A0A087Y5X5_POEFO Loading...

Shox homeobox

AlphaFold DB , UniProt , Accession A0A087Y5X5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 282 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.2	Very low	46.4	Very low	236 Å²	236	163.4 Å²	163.4	100%	1.163	88%	0.883	S	S	*	*				0	94.7	0	-67.7	-177.6	-143.4	0	0	106.1
2	E	47.5	Very low	45.7	Very low	200 Å²	200	164 Å²	164	94%	0.935	87%	0.872	S	S	*	*			trans	-175.8	65.9	173.1	-109.7	154.8	-132.2	0	0	110.6
3	E	46.9	Very low	45	Very low	185 Å²	185	162.4 Å²	162.4	86%	0.864	86%	0.864	S	S	*	*			trans	-137	158.6	158.6	-72.3	-163.1	167.9	0	0	108.8
4	L	48.7	Very low	45	Very low	175 Å²	175	162.1 Å²	162.1	92%	0.916	86%	0.855	S	S	*	*			trans	86.3	37	-174.7	-50.9	179.4	0	0	0	118.5
5	T	54	Low	44.4	Very low	151 Å²	151	162.7 Å²	162.7	93%	0.926	85%	0.848	S	S	*	*			trans	-108.8	50	158.6	-41.8	0	0	0	0	111.8
6	A	49.1	Very low	44.3	Very low	90 Å²	90	158.8 Å²	158.8	74%	0.744	84%	0.838	S	S	*	*			trans	-158.2	69.9	179.3	0	0	0	0	0	115.3
7	F	40.8	Very low	44.1	Very low	202 Å²	202	162.2 Å²	162.2	89%	0.886	85%	0.845	S	S	*	*			trans	-157.7	105.6	147.7	-142.8	-100.6	0	0	0	112.8
8	V	44.2	Very low	43.5	Very low	129 Å²	129	162.9 Å²	162.9	78%	0.782	84%	0.843	S	S	*	*			trans	166.1	68.1	134.4	170.1	0	0	0	0	106.1
9	S	48.9	Very low	43.4	Very low	131 Å²	131	159.7 Å²	159.7	92%	0.916	84%	0.836	S	S	*	*			trans	-126.5	75.9	163.5	-77.7	0	0	0	0	107.6
10	K	43.7	Very low	42.9	Very low	189 Å²	189	155.9 Å²	155.9	82%	0.822	82%	0.824	S	S	*	*			trans	-150.3	129.8	169.9	-155.6	163	-174.1	173.4	0	111.5
11	S	39.6	Very low	43.1	Very low	109 Å²	109	158.2 Å²	158.2	76%	0.762	83%	0.827	S	S	*	*			trans	67.6	75.1	172.9	-57.4	0	0	0	0	117.4
12	F	37.8	Very low	42.9	Very low	171 Å²	171	153.4 Å²	153.4	75%	0.75	80%	0.801	S	S	*	*				-41.5	124.1	128	169.8	-89.5	0	0	0	111	Q14	F12-Q14 HydrophobicContact CD1-CB 4.45Å; F12-Q14 HydrophobicContact CD2-CB 4.26Å; F12-Q14 HydrophobicContact CE1-CB 3.77Å; F12-Q14 HydrophobicContact CE2-CB 3.56Å; F12-Q14 HydrophobicContact CE2-CG 4.25Å; F12-Q14 HydrophobicContact CZ-CB 3.28Å; F12-Q14 HydrophobicContact CZ-CG 4.09Å
13	D	36.8	Very low	42.7	Very low	143 Å²	143	148.7 Å²	148.7	77%	0.765	79%	0.791	S	S	*	*			trans	-131.8	103	154.1	-160.1	-63	0	0	0	108.2	K15	D13-K15 PolarHBondContact O-N 3.18Å
14	Q	45.2	Very low	43.1	Very low	158 Å²	158	145.9 Å²	145.9	74%	0.738	78%	0.78	S	S	*	*			trans	-94.3	81.8	-177.3	-177.9	101.5	63.8	0	0	109.1	F12	F12-Q14 HydrophobicContact CD1-CB 4.45Å; F12-Q14 HydrophobicContact CD2-CB 4.26Å; F12-Q14 HydrophobicContact CE1-CB 3.77Å; F12-Q14 HydrophobicContact CE2-CB 3.56Å; F12-Q14 HydrophobicContact CE2-CG 4.25Å; F12-Q14 HydrophobicContact CZ-CB 3.28Å; F12-Q14 HydrophobicContact CZ-CG 4.09Å
15	K	36.3	Very low	43.8	Very low	172 Å²	172	140.8 Å²	140.8	75%	0.748	76%	0.757	S	S	*	*			trans	-129.7	96.8	173	-158.7	154.1	-174.6	175.3	0	113.3	D13	D13-K15 PolarHBondContact O-N 3.18Å
16	S	42.1	Very low	43.7	Very low	99 Å²	99	143.3 Å²	143.3	69%	0.692	75%	0.75	S	S	*	*			trans	38.8	93.9	152.3	58.3	0	0	0	0	117.4
17	K	40.4	Very low	44.5	Very low	218 Å²	218	147.7 Å²	147.7	95%	0.948	75%	0.748	S	S	*	*			trans	-127.4	66.5	144.2	-123.3	179.7	-175.3	-179.3	0	110.6
18	E	34.8	Very low	45.8	Very low	174 Å²	174	142 Å²	142	81%	0.813	72%	0.724	S	S	*	*			trans	-61.4	142.2	165.9	-176.1	161.5	-173.5	0	0	110.1	S20	E18-S20 PolarHBondContact O-N 3.25Å
19	S	41.2	Very low	46.9	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	71%	0.71	S	S	*	*			trans	23	92.3	159.9	-178.3	0	0	0	0	118.9
20	S	33.3	Very low	47.8	Very low	83 Å²	83	139.2 Å²	139.2	58%	0.58	70%	0.697	S	S	*	*			trans	-125.2	73.1	138.9	-74.9	0	0	0	0	110.9	E18 E22	E18-S20 PolarHBondContact O-N 3.25Å; S20-E22 VanDerWaalsContact CB-CD 3.47Å; S20-E22 WeakPolarHBondContact CB-OE1 3.28Å; S20-E22 PolarHBondContact O-N 3.21Å; S20-E22 VanDerWaalsContact O-N 3.11Å; S20-E22 PolarHBondContact OG-OE1 2.89Å
21	K	46.6	Very low	48.6	Very low	204 Å²	204	135.3 Å²	135.3	89%	0.887	68%	0.681	S	S	*	*			trans	-73.2	67.6	137.4	-75.2	-178.9	-179.7	173	0	107.2	S23	K21-S23 VanDerWaalsContact C-N 3.31Å; K21-S23 PolarHBondContact O-N 3.2Å
22	E	43.6	Very low	49.7	Very low	135 Å²	135	132.8 Å²	132.8	63%	0.631	66%	0.664	S	S	*	*			trans	-64.4	100.8	167.5	-85.7	150.5	-164.3	0	0	106.7	S20 I24	S20-E22 VanDerWaalsContact CB-CD 3.47Å; S20-E22 WeakPolarHBondContact CB-OE1 3.28Å; S20-E22 PolarHBondContact O-N 3.21Å; S20-E22 VanDerWaalsContact O-N 3.11Å; S20-E22 PolarHBondContact OG-OE1 2.89Å; E22-I24 PolarHBondContact O-N 3.04Å
23	S	43.8	Very low	50.7	Low	102 Å²	102	126.2 Å²	126.2	71%	0.713	64%	0.644	S	S	*	*			trans	-58.5	95.3	162.6	163.2	0	0	0	0	106.5	K21 T25	K21-S23 VanDerWaalsContact C-N 3.31Å; K21-S23 PolarHBondContact O-N 3.2Å; S23-T25 WeakPolarHBondContact O-CG2 3.41Å; S23-T25 PolarHBondContact O-N 3.4Å
24	I	54.4	Low	51.2	Low	126 Å²	126	125.1 Å²	125.1	65%	0.646	64%	0.638	S	S	*	*			trans	-39.9	110	174	-81.1	175.2	0	0	0	108.4	E22 V29	E22-I24 PolarHBondContact O-N 3.04Å; I24-V29 HydrophobicContact CG2-CG2 3.3Å
25	T	63.7	Low	51.3	Low	68 Å²	68	121.9 Å²	121.9	42%	0.417	63%	0.629	S	S	.	*			trans	-81.5	148.9	-179.8	60	0	0	0	0	108.5	S23 R27 E28 V29	S23-T25 WeakPolarHBondContact O-CG2 3.41Å; S23-T25 PolarHBondContact O-N 3.4Å; T25-R27 PolarHBondContact O-N 2.82Å; T25-E28 WeakPolarHBondContact CB-OE2 3.4Å; T25-E28 PolarHBondContact N-OE2 3.18Å; T25-E28 PolarHBondContact O-N 3.34Å; T25-E28 PolarHBondContact OG1-OE2 2.84Å; T25-V29 PolarHBondContact O-N 3.45Å
26	Y	51.9	Low	52	Low	203 Å²	203	122.2 Å²	122.2	80%	0.796	63%	0.625	S	S	*	*	H	α-helix	trans	-54	-28.9	178.1	-105.3	-95.8	0	0	0	112.6	L30	Y26-L30 VanDerWaalsContact O-CG 3.26Å; Y26-L30 WeakPolarHBondContact O-CG 3.4Å; Y26-L30 PolarHBondContact O-N 3.14Å; Y26-L30 VanDerWaalsContact O-N 3.17Å
27	R	65.3	Low	52.2	Low	183 Å²	183	120.9 Å²	120.9	69%	0.691	62%	0.621	S	S	*	*	H	α-helix	trans	-58.6	-52.9	174.5	-177.8	-178.7	-74.4	-113.8	2.9	112.1	T25 V29 L30 E31	T25-R27 PolarHBondContact O-N 2.82Å; R27-V29 VanDerWaalsContact C-N 3.29Å; R27-V29 PolarHBondContact O-N 3.46Å; R27-L30 PolarHBondContact O-N 3.32Å; R27-L30 VanDerWaalsContact O-N 3.12Å; R27-E31 PolarHBondContact O-N 2.87Å
28	E	68.9	Low	52.5	Low	82 Å²	82	120.9 Å²	120.9	38%	0.383	61%	0.614	S	S	.	*	H	α-helix	trans	-64.3	-33.6	-176.3	-65.8	160.4	116.8	0	0	112.4	T25 S32	T25-E28 WeakPolarHBondContact CB-OE2 3.4Å; T25-E28 PolarHBondContact N-OE2 3.18Å; T25-E28 PolarHBondContact O-N 3.34Å; T25-E28 PolarHBondContact OG1-OE2 2.84Å; E28-S32 VanDerWaalsContact O-CB 3.22Å; E28-S32 WeakPolarHBondContact O-CB 3.37Å; E28-S32 PolarHBondContact O-N 3.04Å; E28-S32 PolarHBondContact O-OG 3.34Å
29	V	67.8	Low	52.9	Low	82 Å²	82	120.6 Å²	120.6	50%	0.497	61%	0.613	S	S	.	*	H	α-helix	trans	-67.1	-42.1	174.8	-176.1	0	0	0	0	111.3	I24 T25 R27 G33	I24-V29 HydrophobicContact CG2-CG2 3.3Å; T25-V29 PolarHBondContact O-N 3.45Å; R27-V29 VanDerWaalsContact C-N 3.29Å; R27-V29 PolarHBondContact O-N 3.46Å; V29-G33 PolarHBondContact O-N 3.07Å; V29-G33 VanDerWaalsContact O-N 3.07Å
30	L	66.3	Low	52.9	Low	120 Å²	120	123.1 Å²	123.1	63%	0.628	62%	0.618	S	S	*	*	H	α-helix	trans	-69.5	-43.1	177.9	-69.4	169	0	0	0	111.6	Y26 R27 G33 L34	Y26-L30 VanDerWaalsContact O-CG 3.26Å; Y26-L30 WeakPolarHBondContact O-CG 3.4Å; Y26-L30 PolarHBondContact O-N 3.14Å; Y26-L30 VanDerWaalsContact O-N 3.17Å; R27-L30 PolarHBondContact O-N 3.32Å; R27-L30 VanDerWaalsContact O-N 3.12Å; L30-G33 CarbonylContact O-C 3.57Å; L30-G33 WeakPolarHBondContact O-CA 3.39Å; L30-G33 PolarHBondContact O-N 2.73Å; L30-L34 PolarHBondContact O-N 3.03Å
31	E	61.4	Low	52.9	Low	106 Å²	106	122.8 Å²	122.8	50%	0.495	63%	0.628	S	S	.	*	H	α-helix	trans	-63.9	-39.2	175.1	-109.2	158	-171.5	0	0	112.2	R27 G33 L34 T35	R27-E31 PolarHBondContact O-N 2.87Å; E31-G33 PolarHBondContact O-N 3.46Å; E31-L34 PolarHBondContact O-N 3.07Å; E31-T35 WeakPolarHBondContact O-CG2 3.44Å; E31-T35 PolarHBondContact O-N 3.13Å; E31-T35 PolarHBondContact O-OG1 2.66Å
32	S	62.5	Low	52.1	Low	57 Å²	57	118.3 Å²	118.3	40%	0.399	62%	0.622	S	S	.	*	H	α-helix	trans	-65.5	-24.3	170.7	-61.5	0	0	0	0	112.9	E28 T35 R36	E28-S32 VanDerWaalsContact O-CB 3.22Å; E28-S32 WeakPolarHBondContact O-CB 3.37Å; E28-S32 PolarHBondContact O-N 3.04Å; E28-S32 PolarHBondContact O-OG 3.34Å; S32-T35 PolarHBondContact O-OG1 3.4Å; S32-R36 PolarHBondContact O-NE 3.5Å; S32-R36 VanDerWaalsContact O-NE 3.12Å; S32-R36 PolarHBondContact O-NH2 3.43Å
33	G	58	Low	52	Low	33 Å²	33	117.6 Å²	117.6	34%	0.34	63%	0.629	S	S	.	*	H	α-helix	trans	-75.2	-46.3	170	0	0	0	0	0	112.2	V29 L30 E31 R36 A37	V29-G33 PolarHBondContact O-N 3.07Å; V29-G33 VanDerWaalsContact O-N 3.07Å; L30-G33 CarbonylContact O-C 3.57Å; L30-G33 WeakPolarHBondContact O-CA 3.39Å; L30-G33 PolarHBondContact O-N 2.73Å; E31-G33 PolarHBondContact O-N 3.46Å; G33-R36 PolarHBondContact O-N 3.25Å; G33-A37 PolarHBondContact O-N 3.44Å
34	L	47.4	Very low	51.8	Low	120 Å²	120	121.9 Å²	121.9	63%	0.628	64%	0.637	S	S	*	*	H	α-helix	trans	-69	-37.4	-174.6	-168.5	65.2	0	0	0	113	L30 E31 R36 A37	L30-L34 PolarHBondContact O-N 3.03Å; E31-L34 PolarHBondContact O-N 3.07Å; L34-R36 PolarHBondContact O-N 2.6Å; L34-A37 WeakPolarHBondContact O-CB 3.45Å; L34-A37 PolarHBondContact O-N 2.86Å; L34-A37 VanDerWaalsContact O-N 3.16Å
35	T	47	Very low	50.8	Low	90 Å²	90	122.8 Å²	122.8	55%	0.552	65%	0.649	S	S	*	*	H	α-helix	trans	-62.4	-40.9	174.8	45.4	0	0	0	0	112.2	E31 S32 A37 R38	E31-T35 WeakPolarHBondContact O-CG2 3.44Å; E31-T35 PolarHBondContact O-N 3.13Å; E31-T35 PolarHBondContact O-OG1 2.66Å; S32-T35 PolarHBondContact O-OG1 3.4Å; T35-A37 PolarHBondContact O-N 3.5Å; T35-R38 PolarHBondContact O-N 3.15Å
36	R	51.1	Low	49.4	Very low	178 Å²	178	125.9 Å²	125.9	67%	0.672	66%	0.663	S	S	*	*	H	α-helix	trans	-66	-18.5	174.6	-76.1	-174.9	-69.4	-113	-4	114.6	S32 G33 L34	S32-R36 PolarHBondContact O-NE 3.5Å; S32-R36 VanDerWaalsContact O-NE 3.12Å; S32-R36 PolarHBondContact O-NH2 3.43Å; G33-R36 PolarHBondContact O-N 3.25Å; L34-R36 PolarHBondContact O-N 2.6Å
37	A	47.1	Very low	48.7	Very low	72 Å²	72	124.3 Å²	124.3	60%	0.595	67%	0.668	S	S	*	*	H	α-helix	trans	-83.2	-17.5	177.2	0	0	0	0	0	113.2	G33 L34 T35	G33-A37 PolarHBondContact O-N 3.44Å; L34-A37 WeakPolarHBondContact O-CB 3.45Å; L34-A37 PolarHBondContact O-N 2.86Å; L34-A37 VanDerWaalsContact O-N 3.16Å; T35-A37 PolarHBondContact O-N 3.5Å
38	R	45.9	Very low	47.2	Very low	217 Å²	217	122.9 Å²	122.9	82%	0.819	67%	0.669	S	S	*	*	H	α-helix	trans	-89.9	-17.5	-174.9	-120.4	177.4	-179	158.9	0.3	114.9	T35 L40	T35-R38 PolarHBondContact O-N 3.15Å; R38-L40 VanDerWaalsContact C-N 3.28Å; R38-L40 PolarHBondContact O-N 3.38Å
39	E	45	Very low	45.4	Very low	169 Å²	169	124.8 Å²	124.8	79%	0.79	68%	0.682	S	S	*	*	S	Bend	trans	-79.6	-3.3	-177.8	-67.3	-71	126.6	0	0	114
40	L	40.8	Very low	43.9	Very low	156 Å²	156	129 Å²	129	82%	0.817	70%	0.7	S	S	*	*	S	Bend	trans	-112.4	90.9	170.3	-66.8	177.5	0	0	0	108.4	R38	R38-L40 VanDerWaalsContact C-N 3.28Å; R38-L40 PolarHBondContact O-N 3.38Å
41	G	32.7	Very low	42.7	Very low	76 Å²	76	128.5 Å²	128.5	78%	0.784	70%	0.702	S	S	*	*			trans	-72.9	159.1	-171.9	0	0	0	0	0	114.7
42	S	28.7	Very low	41.5	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	71%	0.712	S	S	*	*			trans	-128.9	128	155.6	-174.3	0	0	0	0	107
43	P	42.8	Very low	40.1	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	73%	0.733	S	S	*	*			trans	-72.2	152.2	171.4	31.6	-33.4	0	0	0	110
44	E	38.5	Very low	39.1	Very low	192 Å²	192	139.2 Å²	139.2	90%	0.897	76%	0.755	S	S	*	*			trans	-76.3	134.5	174.9	-59.7	-165.9	136.7	0	0	111.2
45	T	34.1	Very low	38.5	Very low	146 Å²	146	141.3 Å²	141.3	90%	0.896	76%	0.761	S	S	*	*			trans	-132.9	131.7	147.7	47.4	0	0	0	0	109.7
46	N	34.7	Very low	37.9	Very low	133 Å²	133	142.3 Å²	142.3	71%	0.711	77%	0.771	S	S	*	*			trans	-94.6	128.2	-179.5	173.4	-25.2	0	0	0	108.7
47	L	35.8	Very low	37.6	Very low	169 Å²	169	139.4 Å²	139.4	89%	0.885	78%	0.775	S	S	*	*			trans	-154.5	100.8	148.6	-137.5	88.9	0	0	0	112.4
48	Q	34.8	Very low	37	Very low	154 Å²	154	141.3 Å²	141.3	72%	0.72	78%	0.779	S	S	*	*			trans	24.3	121.1	136	-135.8	55.3	42.2	0	0	121.1
49	D	31.5	Very low	36.6	Very low	121 Å²	121	138.4 Å²	138.4	65%	0.647	78%	0.775	S	S	*	*			trans	61.5	110.9	132.1	-166.4	35.8	0	0	0	121.3
50	I	36.6	Very low	36.1	Very low	171 Å²	171	138.9 Å²	138.9	88%	0.877	78%	0.782	S	S	*	*				-154.5	136.8	124.2	29.2	172	0	0	0	109.9
51	T	40.3	Very low	35.8	Very low	109 Å²	109	140.1 Å²	140.1	67%	0.669	78%	0.777	S	S	*	*			trans	-84.7	159.6	-178	53.8	0	0	0	0	113.5
52	D	36	Very low	35.9	Very low	135 Å²	135	144.3 Å²	144.3	72%	0.722	77%	0.773	S	S	*	*			trans	52.2	113.1	158.1	-70.2	-63.8	0	0	0	119.6
53	T	33.3	Very low	36	Very low	135 Å²	135	146.2 Å²	146.2	83%	0.828	78%	0.775	S	S	*	*				-166.9	125.7	117	-78.5	0	0	0	0	110.8	H55	T53-H55 PolarHBondContact O-N 3.07Å
54	N	37.9	Very low	35.5	Very low	151 Å²	151	149.4 Å²	149.4	81%	0.807	78%	0.779	S	S	*	*			trans	-76.7	111.5	173.7	-72.6	-89.5	0	0	0	110.9
55	H	34.7	Very low	35.3	Very low	164 Å²	164	146.7 Å²	146.7	76%	0.759	78%	0.775	S	S	*	*			trans	-154.7	120.9	153.3	-148.6	39.2	0	0	0	114.3	T53	T53-H55 PolarHBondContact O-N 3.07Å
56	C	33.9	Very low	35.4	Very low	111 Å²	111	148 Å²	148	75%	0.75	77%	0.771	S	S	*	*			trans	-104.6	113.6	163.8	-65.2	0	0	0	0	109.4	V58	C56-V58 PolarHBondContact O-N 2.95Å; C56-V58 VanDerWaalsContact O-N 3.14Å
57	P	45.7	Very low	35.4	Very low	117 Å²	117	149.3 Å²	149.3	76%	0.76	78%	0.777	S	S	*	*			trans	-78.4	95.5	170.9	-13.9	30.9	0	0	0	110.5
58	V	33	Very low	35.2	Very low	113 Å²	113	149.2 Å²	149.2	69%	0.685	77%	0.772	S	S	*	*			trans	-88.4	147.9	162.6	-176.5	0	0	0	0	108.2	C56	C56-V58 PolarHBondContact O-N 2.95Å; C56-V58 VanDerWaalsContact O-N 3.14Å
59	H	37	Very low	35.4	Very low	156 Å²	156	151.7 Å²	151.7	72%	0.722	78%	0.781	S	S	*	*			trans	74.2	109.9	-179.7	-68.8	-77.9	0	0	0	117.6
60	L	35.7	Very low	36.1	Very low	179 Å²	179	154 Å²	154	94%	0.937	79%	0.787	S	S	*	*				-139.5	133.2	101.4	-117.6	142.1	0	0	0	110.6
61	Y	34.7	Very low	36.2	Very low	181 Å²	181	155.5 Å²	155.5	71%	0.71	79%	0.788	S	S	*	*			trans	-94.5	141.4	-177.1	-141.7	-119.2	0	0	0	107.5
62	K	34	Very low	36.2	Very low	165 Å²	165	158.4 Å²	158.4	72%	0.717	80%	0.798	S	S	*	*			trans	56	97.1	138.7	-156.3	96.3	161.7	-171.7	0	116.9
63	D	31	Very low	36.6	Very low	149 Å²	149	161 Å²	161	80%	0.797	80%	0.803	S	S	*	*				-175.4	121.2	123.1	-90.5	-21.5	0	0	0	111.7
64	H	32.7	Very low	36.8	Very low	187 Å²	187	161.5 Å²	161.5	87%	0.866	80%	0.801	S	S	*	*			trans	174.6	95.6	141.8	-106.2	-75.7	0	0	0	108.5
65	V	33.9	Very low	36.8	Very low	134 Å²	134	164.9 Å²	164.9	81%	0.812	81%	0.809	S	S	*	*			trans	-97.9	153.7	158.8	179.7	0	0	0	0	106.3
66	E	36.8	Very low	36.9	Very low	175 Å²	175	164.4 Å²	164.4	82%	0.818	81%	0.812	S	S	*	*			trans	78.9	73.1	179.6	-52	-157.4	120.3	0	0	118.1
67	L	33.7	Very low	37.1	Very low	160 Å²	160	165.4 Å²	165.4	84%	0.838	81%	0.814	S	S	*	*			trans	-176.1	132.3	133.2	-120.4	66.8	0	0	0	105.1
68	E	32.1	Very low	36.6	Very low	166 Å²	166	165.8 Å²	165.8	78%	0.776	82%	0.82	S	S	*	*			cis	-137.3	151.8	23.5	-58.9	-152.6	121	0	0	112.8
69	K	40.3	Very low	36.6	Very low	206 Å²	206	170.6 Å²	170.6	90%	0.896	83%	0.826	S	S	*	*			trans	-128.2	47.9	177.4	-167.9	-161.2	172.5	-175.9	0	110.7
70	E	44.8	Very low	36.5	Very low	169 Å²	169	168 Å²	168	79%	0.79	83%	0.831	S	S	*	*			trans	-148.6	79.9	-178.6	-94.8	-61.5	131.5	0	0	111
71	K	38.7	Very low	36.7	Very low	203 Å²	203	164.3 Å²	164.3	88%	0.883	82%	0.816	S	S	*	*			trans	-176.3	70.5	149.5	-106.8	177.7	-176.9	-173.9	0	112.1
72	L	40.2	Very low	36.8	Very low	171 Å²	171	165.3 Å²	165.3	90%	0.895	83%	0.827	S	S	*	*			trans	-131.8	72.2	160.8	-168.4	74.5	0	0	0	110.1
73	K	44.3	Very low	36.8	Very low	188 Å²	188	160.6 Å²	160.6	82%	0.817	83%	0.825	S	S	*	*			trans	-159.9	165.4	159.5	-102.6	154.9	-173.8	-179.7	0	106.9
74	D	38.6	Very low	37.4	Very low	147 Å²	147	161.9 Å²	161.9	79%	0.786	83%	0.83	S	S	*	*	S	Bend	trans	67.8	67.9	-178.7	-44.6	-25.9	0	0	0	114.6
75	F	38.3	Very low	37.6	Very low	222 Å²	222	162.9 Å²	162.9	97%	0.974	83%	0.828	S	S	*	*	S	Bend	trans	-169.9	56.3	130.8	-100.2	-63.9	0	0	0	111.2
76	N	36.7	Very low	37.9	Very low	154 Å²	154	165 Å²	165	82%	0.824	83%	0.829	S	S	*	*	S	Bend	trans	-147.3	99	160.6	-170.6	4	0	0	0	109.7
77	V	37.8	Very low	38	Very low	132 Å²	132	162.7 Å²	162.7	80%	0.8	83%	0.83	S	S	*	*			trans	157.8	88.8	157.5	159.7	0	0	0	0	107.1
78	S	34	Very low	38.1	Very low	125 Å²	125	163.2 Å²	163.2	87%	0.874	83%	0.826	S	S	*	*			trans	162.3	120.5	167.3	-79.8	0	0	0	0	104.5
79	R	33.1	Very low	38.7	Very low	214 Å²	214	163.2 Å²	163.2	81%	0.808	83%	0.826	S	S	*	*			cis	-162.9	127.9	21.3	170.8	-179.3	-178.1	141.3	-3.5	108.5	T81	R79-T81 PolarHBondContact NE-OG1 3.41Å
80	A	36.2	Very low	38.7	Very low	102 Å²	102	163.3 Å²	163.3	84%	0.843	83%	0.827	S	S	*	*			trans	-85.4	115.6	160.7	0	0	0	0	0	108.1
81	T	39.1	Very low	38.9	Very low	101 Å²	101	163.8 Å²	163.8	62%	0.62	83%	0.826	S	S	*	*			trans	-158.7	136.6	157.7	42.9	0	0	0	0	108.9	R79	R79-T81 PolarHBondContact NE-OG1 3.41Å
82	E	37.7	Very low	39.2	Very low	202 Å²	202	161.8 Å²	161.8	94%	0.944	83%	0.825	S	S	*	*			trans	-58.6	157.9	173.7	-56.7	165.4	128.9	0	0	112.1
83	G	33.7	Very low	39.5	Very low	65 Å²	65	160.1 Å²	160.1	67%	0.67	82%	0.817	S	S	*	*			trans	179.6	88.6	179.5	0	0	0	0	0	114.8
84	I	42	Very low	40	Very low	176 Å²	176	157.9 Å²	157.9	90%	0.903	82%	0.818	S	S	*	*			trans	-53.7	137.7	167.5	-66.7	154.3	0	0	0	111
85	Y	37.3	Very low	40.5	Very low	209 Å²	209	158 Å²	158	82%	0.82	81%	0.812	S	S	*	*			trans	-149	111.1	152.3	59.3	-84.9	0	0	0	112.4
86	E	40.1	Very low	40.6	Very low	179 Å²	179	153 Å²	153	84%	0.836	80%	0.804	S	S	*	*			trans	-84.1	132.1	142.5	-173.4	-162.7	133.3	0	0	106
87	C	38.5	Very low	41.2	Very low	125 Å²	125	152.1 Å²	152.1	85%	0.845	80%	0.796	S	S	*	*			trans	-156	148.6	160.4	-136	0	0	0	0	113
88	K	37	Very low	41.6	Very low	172 Å²	172	153 Å²	153	75%	0.748	80%	0.795	S	S	*	*			trans	-105.8	159	-159.8	-173.7	166.5	179.9	164.2	0	112.3
89	E	44.4	Very low	42.3	Very low	165 Å²	165	155 Å²	155	77%	0.771	79%	0.791	S	S	*	*			trans	-35	130.3	177.3	-55.8	158.9	98.9	0	0	115.2
90	K	41.3	Very low	42.7	Very low	209 Å²	209	150.2 Å²	150.2	91%	0.909	78%	0.782	S	S	*	*			trans	-141.6	142.7	133.6	-72.3	-158.8	177.8	179.2	0	110.9
91	K	47.7	Very low	43.4	Very low	178 Å²	178	150.5 Å²	150.5	77%	0.774	78%	0.784	S	S	*	*			trans	-100	131.7	-179.7	159.8	-171.3	174.1	179.3	0	108
92	D	45.5	Very low	43.9	Very low	162 Å²	162	153 Å²	153	87%	0.866	79%	0.789	S	S	*	*			trans	-147.2	152.8	157.3	-87.4	-54.2	0	0	0	110.5
93	D	47.4	Very low	44.5	Very low	136 Å²	136	146.6 Å²	146.6	73%	0.727	78%	0.777	S	S	*	*			trans	-109	119.8	-158.3	-153.8	-69.9	0	0	0	110.3
94	V	54.7	Low	45.4	Very low	140 Å²	140	153.1 Å²	153.1	85%	0.848	79%	0.787	S	S	*	*			trans	-137.1	106.5	169.6	-177.1	0	0	0	0	110.3
95	K	47.5	Very low	46.3	Very low	150 Å²	150	152.5 Å²	152.5	65%	0.652	78%	0.784	S	S	*	*			trans	-72.9	123.6	170	-169.8	-169.6	-166.6	-142.9	0	110.1	E97	K95-E97 WeakPolarHBondContact CE-OE1 3.36Å; K95-E97 VanDerWaalsContact CE-OE2 3.32Å; K95-E97 WeakPolarHBondContact CE-OE2 3.43Å; K95-E97 HydrophobicContact CG-CG 4.46Å; K95-E97 IonicContact NZ-OE1 2.69Å; K95-E97 PolarHBondContact NZ-OE1 3.39Å; K95-E97 IonicContact NZ-OE2 2.65Å; K95-E97 PolarHBondContact NZ-OE2 2.99Å
96	S	41.3	Very low	47.7	Very low	116 Å²	116	152.7 Å²	152.7	81%	0.811	79%	0.79	S	S	*	*			trans	-127.9	123.8	161.4	-168.2	0	0	0	0	108.3
97	E	49	Very low	49.4	Very low	137 Å²	137	153.1 Å²	153.1	64%	0.64	79%	0.792	S	S	*	*			trans	-101.5	153.3	177.2	-75.4	165.3	142.8	0	0	110.3	K95	K95-E97 WeakPolarHBondContact CE-OE1 3.36Å; K95-E97 VanDerWaalsContact CE-OE2 3.32Å; K95-E97 WeakPolarHBondContact CE-OE2 3.43Å; K95-E97 HydrophobicContact CG-CG 4.46Å; K95-E97 IonicContact NZ-OE1 2.69Å; K95-E97 PolarHBondContact NZ-OE1 3.39Å; K95-E97 IonicContact NZ-OE2 2.65Å; K95-E97 PolarHBondContact NZ-OE2 2.99Å
98	D	45.8	Very low	51.5	Low	149 Å²	149	158.3 Å²	158.3	80%	0.797	79%	0.793	S	S	*	*			trans	82.1	155.2	161.8	-111.5	-47.9	0	0	0	123.1
99	E	48.3	Very low	53.6	Low	167 Å²	167	160.6 Å²	160.6	78%	0.78	80%	0.797	S	S	*	*			trans	62.9	86	173.1	-62.4	-67.4	135.1	0	0	117.9
100	D	42.3	Very low	55.7	Low	114 Å²	114	157.5 Å²	157.5	61%	0.61	79%	0.794	S	S	*	*				-176	103	105.8	-147.1	-34.8	0	0	0	111.6	Q102	D100-Q102 VanDerWaalsContact C-N 3.34Å; D100-Q102 PolarHBondContact O-N 2.99Å; D100-Q102 VanDerWaalsContact OD1-CD 3.3Å; D100-Q102 WeakPolarHBondContact OD1-CG 3.38Å; D100-Q102 PolarHBondContact OD1-NE2 2.83Å
101	A	50.6	Low	58.1	Low	109 Å²	109	158 Å²	158	90%	0.901	79%	0.79	S	S	*	*			trans	-92.8	41.1	-176.2	0	0	0	0	0	113.5
102	Q	50.7	Low	60.2	Low	154 Å²	154	151.8 Å²	151.8	72%	0.72	77%	0.767	S	S	*	*			trans	-91.7	116.6	-176.3	-74.7	177.8	41.5	0	0	114.8	D100 K104	D100-Q102 VanDerWaalsContact C-N 3.34Å; D100-Q102 PolarHBondContact O-N 2.99Å; D100-Q102 VanDerWaalsContact OD1-CD 3.3Å; D100-Q102 WeakPolarHBondContact OD1-CG 3.38Å; D100-Q102 PolarHBondContact OD1-NE2 2.83Å; Q102-K104 PolarHBondContact O-N 3.35Å
103	G	48.9	Very low	62.6	Low	67 Å²	67	150.8 Å²	150.8	69%	0.691	76%	0.762	S	S	*	*			trans	60.9	51.8	140.1	0	0	0	0	0	118.9	L105	G103-L105 PolarHBondContact O-N 3.02Å
104	K	52.4	Low	65	Low	202 Å²	202	147.1 Å²	147.1	88%	0.878	74%	0.74	S	S	*	*			trans	-72	54.6	175.6	-60.2	-175.5	-174.1	178.1	0	114.1	Q102 K106	Q102-K104 PolarHBondContact O-N 3.35Å; K104-K106 PolarHBondContact O-N 2.91Å; K104-K106 VanDerWaalsContact O-N 3.11Å
105	L	62.8	Low	67.1	Low	162 Å²	162	144 Å²	144	85%	0.848	72%	0.721	S	S	*	*			trans	-59.2	110.7	162.8	-72.2	169.7	0	0	0	108.1	G103 Q107	G103-L105 PolarHBondContact O-N 3.02Å; L105-Q107 PolarHBondContact O-N 3.37Å
106	K	65.7	Low	69.5	Low	214 Å²	214	142.9 Å²	142.9	93%	0.93	72%	0.721	S	S	*	*			trans	-53.5	92.9	-174.3	-98.3	165.2	173.8	161.6	0	112.2	K104 R108	K104-K106 PolarHBondContact O-N 2.91Å; K104-K106 VanDerWaalsContact O-N 3.11Å; K106-R108 PolarHBondContact O-N 3.07Å
107	Q	76.2	Confident	72.2	Confident	188 Å²	188	144.7 Å²	144.7	88%	0.879	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-66.7	123.2	178.8	-168	159	8.3	0	0	109.2	L105 R109	L105-Q107 PolarHBondContact O-N 3.37Å; Q107-R109 PolarHBondContact O-N 3.01Å
108	R	82.4	Confident	74.5	Confident	234 Å²	234	139.6 Å²	139.6	88%	0.883	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-64.4	125.5	-176.6	-135.1	175	70.8	-179.2	1.5	108.5	K106 S110	K106-R108 PolarHBondContact O-N 3.07Å; R108-S110 PolarHBondContact O-N 3.29Å
109	R	81.3	Confident	77	Confident	219 Å²	219	135 Å²	135	83%	0.826	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-49.4	128.3	-179.5	-170	-177.8	-66.9	-162.7	1.7	110.1	Q107	Q107-R109 PolarHBondContact O-N 3.01Å
110	S	87.4	Confident	79.4	Confident	101 Å²	101	131.5 Å²	131.5	71%	0.706	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-52.1	142.8	-176.3	-56.3	0	0	0	0	112.1	R108	R108-S110 PolarHBondContact O-N 3.29Å
111	R	91.8	Very high	82.1	Confident	220 Å²	220	128.2 Å²	128.2	83%	0.83	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-76.7	133.5	177.2	-173.2	178	179.7	109	0.1	109.2
112	T	92.6	Very high	84.4	Confident	47 Å²	47	123 Å²	123	29%	0.288	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-78.4	130.8	171.6	-49.9	0	0	0	0	109.2	F114 L146 R150	T112-F114 HydrophobicContact CG2-CD1 4.34Å; T112-F114 HydrophobicContact CG2-CE1 4Å; T112-F114 HydrophobicContact CG2-CZ 4.35Å; T112-L146 HydrophobicContact CG2-CD2 4.36Å; T112-R150 WeakPolarHBondContact OG1-CD 3.47Å; T112-R150 PolarHBondContact OG1-NH1 2.68Å; T112-R150 VanDerWaalsContact OG1-NH1 3.14Å
113	N	95.6	Very high	86.6	Confident	140 Å²	140	118.9 Å²	118.9	75%	0.749	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-101.8	134.7	166.2	-61.4	-51.3	0	0	0	107.3
114	F	97.5	Very high	89	Confident	60 Å²	60	120.8 Å²	120.8	26%	0.263	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-95.8	143.6	178.4	-57.3	-73.2	0	0	0	109.5	T112 Q118 L119 L122 L146 R150 W154	T112-F114 HydrophobicContact CG2-CD1 4.34Å; T112-F114 HydrophobicContact CG2-CE1 4Å; T112-F114 HydrophobicContact CG2-CZ 4.35Å; F114-Q118 HydrophobicContact CB-CB 4.33Å; F114-L119 HydrophobicContact CB-CD2 3.84Å; F114-L119 HydrophobicContact CB-CG 3.86Å; F114-L119 HydrophobicContact CD2-CD2 4.21Å; F114-L119 HydrophobicContact CG-CD2 4.26Å; F114-L122 HydrophobicContact CD1-CD1 4.43Å; F114-L146 HydrophobicContact CD1-CD1 3.81Å; F114-L146 HydrophobicContact CD1-CD2 4.06Å; F114-L146 HydrophobicContact CE1-CD1 3.76Å; F114-L146 HydrophobicContact CE1-CD2 3.99Å; F114-R150 HydrophobicContact CE1-CB 4.49Å; F114-W154 AromaticContact CE2-CD1 3.69Å; F114-W154 HydrophobicContact CZ-CB 4.46Å
115	T	98.3	Very high	91.2	Very high	73 Å²	73	111.8 Å²	111.8	45%	0.448	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-71.2	163.8	169.5	70.3	0	0	0	0	110.3	E117 Q118 L119	T115-E117 VanDerWaalsContact C-N 3.31Å; T115-E117 PolarHBondContact O-N 3.41Å; T115-Q118 PolarHBondContact O-N 2.91Å; T115-Q118 VanDerWaalsContact OG1-CG 3.28Å; T115-Q118 WeakPolarHBondContact OG1-CG 3.35Å; T115-Q118 PolarHBondContact OG1-N 3.18Å; T115-L119 WeakPolarHBondContact O-CG 3.42Å; T115-L119 PolarHBondContact O-N 3.49Å
116	L	97.8	Very high	92.9	Very high	128 Å²	128	104.5 Å²	104.5	67%	0.67	48%	0.483	S	S	*	.	H	α-helix	trans	-61.2	-41.4	176.5	-177.8	60.7	0	0	0	111.6	L119 N120	L116-L119 PolarHBondContact O-N 3.08Å; L116-N120 PolarHBondContact O-N 3.36Å; L116-N120 PolarHBondContact O-OD1 3.27Å
117	E	98.2	Very high	94.4	Very high	154 Å²	154	100.2 Å²	100.2	72%	0.72	47%	0.47	S	S	*	.	H	α-helix	trans	-59.6	-46.1	175.7	-176.4	-179.5	-170.1	0	0	112.4	T115 L119 N120 E121	T115-E117 VanDerWaalsContact C-N 3.31Å; T115-E117 PolarHBondContact O-N 3.41Å; E117-L119 VanDerWaalsContact C-N 3.31Å; E117-L119 PolarHBondContact O-N 3.22Å; E117-N120 PolarHBondContact O-N 3.05Å; E117-E121 PolarHBondContact O-N 3.21Å; E117-E121 VanDerWaalsContact O-N 3.14Å
118	Q	98.4	Very high	95.5	Very high	30 Å²	30	97.2 Å²	97.2	14%	0.14	46%	0.456	C	S	.	.	H	α-helix	trans	-60.1	-41.2	174.7	-73	171.7	-21.2	0	0	111.8	F114 T115 L122 L144	F114-Q118 HydrophobicContact CB-CB 4.33Å; T115-Q118 PolarHBondContact O-N 2.91Å; T115-Q118 VanDerWaalsContact OG1-CG 3.28Å; T115-Q118 WeakPolarHBondContact OG1-CG 3.35Å; T115-Q118 PolarHBondContact OG1-N 3.18Å; Q118-L122 VanDerWaalsContact O-CB 3.31Å; Q118-L122 WeakPolarHBondContact O-CB 3.19Å; Q118-L122 VanDerWaalsContact O-CD1 3.27Å; Q118-L122 WeakPolarHBondContact O-CD1 3.31Å; Q118-L122 WeakPolarHBondContact O-CG 3.46Å; Q118-L122 PolarHBondContact O-N 2.88Å; Q118-L122 VanDerWaalsContact O-N 3.07Å; Q118-L144 HydrophobicContact CB-CD1 4.3Å; Q118-L144 HydrophobicContact CB-CD2 4.5Å; Q118-L144 HydrophobicContact CG-CB 4.21Å; Q118-L144 HydrophobicContact CG-CD1 4.47Å; Q118-L144 HydrophobicContact CG-CD2 4.15Å; Q118-L144 PolarHBondContact NE2-O 2.96Å
119	L	98.5	Very high	96.2	Very high	53 Å²	53	87.9 Å²	87.9	28%	0.277	43%	0.425	S	S	.	.	H	α-helix	trans	-65.6	-40.3	176.3	-69.6	173.6	0	0	0	112	F114 T115 L116 E117 L122 E123	F114-L119 HydrophobicContact CB-CD2 3.84Å; F114-L119 HydrophobicContact CB-CG 3.86Å; F114-L119 HydrophobicContact CD2-CD2 4.21Å; F114-L119 HydrophobicContact CG-CD2 4.26Å; T115-L119 WeakPolarHBondContact O-CG 3.42Å; T115-L119 PolarHBondContact O-N 3.49Å; L116-L119 PolarHBondContact O-N 3.08Å; E117-L119 VanDerWaalsContact C-N 3.31Å; E117-L119 PolarHBondContact O-N 3.22Å; L119-L122 PolarHBondContact O-N 3.02Å; L119-E123 WeakPolarHBondContact O-CB 3.24Å; L119-E123 WeakPolarHBondContact O-CG 3.18Å; L119-E123 PolarHBondContact O-N 2.93Å
120	N	98.4	Very high	97	Very high	92 Å²	92	81.9 Å²	81.9	49%	0.492	41%	0.406	S	S	.	.	H	α-helix	trans	-61.2	-46.5	179.2	-68.1	-11.7	0	0	0	111.7	L116 E117 E123 R124	L116-N120 PolarHBondContact O-N 3.36Å; L116-N120 PolarHBondContact O-OD1 3.27Å; E117-N120 PolarHBondContact O-N 3.05Å; N120-E123 PolarHBondContact O-N 3.03Å; N120-R124 WeakPolarHBondContact O-CB 3.27Å; N120-R124 PolarHBondContact O-N 3.5Å
121	E	98.4	Very high	97.5	Very high	45 Å²	45	84.6 Å²	84.6	21%	0.21	40%	0.402	C	S	.	.	H	α-helix	trans	-72.4	-34.3	179.2	-174.5	64.6	-171.2	0	0	112.2	E117 E123 R124 L125 L140 L144	E117-E121 PolarHBondContact O-N 3.21Å; E117-E121 VanDerWaalsContact O-N 3.14Å; E121-E123 VanDerWaalsContact C-N 3.33Å; E121-E123 PolarHBondContact O-N 3.43Å; E121-R124 VanDerWaalsContact CD-NE 3.31Å; E121-R124 PolarHBondContact O-N 3.4Å; E121-R124 IonicContact OE1-CZ 3.37Å; E121-R124 IonicContact OE1-NE 3.13Å; E121-R124 PolarHBondContact OE1-NE 2.89Å; E121-R124 VanDerWaalsContact OE1-NE 3.13Å; E121-R124 IonicContact OE1-NH2 2.73Å; E121-R124 PolarHBondContact OE1-NH2 2.82Å; E121-R124 WeakPolarHBondContact OE2-CD 3.19Å; E121-R124 IonicContact OE2-CZ 3.86Å; E121-R124 IonicContact OE2-NE 2.87Å; E121-R124 PolarHBondContact OE2-NE 3.16Å; E121-R124 IonicContact OE2-NH2 3.96Å; E121-L125 PolarHBondContact O-N 3.16Å; E121-L140 HydrophobicContact CB-CD1 4.49Å; E121-L140 HydrophobicContact CG-CD1 3.53Å; E121-L144 HydrophobicContact CB-CD2 4.08Å; E121-L144 HydrophobicContact CG-CD2 4.31Å
122	L	98.6	Very high	97.8	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-39.1	170.6	-78.3	163.2	0	0	0	112.1	F114 Q118 L119 F126 L140 L144 V151 W154 F155	F114-L122 HydrophobicContact CD1-CD1 4.43Å; Q118-L122 VanDerWaalsContact O-CB 3.31Å; Q118-L122 WeakPolarHBondContact O-CB 3.19Å; Q118-L122 VanDerWaalsContact O-CD1 3.27Å; Q118-L122 WeakPolarHBondContact O-CD1 3.31Å; Q118-L122 WeakPolarHBondContact O-CG 3.46Å; Q118-L122 PolarHBondContact O-N 2.88Å; Q118-L122 VanDerWaalsContact O-N 3.07Å; L119-L122 PolarHBondContact O-N 3.02Å; L122-F126 WeakPolarHBondContact O-CB 3.31Å; L122-F126 PolarHBondContact O-N 3.14Å; L122-F126 VanDerWaalsContact O-N 3.15Å; L122-L140 HydrophobicContact CD2-CD2 3.73Å; L122-L140 HydrophobicContact CG-CD2 4.44Å; L122-L144 HydrophobicContact CD1-CD1 4.31Å; L122-L144 HydrophobicContact CD2-CD1 4.42Å; L122-L144 HydrophobicContact CG-CD1 3.85Å; L122-V151 HydrophobicContact CD2-CG1 4.07Å; L122-W154 HydrophobicContact CB-CD2 4.02Å; L122-W154 HydrophobicContact CB-CE3 4.02Å; L122-W154 HydrophobicContact CB-CH2 3.77Å; L122-W154 HydrophobicContact CB-CZ2 3.74Å; L122-W154 HydrophobicContact CB-CZ3 3.91Å; L122-W154 HydrophobicContact CD1-CD2 4.03Å; L122-W154 HydrophobicContact CD1-CG 3.96Å; L122-W154 HydrophobicContact CD2-CD2 4.04Å; L122-W154 HydrophobicContact CD2-CE3 3.93Å; L122-W154 HydrophobicContact CD2-CG 4.29Å; L122-W154 HydrophobicContact CD2-CZ3 4.49Å; L122-W154 HydrophobicContact CG-CD2 4.27Å; L122-W154 HydrophobicContact CG-CE3 4.44Å; L122-W154 WeakPolarHBondContact O-CH2 3.28Å; L122-W154 WeakPolarHBondContact O-CZ3 3.36Å; L122-F155 HydrophobicContact CD2-CD2 4.35Å; L122-F155 HydrophobicContact CD2-CE2 3.85Å
123	E	98.4	Very high	98.1	Very high	67 Å²	67	77 Å²	77	31%	0.313	38%	0.377	S	S	.	.	H	α-helix	trans	-73.7	-41.6	175.3	-71.1	-171.9	166.7	0	0	111.8	L119 N120 E121 L125 F126 D127 W154 R158	L119-E123 WeakPolarHBondContact O-CB 3.24Å; L119-E123 WeakPolarHBondContact O-CG 3.18Å; L119-E123 PolarHBondContact O-N 2.93Å; N120-E123 PolarHBondContact O-N 3.03Å; E121-E123 VanDerWaalsContact C-N 3.33Å; E121-E123 PolarHBondContact O-N 3.43Å; E123-L125 VanDerWaalsContact C-N 3.34Å; E123-L125 PolarHBondContact O-N 3.08Å; E123-F126 WeakPolarHBondContact O-CA 3.47Å; E123-F126 WeakPolarHBondContact O-CB 3.49Å; E123-F126 PolarHBondContact O-N 3.35Å; E123-D127 PolarHBondContact O-N 3.25Å; E123-W154 HydrophobicContact CG-CH2 3.74Å; E123-W154 HydrophobicContact CG-CZ2 3.77Å; E123-R158 IonicContact OE1-CZ 3.3Å; E123-R158 VanDerWaalsContact OE1-CZ 3.3Å; E123-R158 IonicContact OE1-NH1 2.6Å; E123-R158 PolarHBondContact OE1-NH1 3.03Å; E123-R158 IonicContact OE1-NH2 3.5Å; E123-R158 PolarHBondContact OE1-NH2 3.29Å
124	R	98.4	Very high	98.2	Very high	108 Å²	108	72.7 Å²	72.7	41%	0.408	36%	0.36	S	S	.	.	H	α-helix	trans	-55	-46.6	174.4	-167.6	-160.3	65.6	66.5	-0.9	112	N120 E121 F126 E128	N120-R124 WeakPolarHBondContact O-CB 3.27Å; N120-R124 PolarHBondContact O-N 3.5Å; E121-R124 VanDerWaalsContact CD-NE 3.31Å; E121-R124 PolarHBondContact O-N 3.4Å; E121-R124 IonicContact OE1-CZ 3.37Å; E121-R124 IonicContact OE1-NE 3.13Å; E121-R124 PolarHBondContact OE1-NE 2.89Å; E121-R124 VanDerWaalsContact OE1-NE 3.13Å; E121-R124 IonicContact OE1-NH2 2.73Å; E121-R124 PolarHBondContact OE1-NH2 2.82Å; E121-R124 WeakPolarHBondContact OE2-CD 3.19Å; E121-R124 IonicContact OE2-CZ 3.86Å; E121-R124 IonicContact OE2-NE 2.87Å; E121-R124 PolarHBondContact OE2-NE 3.16Å; E121-R124 IonicContact OE2-NH2 3.96Å; R124-F126 VanDerWaalsContact C-N 3.33Å; R124-E128 IonicContact NH1-OE2 3.4Å; R124-E128 PolarHBondContact NH1-OE2 2.74Å; R124-E128 PolarHBondContact O-N 2.8Å
125	L	98.3	Very high	98.2	Very high	12 Å²	12	76.5 Å²	76.5	6%	0.063	38%	0.377	C	S	.	.	H	α-helix	trans	-72.5	-27.3	176.8	-167.3	70.6	0	0	0	112.3	E121 E123 E128 T129 P132 M136 L140 F155	E121-L125 PolarHBondContact O-N 3.16Å; E123-L125 VanDerWaalsContact C-N 3.34Å; E123-L125 PolarHBondContact O-N 3.08Å; L125-E128 PolarHBondContact O-N 2.74Å; L125-T129 PolarHBondContact O-N 3.13Å; L125-P132 HydrophobicContact CD2-CB 4.23Å; L125-M136 HydrophobicContact CD1-CE 3.94Å; L125-L140 HydrophobicContact CB-CD2 4.43Å; L125-L140 HydrophobicContact CD2-CB 4.4Å; L125-L140 HydrophobicContact CD2-CD2 3.68Å; L125-F155 HydrophobicContact CB-CZ 4.25Å; L125-F155 HydrophobicContact CD2-CZ 4.16Å; L125-F155 HydrophobicContact CG-CZ 4.33Å
126	F	98.5	Very high	98.2	Very high	9 Å²	9	75.7 Å²	75.7	4%	0.039	37%	0.369	C	S	.	.	H	α-helix	trans	-67.6	-38	175.9	-174.6	-96.6	0	0	0	112.5	L122 E123 R124 E128 T129 H130 W154 F155 R158 R159	L122-F126 WeakPolarHBondContact O-CB 3.31Å; L122-F126 PolarHBondContact O-N 3.14Å; L122-F126 VanDerWaalsContact O-N 3.15Å; E123-F126 WeakPolarHBondContact O-CA 3.47Å; E123-F126 WeakPolarHBondContact O-CB 3.49Å; E123-F126 PolarHBondContact O-N 3.35Å; R124-F126 VanDerWaalsContact C-N 3.33Å; F126-E128 VanDerWaalsContact C-N 3.29Å; F126-T129 CarbonylContact O-C 3.59Å; F126-T129 VanDerWaalsContact O-C 3.25Å; F126-T129 PolarHBondContact O-N 3.43Å; F126-H130 AromaticContact CD1-CD2 3.62Å; F126-H130 AromaticContact CD2-CD2 3.99Å; F126-H130 AromaticContact CE1-CD2 3.21Å; F126-H130 WeakPolarHBondContact CE1-CD2 3.48Å; F126-H130 AromaticContact CE1-NE2 3.48Å; F126-H130 WeakPolarHBondContact CE1-NE2 3.21Å; F126-H130 HydrophobicContact CE2-CB 4.19Å; F126-H130 AromaticContact CE2-CD2 3.61Å; F126-H130 AromaticContact CG-CD2 3.99Å; F126-H130 HydrophobicContact CZ-CB 4.42Å; F126-H130 AromaticContact CZ-CD2 3.19Å; F126-H130 WeakPolarHBondContact CZ-CD2 3.45Å; F126-H130 AromaticContact CZ-NE2 3.82Å; F126-H130 PolarHBondContact O-CD2 3.14Å; F126-H130 PolarHBondContact O-N 3.49Å; F126-W154 HydrophobicContact CB-CH2 4.29Å; F126-W154 HydrophobicContact CB-CZ3 4.14Å; F126-W154 HydrophobicContact CD2-CZ3 4.27Å; F126-W154 HydrophobicContact CG-CZ3 4.43Å; F126-F155 HydrophobicContact CB-CE1 4Å; F126-F155 HydrophobicContact CB-CZ 4.44Å; F126-F155 AromaticContact CD2-CD1 3.75Å; F126-F155 HydrophobicContact CD2-CD1 3.75Å; F126-F155 AromaticContact CD2-CE1 3.75Å; F126-F155 HydrophobicContact CD2-CE1 3.75Å; F126-F155 HydrophobicContact CE2-CD1 4.46Å; F126-F155 HydrophobicContact CG-CE1 4.38Å; F126-R158 HydrophobicContact CD1-CG 3.86Å; F126-R158 HydrophobicContact CD2-CB 4.15Å; F126-R158 HydrophobicContact CD2-CG 3.5Å; F126-R158 VanDerWaalsContact CD2-CG 3.5Å; F126-R158 HydrophobicContact CE1-CG 3.69Å; F126-R158 HydrophobicContact CE2-CB 3.89Å; F126-R158 HydrophobicContact CE2-CG 3.33Å; F126-R158 HydrophobicContact CG-CG 3.77Å; F126-R158 HydrophobicContact CZ-CB 4.33Å; F126-R158 HydrophobicContact CZ-CG 3.44Å; F126-R158 VanDerWaalsContact CZ-CG 3.44Å; F126-R159 HydrophobicContact CE2-CG 3.83Å; F126-R159 HydrophobicContact CZ-CG 4.33Å
127	D	98.1	Very high	98.3	Very high	124 Å²	124	71.8 Å²	71.8	66%	0.663	35%	0.345	S	S	*	.	H	α-helix	trans	-69.6	-28.6	176.7	-63.5	-17.7	0	0	0	111.8	E123	E123-D127 PolarHBondContact O-N 3.25Å
128	E	97.9	Very high	98.3	Very high	126 Å²	126	69.5 Å²	69.5	59%	0.589	33%	0.334	S	S	*	.	H	α-helix	trans	-76.6	-46.7	171.6	-174.3	178.2	169.6	0	0	112.1	R124 L125 F126	R124-E128 IonicContact NH1-OE2 3.4Å; R124-E128 PolarHBondContact NH1-OE2 2.74Å; R124-E128 PolarHBondContact O-N 2.8Å; L125-E128 PolarHBondContact O-N 2.74Å; F126-E128 VanDerWaalsContact C-N 3.29Å
129	T	97.8	Very high	98.3	Very high	38 Å²	38	71.7 Å²	71.7	23%	0.233	35%	0.345	C	S	.	.			trans	-149	124.4	172.6	177.5	0	0	0	0	113.5	L125 F126 Y131 P132 M136	L125-T129 PolarHBondContact O-N 3.13Å; F126-T129 CarbonylContact O-C 3.59Å; F126-T129 VanDerWaalsContact O-C 3.25Å; F126-T129 PolarHBondContact O-N 3.43Å; T129-Y131 PolarHBondContact O-N 3.41Å; T129-Y131 PolarHBondContact OG1-N 3.38Å; T129-Y131 VanDerWaalsContact OG1-N 3.14Å; T129-Y131 PolarHBondContact OG1-O 3.36Å; T129-P132 HydrophobicContact CG2-CB 4.09Å; T129-M136 HydrophobicContact CG2-CE 3.62Å; T129-M136 HydrophobicContact CG2-SD 4.3Å
130	H	97.9	Very high	98.3	Very high	93 Å²	93	69.4 Å²	69.4	43%	0.431	33%	0.333	S	S	.	.	S	Bend	trans	-66.6	-19.4	172	-61.7	141.9	0	0	0	113.6	F126 R159	F126-H130 AromaticContact CD1-CD2 3.62Å; F126-H130 AromaticContact CD2-CD2 3.99Å; F126-H130 AromaticContact CE1-CD2 3.21Å; F126-H130 WeakPolarHBondContact CE1-CD2 3.48Å; F126-H130 AromaticContact CE1-NE2 3.48Å; F126-H130 WeakPolarHBondContact CE1-NE2 3.21Å; F126-H130 HydrophobicContact CE2-CB 4.19Å; F126-H130 AromaticContact CE2-CD2 3.61Å; F126-H130 AromaticContact CG-CD2 3.99Å; F126-H130 HydrophobicContact CZ-CB 4.42Å; F126-H130 AromaticContact CZ-CD2 3.19Å; F126-H130 WeakPolarHBondContact CZ-CD2 3.45Å; F126-H130 AromaticContact CZ-NE2 3.82Å; F126-H130 PolarHBondContact O-CD2 3.14Å; F126-H130 PolarHBondContact O-N 3.49Å; H130-R159 VanDerWaalsContact O-CD 3.28Å; H130-R159 WeakPolarHBondContact O-CD 3.28Å; H130-R159 PolarHBondContact O-NH1 3.15Å
131	Y	98.3	Very high	98.3	Very high	157 Å²	157	65.5 Å²	65.5	62%	0.616	31%	0.312	S	S	*	.	S	Bend	trans	-131.7	71.1	-175.2	-65.1	-92.4	0	0	0	110.4	T129	T129-Y131 PolarHBondContact O-N 3.41Å; T129-Y131 PolarHBondContact OG1-N 3.38Å; T129-Y131 VanDerWaalsContact OG1-N 3.14Å; T129-Y131 PolarHBondContact OG1-O 3.36Å
132	P	98	Very high	98.3	Very high	6 Å²	6	70 Å²	70	4%	0.039	33%	0.334	C	S	.	.			trans	-64.8	137.9	178.1	28.4	-37	0	0	0	111.2	L125 T129 M136 R137 F155	L125-P132 HydrophobicContact CD2-CB 4.23Å; T129-P132 HydrophobicContact CG2-CB 4.09Å; P132-M136 HydrophobicContact CB-CB 4Å; P132-M136 HydrophobicContact CB-SD 4.4Å; P132-R137 HydrophobicContact CB-CG 3.95Å; P132-R137 HydrophobicContact CG-CG 3.72Å; P132-R137 PolarHBondContact O-NH1 2.97Å; P132-F155 VanDerWaalsContact CD-CE1 3.49Å; P132-F155 HydrophobicContact CG-CD1 3.6Å; P132-F155 HydrophobicContact CG-CD2 4.01Å; P132-F155 HydrophobicContact CG-CE1 3.54Å; P132-F155 HydrophobicContact CG-CE2 3.96Å; P132-F155 HydrophobicContact CG-CG 3.86Å; P132-F155 HydrophobicContact CG-CZ 3.74Å
133	D	98.4	Very high	98.3	Very high	102 Å²	102	77.4 Å²	77.4	55%	0.545	36%	0.362	S	S	.	.			trans	-65.8	165.5	176.9	-177.3	42.9	0	0	0	112.4	F135 M136 R137	D133-F135 VanDerWaalsContact C-N 3.3Å; D133-F135 PolarHBondContact O-N 2.82Å; D133-F135 PolarHBondContact OD2-N 3.05Å; D133-M136 HydrophobicContact CB-CG 4.31Å; D133-M136 HydrophobicContact CB-SD 4.3Å; D133-M136 PolarHBondContact O-N 3.25Å; D133-R137 WeakPolarHBondContact O-CG 3.43Å; D133-R137 PolarHBondContact O-N 3.29Å; D133-R137 PolarHBondContact O-NH1 3.48Å
134	A	98.1	Very high	98.2	Very high	49 Å²	49	75.4 Å²	75.4	41%	0.405	35%	0.353	S	S	.	.	H	α-helix	trans	-50.9	-47.8	176.8	0	0	0	0	0	112.3	M136 R137 E138	A134-M136 PolarHBondContact O-N 3.28Å; A134-R137 PolarHBondContact O-N 2.94Å; A134-E138 WeakPolarHBondContact O-CB 3.43Å; A134-E138 PolarHBondContact O-N 3.22Å
135	F	98.4	Very high	98.2	Very high	141 Å²	141	73.7 Å²	73.7	62%	0.618	37%	0.369	S	S	*	.	H	α-helix	trans	-61.3	-46.5	178.5	-178.5	-97.6	0	0	0	112.3	D133 R137 E138 E139	D133-F135 VanDerWaalsContact C-N 3.3Å; D133-F135 PolarHBondContact O-N 2.82Å; D133-F135 PolarHBondContact OD2-N 3.05Å; F135-R137 VanDerWaalsContact C-N 3.31Å; F135-R137 PolarHBondContact O-N 3.5Å; F135-E138 PolarHBondContact O-N 2.92Å; F135-E139 PolarHBondContact O-N 3.28Å
136	M	98.3	Very high	98.1	Very high	56 Å²	56	74.4 Å²	74.4	28%	0.276	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-37.3	178.5	-59	176.7	74.4	0	0	112.4	L125 T129 P132 D133 A134 L140	L125-M136 HydrophobicContact CD1-CE 3.94Å; T129-M136 HydrophobicContact CG2-CE 3.62Å; T129-M136 HydrophobicContact CG2-SD 4.3Å; P132-M136 HydrophobicContact CB-CB 4Å; P132-M136 HydrophobicContact CB-SD 4.4Å; D133-M136 HydrophobicContact CB-CG 4.31Å; D133-M136 HydrophobicContact CB-SD 4.3Å; D133-M136 PolarHBondContact O-N 3.25Å; A134-M136 PolarHBondContact O-N 3.28Å; M136-L140 VanDerWaalsContact O-CB 3.31Å; M136-L140 WeakPolarHBondContact O-CB 3.39Å; M136-L140 PolarHBondContact O-N 3.2Å; M136-L140 VanDerWaalsContact O-N 3.08Å
137	R	98.7	Very high	98.1	Very high	46 Å²	46	77.4 Å²	77.4	17%	0.174	39%	0.394	C	S	.	.	H	α-helix	trans	-71.2	-37	176.1	-66.2	-168.8	-47	-80.3	-4.8	112.1	P132 D133 A134 F135 S141 E148 V151	P132-R137 HydrophobicContact CB-CG 3.95Å; P132-R137 HydrophobicContact CG-CG 3.72Å; P132-R137 PolarHBondContact O-NH1 2.97Å; D133-R137 WeakPolarHBondContact O-CG 3.43Å; D133-R137 PolarHBondContact O-N 3.29Å; D133-R137 PolarHBondContact O-NH1 3.48Å; A134-R137 PolarHBondContact O-N 2.94Å; F135-R137 VanDerWaalsContact C-N 3.31Å; F135-R137 PolarHBondContact O-N 3.5Å; R137-S141 VanDerWaalsContact O-CB 3.24Å; R137-S141 WeakPolarHBondContact O-CB 3.48Å; R137-S141 PolarHBondContact O-N 3.04Å; R137-E148 HydrophobicContact CB-CG 4.07Å; R137-E148 IonicContact CZ-OE1 3.17Å; R137-E148 IonicContact NE-OE1 2.74Å; R137-E148 PolarHBondContact NE-OE1 3.26Å; R137-E148 IonicContact NH2-OE1 2.74Å; R137-E148 PolarHBondContact NH2-OE1 2.75Å; R137-V151 HydrophobicContact CB-CG1 4.16Å; R137-V151 HydrophobicContact CG-CG1 4.16Å
138	E	98.6	Very high	98.1	Very high	105 Å²	105	74 Å²	74	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-67.1	-49.2	177.1	-178	144.5	-135	0	0	111	A134 F135 L140 S141 Q142	A134-E138 WeakPolarHBondContact O-CB 3.43Å; A134-E138 PolarHBondContact O-N 3.22Å; F135-E138 PolarHBondContact O-N 2.92Å; E138-L140 PolarHBondContact O-N 2.9Å; E138-S141 WeakPolarHBondContact O-CB 3.3Å; E138-S141 PolarHBondContact O-N 2.99Å; E138-S141 VanDerWaalsContact O-N 3.07Å; E138-S141 PolarHBondContact O-OG 3.41Å; E138-Q142 WeakPolarHBondContact O-CG 3.44Å; E138-Q142 PolarHBondContact O-N 2.97Å
139	E	98.4	Very high	98.1	Very high	77 Å²	77	70.1 Å²	70.1	36%	0.36	36%	0.364	S	S	.	.	H	α-helix	trans	-55.7	-48.7	174	-178.2	178.4	-161	0	0	111.8	F135 S141 Q142 R143	F135-E139 PolarHBondContact O-N 3.28Å; E139-S141 VanDerWaalsContact C-N 3.29Å; E139-S141 PolarHBondContact O-N 3.39Å; E139-Q142 PolarHBondContact O-N 3.41Å; E139-R143 WeakPolarHBondContact O-CG 3.4Å; E139-R143 PolarHBondContact O-N 2.83Å; E139-R143 IonicContact OE1-CZ 3.07Å; E139-R143 IonicContact OE1-NE 2.66Å; E139-R143 PolarHBondContact OE1-NE 3.15Å; E139-R143 IonicContact OE1-NH2 3.38Å; E139-R143 PolarHBondContact OE1-NH2 3.04Å
140	L	98.3	Very high	98.1	Very high	5 Å²	5	71.6 Å²	71.6	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-62.8	-36.5	177.1	-177.9	61.5	0	0	0	112.2	E121 L122 L125 M136 E138 R143 L144 V151 F155	E121-L140 HydrophobicContact CB-CD1 4.49Å; E121-L140 HydrophobicContact CG-CD1 3.53Å; L122-L140 HydrophobicContact CD2-CD2 3.73Å; L122-L140 HydrophobicContact CG-CD2 4.44Å; L125-L140 HydrophobicContact CB-CD2 4.43Å; L125-L140 HydrophobicContact CD2-CB 4.4Å; L125-L140 HydrophobicContact CD2-CD2 3.68Å; M136-L140 VanDerWaalsContact O-CB 3.31Å; M136-L140 WeakPolarHBondContact O-CB 3.39Å; M136-L140 PolarHBondContact O-N 3.2Å; M136-L140 VanDerWaalsContact O-N 3.08Å; E138-L140 PolarHBondContact O-N 2.9Å; L140-R143 PolarHBondContact O-N 2.97Å; L140-L144 HydrophobicContact CD1-CD1 3.7Å; L140-L144 HydrophobicContact CD1-CG 3.84Å; L140-L144 HydrophobicContact CG-CD1 3.98Å; L140-L144 HydrophobicContact CG-CG 4.36Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 WeakPolarHBondContact O-CG 3.43Å; L140-L144 PolarHBondContact O-N 3.39Å; L140-V151 HydrophobicContact CD2-CG1 3.99Å; L140-F155 HydrophobicContact CD2-CE2 4.13Å
141	S	98.4	Very high	98.1	Very high	9 Å²	9	67.1 Å²	67.1	6%	0.063	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-40.1	178.5	79.3	0	0	0	0	112	R137 E138 E139 L144 G145 L146	R137-S141 VanDerWaalsContact O-CB 3.24Å; R137-S141 WeakPolarHBondContact O-CB 3.48Å; R137-S141 PolarHBondContact O-N 3.04Å; E138-S141 WeakPolarHBondContact O-CB 3.3Å; E138-S141 PolarHBondContact O-N 2.99Å; E138-S141 VanDerWaalsContact O-N 3.07Å; E138-S141 PolarHBondContact O-OG 3.41Å; E139-S141 VanDerWaalsContact C-N 3.29Å; E139-S141 PolarHBondContact O-N 3.39Å; S141-L144 PolarHBondContact O-N 3.01Å; S141-G145 PolarHBondContact O-N 3.35Å; S141-G145 VanDerWaalsContact O-N 3.07Å; S141-L146 CarbonylContact C-O 3.46Å; S141-L146 VanDerWaalsContact CB-O 3.28Å; S141-L146 WeakPolarHBondContact CB-O 3.39Å; S141-L146 PolarHBondContact O-N 3.03Å; S141-L146 VanDerWaalsContact O-O 3.05Å
142	Q	98.4	Very high	98.1	Very high	141 Å²	141	63.2 Å²	63.2	66%	0.659	33%	0.332	S	S	*	.	H	α-helix	trans	-64.8	-49.3	174.7	-66.1	174.4	22.6	0	0	111.2	E138 E139 L144 G145	E138-Q142 WeakPolarHBondContact O-CG 3.44Å; E138-Q142 PolarHBondContact O-N 2.97Å; E139-Q142 PolarHBondContact O-N 3.41Å; Q142-L144 PolarHBondContact O-N 3.19Å; Q142-G145 PolarHBondContact O-N 3.34Å
143	R	97.9	Very high	98.2	Very high	155 Å²	155	65.7 Å²	65.7	59%	0.585	35%	0.347	S	S	*	.	H	α-helix	trans	-57	-35.5	177.7	-70	175.4	-178.3	-153.8	3.6	113	E139 L140	E139-R143 WeakPolarHBondContact O-CG 3.4Å; E139-R143 PolarHBondContact O-N 2.83Å; E139-R143 IonicContact OE1-CZ 3.07Å; E139-R143 IonicContact OE1-NE 2.66Å; E139-R143 PolarHBondContact OE1-NE 3.15Å; E139-R143 IonicContact OE1-NH2 3.38Å; E139-R143 PolarHBondContact OE1-NH2 3.04Å; L140-R143 PolarHBondContact O-N 2.97Å
144	L	97.7	Very high	98.2	Very high	25 Å²	25	62.1 Å²	62.1	13%	0.131	33%	0.326	C	S	.	.	H	α-helix	trans	-96.8	-3.6	-175.7	-66.1	-171.7	0	0	0	115.2	Q118 E121 L122 L140 S141 Q142 L146	Q118-L144 HydrophobicContact CB-CD1 4.3Å; Q118-L144 HydrophobicContact CB-CD2 4.5Å; Q118-L144 HydrophobicContact CG-CB 4.21Å; Q118-L144 HydrophobicContact CG-CD1 4.47Å; Q118-L144 HydrophobicContact CG-CD2 4.15Å; Q118-L144 PolarHBondContact NE2-O 2.96Å; E121-L144 HydrophobicContact CB-CD2 4.08Å; E121-L144 HydrophobicContact CG-CD2 4.31Å; L122-L144 HydrophobicContact CD1-CD1 4.31Å; L122-L144 HydrophobicContact CD2-CD1 4.42Å; L122-L144 HydrophobicContact CG-CD1 3.85Å; L140-L144 HydrophobicContact CD1-CD1 3.7Å; L140-L144 HydrophobicContact CD1-CG 3.84Å; L140-L144 HydrophobicContact CG-CD1 3.98Å; L140-L144 HydrophobicContact CG-CG 4.36Å; L140-L144 WeakPolarHBondContact O-CB 3.4Å; L140-L144 WeakPolarHBondContact O-CG 3.43Å; L140-L144 PolarHBondContact O-N 3.39Å; S141-L144 PolarHBondContact O-N 3.01Å; Q142-L144 PolarHBondContact O-N 3.19Å; L144-L146 VanDerWaalsContact C-N 3.3Å; L144-L146 HydrophobicContact CB-CD1 3.84Å; L144-L146 HydrophobicContact CB-CG 4.01Å; L144-L146 HydrophobicContact CD1-CD1 4.1Å; L144-L146 PolarHBondContact O-N 2.73Å
145	G	97.7	Very high	98.2	Very high	72 Å²	72	59.8 Å²	59.8	74%	0.742	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	32.7	-174.6	0	0	0	0	0	113.5	S141 Q142	S141-G145 PolarHBondContact O-N 3.35Å; S141-G145 VanDerWaalsContact O-N 3.07Å; Q142-G145 PolarHBondContact O-N 3.34Å
146	L	97.4	Very high	98.2	Very high	27 Å²	27	57.3 Å²	57.3	14%	0.141	30%	0.297	C	S	.	.			trans	-114.4	162.2	-179.4	-63.3	172.7	0	0	0	109.8	T112 F114 S141 L144 V151	T112-L146 HydrophobicContact CG2-CD2 4.36Å; F114-L146 HydrophobicContact CD1-CD1 3.81Å; F114-L146 HydrophobicContact CD1-CD2 4.06Å; F114-L146 HydrophobicContact CE1-CD1 3.76Å; F114-L146 HydrophobicContact CE1-CD2 3.99Å; S141-L146 CarbonylContact C-O 3.46Å; S141-L146 VanDerWaalsContact CB-O 3.28Å; S141-L146 WeakPolarHBondContact CB-O 3.39Å; S141-L146 PolarHBondContact O-N 3.03Å; S141-L146 VanDerWaalsContact O-O 3.05Å; L144-L146 VanDerWaalsContact C-N 3.3Å; L144-L146 HydrophobicContact CB-CD1 3.84Å; L144-L146 HydrophobicContact CB-CG 4.01Å; L144-L146 HydrophobicContact CD1-CD1 4.1Å; L144-L146 PolarHBondContact O-N 2.73Å; L146-V151 HydrophobicContact CB-CG2 4.4Å
147	S	97.9	Very high	98.2	Very high	71 Å²	71	59.6 Å²	59.6	50%	0.497	31%	0.31	S	S	.	.			trans	-83.3	147.2	166.8	64.3	0	0	0	0	111.4	A149 R150 V151	S147-A149 PolarHBondContact O-N 2.79Å; S147-A149 VanDerWaalsContact O-N 3.16Å; S147-R150 WeakPolarHBondContact O-CA 3.38Å; S147-R150 VanDerWaalsContact O-CB 3.3Å; S147-R150 WeakPolarHBondContact O-CB 3.5Å; S147-R150 PolarHBondContact O-N 2.76Å; S147-R150 WeakPolarHBondContact OG-CG 3.42Å; S147-V151 PolarHBondContact O-N 2.98Å
148	E	98.3	Very high	98.2	Very high	53 Å²	53	60.3 Å²	60.3	25%	0.248	31%	0.313	C	S	.	.	H	α-helix	trans	-48.5	-43.9	177	-176.2	-77.9	158.8	0	0	111.5	R137 R150 V151 Q152	R137-E148 HydrophobicContact CB-CG 4.07Å; R137-E148 IonicContact CZ-OE1 3.17Å; R137-E148 IonicContact NE-OE1 2.74Å; R137-E148 PolarHBondContact NE-OE1 3.26Å; R137-E148 IonicContact NH2-OE1 2.74Å; R137-E148 PolarHBondContact NH2-OE1 2.75Å; E148-R150 PolarHBondContact O-N 3.42Å; E148-R150 VanDerWaalsContact O-N 3.16Å; E148-V151 CarbonylContact O-C 3.25Å; E148-V151 WeakPolarHBondContact O-CA 3.41Å; E148-V151 WeakPolarHBondContact O-CB 3.42Å; E148-V151 PolarHBondContact O-N 3.21Å; E148-Q152 WeakPolarHBondContact O-CB 3.37Å; E148-Q152 PolarHBondContact O-N 3.18Å
149	A	97.6	Very high	98.1	Very high	44 Å²	44	57.5 Å²	57.5	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-24.3	177.4	0	0	0	0	0	114.1	S147 V153	S147-A149 PolarHBondContact O-N 2.79Å; S147-A149 VanDerWaalsContact O-N 3.16Å; A149-V153 WeakPolarHBondContact O-CB 3.39Å; A149-V153 WeakPolarHBondContact O-CG2 3.28Å; A149-V153 PolarHBondContact O-N 3.29Å
150	R	97.9	Very high	98.1	Very high	69 Å²	69	55.9 Å²	55.9	26%	0.26	30%	0.298	S	S	.	.	H	α-helix	trans	-75.4	-43.9	171.4	-66	-72.9	95.8	147.5	4.6	111.2	T112 F114 S147 E148 V153 W154	T112-R150 WeakPolarHBondContact OG1-CD 3.47Å; T112-R150 PolarHBondContact OG1-NH1 2.68Å; T112-R150 VanDerWaalsContact OG1-NH1 3.14Å; F114-R150 HydrophobicContact CE1-CB 4.49Å; S147-R150 WeakPolarHBondContact O-CA 3.38Å; S147-R150 VanDerWaalsContact O-CB 3.3Å; S147-R150 WeakPolarHBondContact O-CB 3.5Å; S147-R150 PolarHBondContact O-N 2.76Å; S147-R150 WeakPolarHBondContact OG-CG 3.42Å; E148-R150 PolarHBondContact O-N 3.42Å; E148-R150 VanDerWaalsContact O-N 3.16Å; R150-V153 PolarHBondContact O-N 3.31Å; R150-W154 WeakPolarHBondContact O-CB 3.18Å; R150-W154 PolarHBondContact O-N 2.96Å
151	V	98.3	Very high	98	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-50.6	174	179.2	0	0	0	0	109.4	L122 R137 L140 L146 S147 E148 V153 W154 F155	L122-V151 HydrophobicContact CD2-CG1 4.07Å; R137-V151 HydrophobicContact CB-CG1 4.16Å; R137-V151 HydrophobicContact CG-CG1 4.16Å; L140-V151 HydrophobicContact CD2-CG1 3.99Å; L146-V151 HydrophobicContact CB-CG2 4.4Å; S147-V151 PolarHBondContact O-N 2.98Å; E148-V151 CarbonylContact O-C 3.25Å; E148-V151 WeakPolarHBondContact O-CA 3.41Å; E148-V151 WeakPolarHBondContact O-CB 3.42Å; E148-V151 PolarHBondContact O-N 3.21Å; V151-V153 PolarHBondContact O-N 3.17Å; V151-W154 WeakPolarHBondContact O-CB 3.28Å; V151-W154 PolarHBondContact O-N 3.2Å; V151-W154 VanDerWaalsContact O-N 3.08Å; V151-F155 HydrophobicContact CG1-CD2 3.79Å; V151-F155 HydrophobicContact CG1-CE2 3.83Å; V151-F155 WeakPolarHBondContact O-CD2 3.32Å; V151-F155 PolarHBondContact O-N 3.16Å
152	Q	98.4	Very high	97.8	Very high	75 Å²	75	64.4 Å²	64.4	35%	0.35	34%	0.34	S	S	.	.	H	α-helix	trans	-54	-48.6	177	-164.4	-156.2	25.8	0	0	112.4	E148 F155 Q156	E148-Q152 WeakPolarHBondContact O-CB 3.37Å; E148-Q152 PolarHBondContact O-N 3.18Å; Q152-F155 PolarHBondContact O-N 3.21Å; Q152-Q156 VanDerWaalsContact O-CG 3.32Å; Q152-Q156 WeakPolarHBondContact O-CG 3.21Å; Q152-Q156 PolarHBondContact O-N 3.25Å
153	V	98.3	Very high	97.7	Very high	57 Å²	57	63.6 Å²	63.6	35%	0.345	33%	0.331	S	S	.	.	H	α-helix	trans	-67.3	-35.5	177.4	167.8	0	0	0	0	112	A149 R150 V151 N157	A149-V153 WeakPolarHBondContact O-CB 3.39Å; A149-V153 WeakPolarHBondContact O-CG2 3.28Å; A149-V153 PolarHBondContact O-N 3.29Å; R150-V153 PolarHBondContact O-N 3.31Å; V151-V153 PolarHBondContact O-N 3.17Å; V153-N157 WeakPolarHBondContact CG1-ND2 3.08Å; V153-N157 WeakPolarHBondContact O-CB 3.32Å; V153-N157 PolarHBondContact O-N 3.08Å; V153-N157 PolarHBondContact O-ND2 2.69Å
154	W	98.4	Very high	97.5	Very high	27 Å²	27	62.8 Å²	62.8	10%	0.102	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-49.8	174.2	-173.7	102.9	0	0	0	110.8	F114 L122 E123 F126 R150 V151 Q156 N157 R158	F114-W154 AromaticContact CE2-CD1 3.69Å; F114-W154 HydrophobicContact CZ-CB 4.46Å; L122-W154 HydrophobicContact CB-CD2 4.02Å; L122-W154 HydrophobicContact CB-CE3 4.02Å; L122-W154 HydrophobicContact CB-CH2 3.77Å; L122-W154 HydrophobicContact CB-CZ2 3.74Å; L122-W154 HydrophobicContact CB-CZ3 3.91Å; L122-W154 HydrophobicContact CD1-CD2 4.03Å; L122-W154 HydrophobicContact CD1-CG 3.96Å; L122-W154 HydrophobicContact CD2-CD2 4.04Å; L122-W154 HydrophobicContact CD2-CE3 3.93Å; L122-W154 HydrophobicContact CD2-CG 4.29Å; L122-W154 HydrophobicContact CD2-CZ3 4.49Å; L122-W154 HydrophobicContact CG-CD2 4.27Å; L122-W154 HydrophobicContact CG-CE3 4.44Å; L122-W154 WeakPolarHBondContact O-CH2 3.28Å; L122-W154 WeakPolarHBondContact O-CZ3 3.36Å; E123-W154 HydrophobicContact CG-CH2 3.74Å; E123-W154 HydrophobicContact CG-CZ2 3.77Å; F126-W154 HydrophobicContact CB-CH2 4.29Å; F126-W154 HydrophobicContact CB-CZ3 4.14Å; F126-W154 HydrophobicContact CD2-CZ3 4.27Å; F126-W154 HydrophobicContact CG-CZ3 4.43Å; R150-W154 WeakPolarHBondContact O-CB 3.18Å; R150-W154 PolarHBondContact O-N 2.96Å; V151-W154 WeakPolarHBondContact O-CB 3.28Å; V151-W154 PolarHBondContact O-N 3.2Å; V151-W154 VanDerWaalsContact O-N 3.08Å; W154-Q156 PolarHBondContact O-N 3.45Å; W154-N157 PolarHBondContact O-N 3.21Å; W154-N157 VanDerWaalsContact O-N 3.15Å; W154-R158 HydrophobicContact CE3-CB 4.1Å; W154-R158 HydrophobicContact CH2-CB 4.13Å; W154-R158 HydrophobicContact CH2-CG 3.82Å; W154-R158 HydrophobicContact CZ3-CB 3.85Å; W154-R158 HydrophobicContact CZ3-CG 3.89Å; W154-R158 WeakPolarHBondContact O-CB 3.37Å; W154-R158 PolarHBondContact O-N 2.88Å
155	F	98.7	Very high	97.1	Very high	1 Å²	1	67.3 Å²	67.3	0%	0.004	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-40	178	-89.3	-90.8	0	0	0	112.6	L122 L125 F126 P132 L140 V151 Q152 R158 R159	L122-F155 HydrophobicContact CD2-CD2 4.35Å; L122-F155 HydrophobicContact CD2-CE2 3.85Å; L125-F155 HydrophobicContact CB-CZ 4.25Å; L125-F155 HydrophobicContact CD2-CZ 4.16Å; L125-F155 HydrophobicContact CG-CZ 4.33Å; F126-F155 HydrophobicContact CB-CE1 4Å; F126-F155 HydrophobicContact CB-CZ 4.44Å; F126-F155 AromaticContact CD2-CD1 3.75Å; F126-F155 HydrophobicContact CD2-CD1 3.75Å; F126-F155 AromaticContact CD2-CE1 3.75Å; F126-F155 HydrophobicContact CD2-CE1 3.75Å; F126-F155 HydrophobicContact CE2-CD1 4.46Å; F126-F155 HydrophobicContact CG-CE1 4.38Å; P132-F155 VanDerWaalsContact CD-CE1 3.49Å; P132-F155 HydrophobicContact CG-CD1 3.6Å; P132-F155 HydrophobicContact CG-CD2 4.01Å; P132-F155 HydrophobicContact CG-CE1 3.54Å; P132-F155 HydrophobicContact CG-CE2 3.96Å; P132-F155 HydrophobicContact CG-CG 3.86Å; P132-F155 HydrophobicContact CG-CZ 3.74Å; L140-F155 HydrophobicContact CD2-CE2 4.13Å; V151-F155 HydrophobicContact CG1-CD2 3.79Å; V151-F155 HydrophobicContact CG1-CE2 3.83Å; V151-F155 WeakPolarHBondContact O-CD2 3.32Å; V151-F155 PolarHBondContact O-N 3.16Å; Q152-F155 PolarHBondContact O-N 3.21Å; F155-R158 PolarHBondContact O-N 2.99Å; F155-R159 WeakPolarHBondContact O-CG 3.28Å; F155-R159 PolarHBondContact O-N 3.06Å
156	Q	98.5	Very high	96.4	Very high	89 Å²	89	68.8 Å²	68.8	42%	0.416	34%	0.339	S	S	.	.	H	α-helix	trans	-59.9	-46.9	173.1	-72.6	175.3	31.4	0	0	112.1	Q152 W154 A160	Q152-Q156 VanDerWaalsContact O-CG 3.32Å; Q152-Q156 WeakPolarHBondContact O-CG 3.21Å; Q152-Q156 PolarHBondContact O-N 3.25Å; W154-Q156 PolarHBondContact O-N 3.45Å; Q156-A160 WeakPolarHBondContact O-CB 3.42Å; Q156-A160 PolarHBondContact O-N 2.98Å
157	N	98.1	Very high	95.7	Very high	104 Å²	104	71.8 Å²	71.8	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-65.5	-40.1	178	-74.2	-46.8	0	0	0	112.2	V153 W154 A160 K161	V153-N157 WeakPolarHBondContact CG1-ND2 3.08Å; V153-N157 WeakPolarHBondContact O-CB 3.32Å; V153-N157 PolarHBondContact O-N 3.08Å; V153-N157 PolarHBondContact O-ND2 2.69Å; W154-N157 PolarHBondContact O-N 3.21Å; W154-N157 VanDerWaalsContact O-N 3.15Å; N157-A160 PolarHBondContact O-N 2.65Å; N157-K161 PolarHBondContact O-N 2.61Å
158	R	98.1	Very high	94.7	Very high	61 Å²	61	73.7 Å²	73.7	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-62.1	-48.6	176.7	-174.6	68.4	178.5	-161.8	-7.1	111.2	E123 F126 W154 F155 A160 K161 C162	E123-R158 IonicContact OE1-CZ 3.3Å; E123-R158 VanDerWaalsContact OE1-CZ 3.3Å; E123-R158 IonicContact OE1-NH1 2.6Å; E123-R158 PolarHBondContact OE1-NH1 3.03Å; E123-R158 IonicContact OE1-NH2 3.5Å; E123-R158 PolarHBondContact OE1-NH2 3.29Å; F126-R158 HydrophobicContact CD1-CG 3.86Å; F126-R158 HydrophobicContact CD2-CB 4.15Å; F126-R158 HydrophobicContact CD2-CG 3.5Å; F126-R158 VanDerWaalsContact CD2-CG 3.5Å; F126-R158 HydrophobicContact CE1-CG 3.69Å; F126-R158 HydrophobicContact CE2-CB 3.89Å; F126-R158 HydrophobicContact CE2-CG 3.33Å; F126-R158 HydrophobicContact CG-CG 3.77Å; F126-R158 HydrophobicContact CZ-CB 4.33Å; F126-R158 HydrophobicContact CZ-CG 3.44Å; F126-R158 VanDerWaalsContact CZ-CG 3.44Å; W154-R158 HydrophobicContact CE3-CB 4.1Å; W154-R158 HydrophobicContact CH2-CB 4.13Å; W154-R158 HydrophobicContact CH2-CG 3.82Å; W154-R158 HydrophobicContact CZ3-CB 3.85Å; W154-R158 HydrophobicContact CZ3-CG 3.89Å; W154-R158 WeakPolarHBondContact O-CB 3.37Å; W154-R158 PolarHBondContact O-N 2.88Å; F155-R158 PolarHBondContact O-N 2.99Å; R158-A160 VanDerWaalsContact C-N 3.33Å; R158-A160 PolarHBondContact O-N 3.2Å; R158-K161 WeakPolarHBondContact O-CB 3.38Å; R158-K161 PolarHBondContact O-N 3.11Å; R158-C162 PolarHBondContact O-N 3.1Å
159	R	98	Very high	93.4	Very high	46 Å²	46	78.2 Å²	78.2	17%	0.174	38%	0.379	C	S	.	.	H	α-helix	trans	-60.9	-38.4	173.5	-70.4	-163.9	-63.6	-87.1	4.7	112.8	F126 H130 F155 C162 R163	F126-R159 HydrophobicContact CE2-CG 3.83Å; F126-R159 HydrophobicContact CZ-CG 4.33Å; H130-R159 VanDerWaalsContact O-CD 3.28Å; H130-R159 WeakPolarHBondContact O-CD 3.28Å; H130-R159 PolarHBondContact O-NH1 3.15Å; F155-R159 WeakPolarHBondContact O-CG 3.28Å; F155-R159 PolarHBondContact O-N 3.06Å; R159-C162 PolarHBondContact O-N 2.94Å; R159-R163 PolarHBondContact O-N 3.11Å
160	A	97.8	Very high	92.1	Very high	43 Å²	43	83.1 Å²	83.1	36%	0.355	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-39.4	176	0	0	0	0	0	112.5	Q156 N157 R158 K164	Q156-A160 WeakPolarHBondContact O-CB 3.42Å; Q156-A160 PolarHBondContact O-N 2.98Å; N157-A160 PolarHBondContact O-N 2.65Å; R158-A160 VanDerWaalsContact C-N 3.33Å; R158-A160 PolarHBondContact O-N 3.2Å; A160-K164 WeakPolarHBondContact O-CB 3.21Å; A160-K164 PolarHBondContact O-N 3.14Å; A160-K164 VanDerWaalsContact O-N 3.08Å
161	K	96.3	Very high	90.5	Very high	136 Å²	136	87.5 Å²	87.5	59%	0.591	42%	0.416	S	S	*	.	H	α-helix	trans	-62.6	-45.4	172.9	-173.7	-174.7	176.1	-169.3	0	111.2	N157 R158 K164 Q165	N157-K161 PolarHBondContact O-N 2.61Å; R158-K161 WeakPolarHBondContact O-CB 3.38Å; R158-K161 PolarHBondContact O-N 3.11Å; K161-K164 PolarHBondContact O-N 3.32Å; K161-Q165 PolarHBondContact O-N 2.86Å
162	C	94.4	Very high	88.5	Confident	57 Å²	57	90.3 Å²	90.3	39%	0.385	45%	0.445	S	S	.	.	H	α-helix	trans	-58.2	-54.4	178.6	-173	0	0	0	0	111.9	R158 R159 K164 Q165 E166	R158-C162 PolarHBondContact O-N 3.1Å; R159-C162 PolarHBondContact O-N 2.94Å; C162-K164 VanDerWaalsContact C-N 3.25Å; C162-K164 PolarHBondContact O-N 2.91Å; C162-Q165 WeakPolarHBondContact O-CB 3.45Å; C162-Q165 PolarHBondContact O-N 3.19Å; C162-E166 PolarHBondContact O-N 3.16Å
163	R	95.7	Very high	86.6	Confident	124 Å²	124	91.6 Å²	91.6	47%	0.468	46%	0.457	S	S	.	.	H	α-helix	trans	-58.4	-34.4	175.1	-66.8	-169	-57.4	-88.9	1.2	113.2	R159 N167	R159-R163 PolarHBondContact O-N 3.11Å; R163-N167 VanDerWaalsContact O-CB 3.28Å; R163-N167 WeakPolarHBondContact O-CB 3.31Å; R163-N167 VanDerWaalsContact O-CG 3.24Å; R163-N167 PolarHBondContact O-N 3.31Å; R163-N167 PolarHBondContact O-OD1 2.99Å
164	K	93.2	Very high	84.3	Confident	137 Å²	137	96.6 Å²	96.6	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-69.1	-34.8	175.3	-171.1	-175.4	173.1	-173.5	0	112	A160 K161 C162 Q168	A160-K164 WeakPolarHBondContact O-CB 3.21Å; A160-K164 PolarHBondContact O-N 3.14Å; A160-K164 VanDerWaalsContact O-N 3.08Å; K161-K164 PolarHBondContact O-N 3.32Å; C162-K164 VanDerWaalsContact C-N 3.25Å; C162-K164 PolarHBondContact O-N 2.91Å; K164-Q168 VanDerWaalsContact O-CG 3.28Å; K164-Q168 WeakPolarHBondContact O-CG 3.28Å; K164-Q168 PolarHBondContact O-N 2.84Å; K164-Q168 PolarHBondContact O-NE2 3.31Å
165	Q	89.2	Confident	82.1	Confident	120 Å²	120	102.7 Å²	102.7	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-67	-50.2	176.5	-173.4	168.1	7.1	0	0	110.5	K161 C162 N167 Q168 M169	K161-Q165 PolarHBondContact O-N 2.86Å; C162-Q165 WeakPolarHBondContact O-CB 3.45Å; C162-Q165 PolarHBondContact O-N 3.19Å; Q165-N167 PolarHBondContact O-N 2.82Å; Q165-Q168 PolarHBondContact O-N 3.1Å; Q165-Q168 VanDerWaalsContact O-N 3.16Å; Q165-M169 VanDerWaalsContact O-CG 3.28Å; Q165-M169 WeakPolarHBondContact O-CG 3.26Å; Q165-M169 PolarHBondContact O-N 2.98Å
166	E	84.5	Confident	79.3	Confident	103 Å²	103	105.6 Å²	105.6	48%	0.481	55%	0.545	S	S	.	.	H	α-helix	trans	-55.7	-48.8	174.7	-176.3	-179.7	-164.5	0	0	112.5	C162 Q168 M169 H170	C162-E166 PolarHBondContact O-N 3.16Å; E166-Q168 PolarHBondContact O-N 2.82Å; E166-M169 PolarHBondContact O-N 2.86Å; E166-H170 PolarHBondContact O-N 3.42Å; E166-H170 PolarHBondContact O-ND1 3.1Å
167	N	81.6	Confident	76.9	Confident	91 Å²	91	107.9 Å²	107.9	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-68.5	-17.9	180	-74.4	22.1	0	0	0	114.2	R163 Q165 K171	R163-N167 VanDerWaalsContact O-CB 3.28Å; R163-N167 WeakPolarHBondContact O-CB 3.31Å; R163-N167 VanDerWaalsContact O-CG 3.24Å; R163-N167 PolarHBondContact O-N 3.31Å; R163-N167 PolarHBondContact O-OD1 2.99Å; Q165-N167 PolarHBondContact O-N 2.82Å; N167-K171 VanDerWaalsContact O-CG 3.31Å; N167-K171 WeakPolarHBondContact O-CG 3.32Å
168	Q	77.5	Confident	74.1	Confident	111 Å²	111	105.8 Å²	105.8	52%	0.519	57%	0.574	S	S	.	*	H	α-helix	trans	-81.9	-38.4	172.7	-77	171.4	121.8	0	0	111.1	K164 Q165 E166 K171	K164-Q168 VanDerWaalsContact O-CG 3.28Å; K164-Q168 WeakPolarHBondContact O-CG 3.28Å; K164-Q168 PolarHBondContact O-N 2.84Å; K164-Q168 PolarHBondContact O-NE2 3.31Å; Q165-Q168 PolarHBondContact O-N 3.1Å; Q165-Q168 VanDerWaalsContact O-N 3.16Å; E166-Q168 PolarHBondContact O-N 2.82Å; Q168-K171 PolarHBondContact O-N 3.47Å
169	M	71.6	Confident	71.8	Confident	147 Å²	147	109.2 Å²	109.2	72%	0.724	61%	0.607	S	S	*	*	H	α-helix	trans	-60.9	-46.7	176.4	-57.5	-104.4	62.2	0	0	111	Q165 E166 K171	Q165-M169 VanDerWaalsContact O-CG 3.28Å; Q165-M169 WeakPolarHBondContact O-CG 3.26Å; Q165-M169 PolarHBondContact O-N 2.98Å; E166-M169 PolarHBondContact O-N 2.86Å; M169-K171 PolarHBondContact O-N 3.3Å
170	H	68.8	Low	69.4	Low	147 Å²	147	113.4 Å²	113.4	68%	0.681	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-14.5	-179.9	-71.6	95.6	0	0	0	115.1	E166	E166-H170 PolarHBondContact O-N 3.42Å; E166-H170 PolarHBondContact O-ND1 3.1Å
171	K	65.9	Low	67.3	Low	161 Å²	161	118.9 Å²	118.9	70%	0.7	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	8.3	-176.8	-75.5	-173.4	177.7	-165.4	0	114.4	N167 Q168 M169 V173	N167-K171 VanDerWaalsContact O-CG 3.31Å; N167-K171 WeakPolarHBondContact O-CG 3.32Å; Q168-K171 PolarHBondContact O-N 3.47Å; M169-K171 PolarHBondContact O-N 3.3Å; K171-V173 HydrophobicContact CB-CG2 4.48Å; K171-V173 PolarHBondContact O-N 3.29Å
172	G	56.1	Low	65	Low	60 Å²	60	118.8 Å²	118.8	62%	0.619	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.4	15.1	173.8	0	0	0	0	0	114.6	I174	G172-I174 VanDerWaalsContact C-N 3.33Å; G172-I174 PolarHBondContact O-N 3.12Å
173	V	58	Low	62.7	Low	101 Å²	101	120.1 Å²	120.1	61%	0.612	67%	0.672	S	S	*	*			trans	-75.9	93.4	174.5	-176.9	0	0	0	0	107.1	K171 L175	K171-V173 HydrophobicContact CB-CG2 4.48Å; K171-V173 PolarHBondContact O-N 3.29Å; V173-L175 HydrophobicContact CG1-CB 4.34Å; V173-L175 PolarHBondContact O-N 3.27Å
174	I	49.8	Very low	60.2	Low	162 Å²	162	119.3 Å²	119.3	83%	0.831	68%	0.684	S	S	*	*			trans	-62.9	81.7	164.7	-55.5	-69.1	0	0	0	107.7	G172	G172-I174 VanDerWaalsContact C-N 3.33Å; G172-I174 PolarHBondContact O-N 3.12Å
175	L	52.1	Low	58.3	Low	155 Å²	155	124.7 Å²	124.7	81%	0.812	70%	0.701	S	S	*	*			trans	-115.3	111.5	156	-134.1	75.3	0	0	0	105.6	V173	V173-L175 HydrophobicContact CG1-CB 4.34Å; V173-L175 PolarHBondContact O-N 3.27Å
176	G	40.8	Very low	56.2	Low	63 Å²	63	124.9 Å²	124.9	65%	0.649	71%	0.71	S	S	*	*			trans	-58.8	151.5	-158.3	0	0	0	0	0	114.7	G178	G176-G178 PolarHBondContact O-N 2.91Å
177	S	47.4	Very low	54.1	Low	136 Å²	136	124.6 Å²	124.6	95%	0.951	73%	0.725	S	S	*	*			trans	-46.6	108.4	153.7	47.1	0	0	0	0	109.6
178	G	40.2	Very low	52.4	Low	61 Å²	61	125 Å²	125	63%	0.629	73%	0.733	S	S	*	*			trans	-162.1	84.5	-172.4	0	0	0	0	0	110.9	G176 H180	G176-G178 PolarHBondContact O-N 2.91Å; G178-H180 PolarHBondContact O-N 2.96Å
179	S	48.8	Very low	51	Low	132 Å²	132	130.3 Å²	130.3	92%	0.923	75%	0.749	S	S	*	*			trans	-64	83.4	157.6	48.1	0	0	0	0	108.9
180	H	48.9	Very low	50	Low	135 Å²	135	128.7 Å²	128.7	63%	0.625	75%	0.748	S	S	*	*			trans	-128.4	81.8	174.9	-158.2	-86.4	0	0	0	109.6	G178 D182 A183	G178-H180 PolarHBondContact O-N 2.96Å; H180-D182 VanDerWaalsContact CE1-C 3.43Å; H180-D182 PolarHBondContact CE1-O 3.5Å; H180-A183 PolarHBondContact CE1-N 3.46Å; H180-A183 PolarHBondContact ND1-N 3.08Å
181	L	53.5	Low	49.1	Very low	158 Å²	158	128.3 Å²	128.3	83%	0.827	75%	0.751	S	S	*	*			trans	-59	147.2	148.6	-60	172.2	0	0	0	107.1
182	D	48.2	Very low	48.4	Very low	133 Å²	133	128.9 Å²	128.9	71%	0.711	76%	0.758	S	S	*	*			trans	68.2	48.2	175.7	-60.4	-64.7	0	0	0	118.6	H180 C184	H180-D182 VanDerWaalsContact CE1-C 3.43Å; H180-D182 PolarHBondContact CE1-O 3.5Å; D182-C184 VanDerWaalsContact C-N 3.28Å; D182-C184 PolarHBondContact O-N 3.47Å
183	A	44.5	Very low	47.8	Very low	86 Å²	86	128.9 Å²	128.9	71%	0.711	76%	0.758	S	S	*	*			trans	-73.7	86.2	151.8	0	0	0	0	0	109.6	H180	H180-A183 PolarHBondContact CE1-N 3.46Å; H180-A183 PolarHBondContact ND1-N 3.08Å
184	C	44	Very low	47.2	Very low	107 Å²	107	128.8 Å²	128.8	72%	0.723	77%	0.768	S	S	*	*			trans	-55.9	147.6	-174.6	-58.4	0	0	0	0	113.7	D182 V186	D182-C184 VanDerWaalsContact C-N 3.28Å; D182-C184 PolarHBondContact O-N 3.47Å; C184-V186 PolarHBondContact O-N 3.48Å
185	R	53.7	Low	47.1	Very low	250 Å²	250	129.1 Å²	129.1	94%	0.943	77%	0.77	S	S	*	*	S	Bend	trans	-65.7	99.8	165.7	-64.4	179	177.6	-153.8	2.3	110.5
186	V	43.6	Very low	47.2	Very low	124 Å²	124	132.6 Å²	132.6	75%	0.752	77%	0.773	S	S	*	*			trans	-159.1	123.7	138.1	167.1	0	0	0	0	106.5	C184 P188	C184-V186 PolarHBondContact O-N 3.48Å; V186-P188 WeakPolarHBondContact O-CD 3.42Å
187	A	41.1	Very low	48	Very low	97 Å²	97	137.3 Å²	137.3	80%	0.802	78%	0.78	S	S	*	*			trans	-94.8	110.4	163.4	0	0	0	0	0	108.3	Y189	A187-Y189 PolarHBondContact O-N 2.75Å
188	P	45.1	Very low	47.9	Very low	99 Å²	99	136.2 Å²	136.2	64%	0.643	77%	0.769	S	S	*	*			trans	-75.4	121.1	158.7	31.1	-28.3	0	0	0	107.6	V186 V190	V186-P188 WeakPolarHBondContact O-CD 3.42Å; P188-V190 PolarHBondContact O-N 3.33Å
189	Y	49.6	Very low	47.9	Very low	222 Å²	222	142.3 Å²	142.3	87%	0.871	78%	0.779	S	S	*	*			trans	-61.8	105.3	172.3	175.7	-90.8	0	0	0	109.6	A187	A187-Y189 PolarHBondContact O-N 2.75Å
190	V	49.1	Very low	47.8	Very low	113 Å²	113	144.2 Å²	144.2	69%	0.685	77%	0.773	S	S	*	*			trans	-133.6	131.8	162.8	-69	0	0	0	0	110.6	P188 M192	P188-V190 PolarHBondContact O-N 3.33Å; V190-M192 PolarHBondContact O-N 3.35Å
191	N	50.9	Low	47.6	Very low	139 Å²	139	144.5 Å²	144.5	74%	0.743	78%	0.775	S	S	*	*			trans	-80	104.7	-172.9	-175.9	-1.7	0	0	0	110.3	G193	N191-G193 PolarHBondContact O-N 2.94Å
192	M	50.6	Low	47	Very low	173 Å²	173	142.6 Å²	142.6	85%	0.852	77%	0.77	S	S	*	*			trans	-84.8	99.1	170.1	-80.6	-67.5	172.3	0	0	109.7	V190	V190-M192 PolarHBondContact O-N 3.35Å
193	G	44.6	Very low	46.8	Very low	60 Å²	60	143.7 Å²	143.7	62%	0.619	77%	0.77	S	S	*	*			trans	-59.4	137.9	-179.3	0	0	0	0	0	112.7	N191 L195	N191-G193 PolarHBondContact O-N 2.94Å; G193-L195 PolarHBondContact O-N 2.93Å; G193-L195 VanDerWaalsContact O-N 3.15Å
194	A	45.6	Very low	46.5	Very low	100 Å²	100	144 Å²	144	83%	0.826	77%	0.774	S	S	*	*			trans	-67.4	111.2	175.9	0	0	0	0	0	110.6	R196	A194-R196 VanDerWaalsContact C-N 3.3Å; A194-R196 PolarHBondContact O-N 2.95Å
195	L	47.3	Very low	46.3	Very low	168 Å²	168	147.6 Å²	147.6	88%	0.88	78%	0.779	S	S	*	*			trans	-69.3	91	166.3	-72.4	177.1	0	0	0	109.5	G193 M197	G193-L195 PolarHBondContact O-N 2.93Å; G193-L195 VanDerWaalsContact O-N 3.15Å; L195-M197 PolarHBondContact O-N 3.12Å
196	R	53.7	Low	45.8	Very low	228 Å²	228	142.7 Å²	142.7	86%	0.86	77%	0.771	S	S	*	*			trans	-59.8	111.2	166.4	169.6	179.4	170.7	149.4	-2.1	109.1	A194	A194-R196 VanDerWaalsContact C-N 3.3Å; A194-R196 PolarHBondContact O-N 2.95Å
197	M	57.8	Low	45.6	Very low	162 Å²	162	146.1 Å²	146.1	80%	0.798	78%	0.779	S	S	*	*			trans	-63.2	133.5	167.2	-65	-65.4	-75.7	0	0	109.6	L195 F199	L195-M197 PolarHBondContact O-N 3.12Å; M197-F199 PolarHBondContact O-N 3.41Å
198	P	45.4	Very low	45.9	Very low	113 Å²	113	149 Å²	149	73%	0.734	78%	0.78	S	S	*	*			trans	-75.7	111.6	175.5	29	-32	0	0	0	110.3	Q200	P198-Q200 PolarHBondContact O-N 2.76Å
199	F	40.5	Very low	45.3	Very low	190 Å²	190	152.8 Å²	152.8	83%	0.833	80%	0.795	S	S	*	*			trans	-70.5	111.2	165.8	179.2	-99.5	0	0	0	108.8	M197 Q201	M197-F199 PolarHBondContact O-N 3.41Å; F199-Q201 HydrophobicContact CE1-CB 4.49Å; F199-Q201 PolarHBondContact O-N 2.73Å; F199-Q201 VanDerWaalsContact O-N 3.12Å
200	Q	45.5	Very low	44.7	Very low	172 Å²	172	145.2 Å²	145.2	80%	0.804	78%	0.784	S	S	*	*			trans	-82	90.3	-176.6	-164.7	176.9	35.6	0	0	110.6	P198 V202	P198-Q200 PolarHBondContact O-N 2.76Å; Q200-V202 HydrophobicContact CG-CG2 4.23Å; Q200-V202 PolarHBondContact O-N 3.35Å
201	Q	45.5	Very low	44	Very low	140 Å²	140	146.1 Å²	146.1	65%	0.654	79%	0.79	S	S	*	*			trans	-72	101.5	168.2	177.1	177	-22.9	0	0	109.3	F199 Q203	F199-Q201 HydrophobicContact CE1-CB 4.49Å; F199-Q201 PolarHBondContact O-N 2.73Å; F199-Q201 VanDerWaalsContact O-N 3.12Å; Q201-Q203 HydrophobicContact CG-CB 4.43Å; Q201-Q203 VanDerWaalsContact NE2-OE1 3.17Å; Q201-Q203 PolarHBondContact O-N 3.18Å
202	V	41.2	Very low	43.2	Very low	119 Å²	119	144.9 Å²	144.9	72%	0.721	79%	0.787	S	S	*	*			trans	-86.6	96.4	167.9	-177	0	0	0	0	108.5	Q200	Q200-V202 HydrophobicContact CG-CG2 4.23Å; Q200-V202 PolarHBondContact O-N 3.35Å
203	Q	42.9	Very low	42.4	Very low	155 Å²	155	145 Å²	145	72%	0.724	79%	0.785	S	S	*	*			trans	-115.3	99.1	164.3	-172.6	174.1	13	0	0	106.9	Q201	Q201-Q203 HydrophobicContact CG-CB 4.43Å; Q201-Q203 VanDerWaalsContact NE2-OE1 3.17Å; Q201-Q203 PolarHBondContact O-N 3.18Å
204	A	39	Very low	41.8	Very low	94 Å²	94	147.3 Å²	147.3	78%	0.777	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-101.3	128.8	175.9	0	0	0	0	0	109.4
205	Q	39.3	Very low	41.1	Very low	181 Å²	181	151.2 Å²	151.2	85%	0.846	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-93.5	159.9	-167.2	-152.8	166.7	-84.8	0	0	111.5
206	L	44	Very low	41.5	Very low	148 Å²	148	148.2 Å²	148.2	78%	0.775	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-57.7	139	175.7	-73.6	72.7	0	0	0	111.6
207	Q	39.7	Very low	40.7	Very low	196 Å²	196	145.8 Å²	145.8	92%	0.916	78%	0.782	S	S	*	*			trans	-133	125.8	146.9	-74.4	-170.8	-36.9	0	0	109.5
208	L	46	Very low	39.7	Very low	157 Å²	157	144.3 Å²	144.3	82%	0.822	78%	0.776	S	S	*	*			trans	-96.3	128.7	168.2	-79.2	156.9	0	0	0	107.4
209	D	33.8	Very low	39.4	Very low	179 Å²	179	147.1 Å²	147.1	96%	0.957	78%	0.779	S	S	*	*			trans	-159.8	161.2	146.1	-122	-32.6	0	0	0	109.5
210	G	35.4	Very low	39.9	Very low	62 Å²	62	143 Å²	143	64%	0.639	77%	0.772	S	S	*	*			trans	-142.3	-161.3	-167.1	0	0	0	0	0	117
211	V	34.6	Very low	39.6	Very low	132 Å²	132	143.3 Å²	143.3	80%	0.8	77%	0.773	S	S	*	*			trans	88.7	87.4	157.9	-172.4	0	0	0	0	118.8
212	T	34.6	Very low	39.4	Very low	113 Å²	113	143 Å²	143	69%	0.693	78%	0.775	S	S	*	*			trans	88.7	152.5	132.2	72.3	0	0	0	0	123.9
213	H	34.2	Very low	39.2	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.815	77%	0.774	S	S	*	*			trans	69	134.2	171.3	-68.1	83.6	0	0	0	117.3
214	S	32.1	Very low	39.1	Very low	109 Å²	109	139 Å²	139	76%	0.762	78%	0.78	S	S	*	*			cis	-163.7	154.2	-10.3	44.8	0	0	0	0	111.7
215	H	30.8	Very low	39.2	Very low	182 Å²	182	143.5 Å²	143.5	84%	0.843	79%	0.785	S	S	*	*			trans	-63.4	-178.4	173.9	-110.6	-70.2	0	0	0	114
216	P	55.5	Low	39.1	Very low	105 Å²	105	139.4 Å²	139.4	68%	0.682	78%	0.782	S	S	*	*			cis	-139.7	159.7	-15.6	36.3	-18.7	0	0	0	116.9
217	H	37.3	Very low	39.6	Very low	177 Å²	177	138 Å²	138	82%	0.819	78%	0.782	S	S	*	*			trans	-159.8	169.5	136	-143.1	63.9	0	0	0	114.5
218	L	37.1	Very low	40	Very low	131 Å²	131	138.6 Å²	138.6	69%	0.686	78%	0.777	S	S	*	*			trans	-90.8	171.5	-168.2	-54.2	166.6	0	0	0	112.6
219	H	39.4	Very low	40.2	Very low	171 Å²	171	139 Å²	139	79%	0.792	78%	0.779	S	S	*	*			cis	-156.8	173.8	4.7	-139.9	-144	0	0	0	110.8
220	P	49.3	Very low	41.1	Very low	105 Å²	105	137.8 Å²	137.8	68%	0.682	77%	0.77	S	S	*	*			trans	-109.6	161.9	-167.5	40.7	-33.9	0	0	0	116.5
221	H	39.3	Very low	42	Very low	177 Å²	177	144.2 Å²	144.2	82%	0.819	78%	0.78	S	S	*	*			trans	-157.1	156.3	145.2	-155.9	-105.3	0	0	0	115.5
222	L	42.3	Very low	43.2	Very low	135 Å²	135	142.7 Å²	142.7	71%	0.707	77%	0.773	S	S	*	*			trans	-57.5	150.5	-162.6	-58.4	176.1	0	0	0	121.9
223	A	36.6	Very low	44.5	Very low	85 Å²	85	142.8 Å²	142.8	70%	0.702	78%	0.776	S	S	*	*				57.2	127.9	125.2	0	0	0	0	0	123.4
224	A	41	Very low	45.8	Very low	103 Å²	103	139.8 Å²	139.8	85%	0.851	77%	0.772	S	S	*	*			trans	-148.2	130.5	133.7	0	0	0	0	0	110.1
225	H	41.1	Very low	47.1	Very low	189 Å²	189	140 Å²	140	88%	0.875	77%	0.771	S	S	*	*			trans	-85.9	147.5	175.5	-68.6	-118.7	0	0	0	110.6
226	A	37.7	Very low	48.6	Very low	95 Å²	95	141.1 Å²	141.1	79%	0.785	77%	0.774	S	S	*	*			trans	-135.2	132	160.9	0	0	0	0	0	109.1
227	P	53.9	Low	48	Very low	119 Å²	119	139.3 Å²	139.3	77%	0.773	77%	0.774	S	S	*	*			trans	-83.9	147.2	-164.7	31.8	-35.8	0	0	0	114.2	L229	P227-L229 PolarHBondContact O-N 3.09Å
228	Y	47	Very low	48.6	Very low	208 Å²	208	138.9 Å²	138.9	82%	0.816	78%	0.777	S	S	*	*			trans	-58.8	124.8	165.9	-105.5	-100.9	0	0	0	111.2	M230	Y228-M230 HydrophobicContact CD1-CE 3.57Å; Y228-M230 HydrophobicContact CE1-CE 3.88Å; Y228-M230 PolarHBondContact O-N 3.23Å
229	L	51.9	Low	49.3	Very low	165 Å²	165	138.3 Å²	138.3	86%	0.864	78%	0.781	S	S	*	*			trans	-88.1	97	161.2	-66.7	-177.6	0	0	0	109.2	P227 F231	P227-L229 PolarHBondContact O-N 3.09Å; L229-F231 PolarHBondContact O-N 3.06Å
230	M	53.1	Low	49.4	Very low	154 Å²	154	138.2 Å²	138.2	76%	0.759	79%	0.785	S	S	*	*			trans	-72.7	116.3	168.5	-80.3	-79.8	110	0	0	109.9	Y228	Y228-M230 HydrophobicContact CD1-CE 3.57Å; Y228-M230 HydrophobicContact CE1-CE 3.88Å; Y228-M230 PolarHBondContact O-N 3.23Å
231	F	53.3	Low	48.9	Very low	197 Å²	197	138 Å²	138	86%	0.864	79%	0.791	S	S	*	*			trans	-109.9	119.7	170.1	-158.2	-88.8	0	0	0	109.2	L229	L229-F231 PolarHBondContact O-N 3.06Å
232	P	59	Low	48.9	Very low	100 Å²	100	134.6 Å²	134.6	65%	0.649	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-81.9	135.9	-174.5	31.1	-33.4	0	0	0	112
233	P	63.6	Low	48.8	Very low	115 Å²	115	136.5 Å²	136.5	75%	0.747	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-80	148.9	174.2	31.9	-33.7	0	0	0	112.2
234	P	60.6	Low	49	Very low	114 Å²	114	137.4 Å²	137.4	74%	0.74	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-77.3	146.3	179.8	31.2	-35	0	0	0	112.7
235	P	59.8	Low	48.8	Very low	113 Å²	113	140.1 Å²	140.1	73%	0.734	81%	0.805	S	S	*	*			trans	-98.3	111.9	-175.3	35.2	-31.6	0	0	0	113.7
236	F	61.2	Low	48.9	Very low	205 Å²	205	136 Å²	136	90%	0.899	80%	0.797	S	S	*	*			trans	-144.1	117	158	-71.8	-71.7	0	0	0	110.8
237	G	42.5	Very low	48.8	Very low	67 Å²	67	136.2 Å²	136.2	69%	0.691	80%	0.8	S	S	*	*			trans	-77.1	-180	158.1	0	0	0	0	0	110.1
238	L	51.8	Low	48	Very low	169 Å²	169	136.5 Å²	136.5	89%	0.885	81%	0.805	S	S	*	*			cis	-155.6	-162.5	15.5	-69.5	169.6	0	0	0	106.6
239	P	50.3	Low	47.7	Very low	119 Å²	119	130.8 Å²	130.8	77%	0.773	80%	0.8	S	S	*	*				-116.1	174.5	-52.7	28.8	-12.5	0	0	0	112
240	I	42.6	Very low	47	Very low	169 Å²	169	128 Å²	128	87%	0.867	80%	0.801	S	S	*	*			trans	-79.3	130	176.7	-49.2	163.3	0	0	0	109.8
241	A	39.2	Very low	46.3	Very low	99 Å²	99	125.4 Å²	125.4	82%	0.818	80%	0.804	S	S	*	*			trans	-117.1	103.4	167.2	0	0	0	0	0	109.8
242	S	38.7	Very low	45.7	Very low	107 Å²	107	120.6 Å²	120.6	75%	0.748	80%	0.801	S	S	*	*			trans	-97.1	109.1	173.2	167	0	0	0	0	109.4
243	L	40	Very low	44.9	Very low	175 Å²	175	123.2 Å²	123.2	92%	0.916	82%	0.815	S	S	*	*			trans	-139.9	114.5	163.4	-65.5	174.1	0	0	0	108
244	A	41.3	Very low	44	Very low	103 Å²	103	121.9 Å²	121.9	85%	0.851	81%	0.813	S	S	*	*			trans	-100.5	131.9	168	0	0	0	0	0	108.6
245	D	35.5	Very low	43.1	Very low	160 Å²	160	120.9 Å²	120.9	86%	0.856	82%	0.815	S	S	*	*			trans	-153.1	172.3	136.8	-155.9	5.5	0	0	0	110.5
246	S	43	Very low	42.2	Very low	102 Å²	102	119 Å²	119	71%	0.713	81%	0.808	S	S	*	*			trans	-109.7	170.5	-148.7	-51.5	0	0	0	0	114.3
247	A	36.3	Very low	41.4	Very low	101 Å²	101	114 Å²	114	84%	0.835	81%	0.805	S	S	*	*			trans	66.3	109.6	157.1	0	0	0	0	0	118.9
248	S	38	Very low	41.8	Very low	125 Å²	125	119.2 Å²	119.2	87%	0.874	81%	0.809	S	S	*	*				-165.1	146.6	93.2	-167	0	0	0	0	111.3
249	A	38.9	Very low	41.6	Very low	88 Å²	88	116.7 Å²	116.7	73%	0.727	81%	0.805	S	S	*	*			trans	-97	160.2	179.7	0	0	0	0	0	112.2
250	A	38.5	Very low	41.6	Very low	105 Å²	105	117.2 Å²	117.2	87%	0.868	80%	0.802	S	S	*	*			trans	64.7	94.7	158.1	0	0	0	0	0	118.8
251	A	38.5	Very low	42.1	Very low	100 Å²	100	112.5 Å²	112.5	83%	0.826	78%	0.784	S	S	*	*			trans	-151.6	121.7	139.2	0	0	0	0	0	112.5
252	A	40.7	Very low	43.2	Very low	97 Å²	97	118 Å²	118	80%	0.802	79%	0.789	S	S	*	*			trans	57.7	57.3	151.9	0	0	0	0	0	120.6	A254	A252-A254 PolarHBondContact O-N 2.91Å
253	V	41.3	Very low	43.9	Very low	155 Å²	155	118.9 Å²	118.9	94%	0.939	79%	0.785	S	S	*	*			trans	-75	70.7	149.9	-76.1	0	0	0	0	111.1
254	A	44.5	Very low	45.4	Very low	86 Å²	86	112.9 Å²	112.9	71%	0.711	76%	0.758	S	S	*	*			trans	-101.8	47.9	171.9	0	0	0	0	0	111.3	A252 A256	A252-A254 PolarHBondContact O-N 2.91Å; A254-A256 VanDerWaalsContact C-N 3.3Å; A254-A256 PolarHBondContact O-N 2.92Å
255	A	42	Very low	47.4	Very low	94 Å²	94	110.9 Å²	110.9	78%	0.777	74%	0.738	S	S	*	*			trans	-66.3	91.3	171.3	0	0	0	0	0	109.1	A257	A255-A257 PolarHBondContact O-N 3.15Å
256	A	41.8	Very low	49.6	Very low	72 Å²	72	108.6 Å²	108.6	60%	0.595	73%	0.725	S	S	*	*			trans	-68	82.4	-179.9	0	0	0	0	0	110.6	A254 K258	A254-A256 VanDerWaalsContact C-N 3.3Å; A254-A256 PolarHBondContact O-N 2.92Å; A256-K258 HydrophobicContact CB-CD 4.33Å; A256-K258 PolarHBondContact O-N 3.01Å
257	A	44.6	Very low	51.7	Low	101 Å²	101	106.6 Å²	106.6	84%	0.835	71%	0.714	S	S	*	*			trans	-65.5	72.1	172.7	0	0	0	0	0	110.6	A255 S259	A255-A257 PolarHBondContact O-N 3.15Å; A257-S259 PolarHBondContact O-N 2.86Å; A257-S259 VanDerWaalsContact O-N 3.1Å
258	K	50.1	Low	54.4	Low	176 Å²	176	105.6 Å²	105.6	77%	0.765	70%	0.695	S	S	*	*			trans	-57.6	115.2	162.1	-95.7	73.2	174.4	-176.3	0	106.6	A256 N260	A256-K258 HydrophobicContact CB-CD 4.33Å; A256-K258 PolarHBondContact O-N 3.01Å; K258-N260 PolarHBondContact O-N 3.24Å
259	S	46.9	Very low	56.9	Low	116 Å²	116	104.3 Å²	104.3	81%	0.811	68%	0.677	S	S	*	*			trans	-53.5	105.1	174.9	45.5	0	0	0	0	109.4	A257 S261	A257-S259 PolarHBondContact O-N 2.86Å; A257-S259 VanDerWaalsContact O-N 3.1Å; S259-S261 PolarHBondContact O-N 3.38Å
260	N	51.9	Low	59.5	Low	131 Å²	131	108.5 Å²	108.5	70%	0.701	67%	0.674	S	S	*	*			trans	-76.7	82.9	179.9	-168.8	22.2	0	0	0	108.6	K258 K262	K258-N260 PolarHBondContact O-N 3.24Å; N260-K262 PolarHBondContact O-N 3.45Å; N260-K262 VanDerWaalsContact O-N 3.1Å
261	S	53.1	Low	62	Low	70 Å²	70	107.6 Å²	107.6	49%	0.49	66%	0.655	S	S	.	*			trans	-57.8	115	176	-161.6	0	0	0	0	108.5	S259 N263 S264	S259-S261 PolarHBondContact O-N 3.38Å; S261-N263 WeakPolarHBondContact CB-OD1 3.36Å; S261-N263 PolarHBondContact O-N 3.01Å; S261-N263 PolarHBondContact OG-OD1 2.97Å; S261-S264 PolarHBondContact O-N 3.07Å
262	K	62.5	Low	64.6	Low	213 Å²	213	110 Å²	110	93%	0.926	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	18.8	-169.7	-63.5	175.3	-179	170.2	0	113.8	N260	N260-K262 PolarHBondContact O-N 3.45Å; N260-K262 VanDerWaalsContact O-N 3.1Å
263	N	52.7	Low	67	Low	126 Å²	126	108.1 Å²	108.1	67%	0.674	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	33.1	-179.3	61.6	0.4	0	0	0	111.2	S261 S265	S261-N263 WeakPolarHBondContact CB-OD1 3.36Å; S261-N263 PolarHBondContact O-N 3.01Å; S261-N263 PolarHBondContact OG-OD1 2.97Å; N263-S265 PolarHBondContact O-N 3.45Å; N263-S265 VanDerWaalsContact O-N 3.11Å
264	S	71.8	Confident	69.4	Low	50 Å²	50	108 Å²	108	35%	0.35	61%	0.614	S	S	.	*			trans	-51.2	118.9	174	-170.1	0	0	0	0	110.1	S261 D268	S261-S264 PolarHBondContact O-N 3.07Å; S264-D268 VanDerWaalsContact OG-CB 3.32Å; S264-D268 WeakPolarHBondContact OG-CB 3.39Å
265	S	82.9	Confident	71.6	Confident	60 Å²	60	109.9 Å²	109.9	42%	0.42	61%	0.606	S	S	.	*			trans	-63.7	156.1	-178.5	179.2	0	0	0	0	110.4	N263 A267 D268 L269	N263-S265 PolarHBondContact O-N 3.45Å; N263-S265 VanDerWaalsContact O-N 3.11Å; S265-A267 PolarHBondContact O-N 3.25Å; S265-A267 VanDerWaalsContact O-N 3.1Å; S265-A267 PolarHBondContact OG-N 2.98Å; S265-D268 VanDerWaalsContact CB-OD2 3.28Å; S265-D268 WeakPolarHBondContact CB-OD2 3.41Å; S265-D268 PolarHBondContact N-OD2 3.34Å; S265-D268 PolarHBondContact O-N 3.5Å; S265-L269 PolarHBondContact O-N 2.94Å
266	I	82.4	Confident	74	Confident	113 Å²	113	111.4 Å²	111.4	58%	0.579	60%	0.596	S	S	*	*	H	α-helix	trans	-53.7	-30.7	168.8	-109.6	68.4	0	0	0	111	L269 R270	I266-L269 HydrophobicContact CD1-CD1 4.5Å; I266-R270 WeakPolarHBondContact O-CB 3.41Å; I266-R270 WeakPolarHBondContact O-CD 3.26Å; I266-R270 WeakPolarHBondContact O-CG 3.19Å; I266-R270 PolarHBondContact O-N 3.22Å; I266-R270 VanDerWaalsContact O-N 3.16Å
267	A	86.9	Confident	76.3	Confident	59 Å²	59	111 Å²	111	49%	0.488	59%	0.586	S	S	.	*	H	α-helix	trans	-67.9	-46	174	0	0	0	0	0	112.3	S265 R270 L271	S265-A267 PolarHBondContact O-N 3.25Å; S265-A267 VanDerWaalsContact O-N 3.1Å; S265-A267 PolarHBondContact OG-N 2.98Å; A267-R270 PolarHBondContact O-N 3.16Å; A267-L271 WeakPolarHBondContact O-CB 3.39Å; A267-L271 PolarHBondContact O-N 3.37Å
268	D	92.4	Very high	78.2	Confident	81 Å²	81	111 Å²	111	43%	0.433	57%	0.569	S	S	.	*	H	α-helix	trans	-64.4	-42.6	178.6	-57.8	-37.4	0	0	0	111.6	S264 S265 R270 L271 K272	S264-D268 VanDerWaalsContact OG-CB 3.32Å; S264-D268 WeakPolarHBondContact OG-CB 3.39Å; S265-D268 VanDerWaalsContact CB-OD2 3.28Å; S265-D268 WeakPolarHBondContact CB-OD2 3.41Å; S265-D268 PolarHBondContact N-OD2 3.34Å; S265-D268 PolarHBondContact O-N 3.5Å; D268-R270 VanDerWaalsContact C-N 3.33Å; D268-R270 PolarHBondContact O-N 2.85Å; D268-L271 PolarHBondContact O-N 3.28Å; D268-K272 VanDerWaalsContact O-CB 3.26Å; D268-K272 WeakPolarHBondContact O-CB 3.35Å; D268-K272 PolarHBondContact O-N 3.21Å
269	L	90.8	Very high	80	Confident	97 Å²	97	106.8 Å²	106.8	51%	0.508	57%	0.567	S	S	.	*	H	α-helix	trans	-59.5	-43.9	175.7	-76.8	161.3	0	0	0	111.2	S265 I266 K272 A273	S265-L269 PolarHBondContact O-N 2.94Å; I266-L269 HydrophobicContact CD1-CD1 4.5Å; L269-K272 PolarHBondContact O-N 3.37Å; L269-A273 WeakPolarHBondContact O-CB 3.48Å; L269-A273 PolarHBondContact O-N 3.17Å
270	R	92.6	Very high	82.1	Confident	176 Å²	176	106.4 Å²	106.4	66%	0.664	56%	0.555	S	S	*	*	H	α-helix	trans	-66.2	-43.7	175.2	-75.1	168.8	174.8	176.4	-4.1	112.5	I266 A267 D268 K272 A273 R274	I266-R270 WeakPolarHBondContact O-CB 3.41Å; I266-R270 WeakPolarHBondContact O-CD 3.26Å; I266-R270 WeakPolarHBondContact O-CG 3.19Å; I266-R270 PolarHBondContact O-N 3.22Å; I266-R270 VanDerWaalsContact O-N 3.16Å; A267-R270 PolarHBondContact O-N 3.16Å; D268-R270 VanDerWaalsContact C-N 3.33Å; D268-R270 PolarHBondContact O-N 2.85Å; R270-K272 VanDerWaalsContact C-N 3.3Å; R270-K272 PolarHBondContact O-N 3.31Å; R270-A273 PolarHBondContact O-N 3.12Å; R270-R274 PolarHBondContact O-N 3.46Å
271	L	91.1	Very high	83.4	Confident	87 Å²	87	103.6 Å²	103.6	46%	0.455	56%	0.558	S	S	.	*	H	α-helix	trans	-63.5	-38.4	177.3	-176.9	63.1	0	0	0	111.2	A267 D268 R274 K275	A267-L271 WeakPolarHBondContact O-CB 3.39Å; A267-L271 PolarHBondContact O-N 3.37Å; D268-L271 PolarHBondContact O-N 3.28Å; L271-R274 PolarHBondContact O-N 2.93Å; L271-K275 HydrophobicContact CG-CD 4.48Å; L271-K275 WeakPolarHBondContact O-CG 3.46Å; L271-K275 PolarHBondContact O-N 2.89Å
272	K	93.9	Very high	83.7	Confident	150 Å²	150	108.7 Å²	108.7	65%	0.652	58%	0.578	S	S	*	*	H	α-helix	trans	-72.3	-35.8	177.7	-162.8	164.4	-174.3	176.4	0	112.3	D268 L269 R270 H276	D268-K272 VanDerWaalsContact O-CB 3.26Å; D268-K272 WeakPolarHBondContact O-CB 3.35Å; D268-K272 PolarHBondContact O-N 3.21Å; L269-K272 PolarHBondContact O-N 3.37Å; R270-K272 VanDerWaalsContact C-N 3.3Å; R270-K272 PolarHBondContact O-N 3.31Å; K272-H276 WeakPolarHBondContact O-CB 3.36Å; K272-H276 PolarHBondContact O-N 3.36Å; K272-H276 VanDerWaalsContact O-N 3.08Å
273	A	91.5	Very high	84.7	Confident	57 Å²	57	103.5 Å²	103.5	47%	0.471	56%	0.561	S	S	.	*	H	α-helix	trans	-62.3	-47.2	170.2	0	0	0	0	0	111.6	L269 R270 K275 H276 T277	L269-A273 WeakPolarHBondContact O-CB 3.48Å; L269-A273 PolarHBondContact O-N 3.17Å; R270-A273 PolarHBondContact O-N 3.12Å; A273-K275 PolarHBondContact O-N 2.88Å; A273-H276 WeakPolarHBondContact O-CB 3.47Å; A273-H276 PolarHBondContact O-N 2.73Å; A273-H276 VanDerWaalsContact O-N 3.09Å; A273-T277 PolarHBondContact O-N 3.02Å
274	R	90.5	Very high	86.4	Confident	154 Å²	154	102.3 Å²	102.3	58%	0.581	56%	0.555	S	S	*	*	H	α-helix	trans	-58.5	-47.1	174.8	-82.3	-166.5	56.7	-167.2	-10.6	113.3	R270 L271 H276 T277 E278	R270-R274 PolarHBondContact O-N 3.46Å; L271-R274 PolarHBondContact O-N 2.93Å; R274-H276 PolarHBondContact O-N 2.87Å; R274-T277 PolarHBondContact O-N 3.05Å; R274-T277 VanDerWaalsContact O-N 3.15Å; R274-T277 PolarHBondContact O-OG1 2.79Å; R274-E278 IonicContact CZ-OE1 3.47Å; R274-E278 IonicContact NE-OE1 3.33Å; R274-E278 PolarHBondContact NE-OE1 3.45Å; R274-E278 IonicContact NH2-OE1 2.75Å; R274-E278 PolarHBondContact NH2-OE1 3.44Å; R274-E278 WeakPolarHBondContact O-CB 3.35Å; R274-E278 VanDerWaalsContact O-CG 3.26Å; R274-E278 WeakPolarHBondContact O-CG 3.4Å; R274-E278 PolarHBondContact O-N 3.43Å
275	K	92.1	Very high	87.2	Confident	125 Å²	125	105.2 Å²	105.2	54%	0.543	57%	0.567	S	S	.	*	H	α-helix	trans	-61.4	-28.4	175.6	-74.3	179.2	177.8	-172.1	0	112.7	L271 A273 A279	L271-K275 HydrophobicContact CG-CD 4.48Å; L271-K275 WeakPolarHBondContact O-CG 3.46Å; L271-K275 PolarHBondContact O-N 2.89Å; A273-K275 PolarHBondContact O-N 2.88Å; K275-A279 WeakPolarHBondContact O-CB 3.22Å; K275-A279 PolarHBondContact O-N 3.32Å
276	H	91.9	Very high	87.5	Confident	125 Å²	125	107.9 Å²	107.9	58%	0.579	58%	0.575	S	S	*	*	H	α-helix	trans	-77.7	-33.7	176.1	-170.9	-75.5	0	0	0	112.6	K272 A273 R274 L280	K272-H276 WeakPolarHBondContact O-CB 3.36Å; K272-H276 PolarHBondContact O-N 3.36Å; K272-H276 VanDerWaalsContact O-N 3.08Å; A273-H276 WeakPolarHBondContact O-CB 3.47Å; A273-H276 PolarHBondContact O-N 2.73Å; A273-H276 VanDerWaalsContact O-N 3.09Å; R274-H276 PolarHBondContact O-N 2.87Å; H276-L280 WeakPolarHBondContact O-CG 3.26Å; H276-L280 PolarHBondContact O-N 2.98Å
277	T	89.2	Confident	87.8	Confident	63 Å²	63	107.6 Å²	107.6	39%	0.387	58%	0.575	S	S	.	*	H	α-helix	trans	-72.5	-44.6	172.7	58.1	0	0	0	0	111	A273 R274 A279 L280 G281 L282	A273-T277 PolarHBondContact O-N 3.02Å; R274-T277 PolarHBondContact O-N 3.05Å; R274-T277 VanDerWaalsContact O-N 3.15Å; R274-T277 PolarHBondContact O-OG1 2.79Å; T277-A279 VanDerWaalsContact C-N 3.29Å; T277-A279 PolarHBondContact O-N 3.11Å; T277-L280 CarbonylContact O-C 3.59Å; T277-L280 WeakPolarHBondContact O-CA 3.49Å; T277-L280 PolarHBondContact O-N 2.69Å; T277-G281 PolarHBondContact O-N 3.47Å; T277-L282 PolarHBondContact O-N 2.91Å
278	E	86.2	Confident	87.9	Confident	103 Å²	103	110.8 Å²	110.8	48%	0.481	58%	0.581	S	S	.	*	H	α-helix	trans	-57	-40.4	174.2	-70.2	161.1	-167.7	0	0	111.6	R274 L280 G281	R274-E278 IonicContact CZ-OE1 3.47Å; R274-E278 IonicContact NE-OE1 3.33Å; R274-E278 PolarHBondContact NE-OE1 3.45Å; R274-E278 IonicContact NH2-OE1 2.75Å; R274-E278 PolarHBondContact NH2-OE1 3.44Å; R274-E278 WeakPolarHBondContact O-CB 3.35Å; R274-E278 VanDerWaalsContact O-CG 3.26Å; R274-E278 WeakPolarHBondContact O-CG 3.4Å; R274-E278 PolarHBondContact O-N 3.43Å; E278-L280 VanDerWaalsContact C-N 3.27Å; E278-L280 PolarHBondContact O-N 2.61Å; E278-G281 PolarHBondContact O-N 3.38Å
279	A	86.1	Confident	87.5	Confident	86 Å²	86	112.9 Å²	112.9	71%	0.711	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-14.9	175.3	0	0	0	0	0	114.8	K275 T277	K275-A279 WeakPolarHBondContact O-CB 3.22Å; K275-A279 PolarHBondContact O-N 3.32Å; T277-A279 VanDerWaalsContact C-N 3.29Å; T277-A279 PolarHBondContact O-N 3.11Å
280	L	91.1	Very high	87.3	Confident	108 Å²	108	114.2 Å²	114.2	57%	0.565	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-4.4	173.9	-72.1	174.1	0	0	0	113	H276 T277 E278 L282	H276-L280 WeakPolarHBondContact O-CG 3.26Å; H276-L280 PolarHBondContact O-N 2.98Å; T277-L280 CarbonylContact O-C 3.59Å; T277-L280 WeakPolarHBondContact O-CA 3.49Å; T277-L280 PolarHBondContact O-N 2.69Å; E278-L280 VanDerWaalsContact C-N 3.27Å; E278-L280 PolarHBondContact O-N 2.61Å; L280-L282 VanDerWaalsContact C-N 3.31Å; L280-L282 HydrophobicContact CB-CD1 4.15Å; L280-L282 HydrophobicContact CB-CG 4.2Å; L280-L282 HydrophobicContact CD1-CD1 4.41Å
281	G	79.1	Confident	86.8	Confident	73 Å²	73	109 Å²	109	75%	0.753	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.2	28.3	-177.3	0	0	0	0	0	114.1	T277 E278	T277-G281 PolarHBondContact O-N 3.47Å; E278-G281 PolarHBondContact O-N 3.38Å
282	L	59.6	Low	86.5	Confident	177 Å²	177	111 Å²	111	93%	0.927	61%	0.605	S	S	*	*			trans	-107.6	0	177.6	-62.6	173.7	0	0	0	111.2	T277 L280	T277-L282 PolarHBondContact O-N 2.91Å; L280-L282 VanDerWaalsContact C-N 3.31Å; L280-L282 HydrophobicContact CB-CD1 4.15Å; L280-L282 HydrophobicContact CB-CG 4.2Å; L280-L282 HydrophobicContact CD1-CD1 4.41Å

Retrieved 282 of 282 residues in 84.4 ms (Link to these results)

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