A0A077YXD9_TRITR Loading...

Copper transport protein

AlphaFold DB , UniProt , Accession A0A077YXD9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 182 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	46.8	Very low	56.5	Low	221 Å²	221	158.8 Å²	158.8	100%	1.089	83%	0.833	S	S	*	*				0	102.2	0	-74.7	114.2	170.5	0	0	106.4
2	D	49.6	Very low	56.6	Low	128 Å²	128	158.9 Å²	158.9	68%	0.684	83%	0.826	S	S	*	*			trans	61.5	139.5	141.2	-31.2	-50.4	0	0	0	117.7
3	H	61	Low	57.2	Low	176 Å²	176	156.6 Å²	156.6	82%	0.815	81%	0.813	S	S	*	*			cis	-158.5	154.9	28.7	-80.8	-78.2	0	0	0	110.6
4	H	58.8	Low	57.3	Low	175 Å²	175	156.4 Å²	156.4	81%	0.81	81%	0.813	S	S	*	*			trans	-51.7	157	165	-81.1	-143.2	0	0	0	114
5	H	61.7	Low	57.6	Low	201 Å²	201	157.5 Å²	157.5	93%	0.931	81%	0.813	S	S	*	*				-165.4	112.3	125.5	-94.6	-68	0	0	0	109.9
6	S	56.6	Low	57.5	Low	104 Å²	104	154.8 Å²	154.8	73%	0.727	81%	0.812	S	S	*	*			trans	-127.4	139.7	171.3	-173.9	0	0	0	0	109.4
7	H	55.2	Low	57.5	Low	192 Å²	192	156.8 Å²	156.8	89%	0.889	82%	0.816	S	S	*	*			trans	-8.1	132.7	170.6	-58	-79.4	0	0	0	120.4
8	G	55.3	Low	57.8	Low	75 Å²	75	155.3 Å²	155.3	77%	0.773	82%	0.817	S	S	*	*			trans	-144.3	118.9	158.5	0	0	0	0	0	109.9
9	H	58.1	Low	57.6	Low	199 Å²	199	150.6 Å²	150.6	92%	0.921	81%	0.811	S	S	*	*			trans	-92.7	108.4	177.9	-151.7	-118.4	0	0	0	106.9
10	E	56	Low	57.3	Low	173 Å²	173	151.1 Å²	151.1	81%	0.808	81%	0.813	S	S	*	*			trans	-86.9	111	179.9	-72.5	-175	108.3	0	0	110.9
11	S	62.1	Low	57.3	Low	103 Å²	103	152.3 Å²	152.3	72%	0.72	81%	0.813	S	S	*	*			trans	-95.7	101.3	163.6	55.7	0	0	0	0	109.2	I13	S11-I13 PolarHBondContact O-N 3.42Å
12	H	58.2	Low	57.4	Low	160 Å²	160	146.2 Å²	146.2	74%	0.741	80%	0.798	S	S	*	*			trans	-72.7	107.5	170.5	-97.6	-98.1	0	0	0	110.2
13	I	64.4	Low	57.4	Low	129 Å²	129	146.7 Å²	146.7	66%	0.662	80%	0.8	S	S	*	*			trans	-83.2	110.8	165.9	-63.7	-178.2	0	0	0	107.6	S11 H15	S11-I13 PolarHBondContact O-N 3.42Å; I13-H15 PolarHBondContact O-N 3.41Å
14	N	57.8	Low	57	Low	153 Å²	153	147.2 Å²	147.2	82%	0.818	80%	0.803	S	S	*	*			trans	-74.1	108.4	166	-86	-20.5	0	0	0	108.7
15	H	61.9	Low	56.6	Low	174 Å²	174	146.8 Å²	146.8	81%	0.806	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-80.6	117.2	169.7	-89.5	-76.2	0	0	0	110.3	I13	I13-H15 PolarHBondContact O-N 3.41Å
16	S	57.4	Low	56.3	Low	113 Å²	113	142.1 Å²	142.1	79%	0.79	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-62.2	145.2	172.7	-40.4	0	0	0	0	112.6
17	E	57.2	Low	56.4	Low	189 Å²	189	146.2 Å²	146.2	88%	0.883	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-47.2	135.9	177.5	-68.3	158.7	80.6	0	0	114.8
18	P	62.9	Low	56.6	Low	130 Å²	130	145.2 Å²	145.2	84%	0.844	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89.7	121.6	159.1	27.4	-15.8	0	0	0	109.8
19	G	53	Low	57.1	Low	67 Å²	67	143.1 Å²	143.1	69%	0.691	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.7	137.7	-178	0	0	0	0	0	114.6	H21	G19-H21 PolarHBondContact O-N 3.47Å
20	D	51.8	Low	57.8	Low	159 Å²	159	142 Å²	142	85%	0.85	77%	0.771	S	S	*	*			trans	-60.5	95.5	167.8	-98.4	-40.8	0	0	0	111.1
21	H	57.6	Low	58.9	Low	177 Å²	177	141.2 Å²	141.2	82%	0.819	76%	0.762	S	S	*	*			trans	-115.6	71.8	156.8	-68.6	-57.5	0	0	0	108.4	G19 D23	G19-H21 PolarHBondContact O-N 3.47Å; H21-D23 PolarHBondContact O-N 2.82Å
22	A	49.7	Very low	59.6	Low	93 Å²	93	142.4 Å²	142.4	77%	0.769	76%	0.755	S	S	*	*			trans	-73.4	70.1	167.6	0	0	0	0	0	109.6	H24	A22-H24 PolarHBondContact O-N 3.46Å
23	D	49.3	Very low	60.7	Low	138 Å²	138	136 Å²	136	74%	0.738	73%	0.725	S	S	*	*			trans	-67.1	119.8	165	-112.5	-35.5	0	0	0	108.1	H21 M25	H21-D23 PolarHBondContact O-N 2.82Å; D23-M25 PolarHBondContact O-N 2.74Å
24	H	53	Low	61.4	Low	188 Å²	188	132.2 Å²	132.2	87%	0.87	72%	0.718	S	S	*	*			trans	-69.6	72.3	-174.2	-140.1	-70.4	0	0	0	110	A22 S26	A22-H24 PolarHBondContact O-N 3.46Å; H24-S26 PolarHBondContact O-N 2.81Å
25	M	48.8	Very low	62.2	Low	166 Å²	166	126.2 Å²	126.2	82%	0.818	69%	0.692	S	S	*	*			trans	-65.9	97.3	174.1	-70.2	-85.6	-170.2	0	0	108.7	D23 M27	D23-M25 PolarHBondContact O-N 2.74Å; M25-M27 PolarHBondContact O-N 2.78Å
26	S	56.3	Low	62.4	Low	103 Å²	103	124.3 Å²	124.3	72%	0.72	68%	0.679	S	S	*	*			trans	-58.3	102	168.8	57.8	0	0	0	0	108.7	H24 M28	H24-S26 PolarHBondContact O-N 2.81Å; S26-M28 PolarHBondContact O-N 2.81Å
27	M	58.1	Low	62.7	Low	189 Å²	189	124.9 Å²	124.9	93%	0.931	67%	0.669	S	S	*	*			trans	-61.3	106.1	174.9	-75.5	-163.2	-105.7	0	0	108.8	M25 S29	M25-M27 PolarHBondContact O-N 2.78Å; M27-S29 PolarHBondContact O-N 2.96Å
28	M	60.1	Low	63.1	Low	172 Å²	172	117.9 Å²	117.9	85%	0.847	64%	0.636	S	S	*	*			trans	-63.6	119.8	168.1	-79.7	-175.1	-178.1	0	0	108.4	S26 M30	S26-M28 PolarHBondContact O-N 2.81Å; M28-M30 PolarHBondContact O-N 2.78Å
29	S	65.5	Low	63.4	Low	31 Å²	31	115 Å²	115	22%	0.217	62%	0.617	C	S	.	*			trans	-64.8	117.3	169.4	39.6	0	0	0	0	109.8	M27 Y31 H33	M27-S29 PolarHBondContact O-N 2.96Å; S29-Y31 PolarHBondContact O-N 2.75Å; S29-H33 PolarHBondContact OG-CD2 2.85Å; S29-H33 PolarHBondContact OG-NE2 2.74Å
30	M	73.3	Confident	63.9	Low	174 Å²	174	112 Å²	112	86%	0.857	59%	0.585	S	S	*	*	S	Bend	trans	-82.6	26.7	171.5	-63	-164.3	-179.1	0	0	112.7	M28	M28-M30 PolarHBondContact O-N 2.78Å
31	Y	78.9	Confident	64.6	Low	158 Å²	158	106.7 Å²	106.7	62%	0.62	56%	0.556	S	S	*	*	S	Bend	trans	-128.3	153.3	176.1	62.3	-94.8	0	0	0	108.9	S29 H33	S29-Y31 PolarHBondContact O-N 2.75Å; Y31-H33 HydrophobicContact CE2-CB 4.13Å; Y31-H33 PolarHBondContact O-CD2 3.03Å; Y31-H33 VanDerWaalsContact O-CD2 3.3Å; Y31-H33 PolarHBondContact O-N 2.75Å; Y31-H33 VanDerWaalsContact O-N 3.12Å
32	F	76.8	Confident	65.3	Low	127 Å²	127	103.4 Å²	103.4	56%	0.557	54%	0.54	S	S	*	.			trans	-59.4	117.7	176.2	-73.1	-77	0	0	0	110.9	F148 M153	F32-F148 WeakPolarHBondContact CA-O 3.46Å; F32-F148 HydrophobicContact CD1-CD1 4.37Å; F32-F148 HydrophobicContact CE1-CD1 4.2Å; F32-F148 HydrophobicContact CZ-CD1 4.33Å; F32-M153 HydrophobicContact CE1-SD 3.86Å; F32-M153 HydrophobicContact CZ-SD 4.46Å
33	H	81.1	Confident	66	Low	25 Å²	25	103.8 Å²	103.8	12%	0.116	54%	0.536	C	S	.	.	B	Isolated β-bridge	trans	-114.7	149	176.8	55	101.2	0	0	0	111	S29 Y31 E38 T147 F148 T150	S29-H33 PolarHBondContact OG-CD2 2.85Å; S29-H33 PolarHBondContact OG-NE2 2.74Å; Y31-H33 HydrophobicContact CE2-CB 4.13Å; Y31-H33 PolarHBondContact O-CD2 3.03Å; Y31-H33 VanDerWaalsContact O-CD2 3.3Å; Y31-H33 PolarHBondContact O-N 2.75Å; Y31-H33 VanDerWaalsContact O-N 3.12Å; H33-E38 IonicContact CE1-OE1 2.79Å; H33-E38 PolarHBondContact CE1-OE1 2.99Å; H33-E38 IonicContact CE1-OE2 3.81Å; H33-E38 PolarHBondContact CE1-OE2 3.15Å; H33-E38 VanDerWaalsContact CE1-OE2 3.31Å; H33-E38 IonicContact ND1-OE1 3.62Å; H33-E38 PolarHBondContact ND1-OE1 3.15Å; H33-E38 IonicContact ND1-OE2 3.05Å; H33-T147 PolarHBondContact NE2-O 2.93Å; H33-F148 PolarHBondContact N-O 3.46Å; H33-F148 VanDerWaalsContact N-O 3.1Å; H33-T150 PolarHBondContact O-N 2.95Å; H33-T150 PolarHBondContact O-OG1 3.29Å
34	G	79	Confident	67.2	Low	50 Å²	50	104.6 Å²	104.6	52%	0.515	53%	0.534	S	S	.	.			trans	-102.3	21	179	0	0	0	0	0	113.9	W151	G34-W151 PolarHBondContact O-NE1 3.4Å
35	G	74.2	Confident	68	Low	27 Å²	27	99.5 Å²	99.5	28%	0.278	51%	0.507	S	S	.	.			trans	-65.6	157	-179.1	0	0	0	0	0	113.2	N149	G35-N149 PolarHBondContact O-ND2 2.87Å
36	Y	66.1	Low	68.9	Low	134 Å²	134	97.2 Å²	97.2	53%	0.525	49%	0.492	S	S	.	.	S	Bend	trans	-107.3	-12.8	173.8	52.8	-93.4	0	0	0	113.2	E38 T47 F53	Y36-E38 PolarHBondContact O-N 3.28Å; Y36-T47 PolarHBondContact O-OG1 3.42Å; Y36-F53 WeakPolarHBondContact O-CD2 3.49Å
37	E	64.9	Low	69.7	Low	125 Å²	125	92.5 Å²	92.5	58%	0.584	46%	0.459	S	S	*	.			trans	-96.6	80.5	177.5	-63.3	-163.8	131.5	0	0	111.2	T47	E37-T47 WeakPolarHBondContact CA-O 3.33Å
38	E	65.3	Low	70.1	Confident	42 Å²	42	87.6 Å²	87.6	20%	0.196	44%	0.443	C	S	.	.			trans	-120.2	148.8	-178.4	-57.7	-57.4	162.4	0	0	112.2	H33 Y36 T47 N149	H33-E38 IonicContact CE1-OE1 2.79Å; H33-E38 PolarHBondContact CE1-OE1 2.99Å; H33-E38 IonicContact CE1-OE2 3.81Å; H33-E38 PolarHBondContact CE1-OE2 3.15Å; H33-E38 VanDerWaalsContact CE1-OE2 3.31Å; H33-E38 IonicContact ND1-OE1 3.62Å; H33-E38 PolarHBondContact ND1-OE1 3.15Å; H33-E38 IonicContact ND1-OE2 3.05Å; Y36-E38 PolarHBondContact O-N 3.28Å; E38-T47 PolarHBondContact O-N 2.89Å; E38-N149 VanDerWaalsContact CG-ND2 3.26Å; E38-N149 WeakPolarHBondContact CG-ND2 3.19Å
39	T	67.8	Low	71	Confident	70 Å²	70	83.6 Å²	83.6	43%	0.429	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-94.6	104.5	167.1	-52.1	0	0	0	0	107.7	F42 K46	T39-F42 VanDerWaalsContact CG2-O 3.29Å; T39-F42 WeakPolarHBondContact CG2-O 3.18Å; T39-K46 HydrophobicContact CG2-CG 3.92Å; T39-K46 VanDerWaalsContact OG1-CE 3.31Å; T39-K46 WeakPolarHBondContact OG1-CE 3.47Å; T39-K46 WeakPolarHBondContact OG1-CG 2.96Å
40	I	65.1	Low	71.8	Confident	4 Å²	4	88 Å²	88	2%	0.021	45%	0.448	C	S	.	.			trans	-74.9	-35.4	-164.7	-63.1	-179.6	0	0	0	112.8	W45 T47 I60 I144 L152	I40-W45 HydrophobicContact CB-CD2 4.27Å; I40-W45 HydrophobicContact CB-CG 4.37Å; I40-W45 HydrophobicContact CG2-CD2 4.48Å; I40-W45 HydrophobicContact CG2-CE3 4.4Å; I40-W45 PolarHBondContact N-O 3.29Å; I40-T47 HydrophobicContact CD1-CG2 4.24Å; I40-I60 HydrophobicContact CD1-CD1 4.32Å; I40-I60 HydrophobicContact CG2-CD1 4.2Å; I40-I144 HydrophobicContact CG2-CG1 4.06Å; I40-L152 HydrophobicContact CD1-CD1 4.13Å; I40-L152 HydrophobicContact CG1-CD1 4.01Å; I40-L152 HydrophobicContact CG2-CD1 4.47Å
41	L	66.3	Low	72.5	Confident	48 Å²	48	82.4 Å²	82.4	25%	0.251	44%	0.435	S	S	.	.	S	Bend	trans	-160.3	-41.4	-174.6	-167.9	69	0	0	0	113.7	W45 L140 L143	L41-W45 HydrophobicContact CB-CE3 4.34Å; L41-L140 HydrophobicContact CD1-CD2 4.45Å; L41-L140 HydrophobicContact CD2-CD2 3.41Å; L41-L140 VanDerWaalsContact CD2-CD2 3.41Å; L41-L143 HydrophobicContact CD1-CB 3.72Å; L41-L143 HydrophobicContact CD1-CD1 3.66Å; L41-L143 HydrophobicContact CD1-CG 4.26Å
42	F	71.1	Confident	72.8	Confident	108 Å²	108	76.1 Å²	76.1	47%	0.474	42%	0.419	S	S	.	.	S	Bend	trans	-123.8	152.4	178.5	-60.9	-73.9	0	0	0	109.2	T39 F44 W45	T39-F42 VanDerWaalsContact CG2-O 3.29Å; T39-F42 WeakPolarHBondContact CG2-O 3.18Å; F42-F44 HydrophobicContact CB-CD1 3.33Å; F42-F44 HydrophobicContact CB-CE1 3.16Å; F42-F44 HydrophobicContact CB-CE2 4.49Å; F42-F44 HydrophobicContact CB-CG 4.09Å; F42-F44 HydrophobicContact CB-CZ 3.8Å; F42-F44 HydrophobicContact CD1-CE1 4.15Å; F42-F44 AromaticContact CD2-CE1 3.54Å; F42-F44 HydrophobicContact CD2-CE1 3.54Å; F42-F44 HydrophobicContact CD2-CE2 4.5Å; F42-F44 AromaticContact CD2-CZ 3.5Å; F42-F44 HydrophobicContact CD2-CZ 3.5Å; F42-F44 HydrophobicContact CE2-CE1 4.43Å; F42-F44 HydrophobicContact CE2-CZ 4.31Å; F42-F44 HydrophobicContact CG-CD1 4.05Å; F42-F44 AromaticContact CG-CE1 3.36Å; F42-F44 HydrophobicContact CG-CE1 3.36Å; F42-F44 AromaticContact CG-CZ 3.84Å; F42-F44 HydrophobicContact CG-CZ 3.84Å; F42-F44 PolarHBondContact O-N 3.49Å; F42-W45 PolarHBondContact O-N 3.49Å
43	S	64.9	Low	73.2	Confident	100 Å²	100	71 Å²	71	70%	0.699	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.5	177.6	56.1	0	0	0	0	113.7	K46	S43-K46 WeakPolarHBondContact O-CE 3.5Å; S43-K46 WeakPolarHBondContact O-CG 3.48Å
44	F	74.7	Confident	73.7	Confident	155 Å²	155	73.2 Å²	73.2	68%	0.68	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-22.5	174.6	72.2	-101.4	0	0	0	114	F42 K46	F42-F44 HydrophobicContact CB-CD1 3.33Å; F42-F44 HydrophobicContact CB-CE1 3.16Å; F42-F44 HydrophobicContact CB-CE2 4.49Å; F42-F44 HydrophobicContact CB-CG 4.09Å; F42-F44 HydrophobicContact CB-CZ 3.8Å; F42-F44 HydrophobicContact CD1-CE1 4.15Å; F42-F44 AromaticContact CD2-CE1 3.54Å; F42-F44 HydrophobicContact CD2-CE1 3.54Å; F42-F44 HydrophobicContact CD2-CE2 4.5Å; F42-F44 AromaticContact CD2-CZ 3.5Å; F42-F44 HydrophobicContact CD2-CZ 3.5Å; F42-F44 HydrophobicContact CE2-CE1 4.43Å; F42-F44 HydrophobicContact CE2-CZ 4.31Å; F42-F44 HydrophobicContact CG-CD1 4.05Å; F42-F44 AromaticContact CG-CE1 3.36Å; F42-F44 HydrophobicContact CG-CE1 3.36Å; F42-F44 AromaticContact CG-CZ 3.84Å; F42-F44 HydrophobicContact CG-CZ 3.84Å; F42-F44 PolarHBondContact O-N 3.49Å; F44-K46 VanDerWaalsContact C-N 3.32Å; F44-K46 PolarHBondContact O-N 3.05Å
45	W	70.1	Confident	74.2	Confident	81 Å²	81	72.9 Å²	72.9	31%	0.307	41%	0.408	S	S	.	.			trans	-94.2	67.6	-179.5	-160.4	-5.2	0	0	0	110	I40 L41 F42 S56	I40-W45 HydrophobicContact CB-CD2 4.27Å; I40-W45 HydrophobicContact CB-CG 4.37Å; I40-W45 HydrophobicContact CG2-CD2 4.48Å; I40-W45 HydrophobicContact CG2-CE3 4.4Å; I40-W45 PolarHBondContact N-O 3.29Å; L41-W45 HydrophobicContact CB-CE3 4.34Å; F42-W45 PolarHBondContact O-N 3.49Å; W45-S56 PolarHBondContact NE1-OG 3.35Å
46	K	67.9	Low	75	Confident	118 Å²	118	71.8 Å²	71.8	51%	0.513	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-107.2	129.7	175.7	-69	-175.7	178.3	177.7	0	110.2	T39 S43 F44	T39-K46 HydrophobicContact CG2-CG 3.92Å; T39-K46 VanDerWaalsContact OG1-CE 3.31Å; T39-K46 WeakPolarHBondContact OG1-CE 3.47Å; T39-K46 WeakPolarHBondContact OG1-CG 2.96Å; S43-K46 WeakPolarHBondContact O-CE 3.5Å; S43-K46 WeakPolarHBondContact O-CG 3.48Å; F44-K46 VanDerWaalsContact C-N 3.32Å; F44-K46 PolarHBondContact O-N 3.05Å
47	T	71.6	Confident	76.3	Confident	5 Å²	5	67.9 Å²	67.9	3%	0.031	38%	0.382	C	S	.	.			trans	-102.4	80.8	179.3	56.6	0	0	0	0	110.9	Y36 E37 E38 I40 T49 G52 S56	Y36-T47 PolarHBondContact O-OG1 3.42Å; E37-T47 WeakPolarHBondContact CA-O 3.33Å; E38-T47 PolarHBondContact O-N 2.89Å; I40-T47 HydrophobicContact CD1-CG2 4.24Å; T47-T49 PolarHBondContact O-N 3.08Å; T47-G52 VanDerWaalsContact CG2-C 3.42Å; T47-G52 VanDerWaalsContact CG2-O 3.26Å; T47-G52 WeakPolarHBondContact CG2-O 3.4Å; T47-S56 WeakPolarHBondContact CG2-OG 3.4Å
48	C	66.6	Low	77.7	Confident	86 Å²	86	65.8 Å²	65.8	58%	0.581	37%	0.374	S	S	*	.			trans	-77.1	-4.2	175.1	-56.5	0	0	0	0	113.3
49	T	80.7	Confident	79	Confident	87 Å²	87	65.2 Å²	65.2	53%	0.534	38%	0.379	S	S	.	.	S	Bend	trans	-127.3	147.8	-178.2	66.4	0	0	0	0	111	T47 G51 G52 F53	T47-T49 PolarHBondContact O-N 3.08Å; T49-G51 PolarHBondContact O-N 3.33Å; T49-G52 PolarHBondContact O-N 3.38Å; T49-G52 PolarHBondContact OG1-N 3.28Å; T49-G52 VanDerWaalsContact OG1-N 3.09Å; T49-F53 PolarHBondContact O-N 3.49Å
50	L	82.5	Confident	80.3	Confident	124 Å²	124	61.9 Å²	61.9	65%	0.649	36%	0.359	S	S	*	.	H	α-helix	trans	-54.6	-38.8	174.4	-175.2	68.1	0	0	0	111.5	F53 V54	L50-F53 WeakPolarHBondContact O-CB 3.31Å; L50-F53 PolarHBondContact O-N 3.39Å; L50-V54 WeakPolarHBondContact O-CG2 3.43Å; L50-V54 PolarHBondContact O-N 3.26Å
51	G	86.7	Confident	81.7	Confident	56 Å²	56	64.1 Å²	64.1	58%	0.577	37%	0.37	S	S	*	.	H	α-helix	trans	-63.9	-43.5	176	0	0	0	0	0	113	T49 F53 V54 G55	T49-G51 PolarHBondContact O-N 3.33Å; G51-F53 VanDerWaalsContact C-N 3.3Å; G51-F53 PolarHBondContact O-N 3.41Å; G51-V54 PolarHBondContact O-N 2.91Å; G51-G55 PolarHBondContact O-N 3.02Å
52	G	85.3	Confident	83.2	Confident	27 Å²	27	66.7 Å²	66.7	28%	0.278	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-37.1	174.7	0	0	0	0	0	112.5	T47 T49 S56	T47-G52 VanDerWaalsContact CG2-C 3.42Å; T47-G52 VanDerWaalsContact CG2-O 3.26Å; T47-G52 WeakPolarHBondContact CG2-O 3.4Å; T49-G52 PolarHBondContact O-N 3.38Å; T49-G52 PolarHBondContact OG1-N 3.28Å; T49-G52 VanDerWaalsContact OG1-N 3.09Å; G52-S56 WeakPolarHBondContact O-CB 3.38Å; G52-S56 PolarHBondContact O-N 2.9Å; G52-S56 PolarHBondContact O-OG 3.47Å
53	F	86.4	Confident	84.3	Confident	18 Å²	18	63.3 Å²	63.3	8%	0.079	37%	0.37	C	S	.	.	H	α-helix	trans	-65.8	-49.7	175.8	-179.4	-99.6	0	0	0	112.2	Y36 T49 L50 G51 G55 S56 F57 W151 L152	Y36-F53 WeakPolarHBondContact O-CD2 3.49Å; T49-F53 PolarHBondContact O-N 3.49Å; L50-F53 WeakPolarHBondContact O-CB 3.31Å; L50-F53 PolarHBondContact O-N 3.39Å; G51-F53 VanDerWaalsContact C-N 3.3Å; G51-F53 PolarHBondContact O-N 3.41Å; F53-G55 VanDerWaalsContact C-N 3.31Å; F53-G55 PolarHBondContact O-N 3.32Å; F53-S56 WeakPolarHBondContact O-CB 3.4Å; F53-S56 PolarHBondContact O-N 3.44Å; F53-S56 VanDerWaalsContact O-N 3.1Å; F53-F57 PolarHBondContact O-N 3.5Å; F53-W151 HydrophobicContact CE1-CB 4.12Å; F53-W151 HydrophobicContact CE1-CG 4.18Å; F53-W151 HydrophobicContact CE2-CB 4.45Å; F53-W151 HydrophobicContact CZ-CB 3.46Å; F53-W151 VanDerWaalsContact CZ-CB 3.46Å; F53-W151 AromaticContact CZ-CD1 3.69Å; F53-W151 AromaticContact CZ-CG 3.69Å; F53-W151 HydrophobicContact CZ-CG 3.69Å; F53-L152 HydrophobicContact CE2-CD2 4.23Å
54	V	90.2	Very high	85.8	Confident	72 Å²	72	58.6 Å²	58.6	44%	0.436	34%	0.337	S	S	.	.	H	α-helix	trans	-61	-41	175.6	173.1	0	0	0	0	111.1	L50 G51 S56 F57 I58	L50-V54 WeakPolarHBondContact O-CG2 3.43Å; L50-V54 PolarHBondContact O-N 3.26Å; G51-V54 PolarHBondContact O-N 2.91Å; V54-S56 VanDerWaalsContact C-N 3.28Å; V54-S56 PolarHBondContact O-N 3.14Å; V54-F57 WeakPolarHBondContact O-CB 3.28Å; V54-F57 PolarHBondContact O-N 3.48Å; V54-I58 HydrophobicContact CG1-CD1 3.99Å; V54-I58 WeakPolarHBondContact O-CG1 3.32Å; V54-I58 PolarHBondContact O-N 3.29Å
55	G	90.9	Very high	86.7	Confident	43 Å²	43	52.4 Å²	52.4	44%	0.443	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-40.4	174	0	0	0	0	0	112.4	G51 F53 G59	G51-G55 PolarHBondContact O-N 3.02Å; F53-G55 VanDerWaalsContact C-N 3.31Å; F53-G55 PolarHBondContact O-N 3.32Å; G55-G59 PolarHBondContact O-N 3.42Å
56	S	90.7	Very high	87.9	Confident	5 Å²	5	52.9 Å²	52.9	4%	0.035	32%	0.32	C	S	.	.	H	α-helix	trans	-71	-39.6	177	-57.4	0	0	0	0	112.5	W45 T47 G52 F53 V54 I58 G59 I60	W45-S56 PolarHBondContact NE1-OG 3.35Å; T47-S56 WeakPolarHBondContact CG2-OG 3.4Å; G52-S56 WeakPolarHBondContact O-CB 3.38Å; G52-S56 PolarHBondContact O-N 2.9Å; G52-S56 PolarHBondContact O-OG 3.47Å; F53-S56 WeakPolarHBondContact O-CB 3.4Å; F53-S56 PolarHBondContact O-N 3.44Å; F53-S56 VanDerWaalsContact O-N 3.1Å; V54-S56 VanDerWaalsContact C-N 3.28Å; V54-S56 PolarHBondContact O-N 3.14Å; S56-I58 PolarHBondContact O-N 3.02Å; S56-G59 PolarHBondContact O-N 2.97Å; S56-I60 WeakPolarHBondContact O-CB 3.48Å; S56-I60 WeakPolarHBondContact O-CD1 3.43Å; S56-I60 VanDerWaalsContact O-CG1 3.24Å; S56-I60 WeakPolarHBondContact O-CG1 3.5Å; S56-I60 PolarHBondContact O-N 2.91Å
57	F	91.9	Very high	89.2	Confident	52 Å²	52	49.4 Å²	49.4	23%	0.228	30%	0.304	C	S	.	.	H	α-helix	trans	-55.9	-49.8	172.6	-177.9	-80.1	0	0	0	111.1	F53 V54 I60 M61 W151 A155	F53-F57 PolarHBondContact O-N 3.5Å; V54-F57 WeakPolarHBondContact O-CB 3.28Å; V54-F57 PolarHBondContact O-N 3.48Å; F57-I60 PolarHBondContact O-N 3.44Å; F57-M61 WeakPolarHBondContact O-CB 3.49Å; F57-M61 PolarHBondContact O-N 3.05Å; F57-W151 VanDerWaalsContact CE2-O 3.26Å; F57-W151 WeakPolarHBondContact CE2-O 3.41Å; F57-A155 HydrophobicContact CD1-CB 4.23Å; F57-A155 HydrophobicContact CD2-CB 3.55Å; F57-A155 HydrophobicContact CE1-CB 4.2Å; F57-A155 HydrophobicContact CE2-CB 3.52Å; F57-A155 HydrophobicContact CG-CB 3.9Å; F57-A155 HydrophobicContact CZ-CB 3.85Å
58	I	94.4	Very high	90.2	Very high	80 Å²	80	50.2 Å²	50.2	41%	0.41	31%	0.307	S	S	.	.	H	α-helix	trans	-64.1	-43.4	177.5	-64.7	168.2	0	0	0	110.5	V54 S56 I60 M61 L62	V54-I58 HydrophobicContact CG1-CD1 3.99Å; V54-I58 WeakPolarHBondContact O-CG1 3.32Å; V54-I58 PolarHBondContact O-N 3.29Å; S56-I58 PolarHBondContact O-N 3.02Å; I58-I60 VanDerWaalsContact C-N 3.34Å; I58-I60 PolarHBondContact O-N 3.4Å; I58-M61 PolarHBondContact O-N 3.39Å; I58-L62 HydrophobicContact CG2-CD1 4.08Å; I58-L62 HydrophobicContact CG2-CG 4.35Å; I58-L62 WeakPolarHBondContact O-CB 3.4Å; I58-L62 WeakPolarHBondContact O-CG 3.49Å; I58-L62 PolarHBondContact O-N 2.94Å
59	G	94.1	Very high	91.4	Very high	30 Å²	30	46.5 Å²	46.5	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-58.7	-43	177.6	0	0	0	0	0	112.9	G55 S56 L62 L63	G55-G59 PolarHBondContact O-N 3.42Å; S56-G59 PolarHBondContact O-N 2.97Å; G59-L62 PolarHBondContact O-N 2.67Å; G59-L63 WeakPolarHBondContact O-CB 3.45Å; G59-L63 PolarHBondContact O-N 3.12Å
60	I	94.1	Very high	91.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.2	-42.4	177.6	-69.3	163.7	0	0	0	111	I40 S56 F57 I58 L62 L63 A64 I144 L152 A155 V156	I40-I60 HydrophobicContact CD1-CD1 4.32Å; I40-I60 HydrophobicContact CG2-CD1 4.2Å; S56-I60 WeakPolarHBondContact O-CB 3.48Å; S56-I60 WeakPolarHBondContact O-CD1 3.43Å; S56-I60 VanDerWaalsContact O-CG1 3.24Å; S56-I60 WeakPolarHBondContact O-CG1 3.5Å; S56-I60 PolarHBondContact O-N 2.91Å; F57-I60 PolarHBondContact O-N 3.44Å; I58-I60 VanDerWaalsContact C-N 3.34Å; I58-I60 PolarHBondContact O-N 3.4Å; I60-L62 VanDerWaalsContact C-N 3.33Å; I60-L62 PolarHBondContact O-N 3.44Å; I60-L63 WeakPolarHBondContact O-CB 3.41Å; I60-L63 PolarHBondContact O-N 2.98Å; I60-A64 PolarHBondContact O-N 3.26Å; I60-I144 HydrophobicContact CD1-CD1 4.26Å; I60-I144 HydrophobicContact CD1-CG1 4.43Å; I60-I144 HydrophobicContact CD1-CG2 3.87Å; I60-I144 HydrophobicContact CG1-CD1 3.84Å; I60-I144 HydrophobicContact CG1-CG2 4.43Å; I60-I144 HydrophobicContact CG2-CD1 4.29Å; I60-I144 HydrophobicContact CG2-CG2 4.14Å; I60-L152 HydrophobicContact CD1-CB 4.35Å; I60-L152 HydrophobicContact CD1-CD1 4.1Å; I60-L152 HydrophobicContact CD1-CD2 3.66Å; I60-L152 HydrophobicContact CD1-CG 4.24Å; I60-A155 HydrophobicContact CB-CB 4.33Å; I60-A155 HydrophobicContact CG2-CB 4.03Å; I60-V156 HydrophobicContact CG2-CG2 3.39Å
61	M	95.4	Very high	92.2	Very high	51 Å²	51	39.3 Å²	39.3	25%	0.251	24%	0.241	S	C	.	.	H	α-helix	trans	-58.3	-45.5	174	-174.4	-172.7	68.3	0	0	111	F57 I58 A64 V65 I158	F57-M61 WeakPolarHBondContact O-CB 3.49Å; F57-M61 PolarHBondContact O-N 3.05Å; I58-M61 PolarHBondContact O-N 3.39Å; M61-A64 PolarHBondContact O-N 2.94Å; M61-V65 WeakPolarHBondContact O-CG2 3.37Å; M61-V65 PolarHBondContact O-N 2.95Å; M61-I158 HydrophobicContact SD-CG2 4.27Å
62	L	96	Very high	92.2	Very high	102 Å²	102	37.1 Å²	37.1	53%	0.534	22%	0.216	S	C	.	.	H	α-helix	trans	-65	-39.1	175.5	-71	176.5	0	0	0	112.3	I58 G59 I60 A64 V65 L66	I58-L62 HydrophobicContact CG2-CD1 4.08Å; I58-L62 HydrophobicContact CG2-CG 4.35Å; I58-L62 WeakPolarHBondContact O-CB 3.4Å; I58-L62 WeakPolarHBondContact O-CG 3.49Å; I58-L62 PolarHBondContact O-N 2.94Å; G59-L62 PolarHBondContact O-N 2.67Å; I60-L62 VanDerWaalsContact C-N 3.33Å; I60-L62 PolarHBondContact O-N 3.44Å; L62-A64 VanDerWaalsContact C-N 3.32Å; L62-A64 PolarHBondContact O-N 3.31Å; L62-V65 PolarHBondContact O-N 3.44Å; L62-L66 VanDerWaalsContact O-CB 3.28Å; L62-L66 WeakPolarHBondContact O-CB 3.43Å; L62-L66 PolarHBondContact O-N 3.09Å
63	L	94.8	Very high	92.3	Very high	38 Å²	38	40.9 Å²	40.9	20%	0.199	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-39.7	175.9	-171.9	65.1	0	0	0	111.5	G59 I60 L66 Y67 I137 L140 L141 I144	G59-L63 WeakPolarHBondContact O-CB 3.45Å; G59-L63 PolarHBondContact O-N 3.12Å; I60-L63 WeakPolarHBondContact O-CB 3.41Å; I60-L63 PolarHBondContact O-N 2.98Å; L63-L66 PolarHBondContact O-N 3.19Å; L63-Y67 PolarHBondContact O-N 2.94Å; L63-I137 HydrophobicContact CD1-CG1 4.27Å; L63-I137 HydrophobicContact CD1-CG2 3.87Å; L63-I137 HydrophobicContact CG-CG2 3.96Å; L63-L140 HydrophobicContact CD2-CB 4.3Å; L63-L141 HydrophobicContact CB-CD2 4.4Å; L63-L141 HydrophobicContact CD2-CD2 4.1Å; L63-L141 HydrophobicContact CD2-CG 4.46Å; L63-L141 HydrophobicContact CG-CD2 4.17Å; L63-I144 HydrophobicContact CD2-CD1 4.24Å
64	A	95.8	Very high	92.3	Very high	1 Å²	1	43 Å²	43	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-68.3	-40.5	174.4	0	0	0	0	0	112.7	I60 M61 L62 L66 Y67 E68 L141	I60-A64 PolarHBondContact O-N 3.26Å; M61-A64 PolarHBondContact O-N 2.94Å; L62-A64 VanDerWaalsContact C-N 3.32Å; L62-A64 PolarHBondContact O-N 3.31Å; A64-L66 VanDerWaalsContact C-N 3.33Å; A64-L66 PolarHBondContact O-N 3.02Å; A64-Y67 WeakPolarHBondContact O-CB 3.48Å; A64-Y67 PolarHBondContact O-N 3.35Å; A64-E68 PolarHBondContact O-N 2.97Å; A64-L141 HydrophobicContact CB-CD1 4.39Å; A64-L141 HydrophobicContact CB-CD2 4.12Å
65	V	95.5	Very high	92.1	Very high	25 Å²	25	42.1 Å²	42.1	15%	0.152	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-43.5	171.7	172.2	0	0	0	0	110.8	M61 L62 Y67 E68 G69 G159 V162 L166 F167	M61-V65 WeakPolarHBondContact O-CG2 3.37Å; M61-V65 PolarHBondContact O-N 2.95Å; L62-V65 PolarHBondContact O-N 3.44Å; V65-Y67 VanDerWaalsContact C-N 3.33Å; V65-Y67 PolarHBondContact O-N 3.29Å; V65-E68 PolarHBondContact O-N 3.45Å; V65-G69 PolarHBondContact O-N 3.36Å; V65-G159 WeakPolarHBondContact CG2-O 3.43Å; V65-V162 HydrophobicContact CG2-CB 4.18Å; V65-V162 HydrophobicContact CG2-CG1 4.03Å; V65-L166 HydrophobicContact CG1-CD1 4.21Å; V65-F167 HydrophobicContact CG1-CE2 4.36Å
66	L	94.3	Very high	91.7	Very high	91 Å²	91	42 Å²	42	48%	0.476	22%	0.216	S	C	.	.	H	α-helix	trans	-63.3	-38.9	178.4	-179	64.2	0	0	0	111.8	L62 L63 A64 E68 G69 I70 I137	L62-L66 VanDerWaalsContact O-CB 3.28Å; L62-L66 WeakPolarHBondContact O-CB 3.43Å; L62-L66 PolarHBondContact O-N 3.09Å; L63-L66 PolarHBondContact O-N 3.19Å; A64-L66 VanDerWaalsContact C-N 3.33Å; A64-L66 PolarHBondContact O-N 3.02Å; L66-E68 PolarHBondContact O-N 2.96Å; L66-G69 PolarHBondContact O-N 2.92Å; L66-G69 VanDerWaalsContact O-N 3.16Å; L66-I70 HydrophobicContact CD1-CD1 4.02Å; L66-I70 HydrophobicContact CD1-CG1 4.21Å; L66-I70 HydrophobicContact CD2-CD1 4.39Å; L66-I70 HydrophobicContact CG-CD1 3.8Å; L66-I70 HydrophobicContact CG-CG1 4.41Å; L66-I70 WeakPolarHBondContact O-CG1 3.29Å; L66-I70 PolarHBondContact O-N 3.39Å; L66-I137 HydrophobicContact CD2-CD1 4.24Å; L66-I137 HydrophobicContact CG-CD1 4.38Å
67	Y	94.5	Very high	91.3	Very high	44 Å²	44	43.9 Å²	43.9	17%	0.173	23%	0.225	C	C	.	.	H	α-helix	trans	-55.9	-49	174	175.8	-108.6	0	0	0	112	L63 A64 V65 G69 I70 K71 Q134 I137 L141	L63-Y67 PolarHBondContact O-N 2.94Å; A64-Y67 WeakPolarHBondContact O-CB 3.48Å; A64-Y67 PolarHBondContact O-N 3.35Å; V65-Y67 VanDerWaalsContact C-N 3.33Å; V65-Y67 PolarHBondContact O-N 3.29Å; Y67-G69 VanDerWaalsContact C-N 3.29Å; Y67-G69 PolarHBondContact O-N 2.95Å; Y67-I70 PolarHBondContact O-N 3.5Å; Y67-K71 WeakPolarHBondContact O-CB 3.43Å; Y67-K71 PolarHBondContact O-N 3.24Å; Y67-Q134 HydrophobicContact CD2-CG 4.11Å; Y67-Q134 HydrophobicContact CE2-CG 3.55Å; Y67-I137 HydrophobicContact CD2-CB 4.29Å; Y67-I137 HydrophobicContact CD2-CG2 4.01Å; Y67-I137 HydrophobicContact CG-CG2 4.29Å; Y67-L141 HydrophobicContact CD1-CD1 4.35Å; Y67-L141 HydrophobicContact CG-CD1 4.01Å
68	E	93.4	Very high	90.8	Very high	22 Å²	22	46.2 Å²	46.2	10%	0.103	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-33.1	176.2	-68.8	-55.6	145.8	0	0	112.7	A64 V65 L66 K71 T72 F167	A64-E68 PolarHBondContact O-N 2.97Å; V65-E68 PolarHBondContact O-N 3.45Å; L66-E68 PolarHBondContact O-N 2.96Å; E68-K71 IonicContact OE1-NZ 3.09Å; E68-K71 PolarHBondContact OE1-NZ 3.37Å; E68-K71 WeakPolarHBondContact OE2-CE 3.45Å; E68-K71 IonicContact OE2-NZ 3.16Å; E68-K71 PolarHBondContact OE2-NZ 3.42Å; E68-T72 WeakPolarHBondContact O-CB 3.04Å; E68-T72 PolarHBondContact O-N 3.27Å; E68-T72 PolarHBondContact O-OG1 3.32Å; E68-F167 HydrophobicContact CB-CD2 4.21Å
69	G	91.1	Very high	90.2	Very high	9 Å²	9	47.5 Å²	47.5	9%	0.093	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-48.9	175.7	0	0	0	0	0	113.6	V65 L66 Y67 K71 T72 F73 F167	V65-G69 PolarHBondContact O-N 3.36Å; L66-G69 PolarHBondContact O-N 2.92Å; L66-G69 VanDerWaalsContact O-N 3.16Å; Y67-G69 VanDerWaalsContact C-N 3.29Å; Y67-G69 PolarHBondContact O-N 2.95Å; G69-K71 VanDerWaalsContact C-N 3.32Å; G69-K71 PolarHBondContact O-N 2.87Å; G69-T72 PolarHBondContact O-N 2.95Å; G69-F73 WeakPolarHBondContact O-CB 3.39Å; G69-F73 PolarHBondContact O-N 3.05Å; G69-F167 VanDerWaalsContact CA-CD2 3.47Å; G69-F167 VanDerWaalsContact CA-CE1 3.46Å; G69-F167 VanDerWaalsContact N-CE2 3.33Å
70	I	90.8	Very high	89.5	Confident	16 Å²	16	54.7 Å²	54.7	8%	0.082	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-41.8	177.3	-68.7	164.3	0	0	0	110.2	L66 Y67 T72 F73 R74 L133 Q134 I137	L66-I70 HydrophobicContact CD1-CD1 4.02Å; L66-I70 HydrophobicContact CD1-CG1 4.21Å; L66-I70 HydrophobicContact CD2-CD1 4.39Å; L66-I70 HydrophobicContact CG-CD1 3.8Å; L66-I70 HydrophobicContact CG-CG1 4.41Å; L66-I70 WeakPolarHBondContact O-CG1 3.29Å; L66-I70 PolarHBondContact O-N 3.39Å; Y67-I70 PolarHBondContact O-N 3.5Å; I70-T72 VanDerWaalsContact C-N 3.33Å; I70-T72 PolarHBondContact O-N 2.87Å; I70-F73 PolarHBondContact O-N 3.38Å; I70-R74 WeakPolarHBondContact O-CB 3.38Å; I70-R74 PolarHBondContact O-N 3.46Å; I70-L133 HydrophobicContact CD1-CD2 3.76Å; I70-L133 HydrophobicContact CD1-CG 4.03Å; I70-Q134 HydrophobicContact CG2-CB 4.1Å; I70-I137 HydrophobicContact CD1-CD1 3.29Å
71	K	89.5	Confident	88.7	Confident	44 Å²	44	57.5 Å²	57.5	19%	0.191	27%	0.273	C	S	.	.	H	α-helix	trans	-55.7	-49	174.9	-173.2	-168	-59.7	165.7	0	110.9	Y67 E68 G69 R74 E75	Y67-K71 WeakPolarHBondContact O-CB 3.43Å; Y67-K71 PolarHBondContact O-N 3.24Å; E68-K71 IonicContact OE1-NZ 3.09Å; E68-K71 PolarHBondContact OE1-NZ 3.37Å; E68-K71 WeakPolarHBondContact OE2-CE 3.45Å; E68-K71 IonicContact OE2-NZ 3.16Å; E68-K71 PolarHBondContact OE2-NZ 3.42Å; G69-K71 VanDerWaalsContact C-N 3.32Å; G69-K71 PolarHBondContact O-N 2.87Å; K71-R74 PolarHBondContact O-N 3.48Å; K71-E75 WeakPolarHBondContact O-CG 3.49Å; K71-E75 PolarHBondContact O-N 2.97Å; K71-E75 VanDerWaalsContact O-N 3.08Å
72	T	87.6	Confident	87.6	Confident	10 Å²	10	59 Å²	59	6%	0.061	28%	0.281	C	S	.	.	H	α-helix	trans	-65.5	-40	179	-59.9	0	0	0	0	112.8	E68 G69 I70 E75 S76 F167 R171	E68-T72 WeakPolarHBondContact O-CB 3.04Å; E68-T72 PolarHBondContact O-N 3.27Å; E68-T72 PolarHBondContact O-OG1 3.32Å; G69-T72 PolarHBondContact O-N 2.95Å; I70-T72 VanDerWaalsContact C-N 3.33Å; I70-T72 PolarHBondContact O-N 2.87Å; T72-E75 PolarHBondContact O-N 2.85Å; T72-S76 WeakPolarHBondContact O-CB 3.34Å; T72-S76 PolarHBondContact O-N 2.93Å; T72-S76 PolarHBondContact O-OG 3.38Å; T72-F167 HydrophobicContact CG2-CB 4.08Å; T72-F167 HydrophobicContact CG2-CD1 4.24Å; T72-F167 WeakPolarHBondContact OG1-CB 3.43Å; T72-R171 HydrophobicContact CG2-CG 4.23Å; T72-R171 PolarHBondContact OG1-NH2 3.07Å
73	F	86.8	Confident	86.6	Confident	106 Å²	106	57.9 Å²	57.9	47%	0.465	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-44.5	176.1	-177.8	-108.7	0	0	0	111.7	G69 I70 E75 S76 L77 M130	G69-F73 WeakPolarHBondContact O-CB 3.39Å; G69-F73 PolarHBondContact O-N 3.05Å; I70-F73 PolarHBondContact O-N 3.38Å; F73-E75 PolarHBondContact O-N 3.37Å; F73-S76 WeakPolarHBondContact O-CB 3.46Å; F73-S76 PolarHBondContact O-N 2.92Å; F73-S76 VanDerWaalsContact O-N 3.07Å; F73-L77 HydrophobicContact CD1-CD1 4.03Å; F73-L77 HydrophobicContact CD1-CG 4.41Å; F73-L77 HydrophobicContact CE1-CD1 3.45Å; F73-L77 VanDerWaalsContact CE1-CD1 3.45Å; F73-L77 HydrophobicContact CE1-CG 4.02Å; F73-L77 HydrophobicContact CE2-CD2 4.46Å; F73-L77 HydrophobicContact CE2-CG 4.45Å; F73-L77 HydrophobicContact CZ-CD1 3.84Å; F73-L77 HydrophobicContact CZ-CD2 4.1Å; F73-L77 HydrophobicContact CZ-CG 4.04Å; F73-L77 PolarHBondContact O-N 3.42Å; F73-M130 HydrophobicContact CD1-CG 4.37Å; F73-M130 HydrophobicContact CD1-SD 3.99Å; F73-M130 HydrophobicContact CE1-CG 4.34Å; F73-M130 HydrophobicContact CE1-SD 4.07Å
74	R	87.3	Confident	85.4	Confident	61 Å²	61	60.2 Å²	60.2	23%	0.23	30%	0.3	C	S	.	.	H	α-helix	trans	-59.2	-46.1	176.9	-172	-175.4	72.6	177.8	3.2	111.8	I70 K71 S76 L77 F78 H131 Q134	I70-R74 WeakPolarHBondContact O-CB 3.38Å; I70-R74 PolarHBondContact O-N 3.46Å; K71-R74 PolarHBondContact O-N 3.48Å; R74-S76 VanDerWaalsContact C-N 3.26Å; R74-S76 PolarHBondContact O-N 3.08Å; R74-L77 PolarHBondContact O-N 3.26Å; R74-F78 PolarHBondContact O-N 3.09Å; R74-H131 PolarHBondContact NH1-ND1 3.35Å; R74-Q134 VanDerWaalsContact NE-OE1 3.11Å; R74-Q134 VanDerWaalsContact NH1-CD 3.27Å
75	E	85	Confident	84.1	Confident	54 Å²	54	63.3 Å²	63.3	25%	0.252	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-37.2	174.8	-72.6	176.8	-141.5	0	0	112.2	K71 T72 F73 F78 R79 R171	K71-E75 WeakPolarHBondContact O-CG 3.49Å; K71-E75 PolarHBondContact O-N 2.97Å; K71-E75 VanDerWaalsContact O-N 3.08Å; T72-E75 PolarHBondContact O-N 2.85Å; F73-E75 PolarHBondContact O-N 3.37Å; E75-F78 PolarHBondContact O-N 2.79Å; E75-R79 WeakPolarHBondContact O-CB 3.29Å; E75-R79 WeakPolarHBondContact O-CG 3.29Å; E75-R79 PolarHBondContact O-N 2.89Å; E75-R79 IonicContact OE2-CZ 2.8Å; E75-R79 IonicContact OE2-NH1 2.94Å; E75-R79 PolarHBondContact OE2-NH1 2.93Å; E75-R79 IonicContact OE2-NH2 2.65Å; E75-R171 IonicContact OE1-CZ 3.31Å; E75-R171 IonicContact OE1-NH1 3.97Å; E75-R171 PolarHBondContact OE1-NH1 3.43Å; E75-R171 IonicContact OE1-NH2 2.78Å; E75-R171 PolarHBondContact OE1-NH2 3.28Å; E75-R171 IonicContact OE2-CZ 3.64Å; E75-R171 IonicContact OE2-NH1 3.47Å; E75-R171 PolarHBondContact OE2-NH1 3.46Å; E75-R171 IonicContact OE2-NH2 2.89Å; E75-R171 PolarHBondContact OE2-NH2 3.18Å; E75-R171 VanDerWaalsContact OE2-NH2 3.09Å
76	S	83.4	Confident	82.6	Confident	40 Å²	40	65.3 Å²	65.3	28%	0.28	34%	0.341	S	S	.	.	H	α-helix	trans	-69.8	-38.5	-179.6	-55.9	0	0	0	0	111.8	T72 F73 R74 R79 R80	T72-S76 WeakPolarHBondContact O-CB 3.34Å; T72-S76 PolarHBondContact O-N 2.93Å; T72-S76 PolarHBondContact O-OG 3.38Å; F73-S76 WeakPolarHBondContact O-CB 3.46Å; F73-S76 PolarHBondContact O-N 2.92Å; F73-S76 VanDerWaalsContact O-N 3.07Å; R74-S76 VanDerWaalsContact C-N 3.26Å; R74-S76 PolarHBondContact O-N 3.08Å; S76-R79 PolarHBondContact OG-NH2 3.05Å; S76-R80 WeakPolarHBondContact O-CG 3.34Å; S76-R80 PolarHBondContact O-N 3.47Å
77	L	81.7	Confident	80.9	Confident	45 Å²	45	65 Å²	65	24%	0.236	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-41	170.8	-68.8	-177	0	0	0	111.8	F73 R74 R80 S81 I126	F73-L77 HydrophobicContact CD1-CD1 4.03Å; F73-L77 HydrophobicContact CD1-CG 4.41Å; F73-L77 HydrophobicContact CE1-CD1 3.45Å; F73-L77 VanDerWaalsContact CE1-CD1 3.45Å; F73-L77 HydrophobicContact CE1-CG 4.02Å; F73-L77 HydrophobicContact CE2-CD2 4.46Å; F73-L77 HydrophobicContact CE2-CG 4.45Å; F73-L77 HydrophobicContact CZ-CD1 3.84Å; F73-L77 HydrophobicContact CZ-CD2 4.1Å; F73-L77 HydrophobicContact CZ-CG 4.04Å; F73-L77 PolarHBondContact O-N 3.42Å; R74-L77 PolarHBondContact O-N 3.26Å; L77-R80 PolarHBondContact O-N 3Å; L77-S81 PolarHBondContact O-N 2.86Å; L77-I126 HydrophobicContact CD1-CG2 4.08Å
78	F	82.1	Confident	79.3	Confident	102 Å²	102	66.4 Å²	66.4	45%	0.447	37%	0.367	S	S	.	.	H	α-helix	trans	-63.5	-46	177	-174.2	-111.7	0	0	0	111.5	R74 E75 R80 S81 I82	R74-F78 PolarHBondContact O-N 3.09Å; E75-F78 PolarHBondContact O-N 2.79Å; F78-R80 VanDerWaalsContact C-N 3.33Å; F78-R80 PolarHBondContact O-N 3.05Å; F78-S81 PolarHBondContact O-N 3.43Å; F78-S81 VanDerWaalsContact O-N 3.12Å; F78-S81 PolarHBondContact O-OG 3.48Å; F78-I82 HydrophobicContact CD1-CD1 3.76Å; F78-I82 HydrophobicContact CE1-CD1 3.3Å; F78-I82 HydrophobicContact CE1-CG1 4.38Å; F78-I82 HydrophobicContact CE2-CD1 4.26Å; F78-I82 HydrophobicContact CG-CD1 4.42Å; F78-I82 HydrophobicContact CZ-CD1 3.59Å; F78-I82 HydrophobicContact CZ-CG1 4.34Å; F78-I82 PolarHBondContact O-N 3.34Å
79	R	80.3	Confident	77.5	Confident	107 Å²	107	69.5 Å²	69.5	40%	0.404	39%	0.391	S	S	.	.	H	α-helix	trans	-56.8	-45.2	173.3	-76.3	-174.1	-76.6	-96.1	-1.1	111.8	E75 S76 S81 I82 C83	E75-R79 WeakPolarHBondContact O-CB 3.29Å; E75-R79 WeakPolarHBondContact O-CG 3.29Å; E75-R79 PolarHBondContact O-N 2.89Å; E75-R79 IonicContact OE2-CZ 2.8Å; E75-R79 IonicContact OE2-NH1 2.94Å; E75-R79 PolarHBondContact OE2-NH1 2.93Å; E75-R79 IonicContact OE2-NH2 2.65Å; S76-R79 PolarHBondContact OG-NH2 3.05Å; R79-S81 VanDerWaalsContact C-N 3.35Å; R79-S81 PolarHBondContact O-N 3.01Å; R79-I82 PolarHBondContact O-N 3.47Å; R79-C83 PolarHBondContact O-N 3.48Å; R79-C83 PolarHBondContact O-SG 2.76Å; R79-C83 VanDerWaalsContact O-SG 3.38Å
80	R	79.2	Confident	76	Confident	181 Å²	181	74.2 Å²	74.2	68%	0.683	42%	0.418	S	S	*	.	H	α-helix	trans	-60	-43	174.9	-75	176.1	174.4	-164.2	-2.3	112.1	S76 L77 F78 I82 C83 S84	S76-R80 WeakPolarHBondContact O-CG 3.34Å; S76-R80 PolarHBondContact O-N 3.47Å; L77-R80 PolarHBondContact O-N 3Å; F78-R80 VanDerWaalsContact C-N 3.33Å; F78-R80 PolarHBondContact O-N 3.05Å; R80-I82 VanDerWaalsContact C-N 3.33Å; R80-I82 PolarHBondContact O-N 2.93Å; R80-C83 PolarHBondContact O-N 2.88Å; R80-S84 WeakPolarHBondContact O-CB 3.43Å; R80-S84 PolarHBondContact O-N 3.36Å; R80-S84 PolarHBondContact O-OG 2.88Å
81	S	77.2	Confident	74.2	Confident	58 Å²	58	78.5 Å²	78.5	41%	0.406	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-35.7	178.9	72.9	0	0	0	0	113.2	L77 F78 R79 A85	L77-S81 PolarHBondContact O-N 2.86Å; F78-S81 PolarHBondContact O-N 3.43Å; F78-S81 VanDerWaalsContact O-N 3.12Å; F78-S81 PolarHBondContact O-OG 3.48Å; R79-S81 VanDerWaalsContact C-N 3.35Å; R79-S81 PolarHBondContact O-N 3.01Å; S81-A85 PolarHBondContact O-N 3.5Å
82	I	72.9	Confident	72.2	Confident	84 Å²	84	87.5 Å²	87.5	43%	0.431	48%	0.482	S	S	.	.	H	α-helix	trans	-72.9	-48.7	175.8	-64.8	170.3	0	0	0	110.8	F78 R79 R80 S84 A85 S86	F78-I82 HydrophobicContact CD1-CD1 3.76Å; F78-I82 HydrophobicContact CE1-CD1 3.3Å; F78-I82 HydrophobicContact CE1-CG1 4.38Å; F78-I82 HydrophobicContact CE2-CD1 4.26Å; F78-I82 HydrophobicContact CG-CD1 4.42Å; F78-I82 HydrophobicContact CZ-CD1 3.59Å; F78-I82 HydrophobicContact CZ-CG1 4.34Å; F78-I82 PolarHBondContact O-N 3.34Å; R79-I82 PolarHBondContact O-N 3.47Å; R80-I82 VanDerWaalsContact C-N 3.33Å; R80-I82 PolarHBondContact O-N 2.93Å; I82-S84 VanDerWaalsContact C-N 3.33Å; I82-S84 PolarHBondContact O-N 2.88Å; I82-A85 WeakPolarHBondContact O-CB 3.4Å; I82-A85 PolarHBondContact O-N 3.2Å; I82-A85 VanDerWaalsContact O-N 3.08Å; I82-S86 PolarHBondContact O-N 2.99Å; I82-S86 VanDerWaalsContact O-N 3.09Å; I82-S86 PolarHBondContact O-OG 3.26Å
83	C	75.3	Confident	70.3	Confident	78 Å²	78	95.6 Å²	95.6	53%	0.527	52%	0.519	S	S	.	.	H	α-helix	trans	-61.5	-40.4	180	-68.5	0	0	0	0	112.2	R79 R80 A85 S86 S87	R79-C83 PolarHBondContact O-N 3.48Å; R79-C83 PolarHBondContact O-SG 2.76Å; R79-C83 VanDerWaalsContact O-SG 3.38Å; R80-C83 PolarHBondContact O-N 2.88Å; C83-A85 PolarHBondContact O-N 3.16Å; C83-S86 PolarHBondContact O-N 3.02Å; C83-S87 PolarHBondContact O-N 3.13Å; C83-S87 PolarHBondContact O-OG 2.9Å
84	S	68.8	Low	68.2	Low	86 Å²	86	94.9 Å²	94.9	60%	0.601	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-29.5	175.5	-63.7	0	0	0	0	113.1	R80 I82	R80-S84 WeakPolarHBondContact O-CB 3.43Å; R80-S84 PolarHBondContact O-N 3.36Å; R80-S84 PolarHBondContact O-OG 2.88Å; I82-S84 VanDerWaalsContact C-N 3.33Å; I82-S84 PolarHBondContact O-N 2.88Å
85	A	68.3	Low	65.8	Low	67 Å²	67	97.9 Å²	97.9	55%	0.554	56%	0.562	S	S	*	*	H	α-helix	trans	-73.5	-39.8	173.5	0	0	0	0	0	111.9	S81 I82 C83 A88	S81-A85 PolarHBondContact O-N 3.5Å; I82-A85 WeakPolarHBondContact O-CB 3.4Å; I82-A85 PolarHBondContact O-N 3.2Å; I82-A85 VanDerWaalsContact O-N 3.08Å; C83-A85 PolarHBondContact O-N 3.16Å; A85-A88 PolarHBondContact O-N 3.06Å
86	S	64.7	Low	63.9	Low	67 Å²	67	101.4 Å²	101.4	47%	0.469	59%	0.589	S	S	.	*	H	α-helix	trans	-71.2	-36.5	179.5	-60.6	0	0	0	0	113.8	I82 C83 A88 S89	I82-S86 PolarHBondContact O-N 2.99Å; I82-S86 VanDerWaalsContact O-N 3.09Å; I82-S86 PolarHBondContact O-OG 3.26Å; C83-S86 PolarHBondContact O-N 3.02Å; S86-A88 VanDerWaalsContact C-N 3.28Å; S86-A88 PolarHBondContact O-N 3.33Å; S86-S89 PolarHBondContact O-N 2.92Å; S86-S89 PolarHBondContact O-OG 2.97Å
87	S	59.5	Low	62	Low	85 Å²	85	105 Å²	105	59%	0.594	62%	0.615	S	S	*	*	H	α-helix	trans	-67.1	-28.4	176.9	-60.4	0	0	0	0	112.8	C83 S89 V90	C83-S87 PolarHBondContact O-N 3.13Å; C83-S87 PolarHBondContact O-OG 2.9Å; S87-S89 VanDerWaalsContact C-N 3.27Å; S87-S89 PolarHBondContact O-N 2.77Å; S87-V90 PolarHBondContact O-N 2.81Å
88	A	59.5	Low	60.1	Low	73 Å²	73	111.4 Å²	111.4	60%	0.603	64%	0.643	S	S	*	*	H	α-helix	trans	-67.3	-26	176.8	0	0	0	0	0	113.1	A85 S86	A85-A88 PolarHBondContact O-N 3.06Å; S86-A88 VanDerWaalsContact C-N 3.28Å; S86-A88 PolarHBondContact O-N 3.33Å
89	S	55.8	Low	58.2	Low	87 Å²	87	112.5 Å²	112.5	61%	0.608	66%	0.658	S	S	*	*	H	α-helix	trans	-82	-29.3	175.7	37.6	0	0	0	0	114.5	S86 S87	S86-S89 PolarHBondContact O-N 2.92Å; S86-S89 PolarHBondContact O-OG 2.97Å; S87-S89 VanDerWaalsContact C-N 3.27Å; S87-S89 PolarHBondContact O-N 2.77Å
90	V	59.1	Low	56.2	Low	107 Å²	107	114.2 Å²	114.2	65%	0.648	68%	0.676	S	S	*	*	H	α-helix	trans	-82.8	-30.2	-173.2	176.1	0	0	0	0	112.8	S87 R92 Q93	S87-V90 PolarHBondContact O-N 2.81Å; V90-R92 PolarHBondContact O-N 3.4Å; V90-Q93 PolarHBondContact O-N 3.29Å
91	S	53.9	Low	54.5	Low	107 Å²	107	111.3 Å²	111.3	75%	0.748	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	2.9	-175.5	-154.9	0	0	0	0	115.4
92	R	47.6	Very low	52.7	Low	233 Å²	233	115.3 Å²	115.3	88%	0.879	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-0.6	174.7	-70.6	-167.4	-173.6	-171.8	2.3	114.7	V90	V90-R92 PolarHBondContact O-N 3.4Å
93	Q	47.6	Very low	51.2	Low	180 Å²	180	117.5 Å²	117.5	84%	0.841	72%	0.722	S	S	*	*			trans	-105.2	59.1	176.7	-150.1	161.2	18.4	0	0	110.5	V90	V90-Q93 PolarHBondContact O-N 3.29Å
94	A	43.3	Very low	49.6	Very low	91 Å²	91	122.6 Å²	122.6	75%	0.752	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-83.9	118.8	164.4	0	0	0	0	0	108.1
95	C	36.8	Very low	48.5	Very low	124 Å²	124	124.1 Å²	124.1	84%	0.838	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-47.2	132.9	-174	-62.2	0	0	0	0	114.3
96	P	45.1	Very low	47	Very low	127 Å²	127	124.4 Å²	124.4	83%	0.825	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-79	124	156	30.4	-24.7	0	0	0	108.5
97	S	43.4	Very low	46	Very low	116 Å²	116	127.3 Å²	127.3	81%	0.811	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-58.8	148.3	168.8	-136.7	0	0	0	0	110.1
98	Q	41.2	Very low	45	Very low	180 Å²	180	132.9 Å²	132.9	84%	0.841	79%	0.792	S	S	*	*			trans	-36.6	138.2	178.7	-63.6	163.4	48.8	0	0	114
99	T	42.5	Very low	44.2	Very low	124 Å²	124	133.8 Å²	133.8	76%	0.761	79%	0.794	S	S	*	*				164.4	112.3	128.8	-73.2	0	0	0	0	110.3
100	D	38.2	Very low	43.8	Very low	144 Å²	144	133 Å²	133	77%	0.77	79%	0.793	S	S	*	*			trans	36	111.4	143.9	-53.8	-39.4	0	0	0	120
101	S	44	Very low	43.4	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	80%	0.803	S	S	*	*				168.1	134.6	118	43.9	0	0	0	0	112.7	T103	S101-T103 PolarHBondContact O-N 3.36Å
102	V	40.2	Very low	42.6	Very low	141 Å²	141	141.9 Å²	141.9	86%	0.855	81%	0.805	S	S	*	*			trans	-58.6	120.7	175.2	174.6	0	0	0	0	110.6
103	T	39.8	Very low	42.7	Very low	131 Å²	131	134.8 Å²	134.8	80%	0.804	79%	0.787	S	S	*	*			trans	-158.4	113.2	147.1	-58.8	0	0	0	0	110.2	S101 S105	S101-T103 PolarHBondContact O-N 3.36Å; T103-S105 PolarHBondContact O-N 3.32Å
104	Q	42.5	Very low	42.5	Very low	185 Å²	185	130.8 Å²	130.8	86%	0.864	78%	0.775	S	S	*	*			trans	-54.2	122.4	159.2	-77.9	169.3	-27	0	0	110.4
105	S	45.3	Very low	42.7	Very low	118 Å²	118	134.7 Å²	134.7	83%	0.825	77%	0.772	S	S	*	*			trans	-174.9	142	143.1	-96.9	0	0	0	0	110.8	T103	T103-S105 PolarHBondContact O-N 3.32Å
106	G	36.8	Very low	42.9	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	77%	0.772	S	S	*	*			trans	-59.8	145.2	-164.1	0	0	0	0	0	114.7
107	V	43.8	Very low	43.1	Very low	127 Å²	127	140.2 Å²	140.2	77%	0.77	77%	0.768	S	S	*	*			trans	-147.4	78.7	146.1	-102.5	0	0	0	0	106.8	S109	V107-S109 PolarHBondContact O-N 2.96Å
108	M	39.4	Very low	43.6	Very low	203 Å²	203	142.9 Å²	142.9	100%	1	77%	0.765	S	S	*	*			trans	-65.5	64.8	148.2	-158	169.4	76.3	0	0	106.5	A110	M108-A110 PolarHBondContact O-N 2.95Å
109	S	42.7	Very low	44.3	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	76%	0.76	S	S	*	*			trans	-97.3	95.3	-171.1	-164.7	0	0	0	0	108.9	V107 Y111	V107-S109 PolarHBondContact O-N 2.96Å; S109-Y111 PolarHBondContact O-N 3.24Å
110	A	46.9	Very low	45.1	Very low	72 Å²	72	139 Å²	139	60%	0.595	76%	0.756	S	S	*	*			trans	42.9	82.2	140.8	0	0	0	0	0	115.6	M108 K112	M108-A110 PolarHBondContact O-N 2.95Å; A110-K112 PolarHBondContact O-N 3.16Å
111	Y	49.7	Very low	46.7	Very low	220 Å²	220	135 Å²	135	86%	0.863	74%	0.739	S	S	*	*			trans	-66.7	59.5	147.6	56.6	-86.2	0	0	0	109.2	S109 V113	S109-Y111 PolarHBondContact O-N 3.24Å; Y111-V113 PolarHBondContact O-N 3.46Å
112	K	38.7	Very low	48.2	Very low	179 Å²	179	134.3 Å²	134.3	78%	0.778	73%	0.729	S	S	*	*			trans	-71.8	73.4	159.3	-108	-172.8	177.8	179.1	0	106.4	A110 T114	A110-K112 PolarHBondContact O-N 3.16Å; K112-T114 PolarHBondContact O-N 2.98Å
113	V	48.9	Very low	50	Low	84 Å²	84	129.7 Å²	129.7	51%	0.509	71%	0.711	S	S	.	*			trans	-63.5	88.9	152.7	-178.6	0	0	0	0	103.4	Y111 Y115	Y111-V113 PolarHBondContact O-N 3.46Å; V113-Y115 HydrophobicContact CB-CD2 4.43Å; V113-Y115 HydrophobicContact CB-CE1 4.27Å; V113-Y115 HydrophobicContact CB-CE2 3.91Å; V113-Y115 HydrophobicContact CG1-CD1 3.76Å; V113-Y115 HydrophobicContact CG1-CD2 4.19Å; V113-Y115 HydrophobicContact CG1-CE1 3.49Å; V113-Y115 VanDerWaalsContact CG1-CE1 3.49Å; V113-Y115 HydrophobicContact CG1-CE2 3.93Å; V113-Y115 HydrophobicContact CG1-CG 4.08Å; V113-Y115 WeakPolarHBondContact O-CD2 3.28Å; V113-Y115 WeakPolarHBondContact O-CE2 3.4Å; V113-Y115 PolarHBondContact O-N 2.99Å
114	T	43.9	Very low	51.9	Low	96 Å²	96	129.1 Å²	129.1	59%	0.589	70%	0.699	S	S	*	*			trans	-71	86.6	170.2	-52.5	0	0	0	0	103.5	K112 R116	K112-T114 PolarHBondContact O-N 2.98Å; T114-R116 PolarHBondContact O-N 2.65Å
115	Y	46.1	Very low	53.8	Low	173 Å²	173	122.4 Å²	122.4	68%	0.678	67%	0.674	S	S	*	*			trans	-57	91.7	160.7	-46.5	-91	0	0	0	104.4	V113 L117	V113-Y115 HydrophobicContact CB-CD2 4.43Å; V113-Y115 HydrophobicContact CB-CE1 4.27Å; V113-Y115 HydrophobicContact CB-CE2 3.91Å; V113-Y115 HydrophobicContact CG1-CD1 3.76Å; V113-Y115 HydrophobicContact CG1-CD2 4.19Å; V113-Y115 HydrophobicContact CG1-CE1 3.49Å; V113-Y115 VanDerWaalsContact CG1-CE1 3.49Å; V113-Y115 HydrophobicContact CG1-CE2 3.93Å; V113-Y115 HydrophobicContact CG1-CG 4.08Å; V113-Y115 WeakPolarHBondContact O-CD2 3.28Å; V113-Y115 WeakPolarHBondContact O-CE2 3.4Å; V113-Y115 PolarHBondContact O-N 2.99Å; Y115-L117 VanDerWaalsContact CB-CD1 3.43Å; Y115-L117 HydrophobicContact CG-CD1 4.46Å; Y115-L117 WeakPolarHBondContact O-CD1 3.48Å; Y115-L117 PolarHBondContact O-N 2.8Å
116	R	40.9	Very low	55.8	Low	225 Å²	225	120.6 Å²	120.6	85%	0.849	66%	0.655	S	S	*	*			trans	-61.9	83.2	153.3	-74.6	-78.3	-149.5	-138.1	1.3	103.6	T114 K118	T114-R116 PolarHBondContact O-N 2.65Å; R116-K118 PolarHBondContact O-N 3.07Å
117	L	50.5	Low	58.1	Low	142 Å²	142	119.8 Å²	119.8	74%	0.743	63%	0.631	S	S	*	*			trans	-53.7	91.5	161.6	-92.5	70.5	0	0	0	104.1	Y115 P119	Y115-L117 VanDerWaalsContact CB-CD1 3.43Å; Y115-L117 HydrophobicContact CG-CD1 4.46Å; Y115-L117 WeakPolarHBondContact O-CD1 3.48Å; Y115-L117 PolarHBondContact O-N 2.8Å; L117-P119 VanDerWaalsContact C-N 3.32Å; L117-P119 WeakPolarHBondContact O-CD 3.41Å
118	K	53.2	Low	60.2	Low	172 Å²	172	117.1 Å²	117.1	75%	0.748	62%	0.619	S	S	*	*			trans	-65.1	106.7	145.9	-91.7	177.4	170.2	-179.7	0	103	R116 V120	R116-K118 PolarHBondContact O-N 3.07Å; K118-V120 PolarHBondContact O-N 3.41Å
119	P	55.5	Low	62.6	Low	114 Å²	114	110 Å²	110	74%	0.74	59%	0.591	S	S	*	*	S	Bend	trans	-61.4	114.4	178.5	28.5	-31.5	0	0	0	105.1	L117	L117-P119 VanDerWaalsContact C-N 3.32Å; L117-P119 WeakPolarHBondContact O-CD 3.41Å
120	V	60.2	Low	64.7	Low	109 Å²	109	107.9 Å²	107.9	66%	0.661	57%	0.572	S	S	*	*	S	Bend	trans	69.2	78.6	-173.4	-162	0	0	0	0	113.9	K118 A125	K118-V120 PolarHBondContact O-N 3.41Å; V120-A125 HydrophobicContact CG1-CB 3.9Å
121	S	71.7	Confident	66.8	Low	59 Å²	59	108.3 Å²	108.3	41%	0.413	56%	0.562	S	S	.	*			trans	-60.8	140.8	157.9	-178.3	0	0	0	0	109.3	G123 H124 A125	S121-G123 PolarHBondContact O-N 3.3Å; S121-H124 WeakPolarHBondContact O-CA 3.41Å; S121-H124 WeakPolarHBondContact O-CB 3.32Å; S121-H124 PolarHBondContact O-N 3.31Å; S121-A125 PolarHBondContact O-N 3.49Å; S121-A125 VanDerWaalsContact O-N 3.15Å
122	V	75.2	Confident	68.8	Low	106 Å²	106	103.9 Å²	103.9	64%	0.642	55%	0.551	S	S	*	*	H	α-helix	trans	-50.4	-32.8	176.8	176.9	0	0	0	0	111.5	H124 A125 I126	V122-H124 PolarHBondContact O-N 2.93Å; V122-A125 PolarHBondContact O-N 2.86Å; V122-I126 HydrophobicContact CG1-CD1 3.77Å; V122-I126 HydrophobicContact CG1-CG1 4.24Å; V122-I126 VanDerWaalsContact O-CG1 3.31Å; V122-I126 WeakPolarHBondContact O-CG1 3.42Å; V122-I126 PolarHBondContact O-N 3.43Å
123	G	77.5	Confident	71.3	Confident	45 Å²	45	98.5 Å²	98.5	46%	0.464	53%	0.53	S	S	.	.	H	α-helix	trans	-61	-41.7	174.3	0	0	0	0	0	113.8	S121 Q127	S121-G123 PolarHBondContact O-N 3.3Å; G123-Q127 WeakPolarHBondContact O-CB 3.46Å; G123-Q127 PolarHBondContact O-N 3.49Å
124	H	79.6	Confident	73.4	Confident	119 Å²	119	95.2 Å²	95.2	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-69.7	-39.6	174.4	-74.9	-69	0	0	0	111.5	S121 V122 I126 Q127 S128	S121-H124 WeakPolarHBondContact O-CA 3.41Å; S121-H124 WeakPolarHBondContact O-CB 3.32Å; S121-H124 PolarHBondContact O-N 3.31Å; V122-H124 PolarHBondContact O-N 2.93Å; H124-I126 PolarHBondContact O-N 2.94Å; H124-Q127 PolarHBondContact O-N 2.83Å; H124-S128 WeakPolarHBondContact O-CB 3.41Å; H124-S128 PolarHBondContact O-N 3.4Å; H124-S128 PolarHBondContact O-OG 3.2Å
125	A	84.3	Confident	75.8	Confident	43 Å²	43	93.5 Å²	93.5	36%	0.355	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-45.3	176.2	0	0	0	0	0	112	V120 S121 V122 S128 A129	V120-A125 HydrophobicContact CG1-CB 3.9Å; S121-A125 PolarHBondContact O-N 3.49Å; S121-A125 VanDerWaalsContact O-N 3.15Å; V122-A125 PolarHBondContact O-N 2.86Å; A125-S128 PolarHBondContact O-N 3.42Å; A125-A129 WeakPolarHBondContact O-CB 3.31Å; A125-A129 PolarHBondContact O-N 2.89Å
126	I	85.7	Confident	78.1	Confident	81 Å²	81	90.1 Å²	90.1	42%	0.415	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.5	-67.9	168.6	0	0	0	110.6	L77 V122 H124 S128 A129 M130	L77-I126 HydrophobicContact CD1-CG2 4.08Å; V122-I126 HydrophobicContact CG1-CD1 3.77Å; V122-I126 HydrophobicContact CG1-CG1 4.24Å; V122-I126 VanDerWaalsContact O-CG1 3.31Å; V122-I126 WeakPolarHBondContact O-CG1 3.42Å; V122-I126 PolarHBondContact O-N 3.43Å; H124-I126 PolarHBondContact O-N 2.94Å; I126-S128 PolarHBondContact O-N 3.34Å; I126-A129 PolarHBondContact O-N 2.83Å; I126-M130 HydrophobicContact CG2-CG 4.4Å; I126-M130 WeakPolarHBondContact O-CB 3.2Å; I126-M130 VanDerWaalsContact O-CG 3.28Å; I126-M130 WeakPolarHBondContact O-CG 3.24Å; I126-M130 PolarHBondContact O-N 3.45Å
127	Q	85.3	Confident	80.6	Confident	55 Å²	55	79.8 Å²	79.8	26%	0.257	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-45.7	177.6	-176.6	-178.4	-4.9	0	0	111.9	G123 H124 M130 H131	G123-Q127 WeakPolarHBondContact O-CB 3.46Å; G123-Q127 PolarHBondContact O-N 3.49Å; H124-Q127 PolarHBondContact O-N 2.83Å; Q127-M130 PolarHBondContact O-N 3.48Å; Q127-H131 PolarHBondContact O-N 2.88Å
128	S	87.9	Confident	82.7	Confident	72 Å²	72	75.1 Å²	75.1	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-64.7	-42.9	176.3	-65	0	0	0	0	111.9	H124 A125 I126 M130 H131 M132	H124-S128 WeakPolarHBondContact O-CB 3.41Å; H124-S128 PolarHBondContact O-N 3.4Å; H124-S128 PolarHBondContact O-OG 3.2Å; A125-S128 PolarHBondContact O-N 3.42Å; I126-S128 PolarHBondContact O-N 3.34Å; S128-M130 PolarHBondContact O-N 2.9Å; S128-H131 WeakPolarHBondContact O-CB 3.37Å; S128-H131 PolarHBondContact O-N 2.97Å; S128-H131 VanDerWaalsContact O-N 3.14Å; S128-M132 WeakPolarHBondContact O-CG 3.37Å; S128-M132 PolarHBondContact O-N 3Å
129	A	89.3	Confident	84.7	Confident	52 Å²	52	73.7 Å²	73.7	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-43.2	177.2	0	0	0	0	0	112.1	A125 I126 H131 M132 L133	A125-A129 WeakPolarHBondContact O-CB 3.31Å; A125-A129 PolarHBondContact O-N 2.89Å; I126-A129 PolarHBondContact O-N 2.83Å; A129-H131 VanDerWaalsContact C-N 3.3Å; A129-H131 PolarHBondContact O-N 3.31Å; A129-M132 PolarHBondContact O-N 2.78Å; A129-L133 PolarHBondContact O-N 3.32Å
130	M	88.1	Confident	86.4	Confident	47 Å²	47	70.4 Å²	70.4	23%	0.232	40%	0.397	C	S	.	.	H	α-helix	trans	-63.4	-36.2	174	-69.7	-65.3	102.8	0	0	112.1	F73 I126 Q127 S128 L133 Q134	F73-M130 HydrophobicContact CD1-CG 4.37Å; F73-M130 HydrophobicContact CD1-SD 3.99Å; F73-M130 HydrophobicContact CE1-CG 4.34Å; F73-M130 HydrophobicContact CE1-SD 4.07Å; I126-M130 HydrophobicContact CG2-CG 4.4Å; I126-M130 WeakPolarHBondContact O-CB 3.2Å; I126-M130 VanDerWaalsContact O-CG 3.28Å; I126-M130 WeakPolarHBondContact O-CG 3.24Å; I126-M130 PolarHBondContact O-N 3.45Å; Q127-M130 PolarHBondContact O-N 3.48Å; S128-M130 PolarHBondContact O-N 2.9Å; M130-L133 HydrophobicContact CE-CD2 4.32Å; M130-Q134 WeakPolarHBondContact O-CB 3.36Å; M130-Q134 PolarHBondContact O-N 3.21Å
131	H	90.5	Very high	87.9	Confident	82 Å²	82	65.9 Å²	65.9	38%	0.38	37%	0.369	S	S	.	.	H	α-helix	trans	-65.3	-45.9	174.3	-178.8	80.7	0	0	0	112	R74 Q127 S128 A129 L133 Q134 L135	R74-H131 PolarHBondContact NH1-ND1 3.35Å; Q127-H131 PolarHBondContact O-N 2.88Å; S128-H131 WeakPolarHBondContact O-CB 3.37Å; S128-H131 PolarHBondContact O-N 2.97Å; S128-H131 VanDerWaalsContact O-N 3.14Å; A129-H131 VanDerWaalsContact C-N 3.3Å; A129-H131 PolarHBondContact O-N 3.31Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 3.38Å; H131-Q134 PolarHBondContact O-N 3.13Å; H131-L135 WeakPolarHBondContact NE2-CD1 3.16Å; H131-L135 WeakPolarHBondContact O-CG 3.2Å; H131-L135 PolarHBondContact O-N 3.43Å
132	M	91.7	Very high	89	Confident	127 Å²	127	68.4 Å²	68.4	63%	0.626	38%	0.375	S	S	*	.	H	α-helix	trans	-59.7	-43.9	176	-68.5	-60	-68	0	0	111.7	S128 A129 L135 L136	S128-M132 WeakPolarHBondContact O-CG 3.37Å; S128-M132 PolarHBondContact O-N 3Å; A129-M132 PolarHBondContact O-N 2.78Å; M132-L135 PolarHBondContact O-N 3.07Å; M132-L136 PolarHBondContact O-N 3.48Å
133	L	92.4	Very high	89.7	Confident	66 Å²	66	67.7 Å²	67.7	35%	0.346	37%	0.367	S	S	.	.	H	α-helix	trans	-63.6	-41.3	176.7	-178.4	62.1	0	0	0	112	I70 A129 M130 H131 L135 L136 I137	I70-L133 HydrophobicContact CD1-CD2 3.76Å; I70-L133 HydrophobicContact CD1-CG 4.03Å; A129-L133 PolarHBondContact O-N 3.32Å; M130-L133 HydrophobicContact CE-CD2 4.32Å; H131-L133 VanDerWaalsContact C-N 3.34Å; H131-L133 PolarHBondContact O-N 3.38Å; L133-L135 VanDerWaalsContact C-N 3.35Å; L133-L135 PolarHBondContact O-N 3.26Å; L133-L136 HydrophobicContact CD1-CD2 4.41Å; L133-L136 WeakPolarHBondContact O-CB 3.25Å; L133-L136 PolarHBondContact O-N 3.36Å; L133-I137 HydrophobicContact CD1-CD1 4.21Å; L133-I137 HydrophobicContact CD1-CG1 4.5Å; L133-I137 HydrophobicContact CG-CD1 4.13Å; L133-I137 WeakPolarHBondContact O-CG1 3.49Å; L133-I137 PolarHBondContact O-N 3.09Å
134	Q	93	Very high	90.3	Very high	14 Å²	14	65.7 Å²	65.7	7%	0.065	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-43.3	175.2	-178.8	179.7	-24.5	0	0	111.7	Y67 I70 R74 M130 H131 I137 S138	Y67-Q134 HydrophobicContact CD2-CG 4.11Å; Y67-Q134 HydrophobicContact CE2-CG 3.55Å; I70-Q134 HydrophobicContact CG2-CB 4.1Å; R74-Q134 VanDerWaalsContact NE-OE1 3.11Å; R74-Q134 VanDerWaalsContact NH1-CD 3.27Å; M130-Q134 WeakPolarHBondContact O-CB 3.36Å; M130-Q134 PolarHBondContact O-N 3.21Å; H131-Q134 PolarHBondContact O-N 3.13Å; Q134-I137 PolarHBondContact O-N 3.23Å; Q134-S138 WeakPolarHBondContact O-CB 3.33Å; Q134-S138 PolarHBondContact O-N 3.4Å
135	L	93.8	Very high	90.7	Very high	60 Å²	60	62.9 Å²	62.9	31%	0.314	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-46.5	176.5	-73.2	179	0	0	0	110.8	H131 M132 L133 I137 S138 Y139	H131-L135 WeakPolarHBondContact NE2-CD1 3.16Å; H131-L135 WeakPolarHBondContact O-CG 3.2Å; H131-L135 PolarHBondContact O-N 3.43Å; M132-L135 PolarHBondContact O-N 3.07Å; L133-L135 VanDerWaalsContact C-N 3.35Å; L133-L135 PolarHBondContact O-N 3.26Å; L135-I137 VanDerWaalsContact C-N 3.34Å; L135-I137 PolarHBondContact O-N 3.49Å; L135-S138 WeakPolarHBondContact O-CB 3.48Å; L135-S138 PolarHBondContact O-N 3.03Å; L135-Y139 HydrophobicContact CB-CD2 4.39Å; L135-Y139 HydrophobicContact CB-CE2 4.23Å; L135-Y139 HydrophobicContact CD2-CE2 4.42Å; L135-Y139 WeakPolarHBondContact O-CD2 3.48Å; L135-Y139 PolarHBondContact O-N 3.25Å
136	L	94	Very high	90.9	Very high	102 Å²	102	66.4 Å²	66.4	53%	0.534	35%	0.348	S	S	.	.	H	α-helix	trans	-53.4	-51.6	176.9	179.5	66.7	0	0	0	111.2	M132 L133 S138 Y139 L140	M132-L136 PolarHBondContact O-N 3.48Å; L133-L136 HydrophobicContact CD1-CD2 4.41Å; L133-L136 WeakPolarHBondContact O-CB 3.25Å; L133-L136 PolarHBondContact O-N 3.36Å; L136-S138 PolarHBondContact O-N 3.33Å; L136-Y139 PolarHBondContact O-N 3.27Å; L136-L140 HydrophobicContact CG-CD1 4.26Å; L136-L140 VanDerWaalsContact O-CG 3.29Å; L136-L140 WeakPolarHBondContact O-CG 3.44Å; L136-L140 PolarHBondContact O-N 3Å
137	I	93.6	Very high	90.9	Very high	8 Å²	8	63.9 Å²	63.9	4%	0.041	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-39.4	-179.4	-63.3	167	0	0	0	111.4	L63 L66 Y67 I70 L133 Q134 L135 Y139 L140 L141	L63-I137 HydrophobicContact CD1-CG1 4.27Å; L63-I137 HydrophobicContact CD1-CG2 3.87Å; L63-I137 HydrophobicContact CG-CG2 3.96Å; L66-I137 HydrophobicContact CD2-CD1 4.24Å; L66-I137 HydrophobicContact CG-CD1 4.38Å; Y67-I137 HydrophobicContact CD2-CB 4.29Å; Y67-I137 HydrophobicContact CD2-CG2 4.01Å; Y67-I137 HydrophobicContact CG-CG2 4.29Å; I70-I137 HydrophobicContact CD1-CD1 3.29Å; L133-I137 HydrophobicContact CD1-CD1 4.21Å; L133-I137 HydrophobicContact CD1-CG1 4.5Å; L133-I137 HydrophobicContact CG-CD1 4.13Å; L133-I137 WeakPolarHBondContact O-CG1 3.49Å; L133-I137 PolarHBondContact O-N 3.09Å; Q134-I137 PolarHBondContact O-N 3.23Å; L135-I137 VanDerWaalsContact C-N 3.34Å; L135-I137 PolarHBondContact O-N 3.49Å; I137-Y139 VanDerWaalsContact C-N 3.32Å; I137-Y139 PolarHBondContact O-N 2.9Å; I137-L140 PolarHBondContact O-N 3.32Å; I137-L141 HydrophobicContact CG2-CD1 4.03Å; I137-L141 HydrophobicContact CG2-CG 4.32Å; I137-L141 WeakPolarHBondContact O-CG 3.44Å; I137-L141 PolarHBondContact O-N 3.36Å
138	S	94.1	Very high	90.8	Very high	44 Å²	44	64.5 Å²	64.5	31%	0.308	34%	0.338	S	S	.	.	H	α-helix	trans	-59.1	-43.5	175.8	-168.7	0	0	0	0	111.9	Q134 L135 L136 M142	Q134-S138 WeakPolarHBondContact O-CB 3.33Å; Q134-S138 PolarHBondContact O-N 3.4Å; L135-S138 WeakPolarHBondContact O-CB 3.48Å; L135-S138 PolarHBondContact O-N 3.03Å; L136-S138 PolarHBondContact O-N 3.33Å; S138-M142 WeakPolarHBondContact O-CB 3.44Å; S138-M142 PolarHBondContact O-N 2.89Å
139	Y	94.6	Very high	90.7	Very high	143 Å²	143	61.1 Å²	61.1	56%	0.561	32%	0.315	S	S	*	.	H	α-helix	trans	-70.5	-35.8	177.8	-73.4	-63	0	0	0	112.2	L135 L136 I137 M142 L143	L135-Y139 HydrophobicContact CB-CD2 4.39Å; L135-Y139 HydrophobicContact CB-CE2 4.23Å; L135-Y139 HydrophobicContact CD2-CE2 4.42Å; L135-Y139 WeakPolarHBondContact O-CD2 3.48Å; L135-Y139 PolarHBondContact O-N 3.25Å; L136-Y139 PolarHBondContact O-N 3.27Å; I137-Y139 VanDerWaalsContact C-N 3.32Å; I137-Y139 PolarHBondContact O-N 2.9Å; Y139-M142 PolarHBondContact O-N 3.35Å; Y139-L143 WeakPolarHBondContact O-CB 3.23Å; Y139-L143 VanDerWaalsContact O-CG 3.29Å; Y139-L143 WeakPolarHBondContact O-CG 3.21Å; Y139-L143 PolarHBondContact O-N 2.91Å
140	L	92.2	Very high	90.7	Very high	44 Å²	44	60.6 Å²	60.6	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-46.6	173.2	-68.7	173.4	0	0	0	111.8	L41 L63 L136 I137 M142 L143 I144	L41-L140 HydrophobicContact CD1-CD2 4.45Å; L41-L140 HydrophobicContact CD2-CD2 3.41Å; L41-L140 VanDerWaalsContact CD2-CD2 3.41Å; L63-L140 HydrophobicContact CD2-CB 4.3Å; L136-L140 HydrophobicContact CG-CD1 4.26Å; L136-L140 VanDerWaalsContact O-CG 3.29Å; L136-L140 WeakPolarHBondContact O-CG 3.44Å; L136-L140 PolarHBondContact O-N 3Å; I137-L140 PolarHBondContact O-N 3.32Å; L140-M142 VanDerWaalsContact C-N 3.32Å; L140-M142 PolarHBondContact O-N 2.98Å; L140-L143 PolarHBondContact O-N 3.36Å; L140-I144 WeakPolarHBondContact O-CD1 3.26Å; L140-I144 VanDerWaalsContact O-CG1 3.32Å; L140-I144 WeakPolarHBondContact O-CG1 3.49Å; L140-I144 PolarHBondContact O-N 3.46Å
141	L	92.3	Very high	90.8	Very high	14 Å²	14	64.7 Å²	64.7	7%	0.073	32%	0.319	C	S	.	.	H	α-helix	trans	-63.3	-38.9	176.4	-69.3	171.4	0	0	0	111.6	L63 A64 Y67 I137 I144 V145 V156	L63-L141 HydrophobicContact CB-CD2 4.4Å; L63-L141 HydrophobicContact CD2-CD2 4.1Å; L63-L141 HydrophobicContact CD2-CG 4.46Å; L63-L141 HydrophobicContact CG-CD2 4.17Å; A64-L141 HydrophobicContact CB-CD1 4.39Å; A64-L141 HydrophobicContact CB-CD2 4.12Å; Y67-L141 HydrophobicContact CD1-CD1 4.35Å; Y67-L141 HydrophobicContact CG-CD1 4.01Å; I137-L141 HydrophobicContact CG2-CD1 4.03Å; I137-L141 HydrophobicContact CG2-CG 4.32Å; I137-L141 WeakPolarHBondContact O-CG 3.44Å; I137-L141 PolarHBondContact O-N 3.36Å; L141-I144 HydrophobicContact CD2-CD1 4.39Å; L141-I144 PolarHBondContact O-N 3.45Å; L141-V145 WeakPolarHBondContact O-CG2 3.32Å; L141-V145 PolarHBondContact O-N 2.91Å; L141-V156 HydrophobicContact CD2-CG1 4.37Å; L141-V156 HydrophobicContact CD2-CG2 4.13Å
142	M	93.2	Very high	90.7	Very high	112 Å²	112	60.8 Å²	60.8	55%	0.552	30%	0.301	S	S	*	.	H	α-helix	trans	-62.9	-45.4	173.6	-176.7	177.7	178	0	0	111.4	S138 Y139 L140 I144 V145 M146	S138-M142 WeakPolarHBondContact O-CB 3.44Å; S138-M142 PolarHBondContact O-N 2.89Å; Y139-M142 PolarHBondContact O-N 3.35Å; L140-M142 VanDerWaalsContact C-N 3.32Å; L140-M142 PolarHBondContact O-N 2.98Å; M142-I144 VanDerWaalsContact C-N 3.27Å; M142-I144 PolarHBondContact O-N 3.14Å; M142-V145 PolarHBondContact O-N 3.11Å; M142-V145 VanDerWaalsContact O-N 3.16Å; M142-M146 HydrophobicContact CG-CG 4.47Å; M142-M146 WeakPolarHBondContact O-CG 3.26Å; M142-M146 PolarHBondContact O-N 3.25Å
143	L	90.4	Very high	90.7	Very high	91 Å²	91	57.4 Å²	57.4	48%	0.476	28%	0.284	S	S	.	.	H	α-helix	trans	-58.3	-40.3	175.5	-75.3	168.8	0	0	0	111.4	L41 Y139 L140 M146 T147	L41-L143 HydrophobicContact CD1-CB 3.72Å; L41-L143 HydrophobicContact CD1-CD1 3.66Å; L41-L143 HydrophobicContact CD1-CG 4.26Å; Y139-L143 WeakPolarHBondContact O-CB 3.23Å; Y139-L143 VanDerWaalsContact O-CG 3.29Å; Y139-L143 WeakPolarHBondContact O-CG 3.21Å; Y139-L143 PolarHBondContact O-N 2.91Å; L140-L143 PolarHBondContact O-N 3.36Å; L143-M146 PolarHBondContact O-N 3.24Å; L143-T147 WeakPolarHBondContact O-CG2 3.25Å; L143-T147 PolarHBondContact O-N 3.21Å
144	I	90	Very high	90.8	Very high	3 Å²	3	59 Å²	59	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-44.7	175	-68.9	156.3	0	0	0	111.6	I40 I60 L63 L140 L141 M142 M146 T147 L152 V156	I40-I144 HydrophobicContact CG2-CG1 4.06Å; I60-I144 HydrophobicContact CD1-CD1 4.26Å; I60-I144 HydrophobicContact CD1-CG1 4.43Å; I60-I144 HydrophobicContact CD1-CG2 3.87Å; I60-I144 HydrophobicContact CG1-CD1 3.84Å; I60-I144 HydrophobicContact CG1-CG2 4.43Å; I60-I144 HydrophobicContact CG2-CD1 4.29Å; I60-I144 HydrophobicContact CG2-CG2 4.14Å; L63-I144 HydrophobicContact CD2-CD1 4.24Å; L140-I144 WeakPolarHBondContact O-CD1 3.26Å; L140-I144 VanDerWaalsContact O-CG1 3.32Å; L140-I144 WeakPolarHBondContact O-CG1 3.49Å; L140-I144 PolarHBondContact O-N 3.46Å; L141-I144 HydrophobicContact CD2-CD1 4.39Å; L141-I144 PolarHBondContact O-N 3.45Å; M142-I144 VanDerWaalsContact C-N 3.27Å; M142-I144 PolarHBondContact O-N 3.14Å; I144-M146 PolarHBondContact O-N 3.02Å; I144-T147 WeakPolarHBondContact O-CB 3.42Å; I144-T147 WeakPolarHBondContact O-CG2 3.48Å; I144-T147 PolarHBondContact O-N 3.41Å; I144-T147 VanDerWaalsContact O-N 3.11Å; I144-T147 PolarHBondContact O-OG1 3.42Å; I144-L152 HydrophobicContact CG2-CB 4.02Å; I144-L152 HydrophobicContact CG2-CD1 4.42Å; I144-V156 HydrophobicContact CG2-CG2 4.1Å
145	V	89.6	Confident	90.8	Very high	61 Å²	61	58.3 Å²	58.3	37%	0.37	29%	0.285	S	S	.	.	H	α-helix	trans	-65.3	-32.2	178	173.1	0	0	0	0	111.3	L141 M142 T147 F148 V156	L141-V145 WeakPolarHBondContact O-CG2 3.32Å; L141-V145 PolarHBondContact O-N 2.91Å; M142-V145 PolarHBondContact O-N 3.11Å; M142-V145 VanDerWaalsContact O-N 3.16Å; V145-T147 PolarHBondContact O-N 3.27Å; V145-F148 PolarHBondContact O-N 3.45Å; V145-V156 HydrophobicContact CG2-CG1 4.35Å; V145-V156 HydrophobicContact CG2-CG2 4.3Å
146	M	88.5	Confident	90.9	Very high	116 Å²	116	56.4 Å²	56.4	57%	0.571	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.3	175.9	-67	-70	-78.8	0	0	113.5	M142 L143 I144 F148	M142-M146 HydrophobicContact CG-CG 4.47Å; M142-M146 WeakPolarHBondContact O-CG 3.26Å; M142-M146 PolarHBondContact O-N 3.25Å; L143-M146 PolarHBondContact O-N 3.24Å; I144-M146 PolarHBondContact O-N 3.02Å; M146-F148 VanDerWaalsContact O-CD2 3.23Å; M146-F148 WeakPolarHBondContact O-CD2 3.36Å; M146-F148 PolarHBondContact O-N 2.84Å
147	T	85.2	Confident	91	Very high	29 Å²	29	55.9 Å²	55.9	18%	0.178	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-0.5	171.4	78.2	0	0	0	0	112.8	H33 L143 I144 V145 N149	H33-T147 PolarHBondContact NE2-O 2.93Å; L143-T147 WeakPolarHBondContact O-CG2 3.25Å; L143-T147 PolarHBondContact O-N 3.21Å; I144-T147 WeakPolarHBondContact O-CB 3.42Å; I144-T147 WeakPolarHBondContact O-CG2 3.48Å; I144-T147 PolarHBondContact O-N 3.41Å; I144-T147 VanDerWaalsContact O-N 3.11Å; I144-T147 PolarHBondContact O-OG1 3.42Å; V145-T147 PolarHBondContact O-N 3.27Å; T147-N149 PolarHBondContact O-N 3.25Å
148	F	81.8	Confident	91.1	Very high	67 Å²	67	59.3 Å²	59.3	29%	0.294	30%	0.295	S	S	.	.			trans	52.1	18.9	179.5	-69.5	-80.2	0	0	0	115.4	F32 H33 V145 M146 T150	F32-F148 WeakPolarHBondContact CA-O 3.46Å; F32-F148 HydrophobicContact CD1-CD1 4.37Å; F32-F148 HydrophobicContact CE1-CD1 4.2Å; F32-F148 HydrophobicContact CZ-CD1 4.33Å; H33-F148 PolarHBondContact N-O 3.46Å; H33-F148 VanDerWaalsContact N-O 3.1Å; V145-F148 PolarHBondContact O-N 3.45Å; M146-F148 VanDerWaalsContact O-CD2 3.23Å; M146-F148 WeakPolarHBondContact O-CD2 3.36Å; M146-F148 PolarHBondContact O-N 2.84Å; F148-T150 PolarHBondContact O-N 2.88Å
149	N	87.2	Confident	91.2	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.011	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-84.4	117.5	176.6	-172.6	-64	0	0	0	110.1	G35 E38 T147 W151 L152 M153	G35-N149 PolarHBondContact O-ND2 2.87Å; E38-N149 VanDerWaalsContact CG-ND2 3.26Å; E38-N149 WeakPolarHBondContact CG-ND2 3.19Å; T147-N149 PolarHBondContact O-N 3.25Å; N149-W151 VanDerWaalsContact C-N 3.31Å; N149-W151 PolarHBondContact O-N 2.85Å; N149-W151 WeakPolarHBondContact OD1-CB 3.46Å; N149-W151 PolarHBondContact OD1-N 3.46Å; N149-L152 HydrophobicContact CB-CB 4.16Å; N149-L152 HydrophobicContact CB-CD1 4.08Å; N149-L152 HydrophobicContact CB-CG 3.93Å; N149-L152 PolarHBondContact O-N 3.44Å; N149-L152 PolarHBondContact OD1-N 3.35Å; N149-M153 PolarHBondContact O-N 2.87Å
150	T	88.1	Confident	91.2	Very high	41 Å²	41	52 Å²	52	25%	0.252	27%	0.266	S	S	.	.	H	α-helix	trans	-58.4	-40.8	-175.8	-59.6	0	0	0	0	112.7	H33 F148 M153 F154	H33-T150 PolarHBondContact O-N 2.95Å; H33-T150 PolarHBondContact O-OG1 3.29Å; F148-T150 PolarHBondContact O-N 2.88Å; T150-M153 PolarHBondContact O-N 2.85Å; T150-F154 HydrophobicContact CG2-CD2 3.79Å; T150-F154 HydrophobicContact CG2-CE2 3.41Å; T150-F154 VanDerWaalsContact CG2-CE2 3.41Å; T150-F154 HydrophobicContact CG2-CZ 4.45Å; T150-F154 WeakPolarHBondContact O-CD2 3.43Å; T150-F154 PolarHBondContact O-N 2.93Å
151	W	90.3	Very high	91.3	Very high	132 Å²	132	51.6 Å²	51.6	50%	0.5	27%	0.273	S	S	.	.	H	α-helix	trans	-69.4	-41.2	-179.2	-60.2	108.6	0	0	0	112.3	G34 F53 F57 N149 M153 F154 A155	G34-W151 PolarHBondContact O-NE1 3.4Å; F53-W151 HydrophobicContact CE1-CB 4.12Å; F53-W151 HydrophobicContact CE1-CG 4.18Å; F53-W151 HydrophobicContact CE2-CB 4.45Å; F53-W151 HydrophobicContact CZ-CB 3.46Å; F53-W151 VanDerWaalsContact CZ-CB 3.46Å; F53-W151 AromaticContact CZ-CD1 3.69Å; F53-W151 AromaticContact CZ-CG 3.69Å; F53-W151 HydrophobicContact CZ-CG 3.69Å; F57-W151 VanDerWaalsContact CE2-O 3.26Å; F57-W151 WeakPolarHBondContact CE2-O 3.41Å; N149-W151 VanDerWaalsContact C-N 3.31Å; N149-W151 PolarHBondContact O-N 2.85Å; N149-W151 WeakPolarHBondContact OD1-CB 3.46Å; N149-W151 PolarHBondContact OD1-N 3.46Å; W151-M153 VanDerWaalsContact C-N 3.33Å; W151-F154 PolarHBondContact O-N 3.28Å; W151-A155 PolarHBondContact O-N 2.96Å
152	L	89.9	Confident	91.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67	-38.6	176.9	-58.5	-170.8	0	0	0	110.9	I40 F53 I60 I144 N149 F154 A155 V156	I40-L152 HydrophobicContact CD1-CD1 4.13Å; I40-L152 HydrophobicContact CG1-CD1 4.01Å; I40-L152 HydrophobicContact CG2-CD1 4.47Å; F53-L152 HydrophobicContact CE2-CD2 4.23Å; I60-L152 HydrophobicContact CD1-CB 4.35Å; I60-L152 HydrophobicContact CD1-CD1 4.1Å; I60-L152 HydrophobicContact CD1-CD2 3.66Å; I60-L152 HydrophobicContact CD1-CG 4.24Å; I144-L152 HydrophobicContact CG2-CB 4.02Å; I144-L152 HydrophobicContact CG2-CD1 4.42Å; N149-L152 HydrophobicContact CB-CB 4.16Å; N149-L152 HydrophobicContact CB-CD1 4.08Å; N149-L152 HydrophobicContact CB-CG 3.93Å; N149-L152 PolarHBondContact O-N 3.44Å; N149-L152 PolarHBondContact OD1-N 3.35Å; L152-F154 VanDerWaalsContact C-N 3.33Å; L152-F154 PolarHBondContact O-N 3.24Å; L152-A155 WeakPolarHBondContact O-CB 3.45Å; L152-A155 PolarHBondContact O-N 2.89Å; L152-A155 VanDerWaalsContact O-N 3.14Å; L152-V156 WeakPolarHBondContact O-CG2 3.31Å; L152-V156 PolarHBondContact O-N 3.3Å
153	M	91	Very high	91.5	Very high	57 Å²	57	48.4 Å²	48.4	28%	0.281	26%	0.26	S	S	.	.	H	α-helix	trans	-58.4	-45.8	172.6	-169.3	-169.8	76.6	0	0	111.1	F32 N149 T150 W151 A155 V156 V157	F32-M153 HydrophobicContact CE1-SD 3.86Å; F32-M153 HydrophobicContact CZ-SD 4.46Å; N149-M153 PolarHBondContact O-N 2.87Å; T150-M153 PolarHBondContact O-N 2.85Å; W151-M153 VanDerWaalsContact C-N 3.33Å; M153-A155 VanDerWaalsContact C-N 3.33Å; M153-A155 PolarHBondContact O-N 2.85Å; M153-V156 PolarHBondContact O-N 3.48Å; M153-V157 WeakPolarHBondContact O-CG2 3.38Å; M153-V157 PolarHBondContact O-N 3.47Å
154	F	93.4	Very high	91.6	Very high	98 Å²	98	51.8 Å²	51.8	43%	0.43	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-40	174.3	-78.1	-59.3	0	0	0	112.6	T150 W151 L152 V156 V157 I158	T150-F154 HydrophobicContact CG2-CD2 3.79Å; T150-F154 HydrophobicContact CG2-CE2 3.41Å; T150-F154 VanDerWaalsContact CG2-CE2 3.41Å; T150-F154 HydrophobicContact CG2-CZ 4.45Å; T150-F154 WeakPolarHBondContact O-CD2 3.43Å; T150-F154 PolarHBondContact O-N 2.93Å; W151-F154 PolarHBondContact O-N 3.28Å; L152-F154 VanDerWaalsContact C-N 3.33Å; L152-F154 PolarHBondContact O-N 3.24Å; F154-V156 VanDerWaalsContact C-N 3.32Å; F154-V156 PolarHBondContact O-N 2.96Å; F154-V157 PolarHBondContact O-N 3.09Å; F154-I158 WeakPolarHBondContact O-CB 3.48Å; F154-I158 VanDerWaalsContact O-CG1 3.3Å; F154-I158 WeakPolarHBondContact O-CG1 3.33Å; F154-I158 PolarHBondContact O-N 3.07Å
155	A	94.3	Very high	91.7	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-44	175.8	0	0	0	0	0	112	F57 I60 W151 L152 M153 G159	F57-A155 HydrophobicContact CD1-CB 4.23Å; F57-A155 HydrophobicContact CD2-CB 3.55Å; F57-A155 HydrophobicContact CE1-CB 4.2Å; F57-A155 HydrophobicContact CE2-CB 3.52Å; F57-A155 HydrophobicContact CG-CB 3.9Å; F57-A155 HydrophobicContact CZ-CB 3.85Å; I60-A155 HydrophobicContact CB-CB 4.33Å; I60-A155 HydrophobicContact CG2-CB 4.03Å; W151-A155 PolarHBondContact O-N 2.96Å; L152-A155 WeakPolarHBondContact O-CB 3.45Å; L152-A155 PolarHBondContact O-N 2.89Å; L152-A155 VanDerWaalsContact O-N 3.14Å; M153-A155 VanDerWaalsContact C-N 3.33Å; M153-A155 PolarHBondContact O-N 2.85Å; A155-G159 PolarHBondContact O-N 3.29Å
156	V	95.2	Very high	91.8	Very high	20 Å²	20	59.3 Å²	59.3	12%	0.121	31%	0.305	C	S	.	.	H	α-helix	trans	-63.5	-46.7	176.5	176.7	0	0	0	0	110.8	I60 L141 I144 V145 L152 M153 F154 G159 A160	I60-V156 HydrophobicContact CG2-CG2 3.39Å; L141-V156 HydrophobicContact CD2-CG1 4.37Å; L141-V156 HydrophobicContact CD2-CG2 4.13Å; I144-V156 HydrophobicContact CG2-CG2 4.1Å; V145-V156 HydrophobicContact CG2-CG1 4.35Å; V145-V156 HydrophobicContact CG2-CG2 4.3Å; L152-V156 WeakPolarHBondContact O-CG2 3.31Å; L152-V156 PolarHBondContact O-N 3.3Å; M153-V156 PolarHBondContact O-N 3.48Å; F154-V156 VanDerWaalsContact C-N 3.32Å; F154-V156 PolarHBondContact O-N 2.96Å; V156-G159 PolarHBondContact O-N 2.95Å; V156-A160 VanDerWaalsContact O-CB 3.25Å; V156-A160 WeakPolarHBondContact O-CB 3.33Å; V156-A160 PolarHBondContact O-N 3.33Å
157	V	95.5	Very high	91.8	Very high	91 Å²	91	56.3 Å²	56.3	55%	0.552	29%	0.289	S	S	*	.	H	α-helix	trans	-64.1	-47.6	-179.1	173.3	0	0	0	0	111.5	M153 F154 A160 G161	M153-V157 WeakPolarHBondContact O-CG2 3.38Å; M153-V157 PolarHBondContact O-N 3.47Å; F154-V157 PolarHBondContact O-N 3.09Å; V157-A160 PolarHBondContact O-N 3.1Å; V157-G161 PolarHBondContact O-N 2.91Å
158	I	96.5	Very high	91.7	Very high	81 Å²	81	55.9 Å²	55.9	42%	0.415	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-46.6	177.9	-67.6	168.6	0	0	0	109.8	M61 F154 A160 G161 V162	M61-I158 HydrophobicContact SD-CG2 4.27Å; F154-I158 WeakPolarHBondContact O-CB 3.48Å; F154-I158 VanDerWaalsContact O-CG1 3.3Å; F154-I158 WeakPolarHBondContact O-CG1 3.33Å; F154-I158 PolarHBondContact O-N 3.07Å; I158-A160 PolarHBondContact O-N 2.97Å; I158-G161 PolarHBondContact O-N 3.46Å; I158-V162 HydrophobicContact CG2-CG2 4.26Å; I158-V162 WeakPolarHBondContact O-CB 3.37Å; I158-V162 VanDerWaalsContact O-CG2 3.31Å; I158-V162 WeakPolarHBondContact O-CG2 3.37Å; I158-V162 PolarHBondContact O-N 2.9Å
159	G	95.9	Very high	91.6	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.1	-41.1	178.5	0	0	0	0	0	113	V65 A155 V156 G163	V65-G159 WeakPolarHBondContact CG2-O 3.43Å; A155-G159 PolarHBondContact O-N 3.29Å; V156-G159 PolarHBondContact O-N 2.95Å; G159-G163 PolarHBondContact O-N 3.24Å
160	A	94.5	Very high	91.2	Very high	33 Å²	33	69.4 Å²	69.4	27%	0.273	34%	0.339	S	S	.	.	H	α-helix	trans	-64.6	-42.4	174.6	0	0	0	0	0	111.7	V156 V157 I158 G163 Y164	V156-A160 VanDerWaalsContact O-CB 3.25Å; V156-A160 WeakPolarHBondContact O-CB 3.33Å; V156-A160 PolarHBondContact O-N 3.33Å; V157-A160 PolarHBondContact O-N 3.1Å; I158-A160 PolarHBondContact O-N 2.97Å; A160-G163 PolarHBondContact O-N 3.39Å; A160-Y164 WeakPolarHBondContact O-CB 3.05Å; A160-Y164 PolarHBondContact O-N 3.41Å
161	G	94.9	Very high	90.5	Very high	35 Å²	35	71 Å²	71	36%	0.361	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-48.8	175	0	0	0	0	0	112.6	V157 I158 G163 Y164 L165	V157-G161 PolarHBondContact O-N 2.91Å; I158-G161 PolarHBondContact O-N 3.46Å; G161-G163 PolarHBondContact O-N 2.98Å; G161-Y164 PolarHBondContact O-N 3.2Å; G161-L165 WeakPolarHBondContact O-CG 3.5Å; G161-L165 PolarHBondContact O-N 3.37Å
162	V	95.5	Very high	89.8	Confident	60 Å²	60	69.2 Å²	69.2	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-61.6	-43.9	176.5	171.6	0	0	0	0	111	V65 I158 L165 L166	V65-V162 HydrophobicContact CG2-CB 4.18Å; V65-V162 HydrophobicContact CG2-CG1 4.03Å; I158-V162 HydrophobicContact CG2-CG2 4.26Å; I158-V162 WeakPolarHBondContact O-CB 3.37Å; I158-V162 VanDerWaalsContact O-CG2 3.31Å; I158-V162 WeakPolarHBondContact O-CG2 3.37Å; I158-V162 PolarHBondContact O-N 2.9Å; V162-L165 PolarHBondContact O-N 2.94Å; V162-L166 HydrophobicContact CG1-CD1 3.87Å; V162-L166 HydrophobicContact CG1-CG 4.28Å; V162-L166 WeakPolarHBondContact O-CG 3.35Å; V162-L166 PolarHBondContact O-N 3.31Å
163	G	94.3	Very high	88.8	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-58.5	-49.2	175.1	0	0	0	0	0	111.6	G159 A160 G161 L165 L166 F167	G159-G163 PolarHBondContact O-N 3.24Å; A160-G163 PolarHBondContact O-N 3.39Å; G161-G163 PolarHBondContact O-N 2.98Å; G163-L165 VanDerWaalsContact C-N 3.3Å; G163-L165 PolarHBondContact O-N 3.29Å; G163-L166 PolarHBondContact O-N 3.26Å; G163-F167 WeakPolarHBondContact O-CD2 3.3Å; G163-F167 PolarHBondContact O-N 3.26Å
164	Y	92.1	Very high	87.6	Confident	161 Å²	161	77.4 Å²	77.4	63%	0.631	39%	0.393	S	S	*	.	H	α-helix	trans	-59.1	-40.8	177.4	-175	-97.1	0	0	0	112.3	A160 G161 G168	A160-Y164 WeakPolarHBondContact O-CB 3.05Å; A160-Y164 PolarHBondContact O-N 3.41Å; G161-Y164 PolarHBondContact O-N 3.2Å; Y164-G168 VanDerWaalsContact O-CA 3.25Å; Y164-G168 WeakPolarHBondContact O-CA 3.41Å; Y164-G168 PolarHBondContact O-N 3.3Å
165	L	92.2	Very high	86	Confident	123 Å²	123	77.9 Å²	77.9	64%	0.644	40%	0.404	S	S	*	.	H	α-helix	trans	-65.7	-48.1	176.7	-70.3	172.1	0	0	0	112.5	G161 V162 G163 W169	G161-L165 WeakPolarHBondContact O-CG 3.5Å; G161-L165 PolarHBondContact O-N 3.37Å; V162-L165 PolarHBondContact O-N 2.94Å; G163-L165 VanDerWaalsContact C-N 3.3Å; G163-L165 PolarHBondContact O-N 3.29Å; L165-W169 WeakPolarHBondContact O-CB 3.38Å; L165-W169 PolarHBondContact O-N 3.47Å
166	L	91.4	Very high	84.2	Confident	99 Å²	99	85.2 Å²	85.2	52%	0.518	44%	0.438	S	S	.	.	H	α-helix	trans	-62.3	-46.7	-178.6	-72.5	173.8	0	0	0	112.1	V65 V162 G163 R170	V65-L166 HydrophobicContact CG1-CD1 4.21Å; V162-L166 HydrophobicContact CG1-CD1 3.87Å; V162-L166 HydrophobicContact CG1-CG 4.28Å; V162-L166 WeakPolarHBondContact O-CG 3.35Å; V162-L166 PolarHBondContact O-N 3.31Å; G163-L166 PolarHBondContact O-N 3.26Å; L166-R170 PolarHBondContact O-N 2.97Å
167	F	88.2	Confident	82	Confident	54 Å²	54	89.5 Å²	89.5	24%	0.237	47%	0.466	C	S	.	.	H	α-helix	trans	-81.5	-30.7	-178.4	-68.7	-72.6	0	0	0	112.3	V65 E68 G69 T72 G163 R170 R171	V65-F167 HydrophobicContact CG1-CE2 4.36Å; E68-F167 HydrophobicContact CB-CD2 4.21Å; G69-F167 VanDerWaalsContact CA-CD2 3.47Å; G69-F167 VanDerWaalsContact CA-CE1 3.46Å; G69-F167 VanDerWaalsContact N-CE2 3.33Å; T72-F167 HydrophobicContact CG2-CB 4.08Å; T72-F167 HydrophobicContact CG2-CD1 4.24Å; T72-F167 WeakPolarHBondContact OG1-CB 3.43Å; G163-F167 WeakPolarHBondContact O-CD2 3.3Å; G163-F167 PolarHBondContact O-N 3.26Å; F167-R170 PolarHBondContact O-N 2.78Å; F167-R171 WeakPolarHBondContact O-CG 3.33Å; F167-R171 PolarHBondContact O-N 2.99Å; F167-R171 VanDerWaalsContact O-N 3.07Å
168	G	83.4	Confident	79.7	Confident	20 Å²	20	91.4 Å²	91.4	21%	0.206	48%	0.482	C	S	.	.	H	α-helix	trans	-62	-47.7	172.1	0	0	0	0	0	112	Y164 R170 R171 T172	Y164-G168 VanDerWaalsContact O-CA 3.25Å; Y164-G168 WeakPolarHBondContact O-CA 3.41Å; Y164-G168 PolarHBondContact O-N 3.3Å; G168-R170 VanDerWaalsContact C-N 3.3Å; G168-R170 PolarHBondContact O-N 3.3Å; G168-R171 WeakPolarHBondContact O-CB 3.26Å; G168-R171 PolarHBondContact O-N 2.97Å; G168-R171 VanDerWaalsContact O-N 3.09Å; G168-T172 PolarHBondContact O-N 2.87Å; G168-T172 VanDerWaalsContact O-N 3.13Å; G168-T172 PolarHBondContact O-OG1 3.1Å
169	W	80.4	Confident	77.5	Confident	180 Å²	180	96.2 Å²	96.2	68%	0.682	50%	0.503	S	S	*	.	H	α-helix	trans	-59.3	-42.1	175.5	-171.6	1.7	0	0	0	111.5	L165 R171 T172 L173	L165-W169 WeakPolarHBondContact O-CB 3.38Å; L165-W169 PolarHBondContact O-N 3.47Å; W169-R171 VanDerWaalsContact C-N 3.31Å; W169-R171 PolarHBondContact O-N 3.26Å; W169-T172 PolarHBondContact O-N 3.26Å; W169-L173 WeakPolarHBondContact O-CG 3.42Å; W169-L173 PolarHBondContact O-N 2.8Å
170	R	77.5	Confident	75.2	Confident	172 Å²	172	104.4 Å²	104.4	65%	0.649	54%	0.541	S	S	*	.	H	α-helix	trans	-62.8	-34.3	176.3	-174.8	176.4	-77.8	-93.3	2.8	113.1	L166 F167 G168 L173 T174	L166-R170 PolarHBondContact O-N 2.97Å; F167-R170 PolarHBondContact O-N 2.78Å; G168-R170 VanDerWaalsContact C-N 3.3Å; G168-R170 PolarHBondContact O-N 3.3Å; R170-L173 PolarHBondContact O-N 3.06Å; R170-T174 PolarHBondContact O-N 3.23Å; R170-T174 PolarHBondContact O-OG1 3.45Å
171	R	73.6	Confident	73.1	Confident	74 Å²	74	109 Å²	109	28%	0.279	57%	0.57	S	S	.	*	H	α-helix	trans	-66.1	-42.4	174.7	-69.5	172.8	-168.8	-148.9	-0.7	111.3	T72 E75 F167 G168 W169 L173 T174 T175	T72-R171 HydrophobicContact CG2-CG 4.23Å; T72-R171 PolarHBondContact OG1-NH2 3.07Å; E75-R171 IonicContact OE1-CZ 3.31Å; E75-R171 IonicContact OE1-NH1 3.97Å; E75-R171 PolarHBondContact OE1-NH1 3.43Å; E75-R171 IonicContact OE1-NH2 2.78Å; E75-R171 PolarHBondContact OE1-NH2 3.28Å; E75-R171 IonicContact OE2-CZ 3.64Å; E75-R171 IonicContact OE2-NH1 3.47Å; E75-R171 PolarHBondContact OE2-NH1 3.46Å; E75-R171 IonicContact OE2-NH2 2.89Å; E75-R171 PolarHBondContact OE2-NH2 3.18Å; E75-R171 VanDerWaalsContact OE2-NH2 3.09Å; F167-R171 WeakPolarHBondContact O-CG 3.33Å; F167-R171 PolarHBondContact O-N 2.99Å; F167-R171 VanDerWaalsContact O-N 3.07Å; G168-R171 WeakPolarHBondContact O-CB 3.26Å; G168-R171 PolarHBondContact O-N 2.97Å; G168-R171 VanDerWaalsContact O-N 3.09Å; W169-R171 VanDerWaalsContact C-N 3.31Å; W169-R171 PolarHBondContact O-N 3.26Å; R171-L173 VanDerWaalsContact C-N 3.35Å; R171-L173 PolarHBondContact O-N 3.02Å; R171-T174 PolarHBondContact O-N 3.28Å; R171-T174 PolarHBondContact O-OG1 2.94Å; R171-T174 VanDerWaalsContact O-OG1 3.13Å; R171-T175 PolarHBondContact O-N 3.45Å; R171-T175 PolarHBondContact O-OG1 3.2Å
172	T	75.9	Confident	71	Confident	95 Å²	95	120.2 Å²	120.2	58%	0.583	61%	0.612	S	S	*	*	H	α-helix	trans	-62	-43.2	176	-51.8	0	0	0	0	111.2	G168 W169 T174 T175	G168-T172 PolarHBondContact O-N 2.87Å; G168-T172 VanDerWaalsContact O-N 3.13Å; G168-T172 PolarHBondContact O-OG1 3.1Å; W169-T172 PolarHBondContact O-N 3.26Å; T172-T174 VanDerWaalsContact C-N 3.26Å; T172-T174 PolarHBondContact O-N 3.02Å; T172-T175 PolarHBondContact O-N 3.12Å
173	L	69.5	Low	69.8	Low	118 Å²	118	123.3 Å²	123.3	62%	0.618	63%	0.625	S	S	*	*	H	α-helix	trans	-66.9	-21.7	178.6	-68.1	176.1	0	0	0	114.7	W169 R170 R171	W169-L173 WeakPolarHBondContact O-CG 3.42Å; W169-L173 PolarHBondContact O-N 2.8Å; R170-L173 PolarHBondContact O-N 3.06Å; R171-L173 VanDerWaalsContact C-N 3.35Å; R171-L173 PolarHBondContact O-N 3.02Å
174	T	65.4	Low	68.5	Low	112 Å²	112	129.7 Å²	129.7	69%	0.687	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-4	179.2	34.7	0	0	0	0	113.4	R170 R171 T172	R170-T174 PolarHBondContact O-N 3.23Å; R170-T174 PolarHBondContact O-OG1 3.45Å; R171-T174 PolarHBondContact O-N 3.28Å; R171-T174 PolarHBondContact O-OG1 2.94Å; R171-T174 VanDerWaalsContact O-OG1 3.13Å; T172-T174 VanDerWaalsContact C-N 3.26Å; T172-T174 PolarHBondContact O-N 3.02Å
175	T	60.8	Low	67.2	Low	108 Å²	108	128 Å²	128	66%	0.663	66%	0.659	S	S	*	*	S	Bend	trans	-94.2	-9.7	-178.3	-53.8	0	0	0	0	113	R171 T172	R171-T175 PolarHBondContact O-N 3.45Å; R171-T175 PolarHBondContact O-OG1 3.2Å; T172-T175 PolarHBondContact O-N 3.12Å
176	E	55.1	Low	65.7	Low	153 Å²	153	128.3 Å²	128.3	72%	0.715	66%	0.66	S	S	*	*			trans	-102.5	130	175.2	-51.8	-90.3	110.7	0	0	108.8
177	P	49.8	Very low	64.1	Low	110 Å²	110	130.1 Å²	130.1	71%	0.714	67%	0.669	S	S	*	*			cis	-131.3	132.8	-5.6	34.2	-14.4	0	0	0	114.2
178	C	47.8	Very low	62.5	Low	131 Å²	131	135.2 Å²	135.2	89%	0.885	70%	0.698	S	S	*	*			trans	-132.1	30.3	159.7	-91	0	0	0	0	112	H180	C178-H180 PolarHBondContact O-N 3.48Å
179	E	48.8	Very low	61	Low	183 Å²	183	143.4 Å²	143.4	86%	0.855	73%	0.733	S	S	*	*			trans	-98	63.3	168.4	-52.2	-169.1	139.4	0	0	109
180	H	48.5	Very low	59.5	Low	171 Å²	171	140.6 Å²	140.6	79%	0.792	74%	0.737	S	S	*	*			trans	-138.2	129	164	-89.1	51.3	0	0	0	107.6	C178	C178-H180 PolarHBondContact O-N 3.48Å
181	C	50.7	Low	58	Low	131 Å²	131	138 Å²	138	89%	0.885	74%	0.744	S	S	*	*			trans	110.1	79.2	172.7	-59	0	0	0	0	115.8
182	H	50.6	Low	56.6	Low	270 Å²	270	143.8 Å²	143.8	100%	1.25	79%	0.786	S	S	*	*			trans	-120.5	0	139.7	-105.1	-79.7	0	0	0	107.9

Retrieved 182 of 182 residues in 562.7 ms (Link to these results)

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