A0A061AJ82_CAEEL Loading...

Mnd1 domain-containing protein

AlphaFold DB , UniProt , Accession A0A061AJ82, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 168 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	37.8	Very low	38.8	Very low	223 Å²	223	162.6 Å²	162.6	100%	1.099	81%	0.81	S	S	*	*				0	114.8	0	-64.2	-166	-161.7	0	0	107.4
2	S	37.7	Very low	39.2	Very low	119 Å²	119	158.5 Å²	158.5	83%	0.832	80%	0.804	S	S	*	*			trans	-103	113.4	-175.3	-173.2	0	0	0	0	109
3	Y	36.8	Very low	40.1	Very low	206 Å²	206	153 Å²	153	81%	0.808	78%	0.783	S	S	*	*			trans	-80.5	117.4	175.7	-71.6	-89	0	0	0	109.2
4	Q	36.7	Very low	41	Very low	186 Å²	186	154.4 Å²	154.4	87%	0.869	78%	0.784	S	S	*	*			trans	-74.5	122.2	167.7	-65.2	-151	-11.5	0	0	108.8	E6	Q4-E6 PolarHBondContact O-N 3.27Å
5	H	36	Very low	41.4	Very low	180 Å²	180	151.9 Å²	151.9	83%	0.833	77%	0.774	S	S	*	*			trans	-78.4	106.3	169.1	-108.3	63.4	0	0	0	108.2	V7	H5-V7 PolarHBondContact O-N 3.15Å
6	E	39.3	Very low	41.7	Very low	177 Å²	177	148.1 Å²	148.1	83%	0.827	76%	0.756	S	S	*	*			trans	-67.9	112.4	164.5	-80.5	-175.1	158.4	0	0	108.9	Q4 V8	Q4-E6 PolarHBondContact O-N 3.27Å; E6-V8 PolarHBondContact O-N 3.48Å; E6-V8 VanDerWaalsContact O-N 3.09Å
7	V	39.7	Very low	42	Very low	126 Å²	126	147.3 Å²	147.3	76%	0.764	75%	0.748	S	S	*	*			trans	-76	96.2	171.4	-175.7	0	0	0	0	107.5	H5 K9	H5-V7 PolarHBondContact O-N 3.15Å; V7-K9 PolarHBondContact O-N 3.04Å
8	V	40.6	Very low	42.4	Very low	95 Å²	95	145.3 Å²	145.3	58%	0.576	74%	0.739	S	S	*	*			trans	-60.5	107.3	169.8	179.3	0	0	0	0	108.1	E6 Y10	E6-V8 PolarHBondContact O-N 3.48Å; E6-V8 VanDerWaalsContact O-N 3.09Å; V8-Y10 HydrophobicContact CB-CE2 4.23Å; V8-Y10 HydrophobicContact CG1-CD2 4.2Å; V8-Y10 HydrophobicContact CG1-CE2 3.89Å; V8-Y10 PolarHBondContact O-N 2.91Å
9	K	39.8	Very low	42.3	Very low	195 Å²	195	144.5 Å²	144.5	85%	0.848	73%	0.731	S	S	*	*			trans	-75.3	100.3	172.8	-72.1	-177.9	180	177.8	0	108.5	V7	V7-K9 PolarHBondContact O-N 3.04Å
10	Y	39.5	Very low	42.4	Very low	202 Å²	202	140.5 Å²	140.5	79%	0.792	72%	0.721	S	S	*	*			trans	-67.7	130.7	168.5	-73.6	-89.1	0	0	0	109.8	V8	V8-Y10 HydrophobicContact CB-CE2 4.23Å; V8-Y10 HydrophobicContact CG1-CD2 4.2Å; V8-Y10 HydrophobicContact CG1-CE2 3.89Å; V8-Y10 PolarHBondContact O-N 2.91Å
11	A	43.1	Very low	42.6	Very low	80 Å²	80	139.7 Å²	139.7	66%	0.661	72%	0.718	S	S	*	*			trans	-61.9	140.6	170.2	0	0	0	0	0	109.8	T13	A11-T13 PolarHBondContact O-N 3.15Å
12	P	43.1	Very low	43.3	Very low	113 Å²	113	135.8 Å²	135.8	73%	0.734	70%	0.7	S	S	*	*			trans	-70	115	-179.4	26.6	-29.7	0	0	0	109.9
13	T	51.1	Low	43.7	Very low	87 Å²	87	140.2 Å²	140.2	53%	0.534	70%	0.698	S	S	.	*			trans	-88.1	149.3	163.3	42.2	0	0	0	0	109.6	A11 D15 N16	A11-T13 PolarHBondContact O-N 3.15Å; T13-D15 PolarHBondContact O-N 3.21Å; T13-N16 WeakPolarHBondContact O-CB 3.3Å; T13-N16 PolarHBondContact O-N 3.08Å
14	E	52.8	Low	44.2	Very low	172 Å²	172	133.3 Å²	133.3	80%	0.804	69%	0.69	S	S	*	*	H	α-helix	trans	-51.5	-26.9	-173.3	-63.1	-175.4	163.1	0	0	114.1	N16 E17	E14-N16 VanDerWaalsContact C-N 3.32Å; E14-N16 PolarHBondContact O-N 2.99Å; E14-E17 PolarHBondContact O-N 3.04Å
15	D	47.6	Very low	44.5	Very low	118 Å²	118	133.2 Å²	133.2	63%	0.631	69%	0.687	S	S	*	*	H	α-helix	trans	-68.3	-26.1	177	-64.2	-34.5	0	0	0	113.9	T13	T13-D15 PolarHBondContact O-N 3.21Å
16	N	45.1	Very low	45	Very low	90 Å²	90	130.7 Å²	130.7	48%	0.481	69%	0.686	S	S	.	*	H	α-helix	trans	-78.2	-21.8	-179	-79.3	-19.8	0	0	0	113.3	T13 E14 I18 A20	T13-N16 WeakPolarHBondContact O-CB 3.3Å; T13-N16 PolarHBondContact O-N 3.08Å; E14-N16 VanDerWaalsContact C-N 3.32Å; E14-N16 PolarHBondContact O-N 2.99Å; N16-I18 VanDerWaalsContact C-N 3.33Å; N16-A20 PolarHBondContact O-N 2.85Å
17	E	47.1	Very low	45.4	Very low	135 Å²	135	127 Å²	127	63%	0.631	68%	0.68	S	S	*	*	H	α-helix	trans	-69.1	-35.3	176.7	-70.9	-168.6	159.2	0	0	111.2	E14 H19 A20 L21	E14-E17 PolarHBondContact O-N 3.04Å; E17-H19 PolarHBondContact O-N 2.95Å; E17-A20 PolarHBondContact O-N 2.98Å; E17-L21 VanDerWaalsContact O-CD1 3.27Å; E17-L21 WeakPolarHBondContact O-CD1 3.37Å; E17-L21 PolarHBondContact O-N 3.01Å
18	I	48.7	Very low	45.7	Very low	112 Å²	112	128.2 Å²	128.2	57%	0.574	68%	0.675	S	S	*	*	H	α-helix	trans	-68.2	-38.3	-179.7	-54.3	179.4	0	0	0	111.2	N16 L21	N16-I18 VanDerWaalsContact C-N 3.33Å; I18-L21 WeakPolarHBondContact O-CB 3.44Å; I18-L21 PolarHBondContact O-N 2.8Å
19	H	41.7	Very low	46.2	Very low	129 Å²	129	127.3 Å²	127.3	60%	0.597	67%	0.673	S	S	*	*	H	α-helix	trans	-74	-28.6	177.7	-77.8	-69.3	0	0	0	113.6	E17 L21	E17-H19 PolarHBondContact O-N 2.95Å; H19-L21 VanDerWaalsContact C-N 3.31Å
20	A	43.5	Very low	46.4	Very low	64 Å²	64	126 Å²	126	53%	0.529	67%	0.667	S	S	.	*	H	α-helix	trans	-71.3	-26.8	172.8	0	0	0	0	0	112.5	N16 E17 I22 R23	N16-A20 PolarHBondContact O-N 2.85Å; E17-A20 PolarHBondContact O-N 2.98Å; A20-I22 VanDerWaalsContact C-N 3.29Å; A20-I22 PolarHBondContact O-N 2.79Å; A20-R23 PolarHBondContact O-N 2.97Å
21	L	47.8	Very low	46.4	Very low	124 Å²	124	120.1 Å²	120.1	65%	0.649	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-20.6	-179.2	-110.4	119.7	0	0	0	114.9	E17 I18 H19	E17-L21 VanDerWaalsContact O-CD1 3.27Å; E17-L21 WeakPolarHBondContact O-CD1 3.37Å; E17-L21 PolarHBondContact O-N 3.01Å; I18-L21 WeakPolarHBondContact O-CB 3.44Å; I18-L21 PolarHBondContact O-N 2.8Å; H19-L21 VanDerWaalsContact C-N 3.31Å
22	I	51.7	Low	46.8	Very low	141 Å²	141	121.1 Å²	121.1	72%	0.723	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-23.4	-179.9	-59.3	175.4	0	0	0	111.5	A20 G24	A20-I22 VanDerWaalsContact C-N 3.29Å; A20-I22 PolarHBondContact O-N 2.79Å; I22-G24 PolarHBondContact O-N 3.45Å
23	R	44.8	Very low	47.3	Very low	212 Å²	212	118 Å²	118	80%	0.8	63%	0.631	S	S	*	*	S	Bend	trans	-98.2	70.7	-177	-76.6	-174.2	-73	-157.2	-3.4	112.2	A20	A20-R23 PolarHBondContact O-N 2.97Å
24	G	47.4	Very low	47.5	Very low	61 Å²	61	123.2 Å²	123.2	63%	0.629	64%	0.64	S	S	*	*	S	Bend	trans	68.1	94.4	149.8	0	0	0	0	0	117.5	I22	I22-G24 PolarHBondContact O-N 3.45Å
25	K	44.2	Very low	47.7	Very low	185 Å²	185	118.7 Å²	118.7	80%	0.804	62%	0.624	S	S	*	*			trans	179.9	124	131.7	-95.7	157.6	-170.3	-176	0	110.7	S27	K25-S27 PolarHBondContact O-N 3.45Å; K25-S27 VanDerWaalsContact O-N 3.17Å
26	P	46.3	Very low	48.7	Very low	127 Å²	127	115.6 Å²	115.6	83%	0.825	61%	0.608	S	S	*	*			trans	-91.5	57.3	-171.5	37.4	-35.2	0	0	0	113
27	S	46.8	Very low	50.3	Low	100 Å²	100	114 Å²	114	70%	0.699	60%	0.601	S	S	*	*			trans	-117.5	5.9	177.1	59	0	0	0	0	115.4	K25 C29	K25-S27 PolarHBondContact O-N 3.45Å; K25-S27 VanDerWaalsContact O-N 3.17Å; S27-C29 PolarHBondContact O-N 2.96Å
28	F	47.5	Very low	52.1	Low	150 Å²	150	113.5 Å²	113.5	66%	0.658	60%	0.599	S	S	*	*			trans	-93.9	41.5	-178.3	-90.1	-84.5	0	0	0	114.4
29	C	50	Low	53.9	Low	77 Å²	77	113.2 Å²	113.2	52%	0.52	60%	0.596	S	S	.	*			trans	-103.7	4	-155.3	-54.8	0	0	0	0	118.2	S27 I33	S27-C29 PolarHBondContact O-N 2.96Å; C29-I33 WeakPolarHBondContact O-CD1 3.49Å
30	K	44.1	Very low	56.1	Low	168 Å²	168	108.5 Å²	108.5	73%	0.73	57%	0.573	S	S	*	*	S	Bend	trans	-141	-44.1	179.4	-67.6	-174.1	-178.7	175.8	0	116.3	R34	K30-R34 WeakPolarHBondContact O-CG 3.36Å; K30-R34 PolarHBondContact O-N 3.32Å; K30-R34 VanDerWaalsContact O-N 3.15Å
31	A	40.1	Very low	58.3	Low	77 Å²	77	110.2 Å²	110.2	64%	0.636	57%	0.57	S	S	*	*	H	α-helix	trans	-67.8	-45.4	-178.6	0	0	0	0	0	112.2	I33 R34 V35	A31-I33 VanDerWaalsContact C-N 3.3Å; A31-I33 PolarHBondContact O-N 2.97Å; A31-R34 PolarHBondContact O-N 2.96Å; A31-V35 WeakPolarHBondContact O-CG2 3.42Å; A31-V35 PolarHBondContact O-N 3.45Å; A31-V35 VanDerWaalsContact O-N 3.11Å
32	N	50.7	Low	60.4	Low	102 Å²	102	109.4 Å²	109.4	55%	0.545	56%	0.563	S	S	.	*	H	α-helix	trans	-64.2	-33.5	177.8	-114.5	4.7	0	0	0	113.1	N36	N32-N36 WeakPolarHBondContact O-CB 3.22Å; N32-N36 PolarHBondContact O-N 3.47Å; N32-N36 VanDerWaalsContact O-N 3.12Å
33	I	55	Low	62.4	Low	48 Å²	48	107 Å²	107	25%	0.246	55%	0.545	C	S	.	.	H	α-helix	trans	-71.3	-38.3	177.6	-56.1	-178.7	0	0	0	110.8	C29 A31 N36 T37 A123	C29-I33 WeakPolarHBondContact O-CD1 3.49Å; A31-I33 VanDerWaalsContact C-N 3.3Å; A31-I33 PolarHBondContact O-N 2.97Å; I33-N36 PolarHBondContact O-N 3.21Å; I33-T37 PolarHBondContact O-N 3.47Å; I33-T37 PolarHBondContact O-OG1 2.99Å; I33-A123 HydrophobicContact CD1-CB 4.2Å
34	R	54.6	Low	64.8	Low	195 Å²	195	99.3 Å²	99.3	74%	0.736	52%	0.519	S	S	*	.	H	α-helix	trans	-64.8	-43.8	175.4	-76.6	-177.2	179.2	-172.9	-1.2	112.3	K30 A31 N36 T37 Q38	K30-R34 WeakPolarHBondContact O-CG 3.36Å; K30-R34 PolarHBondContact O-N 3.32Å; K30-R34 VanDerWaalsContact O-N 3.15Å; A31-R34 PolarHBondContact O-N 2.96Å; R34-N36 VanDerWaalsContact C-N 3.31Å; R34-N36 PolarHBondContact O-N 3.28Å; R34-T37 PolarHBondContact O-N 2.94Å; R34-Q38 PolarHBondContact O-N 3Å
35	V	57.3	Low	67.1	Low	77 Å²	77	99.6 Å²	99.6	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-60.4	-42.6	175.5	175.1	0	0	0	0	110.8	A31 T37 Q38 Q39	A31-V35 WeakPolarHBondContact O-CG2 3.42Å; A31-V35 PolarHBondContact O-N 3.45Å; A31-V35 VanDerWaalsContact O-N 3.11Å; V35-T37 PolarHBondContact O-N 2.91Å; V35-Q38 PolarHBondContact O-N 3.35Å; V35-Q39 WeakPolarHBondContact O-CG 3.32Å; V35-Q39 PolarHBondContact O-N 2.92Å; V35-Q39 VanDerWaalsContact O-N 3.11Å
36	N	68.3	Low	69.6	Low	53 Å²	53	95.5 Å²	95.5	28%	0.283	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-38.4	176.6	-166.1	-21.1	0	0	0	112.4	N32 I33 R34 Q38 Q39 F40 R119	N32-N36 WeakPolarHBondContact O-CB 3.22Å; N32-N36 PolarHBondContact O-N 3.47Å; N32-N36 VanDerWaalsContact O-N 3.12Å; I33-N36 PolarHBondContact O-N 3.21Å; R34-N36 VanDerWaalsContact C-N 3.31Å; R34-N36 PolarHBondContact O-N 3.28Å; N36-Q38 PolarHBondContact O-N 3.28Å; N36-Q39 PolarHBondContact O-N 3.29Å; N36-F40 PolarHBondContact O-N 2.92Å; N36-R119 HydrophobicContact CB-CG 4.34Å; N36-R119 WeakPolarHBondContact ND2-CG 3.4Å
37	T	79.3	Confident	72.1	Confident	56 Å²	56	89.7 Å²	89.7	34%	0.344	45%	0.451	S	S	.	.	H	α-helix	trans	-65.7	-40.1	177.2	-50.8	0	0	0	0	112.1	I33 R34 V35 F40 Q41	I33-T37 PolarHBondContact O-N 3.47Å; I33-T37 PolarHBondContact O-OG1 2.99Å; R34-T37 PolarHBondContact O-N 2.94Å; V35-T37 PolarHBondContact O-N 2.91Å; T37-F40 WeakPolarHBondContact O-CB 3.4Å; T37-F40 PolarHBondContact O-N 3.3Å; T37-Q41 WeakPolarHBondContact O-CG 3.47Å; T37-Q41 PolarHBondContact O-N 3.21Å; T37-Q41 VanDerWaalsContact O-N 3.1Å
38	Q	85.1	Confident	74.5	Confident	125 Å²	125	89.8 Å²	89.8	58%	0.584	44%	0.444	S	S	*	.	H	α-helix	trans	-65.6	-45.8	177.1	-178.6	174.1	-9.9	0	0	111.6	R34 V35 N36 F40 Q41 E42	R34-Q38 PolarHBondContact O-N 3Å; V35-Q38 PolarHBondContact O-N 3.35Å; N36-Q38 PolarHBondContact O-N 3.28Å; Q38-F40 VanDerWaalsContact C-N 3.26Å; Q38-F40 PolarHBondContact O-N 3.38Å; Q38-Q41 PolarHBondContact O-N 2.76Å; Q38-Q41 VanDerWaalsContact O-N 3.11Å; Q38-E42 WeakPolarHBondContact CG-OE1 3.39Å; Q38-E42 PolarHBondContact NE2-OE1 3.46Å; Q38-E42 WeakPolarHBondContact O-CG 3.39Å; Q38-E42 PolarHBondContact O-N 3.23Å
39	Q	85.3	Confident	76.9	Confident	107 Å²	107	89.4 Å²	89.4	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-59.3	-37.5	175.9	-72.1	177.2	-15.5	0	0	112.2	V35 N36 E42 R43	V35-Q39 WeakPolarHBondContact O-CG 3.32Å; V35-Q39 PolarHBondContact O-N 2.92Å; V35-Q39 VanDerWaalsContact O-N 3.11Å; N36-Q39 PolarHBondContact O-N 3.29Å; Q39-E42 PolarHBondContact O-N 3.02Å; Q39-R43 WeakPolarHBondContact O-CG 3.38Å; Q39-R43 PolarHBondContact O-N 3.4Å
40	F	87.3	Confident	79.2	Confident	29 Å²	29	87.9 Å²	87.9	13%	0.127	43%	0.425	C	S	.	.	H	α-helix	trans	-62.3	-46.3	173.7	179.1	-102.7	0	0	0	111.9	N36 T37 Q38 E42 R43 L44 T112 E116	N36-F40 PolarHBondContact O-N 2.92Å; T37-F40 WeakPolarHBondContact O-CB 3.4Å; T37-F40 PolarHBondContact O-N 3.3Å; Q38-F40 VanDerWaalsContact C-N 3.26Å; Q38-F40 PolarHBondContact O-N 3.38Å; F40-E42 PolarHBondContact O-N 3.45Å; F40-R43 PolarHBondContact O-N 3.03Å; F40-L44 HydrophobicContact CD1-CD1 4.02Å; F40-L44 HydrophobicContact CD1-CG 4.41Å; F40-L44 HydrophobicContact CE1-CD1 3.45Å; F40-L44 VanDerWaalsContact CE1-CD1 3.45Å; F40-L44 HydrophobicContact CE1-CG 4.06Å; F40-L44 HydrophobicContact CZ-CD1 3.89Å; F40-L44 HydrophobicContact CZ-CD2 4.24Å; F40-L44 HydrophobicContact CZ-CG 4.17Å; F40-L44 WeakPolarHBondContact O-CG 3.21Å; F40-L44 PolarHBondContact O-N 2.82Å; F40-T112 HydrophobicContact CD2-CG2 3.47Å; F40-T112 VanDerWaalsContact CD2-CG2 3.47Å; F40-T112 HydrophobicContact CE2-CG2 3.41Å; F40-T112 VanDerWaalsContact CE2-CG2 3.41Å; F40-T112 HydrophobicContact CZ-CG2 4.42Å; F40-E116 HydrophobicContact CD2-CB 3.63Å; F40-E116 HydrophobicContact CD2-CG 4.06Å; F40-E116 HydrophobicContact CE1-CG 4.34Å; F40-E116 HydrophobicContact CE2-CB 3.36Å; F40-E116 HydrophobicContact CE2-CG 3.64Å; F40-E116 HydrophobicContact CZ-CB 4.06Å; F40-E116 HydrophobicContact CZ-CG 3.81Å
41	Q	90.2	Very high	81.8	Confident	100 Å²	100	85.3 Å²	85.3	47%	0.467	41%	0.412	S	S	.	.	H	α-helix	trans	-64.6	-38.4	177.7	-68.7	-61.4	-26.1	0	0	112.9	T37 Q38 R43 L44 T45	T37-Q41 WeakPolarHBondContact O-CG 3.47Å; T37-Q41 PolarHBondContact O-N 3.21Å; T37-Q41 VanDerWaalsContact O-N 3.1Å; Q38-Q41 PolarHBondContact O-N 2.76Å; Q38-Q41 VanDerWaalsContact O-N 3.11Å; Q41-R43 VanDerWaalsContact C-N 3.33Å; Q41-R43 PolarHBondContact O-N 3.4Å; Q41-L44 PolarHBondContact O-N 3.25Å; Q41-T45 PolarHBondContact O-N 3.44Å; Q41-T45 PolarHBondContact O-OG1 3.12Å
42	E	93	Very high	84.5	Confident	108 Å²	108	85.8 Å²	85.8	51%	0.505	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-40.8	174.5	-72.3	170.5	-173.4	0	0	111.5	Q38 Q39 F40 T45 Y46	Q38-E42 WeakPolarHBondContact CG-OE1 3.39Å; Q38-E42 PolarHBondContact NE2-OE1 3.46Å; Q38-E42 WeakPolarHBondContact O-CG 3.39Å; Q38-E42 PolarHBondContact O-N 3.23Å; Q39-E42 PolarHBondContact O-N 3.02Å; F40-E42 PolarHBondContact O-N 3.45Å; E42-T45 PolarHBondContact O-N 3.24Å; E42-Y46 PolarHBondContact O-N 2.81Å
43	R	93.2	Very high	86.8	Confident	91 Å²	91	84.9 Å²	84.9	34%	0.343	40%	0.396	S	S	.	.	H	α-helix	trans	-66.2	-39.4	174.4	-74.9	-178.4	-179	-133	8.2	112.9	Q39 F40 Q41 Y46 L47 E108 T112	Q39-R43 WeakPolarHBondContact O-CG 3.38Å; Q39-R43 PolarHBondContact O-N 3.4Å; F40-R43 PolarHBondContact O-N 3.03Å; Q41-R43 VanDerWaalsContact C-N 3.33Å; Q41-R43 PolarHBondContact O-N 3.4Å; R43-Y46 WeakPolarHBondContact O-CB 3.47Å; R43-Y46 PolarHBondContact O-N 3.24Å; R43-L47 PolarHBondContact O-N 3.05Å; R43-E108 WeakPolarHBondContact CD-OE1 3.25Å; R43-E108 IonicContact CZ-OE1 3.47Å; R43-E108 IonicContact NE-OE1 3.67Å; R43-E108 IonicContact NH1-OE1 2.75Å; R43-E108 PolarHBondContact NH1-OE1 3.41Å; R43-T112 HydrophobicContact CB-CG2 3.95Å; R43-T112 WeakPolarHBondContact CD-OG1 3.31Å
44	L	94.4	Very high	88.8	Confident	49 Å²	49	84 Å²	84	26%	0.257	39%	0.392	S	S	.	.	H	α-helix	trans	-62.2	-44.3	173	-70.2	-175.9	0	0	0	111.4	F40 Q41 Y46 L47 D48 T112	F40-L44 HydrophobicContact CD1-CD1 4.02Å; F40-L44 HydrophobicContact CD1-CG 4.41Å; F40-L44 HydrophobicContact CE1-CD1 3.45Å; F40-L44 VanDerWaalsContact CE1-CD1 3.45Å; F40-L44 HydrophobicContact CE1-CG 4.06Å; F40-L44 HydrophobicContact CZ-CD1 3.89Å; F40-L44 HydrophobicContact CZ-CD2 4.24Å; F40-L44 HydrophobicContact CZ-CG 4.17Å; F40-L44 WeakPolarHBondContact O-CG 3.21Å; F40-L44 PolarHBondContact O-N 2.82Å; Q41-L44 PolarHBondContact O-N 3.25Å; L44-Y46 VanDerWaalsContact C-N 3.28Å; L44-Y46 PolarHBondContact O-N 3.39Å; L44-L47 HydrophobicContact CD2-CD1 4.37Å; L44-L47 WeakPolarHBondContact O-CB 3.49Å; L44-L47 PolarHBondContact O-N 2.96Å; L44-L47 VanDerWaalsContact O-N 3.09Å; L44-D48 PolarHBondContact O-N 2.95Å; L44-T112 HydrophobicContact CD2-CG2 4.26Å
45	T	96.5	Very high	90.9	Very high	68 Å²	68	82.6 Å²	82.6	42%	0.417	39%	0.386	S	S	.	.	H	α-helix	trans	-61.6	-38.4	176.1	-56.6	0	0	0	0	111.7	Q41 E42 K49	Q41-T45 PolarHBondContact O-N 3.44Å; Q41-T45 PolarHBondContact O-OG1 3.12Å; E42-T45 PolarHBondContact O-N 3.24Å; T45-K49 WeakPolarHBondContact O-CG 3.39Å; T45-K49 PolarHBondContact O-N 3.06Å
46	Y	97.4	Very high	92.9	Very high	99 Å²	99	86 Å²	86	39%	0.388	40%	0.395	S	S	.	.	H	α-helix	trans	-62	-48.4	172.3	171.6	-100.2	0	0	0	111	E42 R43 L44 D48 K49 R50 E108	E42-Y46 PolarHBondContact O-N 2.81Å; R43-Y46 WeakPolarHBondContact O-CB 3.47Å; R43-Y46 PolarHBondContact O-N 3.24Å; L44-Y46 VanDerWaalsContact C-N 3.28Å; L44-Y46 PolarHBondContact O-N 3.39Å; Y46-D48 VanDerWaalsContact C-N 3.32Å; Y46-D48 PolarHBondContact O-N 3.15Å; Y46-K49 WeakPolarHBondContact O-CB 3.44Å; Y46-K49 PolarHBondContact O-N 3.39Å; Y46-R50 HydrophobicContact CD1-CG 4.16Å; Y46-R50 HydrophobicContact CD2-CG 4.39Å; Y46-R50 HydrophobicContact CE1-CG 3.76Å; Y46-R50 HydrophobicContact CE2-CG 4.03Å; Y46-R50 HydrophobicContact CG-CG 4.46Å; Y46-R50 VanDerWaalsContact O-CG 3.26Å; Y46-R50 WeakPolarHBondContact O-CG 3.28Å; Y46-R50 PolarHBondContact O-N 3.4Å; Y46-R50 VanDerWaalsContact O-N 3.07Å; Y46-R50 PolarHBondContact OH-NE 3.06Å; Y46-E108 HydrophobicContact CD1-CG 4.03Å; Y46-E108 HydrophobicContact CE1-CG 4.09Å
47	L	97.5	Very high	94.3	Very high	5 Å²	5	84.3 Å²	84.3	3%	0.026	39%	0.385	C	S	.	.	H	α-helix	trans	-56.7	-43.8	176.7	-80.8	164.2	0	0	0	112.3	R43 L44 K49 R50 Y51 I105 E108 L109	R43-L47 PolarHBondContact O-N 3.05Å; L44-L47 HydrophobicContact CD2-CD1 4.37Å; L44-L47 WeakPolarHBondContact O-CB 3.49Å; L44-L47 PolarHBondContact O-N 2.96Å; L44-L47 VanDerWaalsContact O-N 3.09Å; L47-K49 VanDerWaalsContact C-N 3.34Å; L47-K49 PolarHBondContact O-N 3.38Å; L47-R50 WeakPolarHBondContact O-CB 3.48Å; L47-R50 PolarHBondContact O-N 3.38Å; L47-R50 VanDerWaalsContact O-N 3.08Å; L47-Y51 VanDerWaalsContact O-CD2 3.27Å; L47-Y51 WeakPolarHBondContact O-CD2 3.46Å; L47-Y51 PolarHBondContact O-N 2.94Å; L47-I105 HydrophobicContact CD2-CB 4.46Å; L47-I105 HydrophobicContact CD2-CG2 4.08Å; L47-I105 WeakPolarHBondContact CD2-O 3.41Å; L47-E108 HydrophobicContact CD2-CB 3.95Å; L47-E108 HydrophobicContact CD2-CG 4.27Å; L47-E108 HydrophobicContact CG-CB 4.45Å; L47-E108 HydrophobicContact CG-CG 4.23Å; L47-L109 HydrophobicContact CD1-CB 4.15Å; L47-L109 HydrophobicContact CD1-CD1 4.05Å; L47-L109 HydrophobicContact CD2-CB 4.23Å
48	D	97.7	Very high	95.1	Very high	102 Å²	102	84 Å²	84	55%	0.545	38%	0.384	S	S	.	.	H	α-helix	trans	-57.4	-46.4	176.6	-72.6	-19.6	0	0	0	111.7	L44 Y46 R50 Y51 D52	L44-D48 PolarHBondContact O-N 2.95Å; Y46-D48 VanDerWaalsContact C-N 3.32Å; Y46-D48 PolarHBondContact O-N 3.15Å; D48-R50 VanDerWaalsContact C-N 3.27Å; D48-R50 PolarHBondContact O-N 3.12Å; D48-Y51 PolarHBondContact O-N 2.78Å; D48-D52 PolarHBondContact O-N 3.45Å
49	K	98.3	Very high	95.7	Very high	142 Å²	142	83.4 Å²	83.4	62%	0.617	38%	0.381	S	S	*	.	H	α-helix	trans	-60.6	-36.8	176	-69.6	173.3	-178.3	176.7	0	112.4	T45 Y46 L47 H53	T45-K49 WeakPolarHBondContact O-CG 3.39Å; T45-K49 PolarHBondContact O-N 3.06Å; Y46-K49 WeakPolarHBondContact O-CB 3.44Å; Y46-K49 PolarHBondContact O-N 3.39Å; L47-K49 VanDerWaalsContact C-N 3.34Å; L47-K49 PolarHBondContact O-N 3.38Å; K49-H53 WeakPolarHBondContact O-CB 3.46Å; K49-H53 PolarHBondContact O-N 3.46Å
50	R	98	Very high	96.3	Very high	45 Å²	45	80.3 Å²	80.3	17%	0.17	37%	0.371	C	S	.	.	H	α-helix	trans	-71.4	-39.9	178.1	-58.8	-70.1	-88.3	152.9	11.4	111	Y46 L47 D48 H53 L54 E101 I105	Y46-R50 HydrophobicContact CD1-CG 4.16Å; Y46-R50 HydrophobicContact CD2-CG 4.39Å; Y46-R50 HydrophobicContact CE1-CG 3.76Å; Y46-R50 HydrophobicContact CE2-CG 4.03Å; Y46-R50 HydrophobicContact CG-CG 4.46Å; Y46-R50 VanDerWaalsContact O-CG 3.26Å; Y46-R50 WeakPolarHBondContact O-CG 3.28Å; Y46-R50 PolarHBondContact O-N 3.4Å; Y46-R50 VanDerWaalsContact O-N 3.07Å; Y46-R50 PolarHBondContact OH-NE 3.06Å; L47-R50 WeakPolarHBondContact O-CB 3.48Å; L47-R50 PolarHBondContact O-N 3.38Å; L47-R50 VanDerWaalsContact O-N 3.08Å; D48-R50 VanDerWaalsContact C-N 3.27Å; D48-R50 PolarHBondContact O-N 3.12Å; R50-H53 WeakPolarHBondContact O-CB 3.46Å; R50-H53 PolarHBondContact O-N 2.83Å; R50-L54 PolarHBondContact O-N 3.11Å; R50-E101 WeakPolarHBondContact CD-OE1 3.35Å; R50-E101 IonicContact CZ-OE1 2.78Å; R50-E101 IonicContact CZ-OE2 2.97Å; R50-E101 IonicContact NE-OE1 2.99Å; R50-E101 PolarHBondContact NE-OE1 2.93Å; R50-E101 IonicContact NE-OE2 3.57Å; R50-E101 IonicContact NH1-OE1 3.49Å; R50-E101 PolarHBondContact NH1-OE1 2.8Å; R50-E101 IonicContact NH1-OE2 3.44Å; R50-E101 PolarHBondContact NH1-OE2 3.22Å; R50-E101 VanDerWaalsContact NH2-CD 3.32Å; R50-E101 IonicContact NH2-OE1 3.11Å; R50-E101 IonicContact NH2-OE2 3.51Å; R50-E101 PolarHBondContact NH2-OE2 3.48Å; R50-I105 HydrophobicContact CB-CD1 4.05Å; R50-I105 HydrophobicContact CB-CG1 3.62Å
51	Y	98	Very high	96.8	Very high	113 Å²	113	80.5 Å²	80.5	44%	0.443	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-44.1	171.8	-86.2	-70.3	0	0	0	112.1	L47 D48 H53 L54 R55 I105	L47-Y51 VanDerWaalsContact O-CD2 3.27Å; L47-Y51 WeakPolarHBondContact O-CD2 3.46Å; L47-Y51 PolarHBondContact O-N 2.94Å; D48-Y51 PolarHBondContact O-N 2.78Å; Y51-H53 VanDerWaalsContact C-N 3.3Å; Y51-H53 PolarHBondContact O-N 3.28Å; Y51-L54 PolarHBondContact O-N 2.98Å; Y51-R55 WeakPolarHBondContact O-CB 3.34Å; Y51-R55 PolarHBondContact O-N 3.24Å; Y51-I105 HydrophobicContact CD1-CD1 4.12Å; Y51-I105 HydrophobicContact CD1-CG2 4.41Å; Y51-I105 HydrophobicContact CD2-CG2 4.12Å; Y51-I105 HydrophobicContact CE1-CD1 4.39Å; Y51-I105 HydrophobicContact CE1-CG2 3.79Å; Y51-I105 HydrophobicContact CE2-CG2 3.45Å; Y51-I105 VanDerWaalsContact CE2-CG2 3.45Å; Y51-I105 HydrophobicContact CG-CD1 4.26Å; Y51-I105 WeakPolarHBondContact OH-CG2 3.45Å
52	D	98.3	Very high	97.2	Very high	88 Å²	88	83 Å²	83	47%	0.471	38%	0.379	S	S	.	.	H	α-helix	trans	-61.5	-39.6	174.7	-85.3	-17.5	0	0	0	112.2	D48 R55 K56	D48-D52 PolarHBondContact O-N 3.45Å; D52-R55 WeakPolarHBondContact O-CB 3.38Å; D52-R55 PolarHBondContact O-N 3.38Å; D52-K56 WeakPolarHBondContact O-CG 3.4Å; D52-K56 PolarHBondContact O-N 2.96Å
53	H	97.9	Very high	97.4	Very high	82 Å²	82	85.1 Å²	85.1	38%	0.38	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-46.7	174.6	-179.1	-138.7	0	0	0	111.9	K49 R50 Y51 R55 K56 M57 E101	K49-H53 WeakPolarHBondContact O-CB 3.46Å; K49-H53 PolarHBondContact O-N 3.46Å; R50-H53 WeakPolarHBondContact O-CB 3.46Å; R50-H53 PolarHBondContact O-N 2.83Å; Y51-H53 VanDerWaalsContact C-N 3.3Å; Y51-H53 PolarHBondContact O-N 3.28Å; H53-R55 VanDerWaalsContact C-N 3.3Å; H53-R55 PolarHBondContact O-N 2.89Å; H53-K56 WeakPolarHBondContact O-CB 3.48Å; H53-K56 PolarHBondContact O-N 3.32Å; H53-K56 VanDerWaalsContact O-N 3.17Å; H53-M57 PolarHBondContact O-N 3.3Å; H53-E101 IonicContact CE1-OE2 2.84Å; H53-E101 IonicContact CG-OE1 3.73Å; H53-E101 IonicContact ND1-OE1 3.41Å; H53-E101 PolarHBondContact ND1-OE1 3.05Å; H53-E101 IonicContact ND1-OE2 3.27Å; H53-E101 PolarHBondContact ND1-OE2 3.43Å
54	L	98.2	Very high	97.6	Very high	30 Å²	30	82.6 Å²	82.6	16%	0.157	38%	0.377	C	S	.	.	H	α-helix	trans	-60	-39.2	174.7	-178.3	59.5	0	0	0	112.2	R50 Y51 M57 T58 M98 E101 A102 I105	R50-L54 PolarHBondContact O-N 3.11Å; Y51-L54 PolarHBondContact O-N 2.98Å; L54-M57 HydrophobicContact CB-CE 4.44Å; L54-M57 HydrophobicContact CD1-CE 4.17Å; L54-M57 PolarHBondContact O-N 3.09Å; L54-T58 PolarHBondContact O-N 3.42Å; L54-T58 PolarHBondContact O-OG1 3.43Å; L54-M98 HydrophobicContact CD1-CB 3.95Å; L54-M98 HydrophobicContact CD1-CE 4.12Å; L54-M98 HydrophobicContact CD1-CG 4.08Å; L54-E101 HydrophobicContact CB-CG 4.05Å; L54-E101 HydrophobicContact CD1-CB 4.31Å; L54-A102 HydrophobicContact CD2-CB 4.31Å; L54-I105 HydrophobicContact CB-CD1 4.15Å; L54-I105 HydrophobicContact CD2-CD1 3.91Å
55	R	98.1	Very high	97.8	Very high	165 Å²	165	82.7 Å²	82.7	62%	0.623	38%	0.38	S	S	*	.	H	α-helix	trans	-62.2	-43.9	174.6	-176.1	-178.2	178.7	173.8	2.6	111.7	Y51 D52 H53 T58 H59	Y51-R55 WeakPolarHBondContact O-CB 3.34Å; Y51-R55 PolarHBondContact O-N 3.24Å; D52-R55 WeakPolarHBondContact O-CB 3.38Å; D52-R55 PolarHBondContact O-N 3.38Å; H53-R55 VanDerWaalsContact C-N 3.3Å; H53-R55 PolarHBondContact O-N 2.89Å; R55-T58 WeakPolarHBondContact O-CB 3.49Å; R55-T58 PolarHBondContact O-N 3.44Å; R55-H59 PolarHBondContact O-N 3.35Å
56	K	98.1	Very high	97.9	Very high	150 Å²	150	83.1 Å²	83.1	65%	0.652	38%	0.38	S	S	*	.	H	α-helix	trans	-62.3	-44.4	175.7	-72.7	171.7	-177.1	176.6	0	111.8	D52 H53 T58 H59 S60	D52-K56 WeakPolarHBondContact O-CG 3.4Å; D52-K56 PolarHBondContact O-N 2.96Å; H53-K56 WeakPolarHBondContact O-CB 3.48Å; H53-K56 PolarHBondContact O-N 3.32Å; H53-K56 VanDerWaalsContact O-N 3.17Å; K56-T58 VanDerWaalsContact C-N 3.31Å; K56-T58 PolarHBondContact O-N 2.92Å; K56-H59 PolarHBondContact O-N 3.11Å; K56-S60 PolarHBondContact O-N 3.47Å
57	M	97.9	Very high	97.9	Very high	16 Å²	16	82.4 Å²	82.4	8%	0.079	38%	0.38	C	S	.	.	H	α-helix	trans	-61.1	-40.1	174.3	-71	-173	-75.7	0	0	111.9	H53 L54 H59 S60 L61 L97 M98 E101	H53-M57 PolarHBondContact O-N 3.3Å; L54-M57 HydrophobicContact CB-CE 4.44Å; L54-M57 HydrophobicContact CD1-CE 4.17Å; L54-M57 PolarHBondContact O-N 3.09Å; M57-H59 VanDerWaalsContact C-N 3.3Å; M57-H59 PolarHBondContact O-N 3.39Å; M57-S60 PolarHBondContact O-N 2.95Å; M57-L61 WeakPolarHBondContact O-CB 3.36Å; M57-L61 PolarHBondContact O-N 2.95Å; M57-L97 HydrophobicContact SD-CB 4Å; M57-M98 HydrophobicContact CB-CG 3.6Å; M57-M98 HydrophobicContact CB-SD 4.2Å; M57-M98 HydrophobicContact SD-CG 4.24Å; M57-E101 HydrophobicContact CE-CB 3.51Å; M57-E101 HydrophobicContact CE-CG 3.52Å
58	T	97.4	Very high	97.9	Very high	51 Å²	51	83 Å²	83	31%	0.313	38%	0.383	S	S	.	.	H	α-helix	trans	-60	-40.7	175.6	-55.7	0	0	0	0	111.9	L54 R55 K56 R62 M98	L54-T58 PolarHBondContact O-N 3.42Å; L54-T58 PolarHBondContact O-OG1 3.43Å; R55-T58 WeakPolarHBondContact O-CB 3.49Å; R55-T58 PolarHBondContact O-N 3.44Å; K56-T58 VanDerWaalsContact C-N 3.31Å; K56-T58 PolarHBondContact O-N 2.92Å; T58-R62 WeakPolarHBondContact O-CB 3.42Å; T58-R62 PolarHBondContact O-N 3.45Å; T58-R62 VanDerWaalsContact O-N 3.15Å; T58-M98 HydrophobicContact CG2-CE 4.36Å; T58-M98 WeakPolarHBondContact OG1-CE 3.38Å
59	H	97.7	Very high	97.8	Very high	111 Å²	111	82.7 Å²	82.7	51%	0.514	38%	0.378	S	S	.	.	H	α-helix	trans	-68.5	-43.8	175.3	-81.9	-48	0	0	0	112.7	R55 K56 M57 R62 K63	R55-H59 PolarHBondContact O-N 3.35Å; K56-H59 PolarHBondContact O-N 3.11Å; M57-H59 VanDerWaalsContact C-N 3.3Å; M57-H59 PolarHBondContact O-N 3.39Å; H59-R62 PolarHBondContact O-N 3.06Å; H59-K63 PolarHBondContact O-N 2.94Å
60	S	97.4	Very high	97.7	Very high	43 Å²	43	80.1 Å²	80.1	30%	0.301	37%	0.371	S	S	.	.	H	α-helix	trans	-62.3	-45.7	177.3	164.8	0	0	0	0	111.7	K56 M57 R62 K63 K64 E94	K56-S60 PolarHBondContact O-N 3.47Å; M57-S60 PolarHBondContact O-N 2.95Å; S60-R62 VanDerWaalsContact C-N 3.34Å; S60-R62 PolarHBondContact O-N 3.37Å; S60-K63 WeakPolarHBondContact O-CB 3.48Å; S60-K63 PolarHBondContact O-N 3.26Å; S60-K63 VanDerWaalsContact O-N 3.12Å; S60-K64 PolarHBondContact O-N 3.03Å; S60-K64 PolarHBondContact OG-NZ 3.43Å; S60-E94 WeakPolarHBondContact CB-OE1 3.21Å; S60-E94 PolarHBondContact OG-OE1 2.95Å; S60-E94 PolarHBondContact OG-OE2 3.02Å
61	L	98.1	Very high	97.6	Very high	32 Å²	32	79.1 Å²	79.1	17%	0.168	37%	0.369	C	S	.	.	H	α-helix	trans	-58.8	-45.2	176	-176.1	64.4	0	0	0	111.7	M57 K63 K64 V65 I91 E94 M98	M57-L61 WeakPolarHBondContact O-CB 3.36Å; M57-L61 PolarHBondContact O-N 2.95Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 3.38Å; L61-K64 PolarHBondContact O-N 3.25Å; L61-V65 WeakPolarHBondContact O-CG2 3.33Å; L61-V65 PolarHBondContact O-N 3.2Å; L61-I91 HydrophobicContact CD1-CB 4.22Å; L61-I91 HydrophobicContact CD1-CG1 4.23Å; L61-I91 HydrophobicContact CD1-CG2 3.92Å; L61-E94 WeakPolarHBondContact CA-OE2 3.35Å; L61-E94 HydrophobicContact CB-CG 4.17Å; L61-E94 HydrophobicContact CD1-CB 4.19Å; L61-E94 HydrophobicContact CD1-CG 4.22Å; L61-E94 PolarHBondContact N-OE1 3.44Å; L61-M98 HydrophobicContact CB-SD 4.05Å; L61-M98 HydrophobicContact CD2-SD 3.53Å; L61-M98 VanDerWaalsContact CD2-SD 3.53Å; L61-M98 HydrophobicContact CG-SD 4.41Å
62	R	98	Very high	97.3	Very high	154 Å²	154	79.4 Å²	79.4	58%	0.581	38%	0.376	S	S	*	.	H	α-helix	trans	-58.6	-42.1	176.4	-174.8	-175	-59.3	-99.9	-1.1	111.6	T58 H59 S60 V65 N66	T58-R62 WeakPolarHBondContact O-CB 3.42Å; T58-R62 PolarHBondContact O-N 3.45Å; T58-R62 VanDerWaalsContact O-N 3.15Å; H59-R62 PolarHBondContact O-N 3.06Å; S60-R62 VanDerWaalsContact C-N 3.34Å; S60-R62 PolarHBondContact O-N 3.37Å; R62-V65 PolarHBondContact O-N 3.44Å; R62-N66 VanDerWaalsContact O-CG 3.27Å; R62-N66 PolarHBondContact O-N 2.8Å; R62-N66 PolarHBondContact O-OD1 3.16Å
63	K	98.1	Very high	97.1	Very high	151 Å²	151	83.5 Å²	83.5	66%	0.657	39%	0.385	S	S	*	.	H	α-helix	trans	-60.7	-46.5	177	-172	-174.5	174.8	-169.7	0	111.2	H59 S60 L61 V65 N66 E67	H59-K63 PolarHBondContact O-N 2.94Å; S60-K63 WeakPolarHBondContact O-CB 3.48Å; S60-K63 PolarHBondContact O-N 3.26Å; S60-K63 VanDerWaalsContact O-N 3.12Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 3.38Å; K63-V65 PolarHBondContact O-N 2.54Å; K63-N66 PolarHBondContact O-N 2.9Å; K63-E67 WeakPolarHBondContact O-CB 3.26Å; K63-E67 PolarHBondContact O-N 3.49Å
64	K	97.8	Very high	96.9	Very high	38 Å²	38	84.3 Å²	84.3	17%	0.165	39%	0.391	C	S	.	.	H	α-helix	trans	-64.8	-37.2	178.5	-63.9	-163.9	-176.5	80.5	0	112.9	S60 L61 E67 L68 L87 E90 I91 E94	S60-K64 PolarHBondContact O-N 3.03Å; S60-K64 PolarHBondContact OG-NZ 3.43Å; L61-K64 PolarHBondContact O-N 3.25Å; K64-E67 PolarHBondContact O-N 3.02Å; K64-L68 WeakPolarHBondContact O-CB 3.5Å; K64-L68 PolarHBondContact O-N 3.09Å; K64-L87 HydrophobicContact CB-CD2 4.47Å; K64-E90 HydrophobicContact CD-CB 3.89Å; K64-E90 WeakPolarHBondContact CE-OE2 3.46Å; K64-I91 HydrophobicContact CB-CD1 4.23Å; K64-I91 HydrophobicContact CB-CG1 3.78Å; K64-E94 IonicContact NZ-OE1 3.9Å; K64-E94 IonicContact NZ-OE2 3.95Å; K64-E94 PolarHBondContact NZ-OE2 3.36Å
65	V	97.9	Very high	96.4	Very high	51 Å²	51	89.4 Å²	89.4	31%	0.309	42%	0.419	S	S	.	.	H	α-helix	trans	-64.1	-45.7	174.8	170.4	0	0	0	0	110.7	L61 R62 K63 E67 L68 E69 I91	L61-V65 WeakPolarHBondContact O-CG2 3.33Å; L61-V65 PolarHBondContact O-N 3.2Å; R62-V65 PolarHBondContact O-N 3.44Å; K63-V65 PolarHBondContact O-N 2.54Å; V65-E67 VanDerWaalsContact C-N 3.34Å; V65-E67 PolarHBondContact O-N 3.32Å; V65-L68 WeakPolarHBondContact O-CB 3.44Å; V65-L68 PolarHBondContact O-N 3.18Å; V65-E69 WeakPolarHBondContact O-CG 3.4Å; V65-E69 PolarHBondContact O-N 3.11Å; V65-I91 HydrophobicContact CG2-CD1 4.09Å; V65-I91 HydrophobicContact CG2-CG1 4.42Å
66	N	97.8	Very high	95.9	Very high	78 Å²	78	88.5 Å²	88.5	42%	0.417	43%	0.426	S	S	.	.	H	α-helix	trans	-62.2	-42.7	176.6	-68.3	2.1	0	0	0	111.7	R62 K63 L68 E69 D70	R62-N66 VanDerWaalsContact O-CG 3.27Å; R62-N66 PolarHBondContact O-N 2.8Å; R62-N66 PolarHBondContact O-OD1 3.16Å; K63-N66 PolarHBondContact O-N 2.9Å; N66-L68 VanDerWaalsContact C-N 3.33Å; N66-L68 PolarHBondContact O-N 2.64Å; N66-E69 WeakPolarHBondContact O-CB 3.39Å; N66-E69 PolarHBondContact O-N 3.43Å; N66-D70 VanDerWaalsContact O-CG 3.31Å; N66-D70 PolarHBondContact O-N 2.82Å
67	E	97.2	Very high	95.7	Very high	84 Å²	84	84.6 Å²	84.6	39%	0.393	41%	0.413	S	S	.	.	H	α-helix	trans	-61.7	-41.4	176.7	-173.7	175.8	171.1	0	0	111.9	K63 K64 V65 D70 I71 L87	K63-E67 WeakPolarHBondContact O-CB 3.26Å; K63-E67 PolarHBondContact O-N 3.49Å; K64-E67 PolarHBondContact O-N 3.02Å; V65-E67 VanDerWaalsContact C-N 3.34Å; V65-E67 PolarHBondContact O-N 3.32Å; E67-D70 PolarHBondContact O-N 2.89Å; E67-I71 HydrophobicContact CG-CD1 4.39Å; E67-I71 WeakPolarHBondContact O-CG1 3.26Å; E67-I71 PolarHBondContact O-N 2.89Å; E67-L87 HydrophobicContact CB-CD1 4.45Å; E67-L87 HydrophobicContact CG-CD1 3.98Å; E67-L87 HydrophobicContact CG-CD2 4.43Å
68	L	97.4	Very high	95.5	Very high	18 Å²	18	91.6 Å²	91.6	9%	0.094	45%	0.445	C	S	.	.	H	α-helix	trans	-61.4	-46.3	173	175.2	65.3	0	0	0	111.4	K64 V65 N66 D70 I71 M72 I84 L87 L88 I91	K64-L68 WeakPolarHBondContact O-CB 3.5Å; K64-L68 PolarHBondContact O-N 3.09Å; V65-L68 WeakPolarHBondContact O-CB 3.44Å; V65-L68 PolarHBondContact O-N 3.18Å; N66-L68 VanDerWaalsContact C-N 3.33Å; N66-L68 PolarHBondContact O-N 2.64Å; L68-D70 VanDerWaalsContact C-N 3.26Å; L68-D70 PolarHBondContact O-N 3.5Å; L68-I71 PolarHBondContact O-N 3.47Å; L68-M72 HydrophobicContact CD1-CG 4.11Å; L68-M72 HydrophobicContact CD1-SD 4.04Å; L68-M72 HydrophobicContact CG-CG 4.43Å; L68-M72 HydrophobicContact CG-SD 3.97Å; L68-M72 WeakPolarHBondContact O-CB 3.01Å; L68-M72 VanDerWaalsContact O-CG 3.22Å; L68-M72 WeakPolarHBondContact O-CG 3.32Å; L68-M72 PolarHBondContact O-N 2.86Å; L68-I84 HydrophobicContact CD1-CB 4.18Å; L68-I84 HydrophobicContact CD1-CG1 4Å; L68-I84 HydrophobicContact CD1-CG2 3.89Å; L68-L87 HydrophobicContact CB-CD1 4.27Å; L68-L87 HydrophobicContact CD1-CB 4.38Å; L68-L88 HydrophobicContact CD1-CG 4.44Å; L68-L88 HydrophobicContact CD2-CD2 3.63Å; L68-L88 HydrophobicContact CD2-CG 4.26Å; L68-I91 HydrophobicContact CB-CD1 4.21Å; L68-I91 HydrophobicContact CD2-CD1 3.77Å
69	E	96.3	Very high	95.3	Very high	94 Å²	94	96.1 Å²	96.1	44%	0.439	46%	0.463	S	S	.	.	H	α-helix	trans	-60	-36.7	176.4	-73.7	179.1	-175.2	0	0	112.3	V65 N66 R73	V65-E69 WeakPolarHBondContact O-CG 3.4Å; V65-E69 PolarHBondContact O-N 3.11Å; N66-E69 WeakPolarHBondContact O-CB 3.39Å; N66-E69 PolarHBondContact O-N 3.43Å; E69-R73 WeakPolarHBondContact O-CG 3.39Å
70	D	96.4	Very high	95.2	Very high	88 Å²	88	92 Å²	92	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-70.4	-43.2	178.5	-71.3	-24.9	0	0	0	111.6	N66 E67 L68 R73	N66-D70 VanDerWaalsContact O-CG 3.31Å; N66-D70 PolarHBondContact O-N 2.82Å; E67-D70 PolarHBondContact O-N 2.89Å; L68-D70 VanDerWaalsContact C-N 3.26Å; L68-D70 PolarHBondContact O-N 3.5Å; D70-R73 WeakPolarHBondContact O-CB 3.16Å; D70-R73 PolarHBondContact O-N 3.19Å; D70-R73 IonicContact OD1-CZ 3.88Å; D70-R73 IonicContact OD1-NH1 3.04Å; D70-R73 PolarHBondContact OD1-NH1 3.25Å
71	I	95.6	Very high	95	Very high	24 Å²	24	94.6 Å²	94.6	12%	0.123	45%	0.453	C	S	.	.	H	α-helix	trans	-68.1	-36.5	177.4	-64.4	174.7	0	0	0	111.3	E67 L68 R73 L74 N80 T83 I84 L87	E67-I71 HydrophobicContact CG-CD1 4.39Å; E67-I71 WeakPolarHBondContact O-CG1 3.26Å; E67-I71 PolarHBondContact O-N 2.89Å; L68-I71 PolarHBondContact O-N 3.47Å; I71-R73 PolarHBondContact O-N 3.49Å; I71-R73 VanDerWaalsContact O-N 3.08Å; I71-L74 WeakPolarHBondContact O-CB 3.5Å; I71-L74 PolarHBondContact O-N 3.06Å; I71-N80 HydrophobicContact CG2-CB 3.98Å; I71-T83 HydrophobicContact CD1-CG2 3.42Å; I71-T83 VanDerWaalsContact CD1-CG2 3.42Å; I71-I84 HydrophobicContact CB-CG1 4.42Å; I71-I84 HydrophobicContact CG2-CD1 4.04Å; I71-I84 HydrophobicContact CG2-CG1 3.72Å; I71-L87 HydrophobicContact CD1-CD1 3.68Å
72	M	92	Very high	94.9	Very high	119 Å²	119	97.4 Å²	97.4	59%	0.586	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.6	176.3	-73.7	-178.2	69.8	0	0	113.9	L68 I84	L68-M72 HydrophobicContact CD1-CG 4.11Å; L68-M72 HydrophobicContact CD1-SD 4.04Å; L68-M72 HydrophobicContact CG-CG 4.43Å; L68-M72 HydrophobicContact CG-SD 3.97Å; L68-M72 WeakPolarHBondContact O-CB 3.01Å; L68-M72 VanDerWaalsContact O-CG 3.22Å; L68-M72 WeakPolarHBondContact O-CG 3.32Å; L68-M72 PolarHBondContact O-N 2.86Å; M72-I84 HydrophobicContact CG-CD1 3.98Å; M72-I84 HydrophobicContact CG-CG1 4.25Å
73	R	93.7	Very high	94.8	Very high	174 Å²	174	92 Å²	92	66%	0.657	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-9.1	172.9	-66.6	170.5	-170.5	152	9.7	113.3	E69 D70 I71	E69-R73 WeakPolarHBondContact O-CG 3.39Å; D70-R73 WeakPolarHBondContact O-CB 3.16Å; D70-R73 PolarHBondContact O-N 3.19Å; D70-R73 IonicContact OD1-CZ 3.88Å; D70-R73 IonicContact OD1-NH1 3.04Å; D70-R73 PolarHBondContact OD1-NH1 3.25Å; I71-R73 PolarHBondContact O-N 3.49Å; I71-R73 VanDerWaalsContact O-N 3.08Å
74	L	93.3	Very high	94.8	Very high	99 Å²	99	85.8 Å²	85.8	52%	0.518	43%	0.426	S	S	.	.	S	Bend	trans	-82.1	176.3	177	-58	178.5	0	0	0	110.8	I71	I71-L74 WeakPolarHBondContact O-CB 3.5Å; I71-L74 PolarHBondContact O-N 3.06Å
75	D	88.1	Confident	94.7	Very high	138 Å²	138	88.5 Å²	88.5	74%	0.738	44%	0.439	S	S	*	.			trans	-64.5	146.4	176.7	-70.3	-33.7	0	0	0	111.2	D77 N80	D75-D77 PolarHBondContact O-N 3.47Å; D75-N80 PolarHBondContact O-ND2 2.96Å
76	N	88.7	Confident	94.7	Very high	146 Å²	146	92.2 Å²	92.2	78%	0.781	45%	0.451	S	S	*	.			trans	-78.3	67.7	-179.8	-71.5	-31.3	0	0	0	111.5
77	D	93.4	Very high	94.7	Very high	68 Å²	68	89 Å²	89	36%	0.364	43%	0.434	S	S	.	.			trans	-94.8	165.5	172.2	65.6	45.7	0	0	0	112.4	D75 E79 N80 M81	D75-D77 PolarHBondContact O-N 3.47Å; D77-E79 VanDerWaalsContact C-N 3.3Å; D77-E79 PolarHBondContact O-N 3.41Å; D77-E79 PolarHBondContact OD1-N 3.47Å; D77-N80 VanDerWaalsContact CG-ND2 3.3Å; D77-N80 PolarHBondContact O-N 3.38Å; D77-N80 VanDerWaalsContact OD1-CB 3.25Å; D77-N80 WeakPolarHBondContact OD1-CB 3.08Å; D77-N80 PolarHBondContact OD1-N 3.43Å; D77-N80 PolarHBondContact OD1-ND2 2.97Å; D77-N80 PolarHBondContact OD2-ND2 3.23Å; D77-M81 VanDerWaalsContact O-CG 3.28Å; D77-M81 WeakPolarHBondContact O-CG 3.4Å; D77-M81 PolarHBondContact O-N 2.91Å
78	E	93.4	Very high	94.7	Very high	162 Å²	162	87.7 Å²	87.7	76%	0.757	43%	0.43	S	S	*	.	H	α-helix	trans	-62.6	-36	-176.1	-169.9	173.3	-169.8	0	0	112.3	M81 D82	E78-M81 PolarHBondContact O-N 3.27Å; E78-D82 WeakPolarHBondContact O-CB 3.35Å; E78-D82 PolarHBondContact O-N 2.87Å
79	E	93.9	Very high	94.8	Very high	146 Å²	146	89.9 Å²	89.9	68%	0.682	44%	0.441	S	S	*	.	H	α-helix	trans	-68.6	-42.3	179.8	-175.1	174	-171.7	0	0	111.7	D77 D82 T83	D77-E79 VanDerWaalsContact C-N 3.3Å; D77-E79 PolarHBondContact O-N 3.41Å; D77-E79 PolarHBondContact OD1-N 3.47Å; E79-D82 PolarHBondContact O-N 3.37Å; E79-T83 WeakPolarHBondContact O-CB 3.26Å; E79-T83 PolarHBondContact O-N 2.87Å; E79-T83 PolarHBondContact O-OG1 3.38Å
80	N	94.3	Very high	94.9	Very high	24 Å²	24	89.1 Å²	89.1	13%	0.128	44%	0.438	C	S	.	.	H	α-helix	trans	-65.7	-41.3	175.4	-69	-25.1	0	0	0	110.6	I71 D75 D77 T83 I84	I71-N80 HydrophobicContact CG2-CB 3.98Å; D75-N80 PolarHBondContact O-ND2 2.96Å; D77-N80 VanDerWaalsContact CG-ND2 3.3Å; D77-N80 PolarHBondContact O-N 3.38Å; D77-N80 VanDerWaalsContact OD1-CB 3.25Å; D77-N80 WeakPolarHBondContact OD1-CB 3.08Å; D77-N80 PolarHBondContact OD1-N 3.43Å; D77-N80 PolarHBondContact OD1-ND2 2.97Å; D77-N80 PolarHBondContact OD2-ND2 3.23Å; N80-T83 PolarHBondContact O-N 2.99Å; N80-I84 WeakPolarHBondContact O-CB 3.36Å; N80-I84 WeakPolarHBondContact O-CD1 3.41Å; N80-I84 WeakPolarHBondContact O-CG1 3.37Å; N80-I84 PolarHBondContact O-N 3.25Å
81	M	94.7	Very high	94.9	Very high	99 Å²	99	86.1 Å²	86.1	49%	0.488	42%	0.421	S	S	.	.	H	α-helix	trans	-63.4	-43.1	176.5	-70.4	-55.6	-59.6	0	0	112.5	D77 E78 T83 I84 Q85	D77-M81 VanDerWaalsContact O-CG 3.28Å; D77-M81 WeakPolarHBondContact O-CG 3.4Å; D77-M81 PolarHBondContact O-N 2.91Å; E78-M81 PolarHBondContact O-N 3.27Å; M81-T83 VanDerWaalsContact C-N 3.31Å; M81-T83 PolarHBondContact O-N 3.22Å; M81-I84 PolarHBondContact O-N 2.87Å; M81-I84 HydrophobicContact SD-CD1 4.25Å; M81-Q85 PolarHBondContact O-N 2.96Å
82	D	95.8	Very high	95.1	Very high	90 Å²	90	90.9 Å²	90.9	48%	0.481	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-40.1	174.1	-87.4	-4.9	0	0	0	112	E78 E79 Q85 K86	E78-D82 WeakPolarHBondContact O-CB 3.35Å; E78-D82 PolarHBondContact O-N 2.87Å; E79-D82 PolarHBondContact O-N 3.37Å; D82-Q85 PolarHBondContact O-N 3.17Å; D82-K86 WeakPolarHBondContact O-CG 3.44Å; D82-K86 PolarHBondContact O-N 2.88Å; D82-K86 VanDerWaalsContact O-N 3.09Å
83	T	95.7	Very high	95.3	Very high	40 Å²	40	92 Å²	92	25%	0.245	44%	0.439	C	S	.	.	H	α-helix	trans	-70.6	-41.9	179.7	-54.5	0	0	0	0	111.6	I71 E79 N80 M81 Q85 K86 L87	I71-T83 HydrophobicContact CD1-CG2 3.42Å; I71-T83 VanDerWaalsContact CD1-CG2 3.42Å; E79-T83 WeakPolarHBondContact O-CB 3.26Å; E79-T83 PolarHBondContact O-N 2.87Å; E79-T83 PolarHBondContact O-OG1 3.38Å; N80-T83 PolarHBondContact O-N 2.99Å; M81-T83 VanDerWaalsContact C-N 3.31Å; M81-T83 PolarHBondContact O-N 3.22Å; T83-Q85 VanDerWaalsContact C-N 3.31Å; T83-Q85 PolarHBondContact O-N 3.49Å; T83-K86 PolarHBondContact O-N 2.9Å; T83-L87 HydrophobicContact CG2-CD1 4.29Å; T83-L87 WeakPolarHBondContact O-CG 3.43Å; T83-L87 PolarHBondContact O-N 2.71Å
84	I	96.6	Very high	95.5	Very high	22 Å²	22	84.5 Å²	84.5	11%	0.113	41%	0.411	C	S	.	.	H	α-helix	trans	-55.3	-47.7	172	-75.5	164.5	0	0	0	110.3	L68 I71 M72 N80 M81 K86 L87 L88	L68-I84 HydrophobicContact CD1-CB 4.18Å; L68-I84 HydrophobicContact CD1-CG1 4Å; L68-I84 HydrophobicContact CD1-CG2 3.89Å; I71-I84 HydrophobicContact CB-CG1 4.42Å; I71-I84 HydrophobicContact CG2-CD1 4.04Å; I71-I84 HydrophobicContact CG2-CG1 3.72Å; M72-I84 HydrophobicContact CG-CD1 3.98Å; M72-I84 HydrophobicContact CG-CG1 4.25Å; N80-I84 WeakPolarHBondContact O-CB 3.36Å; N80-I84 WeakPolarHBondContact O-CD1 3.41Å; N80-I84 WeakPolarHBondContact O-CG1 3.37Å; N80-I84 PolarHBondContact O-N 3.25Å; M81-I84 PolarHBondContact O-N 2.87Å; M81-I84 HydrophobicContact SD-CD1 4.25Å; I84-K86 PolarHBondContact O-N 3.02Å; I84-L87 PolarHBondContact O-N 2.93Å; I84-L88 HydrophobicContact CG2-CD1 3.9Å; I84-L88 HydrophobicContact CG2-CG 4.38Å; I84-L88 WeakPolarHBondContact O-CB 3.35Å; I84-L88 VanDerWaalsContact O-CG 3.31Å; I84-L88 WeakPolarHBondContact O-CG 3.39Å; I84-L88 PolarHBondContact O-N 3.38Å
85	Q	97.1	Very high	95.7	Very high	94 Å²	94	85.1 Å²	85.1	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-63.6	-43.3	-178.6	-174.2	55.8	52.3	0	0	111.8	M81 D82 T83 L88 D89	M81-Q85 PolarHBondContact O-N 2.96Å; D82-Q85 PolarHBondContact O-N 3.17Å; T83-Q85 VanDerWaalsContact C-N 3.31Å; T83-Q85 PolarHBondContact O-N 3.49Å; Q85-L88 PolarHBondContact O-N 3.27Å; Q85-D89 PolarHBondContact NE2-OD1 3.44Å; Q85-D89 PolarHBondContact NE2-OD2 3.49Å; Q85-D89 VanDerWaalsContact NE2-OD2 3.11Å; Q85-D89 PolarHBondContact O-N 3.15Å; Q85-D89 VanDerWaalsContact O-N 3.11Å
86	K	97.3	Very high	96.2	Very high	130 Å²	130	82.4 Å²	82.4	57%	0.565	39%	0.393	S	S	*	.	H	α-helix	trans	-59.7	-48.5	174.7	-71.8	167.4	-172.3	161.6	0	111.5	D82 T83 I84 L88 D89 E90	D82-K86 WeakPolarHBondContact O-CG 3.44Å; D82-K86 PolarHBondContact O-N 2.88Å; D82-K86 VanDerWaalsContact O-N 3.09Å; T83-K86 PolarHBondContact O-N 2.9Å; I84-K86 PolarHBondContact O-N 3.02Å; K86-L88 VanDerWaalsContact C-N 3.35Å; K86-L88 PolarHBondContact O-N 2.95Å; K86-D89 PolarHBondContact O-N 2.92Å; K86-E90 WeakPolarHBondContact O-CG 3.35Å; K86-E90 PolarHBondContact O-N 2.91Å
87	L	97.8	Very high	96.6	Very high	9 Å²	9	79.8 Å²	79.8	5%	0.047	38%	0.378	C	S	.	.	H	α-helix	trans	-61.3	-41.6	178.5	-77.9	171.5	0	0	0	112.1	K64 E67 L68 I71 T83 I84 D89 E90 I91	K64-L87 HydrophobicContact CB-CD2 4.47Å; E67-L87 HydrophobicContact CB-CD1 4.45Å; E67-L87 HydrophobicContact CG-CD1 3.98Å; E67-L87 HydrophobicContact CG-CD2 4.43Å; L68-L87 HydrophobicContact CB-CD1 4.27Å; L68-L87 HydrophobicContact CD1-CB 4.38Å; I71-L87 HydrophobicContact CD1-CD1 3.68Å; T83-L87 HydrophobicContact CG2-CD1 4.29Å; T83-L87 WeakPolarHBondContact O-CG 3.43Å; T83-L87 PolarHBondContact O-N 2.71Å; I84-L87 PolarHBondContact O-N 2.93Å; L87-D89 VanDerWaalsContact C-N 3.33Å; L87-D89 PolarHBondContact O-N 3.48Å; L87-E90 PolarHBondContact O-N 3.45Å; L87-I91 WeakPolarHBondContact O-CB 3.27Å; L87-I91 WeakPolarHBondContact O-CD1 3.38Å; L87-I91 WeakPolarHBondContact O-CG1 3.47Å; L87-I91 PolarHBondContact O-N 3.49Å
88	L	98.1	Very high	96.8	Very high	58 Å²	58	78.2 Å²	78.2	30%	0.304	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-42.3	176.5	-76.3	173.3	0	0	0	112.1	L68 I84 Q85 K86 I91 K92	L68-L88 HydrophobicContact CD1-CG 4.44Å; L68-L88 HydrophobicContact CD2-CD2 3.63Å; L68-L88 HydrophobicContact CD2-CG 4.26Å; I84-L88 HydrophobicContact CG2-CD1 3.9Å; I84-L88 HydrophobicContact CG2-CG 4.38Å; I84-L88 WeakPolarHBondContact O-CB 3.35Å; I84-L88 VanDerWaalsContact O-CG 3.31Å; I84-L88 WeakPolarHBondContact O-CG 3.39Å; I84-L88 PolarHBondContact O-N 3.38Å; Q85-L88 PolarHBondContact O-N 3.27Å; K86-L88 VanDerWaalsContact C-N 3.35Å; K86-L88 PolarHBondContact O-N 2.95Å; L88-I91 PolarHBondContact O-N 3Å; L88-K92 WeakPolarHBondContact O-CB 3.49Å; L88-K92 VanDerWaalsContact O-CG 3.26Å; L88-K92 WeakPolarHBondContact O-CG 3.42Å; L88-K92 PolarHBondContact O-N 3.28Å
89	D	98.2	Very high	97	Very high	64 Å²	64	76 Å²	76	34%	0.342	35%	0.354	S	S	.	.	H	α-helix	trans	-70.9	-34.8	178.7	-68.4	-25.7	0	0	0	112	Q85 K86 L87 K92 R93	Q85-D89 PolarHBondContact NE2-OD1 3.44Å; Q85-D89 PolarHBondContact NE2-OD2 3.49Å; Q85-D89 VanDerWaalsContact NE2-OD2 3.11Å; Q85-D89 PolarHBondContact O-N 3.15Å; Q85-D89 VanDerWaalsContact O-N 3.11Å; K86-D89 PolarHBondContact O-N 2.92Å; L87-D89 VanDerWaalsContact C-N 3.33Å; L87-D89 PolarHBondContact O-N 3.48Å; D89-K92 IonicContact OD1-NZ 3.43Å; D89-K92 PolarHBondContact OD1-NZ 3.37Å; D89-R93 WeakPolarHBondContact O-CB 3.37Å; D89-R93 PolarHBondContact O-N 3Å
90	E	97.9	Very high	97.2	Very high	77 Å²	77	72.3 Å²	72.3	36%	0.36	34%	0.339	S	S	.	.	H	α-helix	trans	-64	-46.7	170.3	-70.7	-174	-170.6	0	0	113.2	K64 K86 L87 K92 R93 E94	K64-E90 HydrophobicContact CD-CB 3.89Å; K64-E90 WeakPolarHBondContact CE-OE2 3.46Å; K86-E90 WeakPolarHBondContact O-CG 3.35Å; K86-E90 PolarHBondContact O-N 2.91Å; L87-E90 PolarHBondContact O-N 3.45Å; E90-K92 VanDerWaalsContact C-N 3.35Å; E90-K92 PolarHBondContact O-N 3.3Å; E90-R93 PolarHBondContact O-N 3.08Å; E90-E94 WeakPolarHBondContact O-CB 3.36Å; E90-E94 PolarHBondContact O-N 2.84Å
91	I	98.3	Very high	97.4	Very high	25 Å²	25	71.6 Å²	71.6	13%	0.128	34%	0.335	C	S	.	.	H	α-helix	trans	-59.7	-45.2	176.9	-74.4	165.8	0	0	0	110.6	L61 K64 V65 L68 L87 L88 R93 E94 K95	L61-I91 HydrophobicContact CD1-CB 4.22Å; L61-I91 HydrophobicContact CD1-CG1 4.23Å; L61-I91 HydrophobicContact CD1-CG2 3.92Å; K64-I91 HydrophobicContact CB-CD1 4.23Å; K64-I91 HydrophobicContact CB-CG1 3.78Å; V65-I91 HydrophobicContact CG2-CD1 4.09Å; V65-I91 HydrophobicContact CG2-CG1 4.42Å; L68-I91 HydrophobicContact CB-CD1 4.21Å; L68-I91 HydrophobicContact CD2-CD1 3.77Å; L87-I91 WeakPolarHBondContact O-CB 3.27Å; L87-I91 WeakPolarHBondContact O-CD1 3.38Å; L87-I91 WeakPolarHBondContact O-CG1 3.47Å; L87-I91 PolarHBondContact O-N 3.49Å; L88-I91 PolarHBondContact O-N 3Å; I91-R93 PolarHBondContact O-N 2.98Å; I91-E94 PolarHBondContact O-N 2.95Å; I91-K95 VanDerWaalsContact O-CB 3.26Å; I91-K95 WeakPolarHBondContact O-CB 3.5Å; I91-K95 PolarHBondContact O-N 3.09Å
92	K	98.1	Very high	97.5	Very high	124 Å²	124	68.9 Å²	68.9	54%	0.539	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-45.8	176.7	-74.8	169.8	-168.3	162.6	0	111.6	L88 D89 E90 Q96	L88-K92 WeakPolarHBondContact O-CB 3.49Å; L88-K92 VanDerWaalsContact O-CG 3.26Å; L88-K92 WeakPolarHBondContact O-CG 3.42Å; L88-K92 PolarHBondContact O-N 3.28Å; D89-K92 IonicContact OD1-NZ 3.43Å; D89-K92 PolarHBondContact OD1-NZ 3.37Å; E90-K92 VanDerWaalsContact C-N 3.35Å; E90-K92 PolarHBondContact O-N 3.3Å; K92-Q96 PolarHBondContact O-N 3.21Å; K92-Q96 VanDerWaalsContact O-N 3.11Å
93	R	98	Very high	97.6	Very high	142 Å²	142	70.7 Å²	70.7	54%	0.536	33%	0.333	S	S	.	.	H	α-helix	trans	-63.3	-47.6	179.1	-169.1	-173.2	-48	101.4	8.6	111.4	D89 E90 I91 K95 Q96 L97	D89-R93 WeakPolarHBondContact O-CB 3.37Å; D89-R93 PolarHBondContact O-N 3Å; E90-R93 PolarHBondContact O-N 3.08Å; I91-R93 PolarHBondContact O-N 2.98Å; R93-K95 PolarHBondContact O-N 2.88Å; R93-Q96 WeakPolarHBondContact O-CB 3.34Å; R93-Q96 PolarHBondContact O-N 3.41Å; R93-Q96 VanDerWaalsContact O-N 3.09Å; R93-L97 WeakPolarHBondContact O-CG 3.37Å; R93-L97 PolarHBondContact O-N 3.32Å
94	E	97.7	Very high	97.7	Very high	18 Å²	18	72.3 Å²	72.3	8%	0.084	34%	0.34	C	S	.	.	H	α-helix	trans	-66.2	-39	-179.8	-176	162.4	-147.6	0	0	112.2	S60 L61 K64 E90 I91 Q96 L97 M98	S60-E94 WeakPolarHBondContact CB-OE1 3.21Å; S60-E94 PolarHBondContact OG-OE1 2.95Å; S60-E94 PolarHBondContact OG-OE2 3.02Å; L61-E94 WeakPolarHBondContact CA-OE2 3.35Å; L61-E94 HydrophobicContact CB-CG 4.17Å; L61-E94 HydrophobicContact CD1-CB 4.19Å; L61-E94 HydrophobicContact CD1-CG 4.22Å; L61-E94 PolarHBondContact N-OE1 3.44Å; K64-E94 IonicContact NZ-OE1 3.9Å; K64-E94 IonicContact NZ-OE2 3.95Å; K64-E94 PolarHBondContact NZ-OE2 3.36Å; E90-E94 WeakPolarHBondContact O-CB 3.36Å; E90-E94 PolarHBondContact O-N 2.84Å; I91-E94 PolarHBondContact O-N 2.95Å; E94-Q96 PolarHBondContact O-N 3.19Å; E94-L97 PolarHBondContact O-N 3.44Å; E94-M98 WeakPolarHBondContact O-CG 3.45Å; E94-M98 PolarHBondContact O-N 3.14Å
95	K	97.6	Very high	97.8	Very high	112 Å²	112	71.5 Å²	71.5	49%	0.487	34%	0.336	S	S	.	.	H	α-helix	trans	-57.7	-38.2	170.5	-178	178.8	178.2	176.3	0	111.9	I91 R93 R99	I91-K95 VanDerWaalsContact O-CB 3.26Å; I91-K95 WeakPolarHBondContact O-CB 3.5Å; I91-K95 PolarHBondContact O-N 3.09Å; R93-K95 PolarHBondContact O-N 2.88Å; K95-R99 WeakPolarHBondContact O-CG 3.49Å; K95-R99 PolarHBondContact O-N 3.07Å; K95-R99 VanDerWaalsContact O-N 3.16Å
96	Q	97.9	Very high	97.8	Very high	80 Å²	80	73.8 Å²	73.8	37%	0.374	34%	0.344	S	S	.	.	H	α-helix	trans	-66.2	-48	175.3	-170.9	56.3	39.8	0	0	111.5	K92 R93 E94 M98 R99 D100	K92-Q96 PolarHBondContact O-N 3.21Å; K92-Q96 VanDerWaalsContact O-N 3.11Å; R93-Q96 WeakPolarHBondContact O-CB 3.34Å; R93-Q96 PolarHBondContact O-N 3.41Å; R93-Q96 VanDerWaalsContact O-N 3.09Å; E94-Q96 PolarHBondContact O-N 3.19Å; Q96-M98 VanDerWaalsContact C-N 3.28Å; Q96-M98 PolarHBondContact O-N 3.08Å; Q96-R99 WeakPolarHBondContact O-CB 3.45Å; Q96-R99 PolarHBondContact O-N 3.13Å; Q96-D100 PolarHBondContact NE2-OD1 3.31Å; Q96-D100 VanDerWaalsContact O-CG 3.26Å; Q96-D100 PolarHBondContact O-N 2.97Å
97	L	96.4	Very high	97.6	Very high	92 Å²	92	69 Å²	69	48%	0.482	33%	0.332	S	S	.	.	H	α-helix	trans	-57.7	-40.1	177	-66.4	173.9	0	0	0	112.3	M57 R93 E94 R99 D100 E101	M57-L97 HydrophobicContact SD-CB 4Å; R93-L97 WeakPolarHBondContact O-CG 3.37Å; R93-L97 PolarHBondContact O-N 3.32Å; E94-L97 PolarHBondContact O-N 3.44Å; L97-R99 PolarHBondContact O-N 3.35Å; L97-D100 PolarHBondContact O-N 3.39Å; L97-E101 WeakPolarHBondContact O-CB 3.26Å; L97-E101 PolarHBondContact O-N 3.08Å
98	M	98.1	Very high	97.5	Very high	34 Å²	34	70.3 Å²	70.3	17%	0.167	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-40.2	174.7	-73.1	-177.8	63.1	0	0	112.8	L54 M57 T58 L61 E94 Q96 A102	L54-M98 HydrophobicContact CD1-CB 3.95Å; L54-M98 HydrophobicContact CD1-CE 4.12Å; L54-M98 HydrophobicContact CD1-CG 4.08Å; M57-M98 HydrophobicContact CB-CG 3.6Å; M57-M98 HydrophobicContact CB-SD 4.2Å; M57-M98 HydrophobicContact SD-CG 4.24Å; T58-M98 HydrophobicContact CG2-CE 4.36Å; T58-M98 WeakPolarHBondContact OG1-CE 3.38Å; L61-M98 HydrophobicContact CB-SD 4.05Å; L61-M98 HydrophobicContact CD2-SD 3.53Å; L61-M98 VanDerWaalsContact CD2-SD 3.53Å; L61-M98 HydrophobicContact CG-SD 4.41Å; E94-M98 WeakPolarHBondContact O-CG 3.45Å; E94-M98 PolarHBondContact O-N 3.14Å; Q96-M98 VanDerWaalsContact C-N 3.28Å; Q96-M98 PolarHBondContact O-N 3.08Å; M98-A102 WeakPolarHBondContact O-CB 3.28Å; M98-A102 PolarHBondContact O-N 3.49Å
99	R	98	Very high	97.3	Very high	116 Å²	116	70.5 Å²	70.5	44%	0.438	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-46.1	175.7	-75.4	-173.4	-75.4	-153.6	2.4	111	K95 Q96 L97 E101 A102 H103	K95-R99 WeakPolarHBondContact O-CG 3.49Å; K95-R99 PolarHBondContact O-N 3.07Å; K95-R99 VanDerWaalsContact O-N 3.16Å; Q96-R99 WeakPolarHBondContact O-CB 3.45Å; Q96-R99 PolarHBondContact O-N 3.13Å; L97-R99 PolarHBondContact O-N 3.35Å; R99-E101 VanDerWaalsContact C-N 3.31Å; R99-E101 PolarHBondContact O-N 2.91Å; R99-A102 PolarHBondContact O-N 2.96Å; R99-H103 PolarHBondContact O-CD2 3.37Å; R99-H103 PolarHBondContact O-N 3.31Å
100	D	97.9	Very high	97	Very high	68 Å²	68	70.8 Å²	70.8	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-61.6	-42.7	179.4	-60.5	-21.3	0	0	0	110.9	Q96 L97 H103 I104	Q96-D100 PolarHBondContact NE2-OD1 3.31Å; Q96-D100 VanDerWaalsContact O-CG 3.26Å; Q96-D100 PolarHBondContact O-N 2.97Å; L97-D100 PolarHBondContact O-N 3.39Å; D100-H103 WeakPolarHBondContact O-CB 3.45Å; D100-H103 PolarHBondContact O-N 3.44Å; D100-I104 WeakPolarHBondContact O-CG1 3.48Å; D100-I104 PolarHBondContact O-N 3.14Å
101	E	98	Very high	96.5	Very high	10 Å²	10	73 Å²	73	5%	0.047	35%	0.354	C	S	.	.	H	α-helix	trans	-62.7	-45.9	176.3	-166.8	74	179.9	0	0	112.1	R50 H53 L54 M57 L97 R99 H103 I104 I105	R50-E101 WeakPolarHBondContact CD-OE1 3.35Å; R50-E101 IonicContact CZ-OE1 2.78Å; R50-E101 IonicContact CZ-OE2 2.97Å; R50-E101 IonicContact NE-OE1 2.99Å; R50-E101 PolarHBondContact NE-OE1 2.93Å; R50-E101 IonicContact NE-OE2 3.57Å; R50-E101 IonicContact NH1-OE1 3.49Å; R50-E101 PolarHBondContact NH1-OE1 2.8Å; R50-E101 IonicContact NH1-OE2 3.44Å; R50-E101 PolarHBondContact NH1-OE2 3.22Å; R50-E101 VanDerWaalsContact NH2-CD 3.32Å; R50-E101 IonicContact NH2-OE1 3.11Å; R50-E101 IonicContact NH2-OE2 3.51Å; R50-E101 PolarHBondContact NH2-OE2 3.48Å; H53-E101 IonicContact CE1-OE2 2.84Å; H53-E101 IonicContact CG-OE1 3.73Å; H53-E101 IonicContact ND1-OE1 3.41Å; H53-E101 PolarHBondContact ND1-OE1 3.05Å; H53-E101 IonicContact ND1-OE2 3.27Å; H53-E101 PolarHBondContact ND1-OE2 3.43Å; L54-E101 HydrophobicContact CB-CG 4.05Å; L54-E101 HydrophobicContact CD1-CB 4.31Å; M57-E101 HydrophobicContact CE-CB 3.51Å; M57-E101 HydrophobicContact CE-CG 3.52Å; L97-E101 WeakPolarHBondContact O-CB 3.26Å; L97-E101 PolarHBondContact O-N 3.08Å; R99-E101 VanDerWaalsContact C-N 3.31Å; R99-E101 PolarHBondContact O-N 2.91Å; E101-H103 VanDerWaalsContact C-N 3.28Å; E101-H103 PolarHBondContact O-N 3.03Å; E101-I104 PolarHBondContact O-N 2.84Å; E101-I104 VanDerWaalsContact O-N 3.15Å; E101-I105 HydrophobicContact CG-CD1 4.21Å; E101-I105 WeakPolarHBondContact O-CG1 3.4Å; E101-I105 PolarHBondContact O-N 3.27Å
102	A	97.8	Very high	96.1	Very high	42 Å²	42	71.9 Å²	71.9	35%	0.347	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-38.3	176.2	0	0	0	0	0	111.9	L54 M98 R99 I105 K106	L54-A102 HydrophobicContact CD2-CB 4.31Å; M98-A102 WeakPolarHBondContact O-CB 3.28Å; M98-A102 PolarHBondContact O-N 3.49Å; R99-A102 PolarHBondContact O-N 2.96Å; A102-I105 PolarHBondContact O-N 2.93Å; A102-K106 WeakPolarHBondContact O-CB 3.35Å; A102-K106 PolarHBondContact O-N 2.88Å
103	H	98.1	Very high	95.6	Very high	127 Å²	127	70.1 Å²	70.1	59%	0.588	34%	0.343	S	S	*	.	H	α-helix	trans	-64.3	-41.4	174.3	-79.5	-59.1	0	0	0	112.4	R99 D100 E101 K106 G107	R99-H103 PolarHBondContact O-CD2 3.37Å; R99-H103 PolarHBondContact O-N 3.31Å; D100-H103 WeakPolarHBondContact O-CB 3.45Å; D100-H103 PolarHBondContact O-N 3.44Å; E101-H103 VanDerWaalsContact C-N 3.28Å; E101-H103 PolarHBondContact O-N 3.03Å; H103-K106 PolarHBondContact O-N 3.27Å; H103-G107 PolarHBondContact O-N 3.48Å
104	I	97.1	Very high	95	Very high	75 Å²	75	70.7 Å²	70.7	39%	0.385	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-45.7	177.4	-68.4	163.8	0	0	0	110.7	D100 E101 K106 G107 E108	D100-I104 WeakPolarHBondContact O-CG1 3.48Å; D100-I104 PolarHBondContact O-N 3.14Å; E101-I104 PolarHBondContact O-N 2.84Å; E101-I104 VanDerWaalsContact O-N 3.15Å; I104-K106 PolarHBondContact O-N 3.41Å; I104-G107 PolarHBondContact O-N 3.45Å; I104-E108 WeakPolarHBondContact O-CB 3.34Å; I104-E108 PolarHBondContact O-N 2.72Å
105	I	97.8	Very high	94.4	Very high	5 Å²	5	72.9 Å²	72.9	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-57.3	-51.1	175.7	-70.2	167.2	0	0	0	110.5	L47 R50 Y51 L54 E101 A102 G107 E108 L109	L47-I105 HydrophobicContact CD2-CB 4.46Å; L47-I105 HydrophobicContact CD2-CG2 4.08Å; L47-I105 WeakPolarHBondContact CD2-O 3.41Å; R50-I105 HydrophobicContact CB-CD1 4.05Å; R50-I105 HydrophobicContact CB-CG1 3.62Å; Y51-I105 HydrophobicContact CD1-CD1 4.12Å; Y51-I105 HydrophobicContact CD1-CG2 4.41Å; Y51-I105 HydrophobicContact CD2-CG2 4.12Å; Y51-I105 HydrophobicContact CE1-CD1 4.39Å; Y51-I105 HydrophobicContact CE1-CG2 3.79Å; Y51-I105 HydrophobicContact CE2-CG2 3.45Å; Y51-I105 VanDerWaalsContact CE2-CG2 3.45Å; Y51-I105 HydrophobicContact CG-CD1 4.26Å; Y51-I105 WeakPolarHBondContact OH-CG2 3.45Å; L54-I105 HydrophobicContact CB-CD1 4.15Å; L54-I105 HydrophobicContact CD2-CD1 3.91Å; E101-I105 HydrophobicContact CG-CD1 4.21Å; E101-I105 WeakPolarHBondContact O-CG1 3.4Å; E101-I105 PolarHBondContact O-N 3.27Å; A102-I105 PolarHBondContact O-N 2.93Å; I105-G107 VanDerWaalsContact C-N 3.33Å; I105-G107 PolarHBondContact O-N 2.87Å; I105-E108 PolarHBondContact O-N 2.87Å; I105-L109 VanDerWaalsContact O-CB 3.25Å; I105-L109 WeakPolarHBondContact O-CB 3.41Å; I105-L109 PolarHBondContact O-N 3.31Å
106	K	96.8	Very high	93.9	Very high	142 Å²	142	68 Å²	68	62%	0.617	34%	0.337	S	S	*	.	H	α-helix	trans	-59.1	-45.2	179.3	-177.8	-179.8	178.4	-179.7	0	111.8	A102 H103 I104 S110	A102-K106 WeakPolarHBondContact O-CB 3.35Å; A102-K106 PolarHBondContact O-N 2.88Å; H103-K106 PolarHBondContact O-N 3.27Å; I104-K106 PolarHBondContact O-N 3.41Å; K106-S110 WeakPolarHBondContact O-CB 3.25Å; K106-S110 PolarHBondContact O-N 3.38Å; K106-S110 PolarHBondContact O-OG 3.14Å
107	G	94.9	Very high	93.1	Very high	30 Å²	30	67.3 Å²	67.3	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-46.8	179.3	0	0	0	0	0	112.2	H103 I104 I105 S110 K111	H103-G107 PolarHBondContact O-N 3.48Å; I104-G107 PolarHBondContact O-N 3.45Å; I105-G107 VanDerWaalsContact C-N 3.33Å; I105-G107 PolarHBondContact O-N 2.87Å; G107-S110 PolarHBondContact O-N 3.1Å; G107-K111 WeakPolarHBondContact O-CG 3.42Å; G107-K111 PolarHBondContact O-N 2.91Å; G107-K111 VanDerWaalsContact O-N 3.14Å
108	E	94.9	Very high	92.5	Very high	35 Å²	35	66.3 Å²	66.3	16%	0.164	33%	0.331	C	S	.	.	H	α-helix	trans	-71	-39.1	-178.6	-169.5	57.2	-145.7	0	0	112.1	R43 Y46 L47 I104 I105 S110 K111 T112	R43-E108 WeakPolarHBondContact CD-OE1 3.25Å; R43-E108 IonicContact CZ-OE1 3.47Å; R43-E108 IonicContact NE-OE1 3.67Å; R43-E108 IonicContact NH1-OE1 2.75Å; R43-E108 PolarHBondContact NH1-OE1 3.41Å; Y46-E108 HydrophobicContact CD1-CG 4.03Å; Y46-E108 HydrophobicContact CE1-CG 4.09Å; L47-E108 HydrophobicContact CD2-CB 3.95Å; L47-E108 HydrophobicContact CD2-CG 4.27Å; L47-E108 HydrophobicContact CG-CB 4.45Å; L47-E108 HydrophobicContact CG-CG 4.23Å; I104-E108 WeakPolarHBondContact O-CB 3.34Å; I104-E108 PolarHBondContact O-N 2.72Å; I105-E108 PolarHBondContact O-N 2.87Å; E108-S110 PolarHBondContact O-N 3.11Å; E108-K111 PolarHBondContact O-N 2.92Å; E108-T112 VanDerWaalsContact O-CB 3.23Å; E108-T112 WeakPolarHBondContact O-CB 3.42Å; E108-T112 PolarHBondContact O-N 3.36Å; E108-T112 PolarHBondContact O-OG1 2.88Å; E108-T112 PolarHBondContact OE1-OG1 3.37Å
109	L	93.7	Very high	91.8	Very high	62 Å²	62	65.6 Å²	65.6	33%	0.325	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-45.9	174.1	-179.2	63.3	0	0	0	111	L47 I105 K111 T112 M113	L47-L109 HydrophobicContact CD1-CB 4.15Å; L47-L109 HydrophobicContact CD1-CD1 4.05Å; L47-L109 HydrophobicContact CD2-CB 4.23Å; I105-L109 VanDerWaalsContact O-CB 3.25Å; I105-L109 WeakPolarHBondContact O-CB 3.41Å; I105-L109 PolarHBondContact O-N 3.31Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-K111 PolarHBondContact O-N 2.9Å; L109-T112 PolarHBondContact O-N 2.78Å; L109-M113 HydrophobicContact CD1-CG 3.94Å; L109-M113 HydrophobicContact CG-CG 4.3Å; L109-M113 WeakPolarHBondContact O-CB 3.48Å; L109-M113 VanDerWaalsContact O-CG 3.28Å; L109-M113 WeakPolarHBondContact O-CG 3.28Å; L109-M113 PolarHBondContact O-N 3.33Å
110	S	91.9	Very high	91	Very high	71 Å²	71	64.2 Å²	64.2	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-60.2	-44.8	179.8	-56.8	0	0	0	0	111.7	K106 G107 E108 Y114	K106-S110 WeakPolarHBondContact O-CB 3.25Å; K106-S110 PolarHBondContact O-N 3.38Å; K106-S110 PolarHBondContact O-OG 3.14Å; G107-S110 PolarHBondContact O-N 3.1Å; E108-S110 PolarHBondContact O-N 3.11Å; S110-Y114 WeakPolarHBondContact O-CB 3.49Å; S110-Y114 PolarHBondContact O-N 3.3Å
111	K	88.1	Confident	90.1	Very high	124 Å²	124	67.9 Å²	67.9	54%	0.539	33%	0.33	S	S	.	.	H	α-helix	trans	-63.9	-46.4	176.3	-70.4	172.6	-175.7	178.5	0	111.8	G107 E108 L109 Y114 N115	G107-K111 WeakPolarHBondContact O-CG 3.42Å; G107-K111 PolarHBondContact O-N 2.91Å; G107-K111 VanDerWaalsContact O-N 3.14Å; E108-K111 PolarHBondContact O-N 2.92Å; L109-K111 VanDerWaalsContact C-N 3.34Å; L109-K111 PolarHBondContact O-N 2.9Å; K111-Y114 PolarHBondContact O-N 3.43Å; K111-N115 WeakPolarHBondContact O-CB 3.49Å; K111-N115 VanDerWaalsContact O-CG 3.26Å; K111-N115 PolarHBondContact O-N 3.29Å; K111-N115 PolarHBondContact O-ND2 2.91Å
112	T	90.1	Very high	89.1	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.006	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-44.7	-177.6	-60.2	0	0	0	0	110.9	F40 R43 L44 E108 L109 E116	F40-T112 HydrophobicContact CD2-CG2 3.47Å; F40-T112 VanDerWaalsContact CD2-CG2 3.47Å; F40-T112 HydrophobicContact CE2-CG2 3.41Å; F40-T112 VanDerWaalsContact CE2-CG2 3.41Å; F40-T112 HydrophobicContact CZ-CG2 4.42Å; R43-T112 HydrophobicContact CB-CG2 3.95Å; R43-T112 WeakPolarHBondContact CD-OG1 3.31Å; L44-T112 HydrophobicContact CD2-CG2 4.26Å; E108-T112 VanDerWaalsContact O-CB 3.23Å; E108-T112 WeakPolarHBondContact O-CB 3.42Å; E108-T112 PolarHBondContact O-N 3.36Å; E108-T112 PolarHBondContact O-OG1 2.88Å; E108-T112 PolarHBondContact OE1-OG1 3.37Å; L109-T112 PolarHBondContact O-N 2.78Å; T112-E116 WeakPolarHBondContact O-CB 3.45Å; T112-E116 PolarHBondContact O-N 3.35Å; T112-E116 VanDerWaalsContact O-N 3.09Å
113	M	87.6	Confident	88.1	Confident	87 Å²	87	73.6 Å²	73.6	43%	0.429	36%	0.36	S	S	.	.	H	α-helix	trans	-65.6	-44.8	176.1	-69.6	-57.8	-59	0	0	112.5	L109 N115 E116 D117	L109-M113 HydrophobicContact CD1-CG 3.94Å; L109-M113 HydrophobicContact CG-CG 4.3Å; L109-M113 WeakPolarHBondContact O-CB 3.48Å; L109-M113 VanDerWaalsContact O-CG 3.28Å; L109-M113 WeakPolarHBondContact O-CG 3.28Å; L109-M113 PolarHBondContact O-N 3.33Å; M113-N115 VanDerWaalsContact C-N 3.35Å; M113-N115 PolarHBondContact O-N 2.96Å; M113-E116 PolarHBondContact O-N 3.5Å; M113-D117 PolarHBondContact O-N 2.92Å
114	Y	85	Confident	87	Confident	154 Å²	154	69.8 Å²	69.8	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-59.3	-45.4	177.4	175.6	-97	0	0	0	112.2	S110 K111 E116 D117 L118	S110-Y114 WeakPolarHBondContact O-CB 3.49Å; S110-Y114 PolarHBondContact O-N 3.3Å; K111-Y114 PolarHBondContact O-N 3.43Å; Y114-E116 VanDerWaalsContact C-N 3.34Å; Y114-E116 PolarHBondContact O-N 3.27Å; Y114-D117 PolarHBondContact O-N 3.4Å; Y114-L118 WeakPolarHBondContact O-CB 3.23Å; Y114-L118 PolarHBondContact O-N 2.9Å
115	N	84.4	Confident	86.1	Confident	63 Å²	63	69.8 Å²	69.8	34%	0.337	35%	0.353	S	S	.	.	H	α-helix	trans	-64.8	-39.4	179.6	-72.8	-14.8	0	0	0	112	K111 M113 L118 R119	K111-N115 WeakPolarHBondContact O-CB 3.49Å; K111-N115 VanDerWaalsContact O-CG 3.26Å; K111-N115 PolarHBondContact O-N 3.29Å; K111-N115 PolarHBondContact O-ND2 2.91Å; M113-N115 VanDerWaalsContact C-N 3.35Å; M113-N115 PolarHBondContact O-N 2.96Å; N115-L118 PolarHBondContact O-N 2.74Å; N115-R119 WeakPolarHBondContact O-CB 3.41Å; N115-R119 PolarHBondContact O-N 3.44Å
116	E	86.3	Confident	84.8	Confident	9 Å²	9	74.8 Å²	74.8	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-68.5	-41.3	177.3	176.9	57.3	-165.4	0	0	112.2	F40 T112 M113 Y114 L118 R119 R120	F40-E116 HydrophobicContact CD2-CB 3.63Å; F40-E116 HydrophobicContact CD2-CG 4.06Å; F40-E116 HydrophobicContact CE1-CG 4.34Å; F40-E116 HydrophobicContact CE2-CB 3.36Å; F40-E116 HydrophobicContact CE2-CG 3.64Å; F40-E116 HydrophobicContact CZ-CB 4.06Å; F40-E116 HydrophobicContact CZ-CG 3.81Å; T112-E116 WeakPolarHBondContact O-CB 3.45Å; T112-E116 PolarHBondContact O-N 3.35Å; T112-E116 VanDerWaalsContact O-N 3.09Å; M113-E116 PolarHBondContact O-N 3.5Å; Y114-E116 VanDerWaalsContact C-N 3.34Å; Y114-E116 PolarHBondContact O-N 3.27Å; E116-L118 VanDerWaalsContact C-N 3.3Å; E116-L118 PolarHBondContact O-N 3.11Å; E116-R119 WeakPolarHBondContact O-CB 3.44Å; E116-R119 PolarHBondContact O-N 3.41Å; E116-R119 IonicContact OE1-CZ 3.5Å; E116-R119 IonicContact OE1-NE 3.44Å; E116-R119 PolarHBondContact OE1-NE 2.8Å; E116-R119 IonicContact OE1-NH2 2.8Å; E116-R119 PolarHBondContact OE1-NH2 3.25Å; E116-R119 IonicContact OE2-CZ 3.66Å; E116-R119 IonicContact OE2-NE 2.79Å; E116-R119 PolarHBondContact OE2-NE 3.45Å; E116-R119 IonicContact OE2-NH2 3.72Å; E116-R120 WeakPolarHBondContact O-CB 3.45Å; E116-R120 VanDerWaalsContact O-CG 3.28Å; E116-R120 WeakPolarHBondContact O-CG 3.36Å; E116-R120 PolarHBondContact O-N 3.43Å; E116-R120 IonicContact OE1-CZ 3.62Å; E116-R120 IonicContact OE1-NE 2.93Å; E116-R120 PolarHBondContact OE1-NE 3.27Å; E116-R120 IonicContact OE1-NH2 2.64Å; E116-R120 PolarHBondContact OE1-NH2 3.03Å
117	D	82.6	Confident	83.4	Confident	67 Å²	67	76 Å²	76	36%	0.358	38%	0.377	S	S	.	.	H	α-helix	trans	-60.8	-41.6	173.3	-82.4	-8	0	0	0	111.4	M113 Y114 R120 R121	M113-D117 PolarHBondContact O-N 2.92Å; Y114-D117 PolarHBondContact O-N 3.4Å; D117-R120 PolarHBondContact O-N 3.25Å; D117-R121 WeakPolarHBondContact O-CG 3.4Å; D117-R121 PolarHBondContact O-N 3.42Å
118	L	82.8	Confident	81.9	Confident	70 Å²	70	82.2 Å²	82.2	37%	0.366	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-44.2	175.3	-176.5	60.6	0	0	0	111.5	Y114 N115 E116 R120 R121 L122	Y114-L118 WeakPolarHBondContact O-CB 3.23Å; Y114-L118 PolarHBondContact O-N 2.9Å; N115-L118 PolarHBondContact O-N 2.74Å; E116-L118 VanDerWaalsContact C-N 3.3Å; E116-L118 PolarHBondContact O-N 3.11Å; L118-R120 VanDerWaalsContact C-N 3.35Å; L118-R120 PolarHBondContact O-N 3.05Å; L118-R121 PolarHBondContact O-N 3Å; L118-L122 HydrophobicContact CD1-CD1 4.44Å; L118-L122 HydrophobicContact CD1-CG 4.48Å; L118-L122 HydrophobicContact CG-CD1 4.23Å; L118-L122 WeakPolarHBondContact O-CG 3.48Å; L118-L122 PolarHBondContact O-N 2.79Å
119	R	84.1	Confident	80.5	Confident	20 Å²	20	82.5 Å²	82.5	8%	0.075	40%	0.397	C	S	.	.	H	α-helix	trans	-56.9	-48.3	174.8	-173.7	-162.9	70.2	68.8	4.9	111	N36 N115 E116 R121 L122 A123 E125	N36-R119 HydrophobicContact CB-CG 4.34Å; N36-R119 WeakPolarHBondContact ND2-CG 3.4Å; N115-R119 WeakPolarHBondContact O-CB 3.41Å; N115-R119 PolarHBondContact O-N 3.44Å; E116-R119 WeakPolarHBondContact O-CB 3.44Å; E116-R119 PolarHBondContact O-N 3.41Å; E116-R119 IonicContact OE1-CZ 3.5Å; E116-R119 IonicContact OE1-NE 3.44Å; E116-R119 PolarHBondContact OE1-NE 2.8Å; E116-R119 IonicContact OE1-NH2 2.8Å; E116-R119 PolarHBondContact OE1-NH2 3.25Å; E116-R119 IonicContact OE2-CZ 3.66Å; E116-R119 IonicContact OE2-NE 2.79Å; E116-R119 PolarHBondContact OE2-NE 3.45Å; E116-R119 IonicContact OE2-NH2 3.72Å; R119-R121 VanDerWaalsContact C-N 3.32Å; R119-R121 PolarHBondContact O-N 2.89Å; R119-L122 PolarHBondContact O-N 2.97Å; R119-A123 VanDerWaalsContact O-CB 3.31Å; R119-A123 WeakPolarHBondContact O-CB 3.46Å; R119-A123 PolarHBondContact O-N 3.41Å; R119-E125 IonicContact CZ-OE2 2.74Å; R119-E125 IonicContact NH1-OE1 3.27Å; R119-E125 PolarHBondContact NH1-OE1 3.42Å; R119-E125 IonicContact NH1-OE2 3.67Å; R119-E125 PolarHBondContact NH1-OE2 2.75Å; R119-E125 IonicContact NH2-OE2 2.8Å; R119-E125 PolarHBondContact NH2-OE2 3.27Å; R119-E125 VanDerWaalsContact NH2-OE2 3.11Å
120	R	80.4	Confident	79.1	Confident	87 Å²	87	82.3 Å²	82.3	33%	0.328	40%	0.397	S	S	.	.	H	α-helix	trans	-61.1	-38.9	179.5	-73.1	167.4	175.9	-139.3	3.6	112.4	E116 D117 L118 G124 E125 W126 I129	E116-R120 WeakPolarHBondContact O-CB 3.45Å; E116-R120 VanDerWaalsContact O-CG 3.28Å; E116-R120 WeakPolarHBondContact O-CG 3.36Å; E116-R120 PolarHBondContact O-N 3.43Å; E116-R120 IonicContact OE1-CZ 3.62Å; E116-R120 IonicContact OE1-NE 2.93Å; E116-R120 PolarHBondContact OE1-NE 3.27Å; E116-R120 IonicContact OE1-NH2 2.64Å; E116-R120 PolarHBondContact OE1-NH2 3.03Å; D117-R120 PolarHBondContact O-N 3.25Å; L118-R120 VanDerWaalsContact C-N 3.35Å; L118-R120 PolarHBondContact O-N 3.05Å; R120-G124 PolarHBondContact O-N 3.43Å; R120-E125 HydrophobicContact CB-CB 4.32Å; R120-E125 PolarHBondContact O-N 3.44Å; R120-W126 PolarHBondContact O-N 2.8Å; R120-I129 HydrophobicContact CB-CD1 4.1Å; R120-I129 HydrophobicContact CG-CD1 4.17Å
121	R	79.2	Confident	77.9	Confident	145 Å²	145	81.5 Å²	81.5	55%	0.547	39%	0.394	S	S	.	.	H	α-helix	trans	-63.5	-49.4	174.1	-74.3	175	-170.5	-165.7	2.3	111.8	D117 L118 R119 A123 G124 W126	D117-R121 WeakPolarHBondContact O-CG 3.4Å; D117-R121 PolarHBondContact O-N 3.42Å; L118-R121 PolarHBondContact O-N 3Å; R119-R121 VanDerWaalsContact C-N 3.32Å; R119-R121 PolarHBondContact O-N 2.89Å; R121-A123 VanDerWaalsContact C-N 3.31Å; R121-A123 PolarHBondContact O-N 3.39Å; R121-G124 PolarHBondContact O-N 3.48Å; R121-W126 HydrophobicContact CG-CB 4.22Å; R121-W126 HydrophobicContact CG-CD2 4.35Å; R121-W126 HydrophobicContact CG-CE3 3.59Å; R121-W126 HydrophobicContact CG-CZ3 4.35Å
122	L	76.9	Confident	77	Confident	136 Å²	136	80.5 Å²	80.5	71%	0.712	40%	0.395	S	S	*	.	H	α-helix	trans	-65.4	-34.1	179.8	-68.8	174	0	0	0	112.5	L118 R119 G124	L118-L122 HydrophobicContact CD1-CD1 4.44Å; L118-L122 HydrophobicContact CD1-CG 4.48Å; L118-L122 HydrophobicContact CG-CD1 4.23Å; L118-L122 WeakPolarHBondContact O-CG 3.48Å; L118-L122 PolarHBondContact O-N 2.79Å; R119-L122 PolarHBondContact O-N 2.97Å; L122-G124 PolarHBondContact O-N 3.09Å
123	A	77.4	Confident	76.1	Confident	36 Å²	36	88.5 Å²	88.5	30%	0.298	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.2	174.5	0	0	0	0	0	113.6	I33 R119 R121 E125	I33-A123 HydrophobicContact CD1-CB 4.2Å; R119-A123 VanDerWaalsContact O-CB 3.31Å; R119-A123 WeakPolarHBondContact O-CB 3.46Å; R119-A123 PolarHBondContact O-N 3.41Å; R121-A123 VanDerWaalsContact C-N 3.31Å; R121-A123 PolarHBondContact O-N 3.39Å; A123-E125 HydrophobicContact CB-CG 3.91Å; A123-E125 PolarHBondContact O-N 2.98Å
124	G	75.6	Confident	75.3	Confident	46 Å²	46	92 Å²	92	47%	0.474	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	7.2	-175.4	0	0	0	0	0	114.3	R120 R121 L122 W126	R120-G124 PolarHBondContact O-N 3.43Å; R121-G124 PolarHBondContact O-N 3.48Å; L122-G124 PolarHBondContact O-N 3.09Å; G124-W126 VanDerWaalsContact C-N 3.26Å; G124-W126 PolarHBondContact O-N 3.37Å
125	E	77	Confident	74.5	Confident	75 Å²	75	87.3 Å²	87.3	35%	0.35	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.8	179.5	-66.2	169.4	-160.8	0	0	112.2	R119 R120 A123 K127 K128 I129	R119-E125 IonicContact CZ-OE2 2.74Å; R119-E125 IonicContact NH1-OE1 3.27Å; R119-E125 PolarHBondContact NH1-OE1 3.42Å; R119-E125 IonicContact NH1-OE2 3.67Å; R119-E125 PolarHBondContact NH1-OE2 2.75Å; R119-E125 IonicContact NH2-OE2 2.8Å; R119-E125 PolarHBondContact NH2-OE2 3.27Å; R119-E125 VanDerWaalsContact NH2-OE2 3.11Å; R120-E125 HydrophobicContact CB-CB 4.32Å; R120-E125 PolarHBondContact O-N 3.44Å; A123-E125 HydrophobicContact CB-CG 3.91Å; A123-E125 PolarHBondContact O-N 2.98Å; E125-K127 PolarHBondContact O-N 3.49Å; E125-K127 VanDerWaalsContact O-N 3.08Å; E125-K128 PolarHBondContact O-N 3.05Å; E125-K128 VanDerWaalsContact O-N 3.13Å; E125-I129 PolarHBondContact O-N 3.48Å
126	W	70.1	Confident	73.7	Confident	110 Å²	110	87.4 Å²	87.4	42%	0.417	43%	0.433	S	S	.	.	H	α-helix	trans	-44.8	-41.1	173.4	153	-62.9	0	0	0	113	R120 R121 G124 K128 I129 D130	R120-W126 PolarHBondContact O-N 2.8Å; R121-W126 HydrophobicContact CG-CB 4.22Å; R121-W126 HydrophobicContact CG-CD2 4.35Å; R121-W126 HydrophobicContact CG-CE3 3.59Å; R121-W126 HydrophobicContact CG-CZ3 4.35Å; G124-W126 VanDerWaalsContact C-N 3.26Å; G124-W126 PolarHBondContact O-N 3.37Å; W126-K128 VanDerWaalsContact C-N 3.28Å; W126-K128 PolarHBondContact O-N 3.4Å; W126-I129 PolarHBondContact O-N 3.32Å; W126-I129 VanDerWaalsContact O-N 3.14Å; W126-D130 VanDerWaalsContact CE2-OD2 3.25Å; W126-D130 PolarHBondContact NE1-OD2 3.06Å; W126-D130 PolarHBondContact O-N 3.35Å
127	K	67.6	Low	72.8	Confident	169 Å²	169	89.2 Å²	89.2	74%	0.735	45%	0.449	S	S	*	.	H	α-helix	trans	-70.2	-29.8	-170.6	-69.9	-174.6	179.3	-179.3	0	111.9	E125 A131	E125-K127 PolarHBondContact O-N 3.49Å; E125-K127 VanDerWaalsContact O-N 3.08Å; K127-A131 PolarHBondContact O-N 2.95Å
128	K	64.9	Low	71.8	Confident	159 Å²	159	88.7 Å²	88.7	69%	0.691	46%	0.455	S	S	*	.	H	α-helix	trans	-74.1	-40.9	172.8	-71.6	-175.5	174	-175.3	0	110.7	E125 W126 D130 A131 D132	E125-K128 PolarHBondContact O-N 3.05Å; E125-K128 VanDerWaalsContact O-N 3.13Å; W126-K128 VanDerWaalsContact C-N 3.28Å; W126-K128 PolarHBondContact O-N 3.4Å; K128-D130 PolarHBondContact O-N 2.93Å; K128-A131 WeakPolarHBondContact O-CB 3.43Å; K128-A131 PolarHBondContact O-N 3.5Å; K128-A131 VanDerWaalsContact O-N 3.14Å; K128-D132 PolarHBondContact O-N 3.11Å
129	I	64.3	Low	70.7	Confident	41 Å²	41	91.5 Å²	91.5	21%	0.21	47%	0.466	C	S	.	.	H	α-helix	trans	-63.8	-41.3	180	-61.9	165.4	0	0	0	112.1	R120 E125 W126 A131 D132 R133	R120-I129 HydrophobicContact CB-CD1 4.1Å; R120-I129 HydrophobicContact CG-CD1 4.17Å; E125-I129 PolarHBondContact O-N 3.48Å; W126-I129 PolarHBondContact O-N 3.32Å; W126-I129 VanDerWaalsContact O-N 3.14Å; I129-A131 VanDerWaalsContact C-N 3.3Å; I129-A131 PolarHBondContact O-N 3.47Å; I129-D132 PolarHBondContact O-N 2.86Å; I129-R133 WeakPolarHBondContact O-CB 3.5Å; I129-R133 WeakPolarHBondContact O-CG 3.43Å; I129-R133 PolarHBondContact O-N 3.27Å
130	D	64.6	Low	69.6	Low	59 Å²	59	93.9 Å²	93.9	32%	0.316	49%	0.485	S	S	.	.	H	α-helix	trans	-65.5	-34.6	175.2	-88.1	-11.3	0	0	0	112.4	W126 K128 K134	W126-D130 VanDerWaalsContact CE2-OD2 3.25Å; W126-D130 PolarHBondContact NE1-OD2 3.06Å; W126-D130 PolarHBondContact O-N 3.35Å; K128-D130 PolarHBondContact O-N 2.93Å; D130-K134 VanDerWaalsContact O-CG 3.32Å; D130-K134 WeakPolarHBondContact O-CG 3.31Å; D130-K134 PolarHBondContact O-N 3.15Å
131	A	67.4	Low	68.6	Low	54 Å²	54	96.5 Å²	96.5	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-69.3	-45.2	175.2	0	0	0	0	0	111	K127 K128 I129 R133 K134 S135	K127-A131 PolarHBondContact O-N 2.95Å; K128-A131 WeakPolarHBondContact O-CB 3.43Å; K128-A131 PolarHBondContact O-N 3.5Å; K128-A131 VanDerWaalsContact O-N 3.14Å; I129-A131 VanDerWaalsContact C-N 3.3Å; I129-A131 PolarHBondContact O-N 3.47Å; A131-R133 PolarHBondContact O-N 3.02Å; A131-K134 PolarHBondContact O-N 3.43Å; A131-S135 PolarHBondContact O-N 3.11Å; A131-S135 PolarHBondContact O-OG 3.22Å
132	D	69.6	Low	67.6	Low	102 Å²	102	92.4 Å²	92.4	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-65.9	-35.8	178.6	-63.6	-17.4	0	0	0	112.1	K128 I129 S135 S136	K128-D132 PolarHBondContact O-N 3.11Å; I129-D132 PolarHBondContact O-N 2.86Å; D132-S135 WeakPolarHBondContact CA-OG 3.39Å; D132-S135 PolarHBondContact O-OG 3.24Å; D132-S136 VanDerWaalsContact O-CB 3.26Å; D132-S136 WeakPolarHBondContact O-CB 3.49Å; D132-S136 PolarHBondContact O-N 3.05Å
133	R	70.9	Confident	66.7	Low	170 Å²	170	89.9 Å²	89.9	64%	0.642	49%	0.493	S	S	*	.	H	α-helix	trans	-66.8	-39.7	173.5	-82.1	-177.8	170.2	177.4	-1.2	112.2	I129 A131 A137	I129-R133 WeakPolarHBondContact O-CB 3.5Å; I129-R133 WeakPolarHBondContact O-CG 3.43Å; I129-R133 PolarHBondContact O-N 3.27Å; A131-R133 PolarHBondContact O-N 3.02Å; R133-A137 WeakPolarHBondContact O-CB 3.43Å; R133-A137 PolarHBondContact O-N 3.39Å
134	K	70.6	Confident	65.6	Low	160 Å²	160	92.5 Å²	92.5	70%	0.696	51%	0.508	S	S	*	.	H	α-helix	trans	-69	-38.3	176.8	-76.5	177.1	-178.4	-178.5	0	112	D130 A131 A138	D130-K134 VanDerWaalsContact O-CG 3.32Å; D130-K134 WeakPolarHBondContact O-CG 3.31Å; D130-K134 PolarHBondContact O-N 3.15Å; A131-K134 PolarHBondContact O-N 3.43Å; K134-A138 WeakPolarHBondContact O-CB 3.44Å; K134-A138 PolarHBondContact O-N 3.12Å; K134-A138 VanDerWaalsContact O-N 3.12Å
135	S	67.3	Low	64.5	Low	55 Å²	55	95 Å²	95	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-68.6	-43.6	175.2	61.2	0	0	0	0	111.9	A131 D132 A137 A138 E139	A131-S135 PolarHBondContact O-N 3.11Å; A131-S135 PolarHBondContact O-OG 3.22Å; D132-S135 WeakPolarHBondContact CA-OG 3.39Å; D132-S135 PolarHBondContact O-OG 3.24Å; S135-A137 VanDerWaalsContact C-N 3.35Å; S135-A137 PolarHBondContact O-N 3.45Å; S135-A138 PolarHBondContact O-N 3.31Å; S135-E139 WeakPolarHBondContact O-CG 3.34Å; S135-E139 PolarHBondContact O-N 3.36Å
136	S	68	Low	63.2	Low	65 Å²	65	99.5 Å²	99.5	46%	0.455	54%	0.542	S	S	.	.	H	α-helix	trans	-65	-35.5	177.8	177	0	0	0	0	113.1	D132 S140	D132-S136 VanDerWaalsContact O-CB 3.26Å; D132-S136 WeakPolarHBondContact O-CB 3.49Å; D132-S136 PolarHBondContact O-N 3.05Å; S136-S140 WeakPolarHBondContact O-CB 3.4Å; S136-S140 PolarHBondContact O-N 3.47Å; S136-S140 PolarHBondContact O-OG 3.37Å
137	A	67.3	Low	62.3	Low	47 Å²	47	101.2 Å²	101.2	39%	0.388	56%	0.558	S	S	.	*	H	α-helix	trans	-66.7	-43.5	173.1	0	0	0	0	0	111.8	R133 S135 E139 S140 E141	R133-A137 WeakPolarHBondContact O-CB 3.43Å; R133-A137 PolarHBondContact O-N 3.39Å; S135-A137 VanDerWaalsContact C-N 3.35Å; S135-A137 PolarHBondContact O-N 3.45Å; A137-E139 VanDerWaalsContact C-N 3.34Å; A137-E139 PolarHBondContact O-N 2.97Å; A137-S140 PolarHBondContact O-N 3.4Å; A137-E141 WeakPolarHBondContact O-CG 3.47Å; A137-E141 PolarHBondContact O-N 3.36Å
138	A	61.6	Low	61.3	Low	57 Å²	57	96 Å²	96	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-36.3	176.7	0	0	0	0	0	112.7	K134 S135 A142	K134-A138 WeakPolarHBondContact O-CB 3.44Å; K134-A138 PolarHBondContact O-N 3.12Å; K134-A138 VanDerWaalsContact O-N 3.12Å; S135-A138 PolarHBondContact O-N 3.31Å; A138-A142 VanDerWaalsContact O-CB 3.32Å; A138-A142 WeakPolarHBondContact O-CB 3.39Å; A138-A142 PolarHBondContact O-N 3.3Å
139	E	60.8	Low	60.6	Low	128 Å²	128	96.7 Å²	96.7	60%	0.598	56%	0.563	S	S	*	*	H	α-helix	trans	-70.2	-35.1	174.6	-73.6	175.4	177.6	0	0	112.8	S135 A137 S143	S135-E139 WeakPolarHBondContact O-CG 3.34Å; S135-E139 PolarHBondContact O-N 3.36Å; A137-E139 VanDerWaalsContact C-N 3.34Å; A137-E139 PolarHBondContact O-N 2.97Å; E139-S143 WeakPolarHBondContact O-CB 3.47Å; E139-S143 PolarHBondContact O-N 3.2Å; E139-S143 PolarHBondContact O-OG 3.35Å
140	S	60.1	Low	59.9	Low	70 Å²	70	101.9 Å²	101.9	49%	0.49	59%	0.591	S	S	.	*	H	α-helix	trans	-70.2	-38.6	175.9	-57.8	0	0	0	0	111.6	S136 A137 S143 S144	S136-S140 WeakPolarHBondContact O-CB 3.4Å; S136-S140 PolarHBondContact O-N 3.47Å; S136-S140 PolarHBondContact O-OG 3.37Å; A137-S140 PolarHBondContact O-N 3.4Å; S140-S143 PolarHBondContact O-N 3.36Å; S140-S144 WeakPolarHBondContact O-CB 3.27Å; S140-S144 PolarHBondContact O-N 3.24Å
141	E	59.1	Low	59.3	Low	142 Å²	142	106.6 Å²	106.6	66%	0.664	62%	0.616	S	S	*	*	H	α-helix	trans	-68.6	-40	173.5	-73.1	-179.9	172.1	0	0	112	A137 S143 S144 S145	A137-E141 WeakPolarHBondContact O-CG 3.47Å; A137-E141 PolarHBondContact O-N 3.36Å; E141-S143 VanDerWaalsContact C-N 3.31Å; E141-S143 PolarHBondContact O-N 3.48Å; E141-S144 PolarHBondContact O-N 3.17Å; E141-S145 VanDerWaalsContact O-CB 3.3Å; E141-S145 WeakPolarHBondContact O-CB 3.47Å; E141-S145 PolarHBondContact O-N 2.89Å
142	A	58.2	Low	58.5	Low	60 Å²	60	110.1 Å²	110.1	50%	0.496	63%	0.632	S	S	.	*	H	α-helix	trans	-63.9	-36.1	174	0	0	0	0	0	112.6	A138	A138-A142 VanDerWaalsContact O-CB 3.32Å; A138-A142 WeakPolarHBondContact O-CB 3.39Å; A138-A142 PolarHBondContact O-N 3.3Å
143	S	57.5	Low	57.2	Low	83 Å²	83	110.7 Å²	110.7	58%	0.58	64%	0.642	S	S	*	*	H	α-helix	trans	-73.2	-34.6	176	-57.6	0	0	0	0	112.4	E139 S140 E141 S145	E139-S143 WeakPolarHBondContact O-CB 3.47Å; E139-S143 PolarHBondContact O-N 3.2Å; E139-S143 PolarHBondContact O-OG 3.35Å; S140-S143 PolarHBondContact O-N 3.36Å; E141-S143 VanDerWaalsContact C-N 3.31Å; E141-S143 PolarHBondContact O-N 3.48Å; S143-S145 VanDerWaalsContact C-N 3.33Å
144	S	55.5	Low	56.1	Low	90 Å²	90	108.5 Å²	108.5	63%	0.629	65%	0.652	S	S	*	*	H	α-helix	trans	-73.7	-24.1	175.6	-168.9	0	0	0	0	113.1	S140 E141 M146	S140-S144 WeakPolarHBondContact O-CB 3.27Å; S140-S144 PolarHBondContact O-N 3.24Å; E141-S144 PolarHBondContact O-N 3.17Å; S144-M146 VanDerWaalsContact C-N 3.33Å
145	S	51.5	Low	54.6	Low	100 Å²	100	107.2 Å²	107.2	70%	0.699	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-14.2	177.9	179.9	0	0	0	0	113.6	E141 S143	E141-S145 VanDerWaalsContact O-CB 3.3Å; E141-S145 WeakPolarHBondContact O-CB 3.47Å; E141-S145 PolarHBondContact O-N 2.89Å; S143-S145 VanDerWaalsContact C-N 3.33Å
146	M	50.7	Low	53.3	Low	168 Å²	168	110.2 Å²	110.2	83%	0.828	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-1.4	-179.5	-81	-142.8	165.5	0	0	115.3	S144 G148	S144-M146 VanDerWaalsContact C-N 3.33Å; M146-G148 PolarHBondContact O-N 3.19Å; M146-G148 VanDerWaalsContact O-N 3.15Å
147	I	50.7	Low	52	Low	147 Å²	147	112.6 Å²	112.6	75%	0.754	70%	0.696	S	S	*	*	S	Bend	trans	-81.8	95.6	168.4	-76.8	158	0	0	0	106.7
148	G	47.2	Very low	50.8	Low	58 Å²	58	118.1 Å²	118.1	60%	0.598	72%	0.719	S	S	*	*			trans	-61.1	153.4	-173.1	0	0	0	0	0	114	M146 D150	M146-G148 PolarHBondContact O-N 3.19Å; M146-G148 VanDerWaalsContact O-N 3.15Å; G148-D150 VanDerWaalsContact C-N 3.34Å; G148-D150 PolarHBondContact O-N 3.18Å
149	D	50.3	Low	49.9	Very low	175 Å²	175	118.3 Å²	118.3	94%	0.936	73%	0.726	S	S	*	*			trans	-53.8	93.7	162.7	-61.6	-58	0	0	0	109.3
150	D	50.1	Low	48.9	Very low	150 Å²	150	121.1 Å²	121.1	80%	0.802	74%	0.739	S	S	*	*			trans	-96.5	115.6	167.3	-156.9	10.6	0	0	0	108	G148 T152	G148-D150 VanDerWaalsContact C-N 3.34Å; G148-D150 PolarHBondContact O-N 3.18Å; D150-T152 PolarHBondContact O-N 3.03Å
151	D	51.6	Low	48.6	Very low	157 Å²	157	126.5 Å²	126.5	84%	0.84	75%	0.754	S	S	*	*			trans	-50.8	104.2	-174.6	-80.7	-53	0	0	0	111.8
152	T	49.6	Very low	47.9	Very low	128 Å²	128	125.6 Å²	125.6	79%	0.785	76%	0.76	S	S	*	*			trans	-94	122.9	162.4	47.6	0	0	0	0	108.8	D150 S154	D150-T152 PolarHBondContact O-N 3.03Å; T152-S154 PolarHBondContact O-N 3.09Å
153	P	42.2	Very low	47.2	Very low	115 Å²	115	133.7 Å²	133.7	75%	0.747	78%	0.78	S	S	*	*			trans	-68.9	125.7	-179.4	27	-30.7	0	0	0	109.6	T155	P153-T155 PolarHBondContact O-N 3.24Å; P153-T155 VanDerWaalsContact O-N 3.15Å
154	S	47.4	Very low	46.4	Very low	123 Å²	123	140.2 Å²	140.2	86%	0.86	79%	0.792	S	S	*	*			trans	-55.4	113.4	169.8	-90	0	0	0	0	110.9	T152	T152-S154 PolarHBondContact O-N 3.09Å
155	T	39.1	Very low	46	Very low	133 Å²	133	143.3 Å²	143.3	82%	0.816	80%	0.796	S	S	*	*			trans	-106.8	105.1	157.1	62.3	0	0	0	0	108.8	P153	P153-T155 PolarHBondContact O-N 3.24Å; P153-T155 VanDerWaalsContact O-N 3.15Å
156	S	40.5	Very low	45.5	Very low	119 Å²	119	145.2 Å²	145.2	83%	0.832	80%	0.804	S	S	*	*			trans	-65.5	129	163.9	-4.2	0	0	0	0	109
157	S	41.4	Very low	45.2	Very low	115 Å²	115	142.6 Å²	142.6	80%	0.804	80%	0.802	S	S	*	*			trans	-170.7	93.4	151.9	176.8	0	0	0	0	110.8
158	D	41.4	Very low	44.5	Very low	162 Å²	162	148.2 Å²	148.2	87%	0.866	83%	0.828	S	S	*	*				54	111.3	128.2	-124.7	-8.5	0	0	0	120.8
159	G	42.2	Very low	44.4	Very low	61 Å²	61	152.7 Å²	152.7	63%	0.629	84%	0.839	S	S	*	*				86.2	88.7	120.6	0	0	0	0	0	119.5
160	H	39.8	Very low	44.1	Very low	188 Å²	188	151.5 Å²	151.5	87%	0.87	83%	0.834	S	S	*	*			trans	-156	121	131.9	-122.1	46	0	0	0	113.1
161	K	54.1	Low	43.7	Very low	183 Å²	183	151.6 Å²	151.6	80%	0.796	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-75.4	148.6	176.4	-68.4	176.9	177.7	176.8	0	110.5
162	P	44.7	Very low	43.3	Very low	123 Å²	123	151.3 Å²	151.3	80%	0.799	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-77.2	125.3	173.2	30.6	-31.4	0	0	0	110.5	R164	P162-R164 PolarHBondContact O-N 3.38Å
163	Y	43.3	Very low	42.9	Very low	230 Å²	230	152.8 Å²	152.8	90%	0.902	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-73.2	123.6	168	-88.2	-93.4	0	0	0	109.7
164	R	41.8	Very low	42.9	Very low	220 Å²	220	155.3 Å²	155.3	83%	0.83	85%	0.845	S	S	*	*			trans	-110.9	121.4	174.5	-171	-178	-177.1	177.4	1.8	109.2	P162	P162-R164 PolarHBondContact O-N 3.38Å
165	E	45.5	Very low	42.6	Very low	154 Å²	154	157.6 Å²	157.6	72%	0.72	84%	0.844	S	S	*	*			trans	17.2	131.8	154.9	-54.6	175.6	144.1	0	0	120.3
166	T	41.6	Very low	42.9	Very low	141 Å²	141	159.5 Å²	159.5	87%	0.865	85%	0.846	S	S	*	*				169	156.6	101.6	32.4	0	0	0	0	112.9
167	S	43.6	Very low	43.1	Very low	113 Å²	113	162.8 Å²	162.8	79%	0.79	85%	0.848	S	S	*	*			trans	-49.7	153.1	-166.8	-49.9	0	0	0	0	121
168	M	37.2	Very low	43.2	Very low	264 Å²	264	167.2 Å²	167.2	100%	1.3	85%	0.852	S	S	*	*				-144.5	0	120	-78.4	-158.7	77.2	0	0	109.7

Retrieved 168 of 168 residues in 43.7 ms (Link to these results)

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