 3.9Å; P121-F144 HydrophobicContact CG-CE1 3.55Å; P121-F144 HydrophobicContact CG-CE2 3.89Å; P121-F144 HydrophobicContact CG-CG 3.78Å; P121-F144 HydrophobicContact CG-CZ 3.74Å; L129-F144 HydrophobicContact CD1-CE2 4.15Å; L129-F144 HydrophobicContact CD1-CZ 4.36Å; I140-F144 HydrophobicContact CG2-CD2 3.77Å; I140-F144 HydrophobicContact CG2-CE2 3.71Å; I140-F144 WeakPolarHBondContact O-CD2 3.39Å; I140-F144 PolarHBondContact O-N 3.1Å; Q141-F144 PolarHBondContact O-N 3.19Å; F144-R147 PolarHBondContact O-N 2.93Å; F144-R148 WeakPolarHBondContact O-CG 3.35Å; F144-R148 PolarHBondContact O-N 3.48Å
145	Q	98.2	Very high	95.3	Very high	91 Å²	91	71 Å²	71	43%	0.425	34%	0.336	S	S	.	.	H	α-helix	trans	-61.7	-48.8	173.5	-70.8	177.1	14.7	0	0	111.8	Q141 I142 W143 R147 R148 A149	Q141-Q145 WeakPolarHBondContact O-CG 3.36Å; Q141-Q145 PolarHBondContact O-N 3.17Å; I142-Q145 PolarHBondContact O-N 3.25Å; W143-Q145 VanDerWaalsContact C-N 3.33Å; W143-Q145 PolarHBondContact O-N 3.16Å; Q145-R147 VanDerWaalsContact C-N 3.31Å; Q145-R147 PolarHBondContact O-N 2.94Å; Q145-R148 PolarHBondContact O-N 3.21Å; Q145-A149 WeakPolarHBondContact O-CB 3.42Å; Q145-A149 PolarHBondContact O-N 3.37Å
146	N	97.4	Very high	94.5	Very high	102 Å²	102	77.1 Å²	77.1	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-63.3	-38.2	177.9	-75	-25.6	0	0	0	111.7	I142 W143 A149 K150	I142-N146 WeakPolarHBondContact CG2-ND2 3.37Å; I142-N146 WeakPolarHBondContact O-CB 3.33Å; I142-N146 VanDerWaalsContact O-CG 3.31Å; I142-N146 PolarHBondContact O-N 3.06Å; I142-N146 PolarHBondContact O-ND2 3.32Å; W143-N146 PolarHBondContact O-N 3.07Å; N146-A149 PolarHBondContact O-N 3.36Å; N146-K150 WeakPolarHBondContact O-CB 3.45Å; N146-K150 PolarHBondContact O-N 2.96Å
147	R	97.9	Very high	93.8	Very high	66 Å²	66	77.3 Å²	77.3	25%	0.249	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-43.8	178.2	-171.8	65.8	-174	87	-4.7	111.5	E112 F115 W143 F144 Q145 K150 L151	E112-R147 IonicContact OE1-NE 2.83Å; F115-R147 HydrophobicContact CD1-CG 4.11Å; F115-R147 HydrophobicContact CD2-CB 4.21Å; F115-R147 HydrophobicContact CD2-CG 3.71Å; F115-R147 HydrophobicContact CE1-CG 4.05Å; F115-R147 HydrophobicContact CE2-CB 4.02Å; F115-R147 HydrophobicContact CE2-CG 3.64Å; F115-R147 HydrophobicContact CG-CG 3.95Å; F115-R147 HydrophobicContact CZ-CG 3.83Å; W143-R147 HydrophobicContact CE3-CB 4.11Å; W143-R147 HydrophobicContact CH2-CB 4.16Å; W143-R147 HydrophobicContact CH2-CG 3.83Å; W143-R147 HydrophobicContact CZ2-CG 4.45Å; W143-R147 HydrophobicContact CZ3-CB 3.89Å; W143-R147 HydrophobicContact CZ3-CG 3.93Å; W143-R147 WeakPolarHBondContact O-CB 3.39Å; W143-R147 PolarHBondContact O-N 3.45Å; F144-R147 PolarHBondContact O-N 2.93Å; Q145-R147 VanDerWaalsContact C-N 3.31Å; Q145-R147 PolarHBondContact O-N 2.94Å; R147-K150 PolarHBondContact O-N 2.93Å; R147-L151 PolarHBondContact O-N 3.2Å
148	R	97.9	Very high	93.1	Very high	58 Å²	58	78.1 Å²	78.1	22%	0.219	37%	0.369	C	S	.	.	H	α-helix	trans	-66.3	-39.5	173.1	-68	-168.6	-60.5	-90	0.5	112.4	F115 S119 Y120 F144 Q145 K150 L151 K152	F115-R148 HydrophobicContact CE2-CG 3.73Å; F115-R148 HydrophobicContact CZ-CG 4.08Å; S119-R148 WeakPolarHBondContact O-CD 3.37Å; S119-R148 PolarHBondContact O-NH1 2.97Å; Y120-R148 VanDerWaalsContact CE1-NE 3.3Å; F144-R148 WeakPolarHBondContact O-CG 3.35Å; F144-R148 PolarHBondContact O-N 3.48Å; Q145-R148 PolarHBondContact O-N 3.21Å; R148-K150 VanDerWaalsContact C-N 3.32Å; R148-K150 PolarHBondContact O-N 3.37Å; R148-L151 WeakPolarHBondContact O-CB 3.45Å; R148-L151 PolarHBondContact O-N 3.42Å; R148-K152 WeakPolarHBondContact O-CB 3.32Å; R148-K152 PolarHBondContact O-N 3.07Å
149	A	96.9	Very high	92.3	Very high	48 Å²	48	82.2 Å²	82.2	40%	0.397	39%	0.387	S	S	.	.	H	α-helix	trans	-61.9	-41.5	175.8	0	0	0	0	0	111.6	Q145 N146 K152 R153	Q145-A149 WeakPolarHBondContact O-CB 3.42Å; Q145-A149 PolarHBondContact O-N 3.37Å; N146-A149 PolarHBondContact O-N 3.36Å; A149-K152 PolarHBondContact O-N 3.09Å; A149-R153 WeakPolarHBondContact O-CB 3.4Å; A149-R153 PolarHBondContact O-N 3.47Å
150	K	95.2	Very high	91.8	Very high	148 Å²	148	87.3 Å²	87.3	64%	0.643	41%	0.41	S	S	*	.	H	α-helix	trans	-62.8	-45.6	173.9	-172	178.1	-179.4	-177.3	0	111.3	N146 R147 R148 K152 R153 S154	N146-K150 WeakPolarHBondContact O-CB 3.45Å; N146-K150 PolarHBondContact O-N 2.96Å; R147-K150 PolarHBondContact O-N 2.93Å; R148-K150 VanDerWaalsContact C-N 3.32Å; R148-K150 PolarHBondContact O-N 3.37Å; K150-K152 PolarHBondContact O-N 3.31Å; K150-R153 PolarHBondContact O-N 3.07Å; K150-S154 PolarHBondContact O-N 3.1Å
151	L	93.3	Very high	91.3	Very high	75 Å²	75	92.7 Å²	92.7	39%	0.393	44%	0.439	S	S	.	.	H	α-helix	trans	-56.5	-49.4	175.2	-177.1	64.9	0	0	0	111.1	F115 R147 R148 R153 S154 H155	F115-L151 HydrophobicContact CZ-CD2 4.32Å; R147-L151 PolarHBondContact O-N 3.2Å; R148-L151 WeakPolarHBondContact O-CB 3.45Å; R148-L151 PolarHBondContact O-N 3.42Å; L151-R153 PolarHBondContact O-N 2.88Å; L151-S154 PolarHBondContact O-N 2.85Å; L151-H155 PolarHBondContact O-N 2.7Å; L151-H155 PolarHBondContact O-ND1 3.44Å
152	K	93	Very high	90.8	Very high	129 Å²	129	95.3 Å²	95.3	56%	0.561	45%	0.452	S	S	*	.	H	α-helix	trans	-63.2	-38.8	178.1	-174	174.4	-178.9	175.1	0	112.8	R148 A149 K150 R156	R148-K152 WeakPolarHBondContact O-CB 3.32Å; R148-K152 PolarHBondContact O-N 3.07Å; A149-K152 PolarHBondContact O-N 3.09Å; K150-K152 PolarHBondContact O-N 3.31Å; K152-R156 PolarHBondContact O-N 3.26Å
153	R	91.2	Very high	90.4	Very high	174 Å²	174	96.2 Å²	96.2	66%	0.657	46%	0.46	S	S	*	.	H	α-helix	trans	-67.4	-42.8	178.9	-172.6	176.2	-115.9	101.6	-3.4	111.5	A149 K150 L151 H155 R156 E157	A149-R153 WeakPolarHBondContact O-CB 3.4Å; A149-R153 PolarHBondContact O-N 3.47Å; K150-R153 PolarHBondContact O-N 3.07Å; L151-R153 PolarHBondContact O-N 2.88Å; R153-H155 VanDerWaalsContact C-N 3.3Å; R153-H155 PolarHBondContact O-N 2.87Å; R153-R156 PolarHBondContact O-N 2.92Å; R153-R156 VanDerWaalsContact O-N 3.08Å; R153-E157 WeakPolarHBondContact O-CB 3.21Å; R153-E157 PolarHBondContact O-N 3.24Å
154	S	86	Confident	89.8	Confident	70 Å²	70	101.4 Å²	101.4	49%	0.49	48%	0.484	S	S	.	.	H	α-helix	trans	-57.4	-41.4	177.9	174.1	0	0	0	0	112.4	K150 L151 R156 E157 S158	K150-S154 PolarHBondContact O-N 3.1Å; L151-S154 PolarHBondContact O-N 2.85Å; S154-R156 VanDerWaalsContact C-N 3.35Å; S154-R156 PolarHBondContact O-N 3.27Å; S154-E157 PolarHBondContact O-N 3.07Å; S154-S158 WeakPolarHBondContact O-CB 3.27Å; S154-S158 PolarHBondContact O-N 3.03Å
155	H	78.8	Confident	89.3	Confident	116 Å²	116	108 Å²	108	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-62	-40.8	175.5	-72	81.2	0	0	0	112.6	L151 R153 Q159	L151-H155 PolarHBondContact O-N 2.7Å; L151-H155 PolarHBondContact O-ND1 3.44Å; R153-H155 VanDerWaalsContact C-N 3.3Å; R153-H155 PolarHBondContact O-N 2.87Å; H155-Q159 WeakPolarHBondContact O-CG 3.18Å; H155-Q159 PolarHBondContact O-N 2.9Å; H155-Q159 VanDerWaalsContact O-N 3.1Å
156	R	81.1	Confident	88.8	Confident	158 Å²	158	106.1 Å²	106.1	60%	0.596	51%	0.512	S	S	*	.	H	α-helix	trans	-69.9	-41.7	178.9	-68.2	176.8	175.4	-162.7	-7.1	112.3	K152 R153 S154 Q159 F160	K152-R156 PolarHBondContact O-N 3.26Å; R153-R156 PolarHBondContact O-N 2.92Å; R153-R156 VanDerWaalsContact O-N 3.08Å; S154-R156 VanDerWaalsContact C-N 3.35Å; S154-R156 PolarHBondContact O-N 3.27Å; R156-Q159 PolarHBondContact O-N 3.11Å; R156-F160 WeakPolarHBondContact O-CB 3.37Å; R156-F160 PolarHBondContact O-N 3.15Å
157	E	80.6	Confident	88.3	Confident	127 Å²	127	108.1 Å²	108.1	59%	0.593	52%	0.516	S	S	*	.	H	α-helix	trans	-66.3	-41.6	179.4	-173.4	170.7	-170.7	0	0	111.1	R153 S154 F160 L161	R153-E157 WeakPolarHBondContact O-CB 3.21Å; R153-E157 PolarHBondContact O-N 3.24Å; S154-E157 PolarHBondContact O-N 3.07Å; E157-F160 PolarHBondContact O-N 3.23Å; E157-L161 WeakPolarHBondContact O-CB 3.3Å; E157-L161 PolarHBondContact O-N 2.73Å
158	S	83.4	Confident	87.8	Confident	62 Å²	62	107.1 Å²	107.1	43%	0.434	52%	0.522	S	S	.	.	H	α-helix	trans	-59.6	-46.7	172.3	176.2	0	0	0	0	111.8	S154 F160 L161 M162	S154-S158 WeakPolarHBondContact O-CB 3.27Å; S154-S158 PolarHBondContact O-N 3.03Å; S158-F160 PolarHBondContact O-N 3.11Å; S158-L161 PolarHBondContact O-N 2.91Å; S158-M162 WeakPolarHBondContact O-CG 3.22Å; S158-M162 PolarHBondContact O-N 3.47Å
159	Q	81.5	Confident	87.1	Confident	121 Å²	121	108.1 Å²	108.1	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-60.9	-45.2	175.5	-75.3	-178.4	11.2	0	0	112.3	H155 R156 L161 M162 V163	H155-Q159 WeakPolarHBondContact O-CG 3.18Å; H155-Q159 PolarHBondContact O-N 2.9Å; H155-Q159 VanDerWaalsContact O-N 3.1Å; R156-Q159 PolarHBondContact O-N 3.11Å; Q159-L161 VanDerWaalsContact C-N 3.31Å; Q159-L161 PolarHBondContact O-N 2.95Å; Q159-M162 HydrophobicContact CG-CE 4.28Å; Q159-M162 PolarHBondContact O-N 3.38Å; Q159-V163 VanDerWaalsContact O-CG2 3.32Å; Q159-V163 WeakPolarHBondContact O-CG2 3.46Å; Q159-V163 PolarHBondContact O-N 3.14Å
160	F	85.4	Confident	86.5	Confident	141 Å²	141	111.1 Å²	111.1	62%	0.618	54%	0.541	S	S	*	.	H	α-helix	trans	-59.9	-43.1	176.8	177.8	-100.2	0	0	0	111.7	R156 E157 S158 V163 K164	R156-F160 WeakPolarHBondContact O-CB 3.37Å; R156-F160 PolarHBondContact O-N 3.15Å; E157-F160 PolarHBondContact O-N 3.23Å; S158-F160 PolarHBondContact O-N 3.11Å; F160-V163 PolarHBondContact O-N 2.76Å; F160-K164 HydrophobicContact CE1-CD 4.47Å; F160-K164 WeakPolarHBondContact O-CB 3.43Å; F160-K164 PolarHBondContact O-N 3.01Å
161	L	87	Confident	85.5	Confident	114 Å²	114	110.4 Å²	110.4	60%	0.597	54%	0.537	S	S	*	.	H	α-helix	trans	-66.9	-39.1	179.9	-160.4	69.9	0	0	0	111.8	E157 S158 Q159 K164 K165	E157-L161 WeakPolarHBondContact O-CB 3.3Å; E157-L161 PolarHBondContact O-N 2.73Å; S158-L161 PolarHBondContact O-N 2.91Å; Q159-L161 VanDerWaalsContact C-N 3.31Å; Q159-L161 PolarHBondContact O-N 2.95Å; L161-K164 PolarHBondContact O-N 3.46Å; L161-K165 WeakPolarHBondContact O-CB 3.09Å; L161-K165 PolarHBondContact O-N 2.88Å
162	M	88.3	Confident	84.5	Confident	116 Å²	116	111.9 Å²	111.9	57%	0.571	55%	0.546	S	S	*	.	H	α-helix	trans	-62.7	-45.7	173.6	-73.1	-169	-68.1	0	0	111.8	S158 Q159 K165 A166	S158-M162 WeakPolarHBondContact O-CG 3.22Å; S158-M162 PolarHBondContact O-N 3.47Å; Q159-M162 HydrophobicContact CG-CE 4.28Å; Q159-M162 PolarHBondContact O-N 3.38Å; M162-K165 PolarHBondContact O-N 3.31Å; M162-A166 PolarHBondContact O-N 3.37Å
163	V	88.5	Confident	83.2	Confident	78 Å²	78	113.5 Å²	113.5	47%	0.473	55%	0.553	S	S	.	*	H	α-helix	trans	-62.3	-45.7	177.1	170.6	0	0	0	0	110.6	Q159 F160 K165 A166 F167	Q159-V163 VanDerWaalsContact O-CG2 3.32Å; Q159-V163 WeakPolarHBondContact O-CG2 3.46Å; Q159-V163 PolarHBondContact O-N 3.14Å; F160-V163 PolarHBondContact O-N 2.76Å; V163-K165 VanDerWaalsContact C-N 3.3Å; V163-K165 PolarHBondContact O-N 3.1Å; V163-A166 PolarHBondContact O-N 3.07Å; V163-F167 HydrophobicContact CG1-CD2 3.51Å; V163-F167 HydrophobicContact CG1-CE2 3.38Å; V163-F167 WeakPolarHBondContact O-CD2 3.19Å; V163-F167 PolarHBondContact O-N 3.06Å
164	K	85.4	Confident	81.9	Confident	134 Å²	134	112.6 Å²	112.6	58%	0.583	56%	0.556	S	S	*	*	H	α-helix	trans	-58.6	-42.1	176.8	-174.2	-178.5	178.4	-175.2	0	111.9	F160 L161 F167 A168	F160-K164 HydrophobicContact CE1-CD 4.47Å; F160-K164 WeakPolarHBondContact O-CB 3.43Å; F160-K164 PolarHBondContact O-N 3.01Å; L161-K164 PolarHBondContact O-N 3.46Å; K164-F167 PolarHBondContact O-N 2.87Å; K164-A168 PolarHBondContact O-N 3.06Å
165	K	87.7	Confident	80.5	Confident	140 Å²	140	117.4 Å²	117.4	61%	0.609	57%	0.571	S	S	*	*	H	α-helix	trans	-63.1	-48.3	175.9	-173.3	177.8	178.4	-179.3	0	111.2	L161 M162 V163 F167 A168 D169	L161-K165 WeakPolarHBondContact O-CB 3.09Å; L161-K165 PolarHBondContact O-N 2.88Å; M162-K165 PolarHBondContact O-N 3.31Å; V163-K165 VanDerWaalsContact C-N 3.3Å; V163-K165 PolarHBondContact O-N 3.1Å; K165-F167 VanDerWaalsContact C-N 3.29Å; K165-F167 PolarHBondContact O-N 2.87Å; K165-A168 WeakPolarHBondContact O-CB 3.38Å; K165-A168 PolarHBondContact O-N 2.85Å; K165-D169 VanDerWaalsContact O-CG 3.27Å; K165-D169 PolarHBondContact O-N 2.98Å
166	A	89.1	Confident	79.1	Confident	51 Å²	51	122 Å²	122	42%	0.421	60%	0.599	S	S	.	*	H	α-helix	trans	-59.9	-38	177.7	0	0	0	0	0	112.8	M162 V163 L170	M162-A166 PolarHBondContact O-N 3.37Å; V163-A166 PolarHBondContact O-N 3.07Å; A166-L170 WeakPolarHBondContact O-CG 3.36Å; A166-L170 PolarHBondContact O-N 3.21Å
167	F	86	Confident	79	Confident	144 Å²	144	120.2 Å²	120.2	63%	0.632	60%	0.599	S	S	*	*	H	α-helix	trans	-67.2	-35.7	174.2	-85.1	-70.2	0	0	0	113.2	V163 K164 K165 K171	V163-F167 HydrophobicContact CG1-CD2 3.51Å; V163-F167 HydrophobicContact CG1-CE2 3.38Å; V163-F167 WeakPolarHBondContact O-CD2 3.19Å; V163-F167 PolarHBondContact O-N 3.06Å; K164-F167 PolarHBondContact O-N 2.87Å; K165-F167 VanDerWaalsContact C-N 3.29Å; K165-F167 PolarHBondContact O-N 2.87Å; F167-K171 PolarHBondContact O-N 3.5Å
168	A	87.6	Confident	78.9	Confident	46 Å²	46	119.8 Å²	119.8	38%	0.38	60%	0.6	S	S	.	*	H	α-helix	trans	-66	-46.9	174.3	0	0	0	0	0	111	K164 K165 L170 K171 D172	K164-A168 PolarHBondContact O-N 3.06Å; K165-A168 WeakPolarHBondContact O-CB 3.38Å; K165-A168 PolarHBondContact O-N 2.85Å; A168-L170 PolarHBondContact O-N 2.95Å; A168-L170 VanDerWaalsContact O-N 3.15Å; A168-K171 WeakPolarHBondContact O-CB 3.12Å; A168-K171 PolarHBondContact O-N 2.74Å; A168-D172 PolarHBondContact O-N 2.89Å; A168-D172 VanDerWaalsContact O-N 3.11Å
169	D	83.9	Confident	78.6	Confident	79 Å²	79	123 Å²	123	42%	0.422	61%	0.609	S	S	.	*	H	α-helix	trans	-61.5	-25.5	179.2	-60.6	-17.4	0	0	0	113.1	K165	K165-D169 VanDerWaalsContact O-CG 3.27Å; K165-D169 PolarHBondContact O-N 2.98Å
170	L	82.9	Confident	78.5	Confident	110 Å²	110	123.1 Å²	123.1	58%	0.576	61%	0.611	S	S	*	*	H	α-helix	trans	-79.3	-33.9	173	-72.4	173.3	0	0	0	112.6	A166 A168 D172 K173	A166-L170 WeakPolarHBondContact O-CG 3.36Å; A166-L170 PolarHBondContact O-N 3.21Å; A168-L170 PolarHBondContact O-N 2.95Å; A168-L170 VanDerWaalsContact O-N 3.15Å; L170-D172 VanDerWaalsContact C-N 3.33Å; L170-K173 PolarHBondContact O-N 3.14Å
171	K	75.4	Confident	78	Confident	133 Å²	133	122 Å²	122	58%	0.578	61%	0.611	S	S	*	*	H	α-helix	trans	-67.5	-37.9	178.7	-163.5	73.4	-176.3	165.5	0	111.1	F167 A168 K173 E174	F167-K171 PolarHBondContact O-N 3.5Å; A168-K171 WeakPolarHBondContact O-CB 3.12Å; A168-K171 PolarHBondContact O-N 2.74Å; K171-K173 PolarHBondContact O-N 2.88Å; K171-E174 PolarHBondContact O-N 3.4Å
172	D	72.2	Confident	77.4	Confident	106 Å²	106	122.5 Å²	122.5	57%	0.567	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-14.8	179.9	-63.5	-16.7	0	0	0	113.1	A168 L170	A168-D172 PolarHBondContact O-N 2.89Å; A168-D172 VanDerWaalsContact O-N 3.11Å; L170-D172 VanDerWaalsContact C-N 3.33Å
173	K	65.2	Low	76.7	Confident	164 Å²	164	123 Å²	123	71%	0.713	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-8.5	177.5	-73.9	-177.3	178.8	175.6	0	114.7	L170 K171	L170-K173 PolarHBondContact O-N 3.14Å; K171-K173 PolarHBondContact O-N 2.88Å
174	E	63	Low	75.8	Confident	155 Å²	155	126.5 Å²	126.5	72%	0.724	63%	0.626	S	S	*	*	S	Bend	trans	-91.8	-4.4	175.1	-77	-175	155.9	0	0	112.6	K171	K171-E174 PolarHBondContact O-N 3.4Å
175	E	58.2	Low	74.9	Confident	170 Å²	170	125.8 Å²	125.8	79%	0.794	63%	0.629	S	S	*	*			trans	-107.6	3.6	-178.8	-72.3	-164	166.7	0	0	115.3
176	D	48.1	Very low	73.8	Confident	212 Å²	212	124.5 Å²	124.5	100%	1.134	63%	0.631	S	S	*	*			trans	-108.6	0	171.6	-78.8	-27.1	0	0	0	111.8

Retrieved 176 of 176 residues in 80.9 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).