A0A075B668_MOUSE Loading...

Prion-like protein doppel

Required for normal acrosome reaction and for normal male fertility. Can bind Cu(2+).

AlphaFold DB , UniProt , Accession A0A075B668, Species MOUSE (Mus musculus, Mouse), Gene Prn, Length 197 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	33.3	Very low	33.8	Very low	238 Å²	238	179.7 Å²	179.7	100%	1.172	86%	0.861	S	S	*	*				0	89.6	0	-155.3	169.4	-89.2	0	0	105.6
2	M	31.8	Very low	33.8	Very low	182 Å²	182	173.6 Å²	173.6	90%	0.897	86%	0.862	S	S	*	*				42.5	116.8	119	-66	-172.9	-175.9	0	0	112.3
3	E	30.3	Very low	33.9	Very low	191 Å²	191	168.2 Å²	168.2	89%	0.893	85%	0.852	S	S	*	*				-163.9	166.5	79.4	-102.5	-162.6	102.7	0	0	114.8
4	W	32.2	Very low	34.2	Very low	227 Å²	227	172.1 Å²	172.1	86%	0.86	85%	0.851	S	S	*	*			trans	-101.6	173.4	-170.1	-93.5	68.4	0	0	0	113.7
5	R	35.3	Very low	34.4	Very low	228 Å²	228	170 Å²	170	86%	0.86	85%	0.852	S	S	*	*			trans	81.8	147.2	155.6	-74.4	171.6	-144.6	-120.6	6.9	116.4
6	S	33.1	Very low	34.2	Very low	106 Å²	106	164.1 Å²	164.1	74%	0.741	85%	0.847	S	S	*	*			cis	-165.1	155.9	2.6	-147.9	0	0	0	0	109.4
7	L	35.8	Very low	34.5	Very low	163 Å²	163	165.4 Å²	165.4	85%	0.853	85%	0.845	S	S	*	*			trans	-49	141.1	169.5	-74.8	126	0	0	0	115.7
8	R	33	Very low	34.6	Very low	212 Å²	212	162.9 Å²	162.9	80%	0.8	84%	0.84	S	S	*	*			trans	-163.4	99.3	140.4	-163.3	175	-65.4	-172.1	0.5	110.6	E10	R8-E10 VanDerWaalsContact CD-OE2 3.23Å; R8-E10 WeakPolarHBondContact CD-OE2 3.34Å
9	V	36.8	Very low	35.2	Very low	142 Å²	142	162.3 Å²	162.3	86%	0.861	83%	0.834	S	S	*	*			trans	-93.5	109.1	161.5	175	0	0	0	0	106.3
10	E	34.8	Very low	35.8	Very low	153 Å²	153	163.6 Å²	163.6	72%	0.715	83%	0.834	S	S	*	*			trans	-81.1	124.9	-178.4	-148.4	139.8	141.1	0	0	109.6	R8	R8-E10 VanDerWaalsContact CD-OE2 3.23Å; R8-E10 WeakPolarHBondContact CD-OE2 3.34Å
11	V	35.5	Very low	36.6	Very low	135 Å²	135	160.3 Å²	160.3	82%	0.818	82%	0.818	S	S	*	*			trans	-77.9	123.8	173.1	171.1	0	0	0	0	108.3
12	A	33.3	Very low	37.6	Very low	106 Å²	106	159.5 Å²	159.5	88%	0.876	80%	0.802	S	S	*	*			trans	-122.4	124.2	163.2	0	0	0	0	0	109.9
13	S	34.8	Very low	38.6	Very low	104 Å²	104	155.3 Å²	155.3	73%	0.727	78%	0.783	S	S	*	*			trans	-102.5	160	-170.2	167.9	0	0	0	0	111.4
14	R	38.9	Very low	39.9	Very low	223 Å²	223	147.4 Å²	147.4	84%	0.842	75%	0.753	S	S	*	*			trans	113.3	134.1	161.6	-68.6	-178.6	-168.2	-155.6	2.8	113.3
15	T	37.2	Very low	41.1	Very low	140 Å²	140	140.6 Å²	140.6	86%	0.859	74%	0.737	S	S	*	*			cis	-173.1	150.2	21.1	9.1	0	0	0	0	108.6
16	G	31.5	Very low	42.4	Very low	76 Å²	76	138 Å²	138	78%	0.784	73%	0.727	S	S	*	*			trans	155.9	72.5	162	0	0	0	0	0	118.4
17	F	38.9	Very low	43.8	Very low	186 Å²	186	140.7 Å²	140.7	82%	0.816	72%	0.721	S	S	*	*			trans	21.6	104.9	145	-151.6	-97	0	0	0	120.7
18	T	36.6	Very low	45	Very low	121 Å²	121	135.7 Å²	135.7	74%	0.742	70%	0.697	S	S	*	*				-154	82.9	129	41	0	0	0	0	109.1	K20	T18-K20 PolarHBondContact O-N 3.21Å; T18-K20 VanDerWaalsContact O-N 3.15Å
19	M	44.8	Very low	46.6	Very low	150 Å²	150	127.9 Å²	127.9	74%	0.739	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	10.1	-174.9	-70.4	-173	88.7	0	0	115.4
20	K	48.8	Very low	48.2	Very low	188 Å²	188	123.9 Å²	123.9	82%	0.817	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-23.1	-176.8	-91.8	174.9	169.9	175.2	0	115.2	T18	T18-K20 PolarHBondContact O-N 3.21Å; T18-K20 VanDerWaalsContact O-N 3.15Å
21	N	52.2	Low	49.9	Very low	95 Å²	95	121.6 Å²	121.6	51%	0.508	64%	0.643	S	S	.	*	H	α-helix	trans	-103.5	-19.8	-169.9	-65.3	8.9	0	0	0	114	T25	N21-T25 PolarHBondContact O-N 2.99Å; N21-T25 PolarHBondContact O-OG1 2.95Å
22	R	54.4	Low	51.3	Low	221 Å²	221	118 Å²	118	83%	0.834	62%	0.623	S	S	*	*	H	α-helix	trans	-69.9	-35.8	176.4	-94.5	-174	174.3	-161.7	-1.1	113.5	W26	R22-W26 VanDerWaalsContact O-CB 3.27Å; R22-W26 WeakPolarHBondContact O-CB 3.38Å; R22-W26 PolarHBondContact O-N 3.31Å
23	L	52.8	Low	52.9	Low	94 Å²	94	119.5 Å²	119.5	49%	0.492	61%	0.614	S	S	.	*	H	α-helix	trans	-65.6	-47.3	176.8	-88.9	143.4	0	0	0	110.3	T25 W26 W27	L23-T25 PolarHBondContact O-N 3.26Å; L23-W26 PolarHBondContact O-N 2.89Å; L23-W27 WeakPolarHBondContact O-CB 3.47Å; L23-W27 PolarHBondContact O-N 2.73Å
24	G	57.3	Low	54.5	Low	26 Å²	26	118.9 Å²	118.9	27%	0.268	60%	0.602	S	S	.	*	H	α-helix	trans	-58.4	-47.3	177.3	0	0	0	0	0	112.8	W26 W27 V28	G24-W26 VanDerWaalsContact C-N 3.34Å; G24-W26 PolarHBondContact O-N 3.2Å; G24-W27 PolarHBondContact O-N 2.95Å; G24-V28 VanDerWaalsContact O-CG2 3.25Å; G24-V28 WeakPolarHBondContact O-CG2 3.06Å; G24-V28 PolarHBondContact O-N 3.09Å
25	T	57.6	Low	55.6	Low	84 Å²	84	113.2 Å²	113.2	52%	0.515	59%	0.588	S	S	.	*	H	α-helix	trans	-65	-36.8	177.3	-49.5	0	0	0	0	112.5	N21 L23 V28 A29	N21-T25 PolarHBondContact O-N 2.99Å; N21-T25 PolarHBondContact O-OG1 2.95Å; L23-T25 PolarHBondContact O-N 3.26Å; T25-V28 PolarHBondContact O-N 2.83Å; T25-A29 WeakPolarHBondContact O-CB 3.25Å; T25-A29 PolarHBondContact O-N 2.84Å
26	W	61.4	Low	56.7	Low	172 Å²	172	108.9 Å²	108.9	65%	0.652	57%	0.566	S	S	*	*	H	α-helix	trans	-69.3	-41.4	177.3	-171.7	25	0	0	0	112.1	R22 L23 G24 A29 I30	R22-W26 VanDerWaalsContact O-CB 3.27Å; R22-W26 WeakPolarHBondContact O-CB 3.38Å; R22-W26 PolarHBondContact O-N 3.31Å; L23-W26 PolarHBondContact O-N 2.89Å; G24-W26 VanDerWaalsContact C-N 3.34Å; G24-W26 PolarHBondContact O-N 3.2Å; W26-A29 PolarHBondContact O-N 3.43Å; W26-I30 HydrophobicContact CD2-CD1 4.26Å; W26-I30 HydrophobicContact CG-CD1 4.17Å; W26-I30 WeakPolarHBondContact O-CD1 3.37Å; W26-I30 VanDerWaalsContact O-CG1 3.27Å; W26-I30 WeakPolarHBondContact O-CG1 3.35Å; W26-I30 PolarHBondContact O-N 3.19Å
27	W	62.5	Low	57.9	Low	164 Å²	164	108.5 Å²	108.5	62%	0.621	55%	0.552	S	S	*	*	H	α-helix	trans	-64	-38.7	174.1	-79.6	111	0	0	0	112.3	L23 G24 I30 L31	L23-W27 WeakPolarHBondContact O-CB 3.47Å; L23-W27 PolarHBondContact O-N 2.73Å; G24-W27 PolarHBondContact O-N 2.95Å; W27-I30 PolarHBondContact O-N 2.83Å; W27-L31 WeakPolarHBondContact O-CB 3.49Å; W27-L31 PolarHBondContact O-N 2.77Å
28	V	62.4	Low	58.6	Low	57 Å²	57	106.1 Å²	106.1	35%	0.345	54%	0.543	S	S	.	.	H	α-helix	trans	-66.7	-41.5	174.6	172.2	0	0	0	0	111.3	G24 T25 I30 L31 C32 F191	G24-V28 VanDerWaalsContact O-CG2 3.25Å; G24-V28 WeakPolarHBondContact O-CG2 3.06Å; G24-V28 PolarHBondContact O-N 3.09Å; T25-V28 PolarHBondContact O-N 2.83Å; V28-I30 VanDerWaalsContact C-N 3.34Å; V28-I30 PolarHBondContact O-N 3.26Å; V28-L31 PolarHBondContact O-N 2.76Å; V28-C32 WeakPolarHBondContact O-CB 3.38Å; V28-C32 PolarHBondContact O-N 3.06Å; V28-C32 PolarHBondContact O-SG 3.47Å; V28-C32 VanDerWaalsContact O-SG 3.4Å; V28-F191 HydrophobicContact CG1-CE1 3.81Å; V28-F191 HydrophobicContact CG1-CZ 3.68Å
29	A	65.3	Low	59.2	Low	49 Å²	49	107.2 Å²	107.2	41%	0.405	54%	0.543	S	S	.	.	H	α-helix	trans	-61.9	-41.5	174.8	0	0	0	0	0	112	T25 W26 C32 M33	T25-A29 WeakPolarHBondContact O-CB 3.25Å; T25-A29 PolarHBondContact O-N 2.84Å; W26-A29 PolarHBondContact O-N 3.43Å; A29-C32 PolarHBondContact O-N 3.09Å; A29-M33 WeakPolarHBondContact O-CB 2.93Å; A29-M33 VanDerWaalsContact O-CG 3.24Å; A29-M33 WeakPolarHBondContact O-CG 3.35Å; A29-M33 PolarHBondContact O-N 3.44Å
30	I	71.7	Confident	59.4	Low	58 Å²	58	103.9 Å²	103.9	30%	0.297	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-43.4	174.9	-68.4	162.1	0	0	0	110.7	W26 W27 V28 M33 L34	W26-I30 HydrophobicContact CD2-CD1 4.26Å; W26-I30 HydrophobicContact CG-CD1 4.17Å; W26-I30 WeakPolarHBondContact O-CD1 3.37Å; W26-I30 VanDerWaalsContact O-CG1 3.27Å; W26-I30 WeakPolarHBondContact O-CG1 3.35Å; W26-I30 PolarHBondContact O-N 3.19Å; W27-I30 PolarHBondContact O-N 2.83Å; V28-I30 VanDerWaalsContact C-N 3.34Å; V28-I30 PolarHBondContact O-N 3.26Å; I30-M33 PolarHBondContact O-N 2.9Å; I30-L34 HydrophobicContact CG2-CD1 3.76Å; I30-L34 HydrophobicContact CG2-CG 4.37Å; I30-L34 WeakPolarHBondContact O-CB 3.21Å; I30-L34 VanDerWaalsContact O-CG 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.34Å; I30-L34 PolarHBondContact O-N 2.94Å
31	L	70.6	Confident	59.2	Low	105 Å²	105	100.1 Å²	100.1	55%	0.55	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-42.4	177.7	-169.7	71	0	0	0	112	W27 V28 L34 L35	W27-L31 WeakPolarHBondContact O-CB 3.49Å; W27-L31 PolarHBondContact O-N 2.77Å; V28-L31 PolarHBondContact O-N 2.76Å; L31-L34 PolarHBondContact O-N 3.12Å; L31-L35 HydrophobicContact CG-CD1 4.08Å; L31-L35 WeakPolarHBondContact O-CB 3.14Å; L31-L35 WeakPolarHBondContact O-CG 3.4Å; L31-L35 PolarHBondContact O-N 3.08Å
32	C	64.8	Low	58.8	Low	59 Å²	59	101.7 Å²	101.7	40%	0.399	54%	0.54	S	S	.	.	H	α-helix	trans	-62.9	-43.5	174.6	-74.8	0	0	0	0	112	V28 A29 L35 A36	V28-C32 WeakPolarHBondContact O-CB 3.38Å; V28-C32 PolarHBondContact O-N 3.06Å; V28-C32 PolarHBondContact O-SG 3.47Å; V28-C32 VanDerWaalsContact O-SG 3.4Å; A29-C32 PolarHBondContact O-N 3.09Å; C32-L35 PolarHBondContact O-N 3.14Å; C32-A36 WeakPolarHBondContact O-CB 3.35Å; C32-A36 PolarHBondContact O-N 3.01Å
33	M	67.3	Low	58.3	Low	137 Å²	137	100.8 Å²	100.8	68%	0.675	54%	0.542	S	S	*	.	H	α-helix	trans	-64.4	-41.1	176	-71.6	-75.5	-90.9	0	0	111.5	A29 I30 S37	A29-M33 WeakPolarHBondContact O-CB 2.93Å; A29-M33 VanDerWaalsContact O-CG 3.24Å; A29-M33 WeakPolarHBondContact O-CG 3.35Å; A29-M33 PolarHBondContact O-N 3.44Å; I30-M33 PolarHBondContact O-N 2.9Å; M33-S37 WeakPolarHBondContact O-CB 3.34Å; M33-S37 PolarHBondContact O-N 3.33Å; M33-S37 PolarHBondContact O-OG 2.9Å
34	L	67.9	Low	58.1	Low	92 Å²	92	100.3 Å²	100.3	48%	0.482	55%	0.552	S	S	.	*	H	α-helix	trans	-64.8	-46.4	176.5	-76	166.8	0	0	0	111.9	I30 L31 A36 S37 H38	I30-L34 HydrophobicContact CG2-CD1 3.76Å; I30-L34 HydrophobicContact CG2-CG 4.37Å; I30-L34 WeakPolarHBondContact O-CB 3.21Å; I30-L34 VanDerWaalsContact O-CG 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.34Å; I30-L34 PolarHBondContact O-N 2.94Å; L31-L34 PolarHBondContact O-N 3.12Å; L34-A36 PolarHBondContact O-N 2.92Å; L34-S37 WeakPolarHBondContact O-CB 3.46Å; L34-S37 PolarHBondContact O-N 3.29Å; L34-H38 PolarHBondContact O-CD2 3.24Å; L34-H38 PolarHBondContact O-N 3.12Å; L34-H38 VanDerWaalsContact O-N 3.09Å
35	L	62.5	Low	57.6	Low	104 Å²	104	110.2 Å²	110.2	55%	0.545	58%	0.582	S	S	.	*	H	α-helix	trans	-62.8	-42.2	177.1	-75.6	164.8	0	0	0	112.4	L31 C32 S37 H38 L39	L31-L35 HydrophobicContact CG-CD1 4.08Å; L31-L35 WeakPolarHBondContact O-CB 3.14Å; L31-L35 WeakPolarHBondContact O-CG 3.4Å; L31-L35 PolarHBondContact O-N 3.08Å; C32-L35 PolarHBondContact O-N 3.14Å; L35-S37 VanDerWaalsContact C-N 3.27Å; L35-S37 PolarHBondContact O-N 3.49Å; L35-H38 PolarHBondContact O-N 3.11Å; L35-L39 PolarHBondContact O-N 2.82Å
36	A	59.3	Low	57	Low	49 Å²	49	109.9 Å²	109.9	41%	0.405	59%	0.594	S	S	.	*	H	α-helix	trans	-65.6	-30.1	175.4	0	0	0	0	0	112.8	C32 L34 S40	C32-A36 WeakPolarHBondContact O-CB 3.35Å; C32-A36 PolarHBondContact O-N 3.01Å; L34-A36 PolarHBondContact O-N 2.92Å; A36-S40 WeakPolarHBondContact O-CB 3.48Å; A36-S40 PolarHBondContact O-N 3.21Å; A36-S40 PolarHBondContact O-OG 2.83Å
37	S	57.8	Low	56.3	Low	68 Å²	68	108.4 Å²	108.4	48%	0.476	60%	0.598	S	S	.	*	H	α-helix	trans	-72.3	-38.9	177.3	-57.8	0	0	0	0	112.2	M33 L34 L35 L39 S40 T41	M33-S37 WeakPolarHBondContact O-CB 3.34Å; M33-S37 PolarHBondContact O-N 3.33Å; M33-S37 PolarHBondContact O-OG 2.9Å; L34-S37 WeakPolarHBondContact O-CB 3.46Å; L34-S37 PolarHBondContact O-N 3.29Å; L35-S37 VanDerWaalsContact C-N 3.27Å; L35-S37 PolarHBondContact O-N 3.49Å; S37-L39 VanDerWaalsContact C-N 3.33Å; S37-L39 PolarHBondContact O-N 2.78Å; S37-S40 PolarHBondContact O-N 2.78Å; S37-T41 PolarHBondContact O-N 2.69Å; S37-T41 VanDerWaalsContact O-N 3.12Å
38	H	53.3	Low	55.7	Low	136 Å²	136	110.1 Å²	110.1	63%	0.63	61%	0.61	S	S	*	*	H	α-helix	trans	-64.9	-34.7	173.6	-76.8	-71.6	0	0	0	112.7	L34 L35 T41	L34-H38 PolarHBondContact O-CD2 3.24Å; L34-H38 PolarHBondContact O-N 3.12Å; L34-H38 VanDerWaalsContact O-N 3.09Å; L35-H38 PolarHBondContact O-N 3.11Å; H38-T41 PolarHBondContact O-OG1 3.48Å
39	L	48.7	Very low	55.1	Low	143 Å²	143	114.3 Å²	114.3	75%	0.749	63%	0.625	S	S	*	*	H	α-helix	trans	-73.2	-28.6	173	-72.2	165.5	0	0	0	112.4	L35 S37	L35-L39 PolarHBondContact O-N 2.82Å; S37-L39 VanDerWaalsContact C-N 3.33Å; S37-L39 PolarHBondContact O-N 2.78Å
40	S	48.6	Very low	54.3	Low	81 Å²	81	122.7 Å²	122.7	57%	0.566	65%	0.646	S	S	*	*	H	α-helix	trans	-79.3	-17.8	178.1	-67.5	0	0	0	0	114.3	A36 S37 V42 K43	A36-S40 WeakPolarHBondContact O-CB 3.48Å; A36-S40 PolarHBondContact O-N 3.21Å; A36-S40 PolarHBondContact O-OG 2.83Å; S37-S40 PolarHBondContact O-N 2.78Å; S40-V42 PolarHBondContact O-N 3.36Å; S40-V42 VanDerWaalsContact O-N 3.09Å; S40-K43 PolarHBondContact O-N 3.33Å; S40-K43 VanDerWaalsContact O-N 3.17Å
41	T	44.3	Very low	53.3	Low	109 Å²	109	128.6 Å²	128.6	67%	0.669	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-2.3	176	42.3	0	0	0	0	115.1	S37 H38	S37-T41 PolarHBondContact O-N 2.69Å; S37-T41 VanDerWaalsContact O-N 3.12Å; H38-T41 PolarHBondContact O-OG1 3.48Å
42	V	45.1	Very low	52.3	Low	128 Å²	128	131.6 Å²	131.6	78%	0.776	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-5.9	173	-172.3	0	0	0	0	113	S40	S40-V42 PolarHBondContact O-N 3.36Å; S40-V42 VanDerWaalsContact O-N 3.09Å
43	K	44.2	Very low	51.1	Low	201 Å²	201	139.1 Å²	139.1	87%	0.874	70%	0.699	S	S	*	*	S	Bend	trans	-109.9	33.1	-177.3	-123.9	177.9	-173.5	171.4	0	115	S40	S40-K43 PolarHBondContact O-N 3.33Å; S40-K43 VanDerWaalsContact O-N 3.17Å
44	A	48.2	Very low	49.8	Very low	85 Å²	85	138.7 Å²	138.7	70%	0.702	70%	0.699	S	S	*	*			trans	-133.7	43.8	176.8	0	0	0	0	0	114
45	R	46	Very low	48.7	Very low	234 Å²	234	144.6 Å²	144.6	88%	0.883	72%	0.715	S	S	*	*			trans	-125.8	60.4	152.3	-74.5	-172.2	-177.7	169.3	1.7	109.8	I47	R45-I47 PolarHBondContact O-N 3.39Å
46	G	46	Very low	47.5	Very low	76 Å²	76	149.2 Å²	149.2	78%	0.784	73%	0.731	S	S	*	*			trans	-66.1	85.3	158.5	0	0	0	0	0	108.7	K48	G46-K48 VanDerWaalsContact C-N 3.28Å; G46-K48 PolarHBondContact O-N 2.78Å
47	I	45.8	Very low	47	Very low	142 Å²	142	152.2 Å²	152.2	73%	0.728	74%	0.744	S	S	*	*			trans	-64.8	96.6	167.7	-69.4	168.8	0	0	0	106.3	R45 H49	R45-I47 PolarHBondContact O-N 3.39Å; I47-H49 HydrophobicContact CG2-CB 3.8Å; I47-H49 PolarHBondContact O-N 3.22Å
48	K	50.9	Low	46.4	Very low	200 Å²	200	156.3 Å²	156.3	87%	0.87	76%	0.76	S	S	*	*			trans	-72	62.8	164.1	-165.4	-178.9	-174.6	-179.8	0	108.1	G46 R50	G46-K48 VanDerWaalsContact C-N 3.28Å; G46-K48 PolarHBondContact O-N 2.78Å; K48-R50 VanDerWaalsContact C-N 3.32Å; K48-R50 PolarHBondContact O-N 3.29Å; K48-R50 VanDerWaalsContact O-N 3.08Å
49	H	49.1	Very low	45.9	Very low	144 Å²	144	154.6 Å²	154.6	67%	0.667	76%	0.761	S	S	*	*			trans	-77.8	97.9	163.6	-146.7	-99.3	0	0	0	106.2	I47 F51	I47-H49 HydrophobicContact CG2-CB 3.8Å; I47-H49 PolarHBondContact O-N 3.22Å; H49-F51 PolarHBondContact O-N 3.41Å
50	R	48.9	Very low	46	Very low	225 Å²	225	154 Å²	154	85%	0.849	77%	0.769	S	S	*	*			trans	-57.7	88.6	165.4	-152.2	-174.9	-162.4	-174.6	4.8	105.6	K48 K52	K48-R50 VanDerWaalsContact C-N 3.32Å; K48-R50 PolarHBondContact O-N 3.29Å; K48-R50 VanDerWaalsContact O-N 3.08Å; R50-K52 PolarHBondContact O-N 3.4Å
51	F	50.2	Low	45.5	Very low	182 Å²	182	154.8 Å²	154.8	80%	0.798	77%	0.774	S	S	*	*			trans	-67.5	89.1	168.4	-129.5	-86.5	0	0	0	105	H49 W53	H49-F51 PolarHBondContact O-N 3.41Å; F51-W53 PolarHBondContact O-N 3.48Å
52	K	49.2	Very low	45.7	Very low	169 Å²	169	153.5 Å²	153.5	74%	0.735	78%	0.783	S	S	*	*			trans	-64.7	85	172.2	-173.9	-174.1	-179.2	-169.8	0	105.2	R50 N54	R50-K52 PolarHBondContact O-N 3.4Å; K52-N54 VanDerWaalsContact C-N 3.32Å; K52-N54 PolarHBondContact O-N 3.28Å
53	W	40.8	Very low	45.2	Very low	217 Å²	217	150.2 Å²	150.2	82%	0.822	78%	0.775	S	S	*	*			trans	-53.6	104.7	164.5	-171.2	-92.5	0	0	0	105.4	F51 R55	F51-W53 PolarHBondContact O-N 3.48Å; W53-R55 PolarHBondContact O-N 2.99Å
54	N	39.3	Very low	45.1	Very low	127 Å²	127	149.6 Å²	149.6	68%	0.679	78%	0.775	S	S	*	*			trans	-60.3	97.7	171.1	-100.8	-29.8	0	0	0	105.7	K52 K56	K52-N54 VanDerWaalsContact C-N 3.32Å; K52-N54 PolarHBondContact O-N 3.28Å; N54-K56 PolarHBondContact O-N 3.03Å
55	R	45.8	Very low	45	Very low	216 Å²	216	151.5 Å²	151.5	82%	0.815	77%	0.772	S	S	*	*			trans	-59.6	89.8	155.6	-92.7	-168.2	-103.1	-176.9	-7.1	106.4	W53 V57	W53-R55 PolarHBondContact O-N 2.99Å; R55-V57 HydrophobicContact CB-CG2 4.31Å; R55-V57 HydrophobicContact CG-CG2 4.24Å
56	K	36.7	Very low	45.3	Very low	202 Å²	202	144.7 Å²	144.7	88%	0.878	76%	0.756	S	S	*	*			trans	-87.7	96	137.8	-69.6	-160.4	-178.5	-169.5	0	105.5	N54	N54-K56 PolarHBondContact O-N 3.03Å
57	V	48.7	Very low	45.4	Very low	111 Å²	111	149.4 Å²	149.4	67%	0.673	76%	0.758	S	S	*	*			trans	-72.3	139.8	160.2	174.8	0	0	0	0	106.6	R55	R55-V57 HydrophobicContact CB-CG2 4.31Å; R55-V57 HydrophobicContact CG-CG2 4.24Å
58	L	45	Very low	45.5	Very low	154 Å²	154	146.1 Å²	146.1	81%	0.806	75%	0.752	S	S	*	*			trans	117.3	142.9	151.1	-141	72.2	0	0	0	115.6
59	P	43.5	Very low	45.5	Very low	100 Å²	100	144.8 Å²	144.8	65%	0.649	74%	0.741	S	S	*	*			cis	-112.5	160.2	-10.9	8	16.2	0	0	0	113.7	S61	P59-S61 PolarHBondContact O-N 3.24Å
60	S	49.8	Very low	45.6	Very low	131 Å²	131	141.5 Å²	141.5	92%	0.916	73%	0.731	S	S	*	*			trans	-50	107.2	146.2	-167.8	0	0	0	0	108.5
61	S	38.5	Very low	46	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	72%	0.716	S	S	*	*			trans	-130	113.2	163.6	-169.3	0	0	0	0	106.6	P59 G63	P59-S61 PolarHBondContact O-N 3.24Å; S61-G63 PolarHBondContact O-N 3.02Å; S61-G63 VanDerWaalsContact O-N 3.09Å
62	G	47.6	Very low	46.5	Very low	82 Å²	82	131.3 Å²	131.3	85%	0.845	71%	0.707	S	S	*	*			trans	-48	119	153.7	0	0	0	0	0	107.4
63	G	35.9	Very low	47.5	Very low	59 Å²	59	128.2 Å²	128.2	61%	0.608	70%	0.698	S	S	*	*			trans	-152.6	106.1	-177.5	0	0	0	0	0	104.9	S61 I65	S61-G63 PolarHBondContact O-N 3.02Å; S61-G63 VanDerWaalsContact O-N 3.09Å; G63-I65 PolarHBondContact O-N 3.08Å
64	Q	41.9	Very low	49.5	Very low	188 Å²	188	123.9 Å²	123.9	88%	0.879	68%	0.682	S	S	*	*			trans	-34.2	120.3	-176.7	-69	168.3	-51.5	0	0	110.9	T66	Q64-T66 VanDerWaalsContact C-N 3.25Å; Q64-T66 PolarHBondContact O-N 3.31Å
65	I	45.5	Very low	51.7	Low	125 Å²	125	121.2 Å²	121.2	64%	0.641	67%	0.672	S	S	*	*			trans	-63.2	101.3	166.7	-48	174.7	0	0	0	104.4	G63 E67 R69 V70	G63-I65 PolarHBondContact O-N 3.08Å; I65-E67 PolarHBondContact O-N 3.47Å; I65-R69 HydrophobicContact CG2-CB 4.19Å; I65-V70 HydrophobicContact CB-CG2 3.7Å; I65-V70 HydrophobicContact CG2-CB 4.48Å; I65-V70 HydrophobicContact CG2-CG2 3.29Å
66	T	51.8	Low	53.7	Low	91 Å²	91	111 Å²	111	56%	0.558	63%	0.633	S	S	*	*			trans	-53.1	129	174.4	41	0	0	0	0	107.8	Q64 A68 R69	Q64-T66 VanDerWaalsContact C-N 3.25Å; Q64-T66 PolarHBondContact O-N 3.31Å; T66-A68 PolarHBondContact O-N 3.47Å; T66-R69 PolarHBondContact O-N 3.08Å
67	E	48.8	Very low	56.3	Low	175 Å²	175	101.6 Å²	101.6	82%	0.818	59%	0.593	S	S	*	*	H	α-helix	trans	-44.4	-32.8	-173.1	-151.8	173.4	168.9	0	0	113.6	I65 R69 V70 A71	I65-E67 PolarHBondContact O-N 3.47Å; E67-R69 PolarHBondContact O-N 2.89Å; E67-V70 PolarHBondContact O-N 2.78Å; E67-A71 PolarHBondContact O-N 3.31Å
68	A	47.3	Very low	58.3	Low	72 Å²	72	97.7 Å²	97.7	60%	0.595	57%	0.567	S	S	*	*	H	α-helix	trans	-59.3	-41.1	174.4	0	0	0	0	0	114.6	T66 E72	T66-A68 PolarHBondContact O-N 3.47Å; A68-E72 PolarHBondContact O-N 3.28Å
69	R	50.3	Low	60.4	Low	172 Å²	172	93.2 Å²	93.2	65%	0.649	54%	0.544	S	S	*	.	H	α-helix	trans	-79.7	-25.6	176.8	-75.6	-169.4	179.2	-167.8	1.2	112.8	I65 T66 E67 A71 N73	I65-R69 HydrophobicContact CG2-CB 4.19Å; T66-R69 PolarHBondContact O-N 3.08Å; E67-R69 PolarHBondContact O-N 2.89Å; R69-A71 VanDerWaalsContact C-N 3.33Å; R69-N73 PolarHBondContact O-N 2.75Å
70	V	51.4	Low	62.5	Low	76 Å²	76	93.4 Å²	93.4	46%	0.461	53%	0.534	S	S	.	.	H	α-helix	trans	-67.5	-39.4	172.2	-176.4	0	0	0	0	109.9	I65 E67 E72 N73	I65-V70 HydrophobicContact CB-CG2 3.7Å; I65-V70 HydrophobicContact CG2-CB 4.48Å; I65-V70 HydrophobicContact CG2-CG2 3.29Å; E67-V70 PolarHBondContact O-N 2.78Å; V70-E72 VanDerWaalsContact C-N 3.34Å; V70-E72 PolarHBondContact O-N 3.42Å; V70-N73 PolarHBondContact O-N 3.4Å
71	A	57.7	Low	64.2	Low	64 Å²	64	93.2 Å²	93.2	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-63.5	-37.7	177.7	0	0	0	0	0	112.7	E67 R69 A77	E67-A71 PolarHBondContact O-N 3.31Å; R69-A71 VanDerWaalsContact C-N 3.33Å; A71-A77 WeakPolarHBondContact O-CB 3.48Å
72	E	60.3	Low	66.5	Low	128 Å²	128	90.1 Å²	90.1	60%	0.598	50%	0.502	S	S	*	.	H	α-helix	trans	-70.8	-29.7	178.8	-72	180	161.5	0	0	113.7	A68 V70 A77	A68-E72 PolarHBondContact O-N 3.28Å; V70-E72 VanDerWaalsContact C-N 3.34Å; V70-E72 PolarHBondContact O-N 3.42Å; E72-A77 WeakPolarHBondContact O-CB 3.32Å
73	N	70.2	Confident	68.4	Low	105 Å²	105	93.1 Å²	93.1	56%	0.561	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	10.2	-179.8	-73.3	-16	0	0	0	113.6	R69 V70 Y109	R69-N73 PolarHBondContact O-N 2.75Å; V70-N73 PolarHBondContact O-N 3.4Å; N73-Y109 WeakPolarHBondContact O-CD1 3.43Å; N73-Y109 WeakPolarHBondContact O-CE1 3.44Å
74	R	83.2	Confident	71.1	Confident	126 Å²	126	96.1 Å²	96.1	48%	0.475	48%	0.484	S	S	.	.	S	Bend	trans	-73.5	135.4	175	-172.9	179.7	175.8	-171.2	-4.5	109.5	G76 A77 A133	R74-G76 PolarHBondContact O-N 3.42Å; R74-A77 HydrophobicContact CB-CB 4.43Å; R74-A77 WeakPolarHBondContact O-CB 3.44Å; R74-A77 PolarHBondContact O-N 3.25Å; R74-A133 PolarHBondContact NH2-O 2.84Å
75	P	86.5	Confident	73.4	Confident	71 Å²	71	89.1 Å²	89.1	46%	0.461	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	125.8	172.8	23.9	-33.8	0	0	0	110.2	Y109 Y110	P75-Y109 CarbonylContact C-O 3.57Å; P75-Y110 HydrophobicContact CB-CD2 4.19Å
76	G	87.6	Confident	75.6	Confident	0 Å²	0	91.4 Å²	91.4	0%	0	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-3	-172.6	0	0	0	0	0	115	R74 Y109 T131 N135	R74-G76 PolarHBondContact O-N 3.42Å; G76-Y109 PolarHBondContact N-O 3.01Å; G76-T131 WeakPolarHBondContact O-CA 3.49Å; G76-N135 PolarHBondContact O-ND2 2.79Å
77	A	90.7	Very high	77.4	Confident	6 Å²	6	88.8 Å²	88.8	5%	0.05	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	141.4	-179.7	0	0	0	0	0	112.3	A71 E72 R74 Y109	A71-A77 WeakPolarHBondContact O-CB 3.48Å; E72-A77 WeakPolarHBondContact O-CB 3.32Å; R74-A77 HydrophobicContact CB-CB 4.43Å; R74-A77 WeakPolarHBondContact O-CB 3.44Å; R74-A77 PolarHBondContact O-N 3.25Å; A77-Y109 PolarHBondContact O-N 3.15Å
78	F	90.8	Very high	79.5	Confident	28 Å²	28	86 Å²	86	12%	0.123	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	131.6	175.8	-71.5	-29.1	0	0	0	111.8	K80 P105 I108 T131 N135 E138 F139 L153 I157	F78-K80 HydrophobicContact CB-CG 4.44Å; F78-P105 HydrophobicContact CB-CB 3.94Å; F78-P105 HydrophobicContact CD1-CB 3.62Å; F78-P105 HydrophobicContact CD1-CG 3.68Å; F78-P105 HydrophobicContact CE1-CB 4.3Å; F78-P105 HydrophobicContact CE1-CG 3.83Å; F78-P105 HydrophobicContact CG-CB 3.86Å; F78-P105 HydrophobicContact CG-CG 4.16Å; F78-P105 HydrophobicContact CZ-CG 4.44Å; F78-I108 HydrophobicContact CD1-CG1 4.44Å; F78-T131 HydrophobicContact CD1-CG2 4.06Å; F78-T131 HydrophobicContact CE1-CG2 3.34Å; F78-T131 HydrophobicContact CZ-CG2 4.07Å; F78-N135 HydrophobicContact CD2-CB 3.99Å; F78-N135 WeakPolarHBondContact CD2-OD1 3.3Å; F78-N135 HydrophobicContact CE2-CB 3.55Å; F78-N135 HydrophobicContact CZ-CB 3.91Å; F78-E138 HydrophobicContact CE2-CB 4.36Å; F78-F139 HydrophobicContact CZ-CE2 4.05Å; F78-F139 HydrophobicContact CZ-CZ 4.32Å; F78-L153 HydrophobicContact CZ-CD1 4.26Å; F78-I157 HydrophobicContact CE1-CD1 3.83Å; F78-I157 HydrophobicContact CE1-CG1 4.14Å; F78-I157 HydrophobicContact CZ-CD1 3.9Å
79	I	88.1	Confident	81.7	Confident	61 Å²	61	84.1 Å²	84.1	31%	0.313	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	102.4	172.3	-51.6	174.5	0	0	0	107	Q81 D106 G107	I79-Q81 HydrophobicContact CG2-CG 4Å; I79-D106 PolarHBondContact O-N 3.15Å; I79-G107 WeakPolarHBondContact CB-O 3.41Å; I79-G107 PolarHBondContact N-O 3.05Å; I79-G107 PolarHBondContact O-N 2.84Å
80	K	89.1	Confident	83.7	Confident	104 Å²	104	77.3 Å²	77.3	45%	0.452	40%	0.401	S	S	.	.			trans	-101.8	96.9	179.6	-61.6	179.6	-175.4	176.8	0	109.3	F78 E138	F78-K80 HydrophobicContact CB-CG 4.44Å; K80-E138 IonicContact NZ-OE1 2.78Å; K80-E138 PolarHBondContact NZ-OE1 2.78Å
81	Q	85.6	Confident	85.6	Confident	126 Å²	126	77.1 Å²	77.1	59%	0.589	41%	0.407	S	S	*	.			trans	-98	-8.4	173.3	-50.1	178.9	-7.3	0	0	112	I79 D106	I79-Q81 HydrophobicContact CG2-CG 4Å; Q81-D106 WeakPolarHBondContact CA-OD2 3.44Å; Q81-D106 WeakPolarHBondContact CB-OD2 3.48Å; Q81-D106 PolarHBondContact N-OD2 3.31Å
82	G	85.6	Confident	87.3	Confident	33 Å²	33	79.5 Å²	79.5	34%	0.34	41%	0.408	S	S	.	.			trans	77.6	24.6	-176.9	0	0	0	0	0	113.8	Y101 D106	G82-Y101 WeakPolarHBondContact O-CE2 3.44Å; G82-D106 PolarHBondContact N-OD2 3.26Å
83	R	88.5	Confident	88.8	Confident	145 Å²	145	73.6 Å²	73.6	55%	0.547	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-91.4	122.1	-178.3	-170.8	-170.1	-47	-172.5	6.1	111.1	L85 D106	R83-L85 PolarHBondContact O-N 3.42Å; R83-L85 VanDerWaalsContact O-N 3.12Å; R83-D106 HydrophobicContact CB-CB 4.33Å; R83-D106 VanDerWaalsContact N-CG 3.26Å; R83-D106 PolarHBondContact N-OD1 2.96Å; R83-D106 VanDerWaalsContact N-OD1 3.12Å; R83-D106 PolarHBondContact N-OD2 3.49Å
84	K	91.3	Very high	89.9	Confident	123 Å²	123	71.2 Å²	71.2	54%	0.535	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-64	118.6	171.3	-170.2	179.5	178.3	-175.4	0	110.8	Y97 Y101	K84-Y97 HydrophobicContact CG-CE1 4Å; K84-Y101 HydrophobicContact CB-CD2 4.11Å; K84-Y101 HydrophobicContact CB-CG 4.14Å; K84-Y101 HydrophobicContact CG-CG 4.39Å
85	L	90.3	Very high	90.4	Very high	41 Å²	41	74 Å²	74	22%	0.215	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-86.4	148.3	174	-63.3	171.7	0	0	0	110.8	R83 I87 Y97 L156 I160	R83-L85 PolarHBondContact O-N 3.42Å; R83-L85 VanDerWaalsContact O-N 3.12Å; L85-I87 HydrophobicContact CB-CD1 4.05Å; L85-I87 HydrophobicContact CB-CG1 4.43Å; L85-I87 HydrophobicContact CD1-CD1 4.35Å; L85-I87 PolarHBondContact O-N 3.17Å; L85-Y97 WeakPolarHBondContact CB-OH 3.28Å; L85-Y97 PolarHBondContact N-OH 2.84Å; L85-Y97 VanDerWaalsContact N-OH 3.08Å; L85-Y97 WeakPolarHBondContact O-CE1 3.46Å; L85-L156 HydrophobicContact CD1-CD1 3.61Å; L85-I160 HydrophobicContact CD1-CD1 4.17Å; L85-I160 HydrophobicContact CD1-CG1 4.31Å
86	D	91.7	Very high	90.7	Very high	173 Å²	173	73 Å²	73	93%	0.925	37%	0.366	S	S	*	.			trans	-94.6	86.9	177.6	-171.5	31.4	0	0	0	109.8
87	I	91.3	Very high	90.9	Very high	35 Å²	35	73.2 Å²	73.2	18%	0.179	37%	0.367	C	S	.	.			trans	-133.3	135.8	-178.9	-65.1	164.1	0	0	0	108.3	L85 F89 L156 E159	L85-I87 HydrophobicContact CB-CD1 4.05Å; L85-I87 HydrophobicContact CB-CG1 4.43Å; L85-I87 HydrophobicContact CD1-CD1 4.35Å; L85-I87 PolarHBondContact O-N 3.17Å; I87-F89 HydrophobicContact CB-CD2 4.5Å; I87-F89 HydrophobicContact CB-CE1 4.32Å; I87-F89 HydrophobicContact CB-CE2 3.75Å; I87-F89 HydrophobicContact CB-CZ 3.64Å; I87-F89 HydrophobicContact CD1-CZ 4.23Å; I87-F89 HydrophobicContact CG2-CD1 4.15Å; I87-F89 HydrophobicContact CG2-CD2 4.36Å; I87-F89 HydrophobicContact CG2-CE1 3.63Å; I87-F89 HydrophobicContact CG2-CE2 3.88Å; I87-F89 HydrophobicContact CG2-CG 4.48Å; I87-F89 HydrophobicContact CG2-CZ 3.48Å; I87-F89 VanDerWaalsContact CG2-CZ 3.48Å; I87-F89 VanDerWaalsContact O-CD2 3.3Å; I87-F89 WeakPolarHBondContact O-CD2 3.22Å; I87-F89 WeakPolarHBondContact O-CE2 3.49Å; I87-L156 HydrophobicContact CD1-CD1 3.36Å; I87-E159 HydrophobicContact CD1-CB 3.85Å; I87-E159 HydrophobicContact CD1-CG 4.29Å; I87-E159 HydrophobicContact CG1-CB 4.39Å; I87-E159 HydrophobicContact CG1-CG 4.48Å; I87-E159 HydrophobicContact CG2-CG 3.82Å
88	D	93.2	Very high	91	Very high	117 Å²	117	75 Å²	75	63%	0.626	38%	0.381	S	S	*	.			trans	-86.2	110.9	174.5	-174.3	24.4	0	0	0	111.7	G90 N94	D88-G90 PolarHBondContact OD1-N 2.97Å; D88-N94 PolarHBondContact OD1-ND2 3.25Å
89	F	91.8	Very high	91.1	Very high	32 Å²	32	76.7 Å²	76.7	14%	0.14	40%	0.401	C	S	.	.			trans	-99.3	2.7	173.5	-54.9	-76.7	0	0	0	112.7	I87 N94 Y97 V152 R155 L156	I87-F89 HydrophobicContact CB-CD2 4.5Å; I87-F89 HydrophobicContact CB-CE1 4.32Å; I87-F89 HydrophobicContact CB-CE2 3.75Å; I87-F89 HydrophobicContact CB-CZ 3.64Å; I87-F89 HydrophobicContact CD1-CZ 4.23Å; I87-F89 HydrophobicContact CG2-CD1 4.15Å; I87-F89 HydrophobicContact CG2-CD2 4.36Å; I87-F89 HydrophobicContact CG2-CE1 3.63Å; I87-F89 HydrophobicContact CG2-CE2 3.88Å; I87-F89 HydrophobicContact CG2-CG 4.48Å; I87-F89 HydrophobicContact CG2-CZ 3.48Å; I87-F89 VanDerWaalsContact CG2-CZ 3.48Å; I87-F89 VanDerWaalsContact O-CD2 3.3Å; I87-F89 WeakPolarHBondContact O-CD2 3.22Å; I87-F89 WeakPolarHBondContact O-CE2 3.49Å; F89-N94 WeakPolarHBondContact CA-OD1 3.47Å; F89-N94 WeakPolarHBondContact CB-OD1 3.28Å; F89-N94 PolarHBondContact N-OD1 3.34Å; F89-Y97 HydrophobicContact CD2-CD1 4.32Å; F89-Y97 HydrophobicContact CD2-CG 4.17Å; F89-Y97 AromaticContact CE2-CD1 3.73Å; F89-Y97 HydrophobicContact CE2-CD1 3.73Å; F89-Y97 HydrophobicContact CE2-CD2 4.08Å; F89-Y97 HydrophobicContact CE2-CE1 4.14Å; F89-Y97 HydrophobicContact CE2-CE2 4.47Å; F89-Y97 AromaticContact CE2-CG 3.7Å; F89-Y97 HydrophobicContact CE2-CG 3.7Å; F89-Y97 HydrophobicContact CZ-CD2 4.47Å; F89-V152 HydrophobicContact CD1-CG1 4.08Å; F89-V152 HydrophobicContact CD2-CG1 4.4Å; F89-V152 HydrophobicContact CE1-CG1 4.06Å; F89-V152 HydrophobicContact CE2-CG1 4.38Å; F89-V152 HydrophobicContact CG-CG1 4.25Å; F89-V152 HydrophobicContact CZ-CG1 4.21Å; F89-R155 HydrophobicContact CD1-CB 3.79Å; F89-R155 HydrophobicContact CD1-CG 3.75Å; F89-R155 HydrophobicContact CE1-CB 3.91Å; F89-R155 HydrophobicContact CE1-CG 3.96Å; F89-L156 HydrophobicContact CE1-CB 3.95Å; F89-L156 HydrophobicContact CZ-CB 4.03Å; F89-L156 HydrophobicContact CZ-CD1 4.14Å
90	G	92.8	Very high	91.3	Very high	30 Å²	30	75.4 Å²	75.4	31%	0.309	39%	0.394	S	S	.	.	H	α-helix	trans	85	170.6	-169.4	0	0	0	0	0	113.2	D88 E92 G93 N94	D88-G90 PolarHBondContact OD1-N 2.97Å; G90-E92 VanDerWaalsContact C-N 3.31Å; G90-E92 PolarHBondContact O-N 3.31Å; G90-E92 VanDerWaalsContact O-N 3.15Å; G90-G93 PolarHBondContact O-N 3.21Å; G90-N94 VanDerWaalsContact O-CB 3.28Å; G90-N94 WeakPolarHBondContact O-CB 3.39Å; G90-N94 PolarHBondContact O-N 3.25Å; G90-N94 PolarHBondContact O-ND2 3.2Å; G90-N94 PolarHBondContact O-OD1 3.06Å
91	A	92.6	Very high	91.4	Very high	71 Å²	71	74.6 Å²	74.6	59%	0.587	39%	0.389	S	S	*	.	H	α-helix	trans	-58.3	-35.3	-167.8	0	0	0	0	0	115.3	R95	A91-R95 PolarHBondContact O-NE 3.19Å
92	E	92.1	Very high	91.5	Very high	114 Å²	114	75.9 Å²	75.9	53%	0.533	39%	0.389	S	S	.	.	H	α-helix	trans	-80.8	-47	178.4	-170.5	-174.4	-172.3	0	0	111.4	G90 N94 R95 Y96 L148	G90-E92 VanDerWaalsContact C-N 3.31Å; G90-E92 PolarHBondContact O-N 3.31Å; G90-E92 VanDerWaalsContact O-N 3.15Å; E92-N94 VanDerWaalsContact C-N 3.33Å; E92-N94 PolarHBondContact O-N 3.43Å; E92-R95 PolarHBondContact O-N 2.75Å; E92-Y96 PolarHBondContact O-N 2.87Å; E92-L148 HydrophobicContact CG-CD1 4.18Å; E92-L148 HydrophobicContact CG-CD2 3.95Å
93	G	91.5	Very high	91.6	Very high	4 Å²	4	76.9 Å²	76.9	4%	0.041	39%	0.385	C	S	.	.	H	α-helix	trans	-62.3	-39.1	178.8	0	0	0	0	0	112.5	G90 R95 Y96 Y97	G90-G93 PolarHBondContact O-N 3.21Å; G93-R95 PolarHBondContact O-N 2.9Å; G93-Y96 PolarHBondContact O-N 3.09Å; G93-Y97 WeakPolarHBondContact O-CB 3.24Å; G93-Y97 PolarHBondContact O-N 3.12Å
94	N	94.1	Very high	91.7	Very high	55 Å²	55	70 Å²	70	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-40.9	178.1	-68.2	-10.9	0	0	0	111.8	D88 F89 G90 E92 A98	D88-N94 PolarHBondContact OD1-ND2 3.25Å; F89-N94 WeakPolarHBondContact CA-OD1 3.47Å; F89-N94 WeakPolarHBondContact CB-OD1 3.28Å; F89-N94 PolarHBondContact N-OD1 3.34Å; G90-N94 VanDerWaalsContact O-CB 3.28Å; G90-N94 WeakPolarHBondContact O-CB 3.39Å; G90-N94 PolarHBondContact O-N 3.25Å; G90-N94 PolarHBondContact O-ND2 3.2Å; G90-N94 PolarHBondContact O-OD1 3.06Å; E92-N94 VanDerWaalsContact C-N 3.33Å; E92-N94 PolarHBondContact O-N 3.43Å; N94-A98 WeakPolarHBondContact O-CB 3.15Å; N94-A98 PolarHBondContact O-N 3.1Å
95	R	93.7	Very high	91.7	Very high	184 Å²	184	64.2 Å²	64.2	69%	0.694	33%	0.334	S	S	*	.	H	α-helix	trans	-65.5	-45.6	175.5	-79.5	-176.9	-91	175.3	-10.4	111.2	A91 E92 G93 A98 A99	A91-R95 PolarHBondContact O-NE 3.19Å; E92-R95 PolarHBondContact O-N 2.75Å; G93-R95 PolarHBondContact O-N 2.9Å; R95-A98 PolarHBondContact O-N 3.49Å; R95-A99 PolarHBondContact O-N 3.23Å
96	Y	92.2	Very high	91.7	Very high	52 Å²	52	63.1 Å²	63.1	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-63.1	-46.4	178	-177.2	-93.6	0	0	0	112.2	E92 G93 A99 N100 F104 L148 H149 V152	E92-Y96 PolarHBondContact O-N 2.87Å; G93-Y96 PolarHBondContact O-N 3.09Å; Y96-A99 PolarHBondContact O-N 3.11Å; Y96-N100 HydrophobicContact CE1-CB 4.35Å; Y96-N100 WeakPolarHBondContact O-CB 3.27Å; Y96-N100 PolarHBondContact O-N 3.4Å; Y96-N100 VanDerWaalsContact O-N 3.09Å; Y96-N100 PolarHBondContact O-ND2 2.89Å; Y96-F104 HydrophobicContact CD1-CZ 4.32Å; Y96-F104 HydrophobicContact CE1-CE2 4.16Å; Y96-F104 AromaticContact CE1-CZ 3.88Å; Y96-F104 HydrophobicContact CE1-CZ 3.88Å; Y96-L148 HydrophobicContact CD1-CG 4.49Å; Y96-L148 HydrophobicContact CD2-CD2 3.82Å; Y96-L148 HydrophobicContact CD2-CG 4.45Å; Y96-L148 HydrophobicContact CG-CD2 3.8Å; Y96-L148 HydrophobicContact CG-CG 4.16Å; Y96-H149 HydrophobicContact CE1-CB 4Å; Y96-H149 PolarHBondContact OH-ND1 2.72Å; Y96-V152 HydrophobicContact CD1-CG2 4.28Å
97	Y	92.9	Very high	91.7	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-64.3	-41.1	178.2	-176.5	-107.4	0	0	0	111.4	K84 L85 F89 G93 A99 N100 Y101 F104 V152 L156	K84-Y97 HydrophobicContact CG-CE1 4Å; L85-Y97 WeakPolarHBondContact CB-OH 3.28Å; L85-Y97 PolarHBondContact N-OH 2.84Å; L85-Y97 VanDerWaalsContact N-OH 3.08Å; L85-Y97 WeakPolarHBondContact O-CE1 3.46Å; F89-Y97 HydrophobicContact CD2-CD1 4.32Å; F89-Y97 HydrophobicContact CD2-CG 4.17Å; F89-Y97 AromaticContact CE2-CD1 3.73Å; F89-Y97 HydrophobicContact CE2-CD1 3.73Å; F89-Y97 HydrophobicContact CE2-CD2 4.08Å; F89-Y97 HydrophobicContact CE2-CE1 4.14Å; F89-Y97 HydrophobicContact CE2-CE2 4.47Å; F89-Y97 AromaticContact CE2-CG 3.7Å; F89-Y97 HydrophobicContact CE2-CG 3.7Å; F89-Y97 HydrophobicContact CZ-CD2 4.47Å; G93-Y97 WeakPolarHBondContact O-CB 3.24Å; G93-Y97 PolarHBondContact O-N 3.12Å; Y97-A99 PolarHBondContact O-N 2.93Å; Y97-N100 CarbonylContact O-C 3.59Å; Y97-N100 PolarHBondContact O-N 3.48Å; Y97-N100 VanDerWaalsContact O-N 3.14Å; Y97-Y101 WeakPolarHBondContact O-CA 3.12Å; Y97-Y101 WeakPolarHBondContact O-CB 3.48Å; Y97-Y101 PolarHBondContact O-N 2.86Å; Y97-F104 AromaticContact CD2-CD2 3.59Å; Y97-F104 HydrophobicContact CD2-CD2 3.59Å; Y97-F104 AromaticContact CD2-CE2 3.83Å; Y97-F104 HydrophobicContact CD2-CE2 3.83Å; Y97-F104 HydrophobicContact CD2-CG 4.01Å; Y97-F104 HydrophobicContact CD2-CZ 4.44Å; Y97-F104 HydrophobicContact CE2-CB 3.84Å; Y97-F104 AromaticContact CE2-CD2 3.69Å; Y97-F104 HydrophobicContact CE2-CD2 3.69Å; Y97-F104 HydrophobicContact CE2-CE2 4.39Å; Y97-F104 AromaticContact CE2-CG 3.78Å; Y97-F104 HydrophobicContact CE2-CG 3.78Å; Y97-V152 HydrophobicContact CD2-CG1 3.89Å; Y97-V152 HydrophobicContact CG-CG1 4.37Å; Y97-L156 HydrophobicContact CE2-CD2 4.16Å
98	A	92.6	Very high	91.7	Very high	42 Å²	42	53.9 Å²	53.9	35%	0.347	28%	0.282	S	S	.	.	H	α-helix	trans	-60.4	-29.9	177	0	0	0	0	0	113.5	N94 R95 Y101	N94-A98 WeakPolarHBondContact O-CB 3.15Å; N94-A98 PolarHBondContact O-N 3.1Å; R95-A98 PolarHBondContact O-N 3.49Å; A98-Y101 WeakPolarHBondContact O-CD1 3.35Å
99	A	92.7	Very high	91.5	Very high	64 Å²	64	51.5 Å²	51.5	53%	0.529	27%	0.265	S	S	.	.	H	α-helix	trans	-85.1	-27.1	176.1	0	0	0	0	0	113.5	R95 Y96 Y97	R95-A99 PolarHBondContact O-N 3.23Å; Y96-A99 PolarHBondContact O-N 3.11Å; Y97-A99 PolarHBondContact O-N 2.93Å
100	N	91.7	Very high	91.3	Very high	34 Å²	34	52.3 Å²	52.3	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-122	12.1	-168.5	-61.6	-74.3	0	0	0	114.5	Y96 Y97 W102 Q103 F104	Y96-N100 HydrophobicContact CE1-CB 4.35Å; Y96-N100 WeakPolarHBondContact O-CB 3.27Å; Y96-N100 PolarHBondContact O-N 3.4Å; Y96-N100 VanDerWaalsContact O-N 3.09Å; Y96-N100 PolarHBondContact O-ND2 2.89Å; Y97-N100 CarbonylContact O-C 3.59Å; Y97-N100 PolarHBondContact O-N 3.48Å; Y97-N100 VanDerWaalsContact O-N 3.14Å; N100-W102 PolarHBondContact O-N 2.88Å; N100-Q103 WeakPolarHBondContact O-CB 3.32Å; N100-Q103 PolarHBondContact O-N 2.69Å; N100-Q103 PolarHBondContact OD1-NE2 2.91Å; N100-F104 HydrophobicContact CB-CE2 4.09Å; N100-F104 VanDerWaalsContact O-CD2 3.25Å; N100-F104 WeakPolarHBondContact O-CD2 3.13Å
101	Y	90.7	Very high	90.8	Very high	88 Å²	88	57.8 Å²	57.8	35%	0.345	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-52.2	-31.4	-173.4	64.7	-88.8	0	0	0	113.8	G82 K84 Y97 A98 Q103 F104	G82-Y101 WeakPolarHBondContact O-CE2 3.44Å; K84-Y101 HydrophobicContact CB-CD2 4.11Å; K84-Y101 HydrophobicContact CB-CG 4.14Å; K84-Y101 HydrophobicContact CG-CG 4.39Å; Y97-Y101 WeakPolarHBondContact O-CA 3.12Å; Y97-Y101 WeakPolarHBondContact O-CB 3.48Å; Y97-Y101 PolarHBondContact O-N 2.86Å; A98-Y101 WeakPolarHBondContact O-CD1 3.35Å; Y101-Q103 PolarHBondContact O-N 2.93Å; Y101-F104 PolarHBondContact O-N 3.36Å; Y101-F104 VanDerWaalsContact O-N 3.11Å
102	W	88.8	Confident	90	Very high	152 Å²	152	54.9 Å²	54.9	58%	0.576	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-64.5	-19.8	179	59.1	-91.4	0	0	0	114.4	N100	N100-W102 PolarHBondContact O-N 2.88Å
103	Q	88.3	Confident	89.3	Confident	55 Å²	55	52 Å²	52	26%	0.257	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-82.2	-21.2	175.8	-63.9	-176.5	58.5	0	0	112.5	N100 Y101	N100-Q103 WeakPolarHBondContact O-CB 3.32Å; N100-Q103 PolarHBondContact O-N 2.69Å; N100-Q103 PolarHBondContact OD1-NE2 2.91Å; Y101-Q103 PolarHBondContact O-N 2.93Å
104	F	90.4	Very high	88.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-89.7	153.6	-172.6	-70.1	-82.1	0	0	0	112.1	Y96 Y97 N100 Y101 H149 V152 L153 L156	Y96-F104 HydrophobicContact CD1-CZ 4.32Å; Y96-F104 HydrophobicContact CE1-CE2 4.16Å; Y96-F104 AromaticContact CE1-CZ 3.88Å; Y96-F104 HydrophobicContact CE1-CZ 3.88Å; Y97-F104 AromaticContact CD2-CD2 3.59Å; Y97-F104 HydrophobicContact CD2-CD2 3.59Å; Y97-F104 AromaticContact CD2-CE2 3.83Å; Y97-F104 HydrophobicContact CD2-CE2 3.83Å; Y97-F104 HydrophobicContact CD2-CG 4.01Å; Y97-F104 HydrophobicContact CD2-CZ 4.44Å; Y97-F104 HydrophobicContact CE2-CB 3.84Å; Y97-F104 AromaticContact CE2-CD2 3.69Å; Y97-F104 HydrophobicContact CE2-CD2 3.69Å; Y97-F104 HydrophobicContact CE2-CE2 4.39Å; Y97-F104 AromaticContact CE2-CG 3.78Å; Y97-F104 HydrophobicContact CE2-CG 3.78Å; N100-F104 HydrophobicContact CB-CE2 4.09Å; N100-F104 VanDerWaalsContact O-CD2 3.25Å; N100-F104 WeakPolarHBondContact O-CD2 3.13Å; Y101-F104 PolarHBondContact O-N 3.36Å; Y101-F104 VanDerWaalsContact O-N 3.11Å; F104-H149 AromaticContact CE1-CE1 3.82Å; F104-H149 AromaticContact CE1-NE2 3.67Å; F104-H149 AromaticContact CZ-CE1 3.74Å; F104-H149 AromaticContact CZ-ND1 3.74Å; F104-V152 HydrophobicContact CD1-CG1 4.43Å; F104-V152 HydrophobicContact CE1-CB 4.12Å; F104-V152 HydrophobicContact CE1-CG1 3.7Å; F104-V152 HydrophobicContact CE2-CG1 4.32Å; F104-V152 HydrophobicContact CZ-CB 4.06Å; F104-V152 HydrophobicContact CZ-CG1 3.63Å; F104-L153 HydrophobicContact CD1-CB 4.29Å; F104-L153 HydrophobicContact CD1-CD1 3.91Å; F104-L153 HydrophobicContact CE1-CB 3.91Å; F104-L153 HydrophobicContact CE1-CD1 4.36Å; F104-L156 HydrophobicContact CB-CD2 3.56Å; F104-L156 HydrophobicContact CD1-CD2 3.78Å; F104-L156 HydrophobicContact CG-CD2 3.97Å
105	P	91.4	Very high	87	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.006	30%	0.302	C	S	.	.			trans	-71.4	138.8	171.9	29.8	-35.1	0	0	0	111.4	F78 L153 L156 I160	F78-P105 HydrophobicContact CB-CB 3.94Å; F78-P105 HydrophobicContact CD1-CB 3.62Å; F78-P105 HydrophobicContact CD1-CG 3.68Å; F78-P105 HydrophobicContact CE1-CB 4.3Å; F78-P105 HydrophobicContact CE1-CG 3.83Å; F78-P105 HydrophobicContact CG-CB 3.86Å; F78-P105 HydrophobicContact CG-CG 4.16Å; F78-P105 HydrophobicContact CZ-CG 4.44Å; P105-L153 HydrophobicContact CG-CD1 4.16Å; P105-L156 HydrophobicContact CG-CD2 4.19Å; P105-L156 WeakPolarHBondContact O-CD2 3.48Å; P105-I160 HydrophobicContact CG-CD1 4.46Å; P105-I160 WeakPolarHBondContact O-CD1 3.37Å
106	D	90.4	Very high	85.5	Confident	19 Å²	19	55.3 Å²	55.3	10%	0.102	30%	0.299	C	S	.	.	S	Bend	trans	-90.2	-19.8	171.4	-50.9	-38.6	0	0	0	111.5	I79 Q81 G82 R83	I79-D106 PolarHBondContact O-N 3.15Å; Q81-D106 WeakPolarHBondContact CA-OD2 3.44Å; Q81-D106 WeakPolarHBondContact CB-OD2 3.48Å; Q81-D106 PolarHBondContact N-OD2 3.31Å; G82-D106 PolarHBondContact N-OD2 3.26Å; R83-D106 HydrophobicContact CB-CB 4.33Å; R83-D106 VanDerWaalsContact N-CG 3.26Å; R83-D106 PolarHBondContact N-OD1 2.96Å; R83-D106 VanDerWaalsContact N-OD1 3.12Å; R83-D106 PolarHBondContact N-OD2 3.49Å
107	G	90.3	Very high	84.6	Confident	13 Å²	13	58.5 Å²	58.5	13%	0.134	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	166	179.1	0	0	0	0	0	111.9	I79	I79-G107 WeakPolarHBondContact CB-O 3.41Å; I79-G107 PolarHBondContact N-O 3.05Å; I79-G107 PolarHBondContact O-N 2.84Å
108	I	91.2	Very high	83.9	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.9	175.3	-63.1	165.5	0	0	0	107.6	F78 Y110 T131 I157 I160 K164	F78-I108 HydrophobicContact CD1-CG1 4.44Å; I108-Y110 PolarHBondContact O-N 3.46Å; I108-T131 HydrophobicContact CD1-CG2 4.04Å; I108-T131 HydrophobicContact CG1-CG2 4.44Å; I108-T131 WeakPolarHBondContact CG2-OG1 3.45Å; I108-I157 HydrophobicContact CD1-CB 4.25Å; I108-I157 HydrophobicContact CD1-CG1 4.18Å; I108-I157 HydrophobicContact CD1-CG2 3.82Å; I108-I160 HydrophobicContact CB-CG2 4.04Å; I108-I160 HydrophobicContact CD1-CB 4.06Å; I108-I160 HydrophobicContact CD1-CG2 3.82Å; I108-I160 HydrophobicContact CG1-CG2 3.84Å; I108-K164 WeakPolarHBondContact O-CE 3.47Å; I108-K164 PolarHBondContact O-NZ 2.95Å
109	Y	89.1	Confident	83.6	Confident	68 Å²	68	59.8 Å²	59.8	27%	0.267	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	108.6	171.1	-176.5	-98.2	0	0	0	108.9	N73 P75 G76 A77 E111	N73-Y109 WeakPolarHBondContact O-CD1 3.43Å; N73-Y109 WeakPolarHBondContact O-CE1 3.44Å; P75-Y109 CarbonylContact C-O 3.57Å; G76-Y109 PolarHBondContact N-O 3.01Å; A77-Y109 PolarHBondContact O-N 3.15Å; Y109-E111 PolarHBondContact OH-OE1 3.22Å
110	Y	87.4	Confident	83.2	Confident	49 Å²	49	61.8 Å²	61.8	19%	0.192	32%	0.32	C	S	.	.			trans	-153.9	119.1	178.8	-173.6	-106.3	0	0	0	110.2	P75 I108 L123 S126 C127 A130	P75-Y110 HydrophobicContact CB-CD2 4.19Å; I108-Y110 PolarHBondContact O-N 3.46Å; Y110-L123 HydrophobicContact CE1-CG 4.49Å; Y110-S126 WeakPolarHBondContact OH-CB 3.41Å; Y110-C127 HydrophobicContact CD1-CB 3.62Å; Y110-C127 HydrophobicContact CE1-CB 3.81Å; Y110-C127 HydrophobicContact CG-CB 4.07Å; Y110-A130 HydrophobicContact CD2-CB 3.81Å; Y110-A130 HydrophobicContact CE2-CB 3.58Å
111	E	82.8	Confident	83	Confident	144 Å²	144	66.3 Å²	66.3	67%	0.673	34%	0.34	S	S	*	.			trans	-106.5	73.7	178.7	-65	-172.7	158.3	0	0	109.7	Y109	Y109-E111 PolarHBondContact OH-OE1 3.22Å
112	G	76.4	Confident	82.9	Confident	10 Å²	10	66.7 Å²	66.7	10%	0.103	35%	0.347	C	S	.	.			trans	-90.5	3.5	-179.4	0	0	0	0	0	115.1
113	C	76.7	Confident	82.8	Confident	53 Å²	53	59.6 Å²	59.6	36%	0.358	32%	0.32	S	S	.	.			trans	-94.4	7	-170.9	-65.7	0	0	0	0	114.5	C166	C113-C166 WeakPolarHBondContact CA-SG 3.46Å; C113-C166 HydrophobicContact CB-CB 3.66Å; C113-C166 WeakPolarHBondContact CB-SG 3.37Å; C113-C166 WeakPolarHBondContact SG-CA 3.08Å; C113-C166 WeakPolarHBondContact SG-CB 3.35Å; C113-C166 CovalentContact SG-SG 2.03Å; C113-C166 PolarHBondContact SG-SG 3.04Å
114	S	69.6	Low	82.9	Confident	108 Å²	108	58 Å²	58	76%	0.755	31%	0.314	S	S	*	.			trans	-78.5	-22.4	-178.5	65.8	0	0	0	0	113.5
115	E	67.4	Low	83	Confident	129 Å²	129	61.7 Å²	61.7	60%	0.603	34%	0.337	S	S	*	.	S	Bend	trans	-87.6	122.5	177.7	-59	179.7	-177.5	0	0	109.9	N117 V118	E115-N117 PolarHBondContact O-N 3.37Å; E115-V118 HydrophobicContact CB-CG2 3.58Å; E115-V118 WeakPolarHBondContact O-CG2 3.25Å; E115-V118 PolarHBondContact O-N 3.41Å
116	A	63.7	Low	82.9	Confident	76 Å²	76	63.9 Å²	63.9	63%	0.628	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-7.6	-169.9	0	0	0	0	0	115.6
117	N	71.8	Confident	82.9	Confident	120 Å²	120	63 Å²	63	64%	0.642	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.8	26.1	-172.8	-67.8	-43.6	0	0	0	113.7	E115 T119	E115-N117 PolarHBondContact O-N 3.37Å; N117-T119 PolarHBondContact O-N 2.05Å
118	V	79	Confident	83	Confident	9 Å²	9	63 Å²	63	6%	0.055	34%	0.344	C	S	.	.			trans	-73.1	130	172.9	-168.3	0	0	0	0	109.4	E115 M122 L123 W169	E115-V118 HydrophobicContact CB-CG2 3.58Å; E115-V118 WeakPolarHBondContact O-CG2 3.25Å; E115-V118 PolarHBondContact O-N 3.41Å; V118-M122 HydrophobicContact CG1-CB 3.77Å; V118-L123 HydrophobicContact CG1-CB 3.8Å; V118-W169 VanDerWaalsContact O-CZ2 3.23Å; V118-W169 WeakPolarHBondContact O-CZ2 3.46Å; V118-W169 PolarHBondContact O-NE1 2.85Å
119	T	85.2	Confident	83	Confident	63 Å²	63	67.1 Å²	67.1	39%	0.387	37%	0.367	S	S	.	.			trans	-84.6	163.9	169.8	64.4	0	0	0	0	111	N117 E121 M122 L123	N117-T119 PolarHBondContact O-N 2.05Å; T119-E121 WeakPolarHBondContact CB-OE2 3.39Å; T119-E121 PolarHBondContact O-N 3.11Å; T119-E121 PolarHBondContact OG1-OE2 2.92Å; T119-M122 PolarHBondContact O-N 3.3Å; T119-M122 WeakPolarHBondContact OG1-CB 3.31Å; T119-M122 PolarHBondContact OG1-N 3.49Å; T119-L123 PolarHBondContact O-N 2.65Å
120	K	85.6	Confident	83.2	Confident	106 Å²	106	64.9 Å²	64.9	46%	0.461	36%	0.362	S	S	.	.	H	α-helix	trans	-58.4	-40.1	179	-172	176.1	-179.5	179.7	0	112.4	L123 V124 W169	K120-L123 PolarHBondContact O-N 2.88Å; K120-V124 VanDerWaalsContact O-CG2 3.24Å; K120-V124 WeakPolarHBondContact O-CG2 3.21Å; K120-V124 PolarHBondContact O-N 3.36Å; K120-W169 HydrophobicContact CB-CE3 4.4Å; K120-W169 HydrophobicContact CB-CH2 3.68Å; K120-W169 HydrophobicContact CB-CZ2 4.28Å; K120-W169 HydrophobicContact CB-CZ3 3.68Å; K120-W169 HydrophobicContact CD-CZ3 4.38Å; K120-W169 HydrophobicContact CG-CH2 4.06Å; K120-W169 HydrophobicContact CG-CZ3 3.79Å; K120-W169 VanDerWaalsContact N-CZ2 3.33Å
121	E	86.8	Confident	83.4	Confident	129 Å²	129	62.5 Å²	62.5	60%	0.603	35%	0.353	S	S	*	.	H	α-helix	trans	-68.4	-41.3	-179.1	-57.4	69.3	-146.9	0	0	110.8	T119 T125	T119-E121 WeakPolarHBondContact CB-OE2 3.39Å; T119-E121 PolarHBondContact O-N 3.11Å; T119-E121 PolarHBondContact OG1-OE2 2.92Å; E121-T125 VanDerWaalsContact O-CB 3.32Å; E121-T125 WeakPolarHBondContact O-CB 3.4Å; E121-T125 PolarHBondContact O-N 3.31Å; E121-T125 PolarHBondContact O-OG1 3.39Å
122	M	87.8	Confident	83.7	Confident	97 Å²	97	60.2 Å²	60.2	48%	0.478	34%	0.342	S	S	.	.	H	α-helix	trans	-64.5	-45.1	174.2	-81.9	174.3	68.8	0	0	111.4	V118 T119 V124 T125 S126	V118-M122 HydrophobicContact CG1-CB 3.77Å; T119-M122 PolarHBondContact O-N 3.3Å; T119-M122 WeakPolarHBondContact OG1-CB 3.31Å; T119-M122 PolarHBondContact OG1-N 3.49Å; M122-V124 PolarHBondContact O-N 2.91Å; M122-T125 PolarHBondContact O-N 3.07Å; M122-S126 VanDerWaalsContact O-CB 3.3Å; M122-S126 WeakPolarHBondContact O-CB 3.26Å; M122-S126 PolarHBondContact O-N 2.93Å; M122-S126 PolarHBondContact O-OG 2.73Å
123	L	88.6	Confident	84.3	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-46	179.8	-174.8	142.2	0	0	0	111.6	Y110 V118 T119 K120 S126 C127 K164 C166 W169	Y110-L123 HydrophobicContact CE1-CG 4.49Å; V118-L123 HydrophobicContact CG1-CB 3.8Å; T119-L123 PolarHBondContact O-N 2.65Å; K120-L123 PolarHBondContact O-N 2.88Å; L123-S126 PolarHBondContact O-N 3.45Å; L123-C127 WeakPolarHBondContact O-CB 3.03Å; L123-C127 PolarHBondContact O-N 3.24Å; L123-K164 HydrophobicContact CD2-CB 3.76Å; L123-C166 WeakPolarHBondContact CD1-SG 3.45Å; L123-W169 HydrophobicContact CB-CH2 4.05Å; L123-W169 HydrophobicContact CD1-CH2 4.18Å
124	V	90.1	Very high	84.8	Confident	22 Å²	22	60.8 Å²	60.8	13%	0.133	35%	0.35	C	S	.	.	H	α-helix	trans	-63.3	-45.6	179	173.7	0	0	0	0	110.6	K120 M122 C127 V128 C161	K120-V124 VanDerWaalsContact O-CG2 3.24Å; K120-V124 WeakPolarHBondContact O-CG2 3.21Å; K120-V124 PolarHBondContact O-N 3.36Å; M122-V124 PolarHBondContact O-N 2.91Å; V124-C127 PolarHBondContact O-N 3.09Å; V124-V128 VanDerWaalsContact O-CG2 3.25Å; V124-V128 WeakPolarHBondContact O-CG2 3.37Å; V124-V128 PolarHBondContact O-N 3.5Å; V124-C161 HydrophobicContact CG1-CB 4.24Å
125	T	91	Very high	85.6	Confident	77 Å²	77	56.7 Å²	56.7	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-46.2	-179.9	-55.8	0	0	0	0	111.3	E121 M122 V128 N129	E121-T125 VanDerWaalsContact O-CB 3.32Å; E121-T125 WeakPolarHBondContact O-CB 3.4Å; E121-T125 PolarHBondContact O-N 3.31Å; E121-T125 PolarHBondContact O-OG1 3.39Å; M122-T125 PolarHBondContact O-N 3.07Å; T125-V128 PolarHBondContact O-N 3.4Å; T125-N129 WeakPolarHBondContact O-CB 3.23Å; T125-N129 VanDerWaalsContact O-CG 3.24Å; T125-N129 PolarHBondContact O-N 2.99Å; T125-N129 PolarHBondContact O-ND2 3.49Å
126	S	90.1	Very high	86.3	Confident	46 Å²	46	56.9 Å²	56.9	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-67.3	-36.5	178.7	-60.6	0	0	0	0	112.2	Y110 M122 L123 N129 A130	Y110-S126 WeakPolarHBondContact OH-CB 3.41Å; M122-S126 VanDerWaalsContact O-CB 3.3Å; M122-S126 WeakPolarHBondContact O-CB 3.26Å; M122-S126 PolarHBondContact O-N 2.93Å; M122-S126 PolarHBondContact O-OG 2.73Å; L123-S126 PolarHBondContact O-N 3.45Å; S126-N129 PolarHBondContact O-N 2.91Å; S126-A130 VanDerWaalsContact O-CB 3.26Å; S126-A130 WeakPolarHBondContact O-CB 3.1Å; S126-A130 PolarHBondContact O-N 3.48Å
127	C	91	Very high	87.1	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-47.5	172.2	176.7	0	0	0	0	111.4	Y110 L123 V124 A130 T131 C161	Y110-C127 HydrophobicContact CD1-CB 3.62Å; Y110-C127 HydrophobicContact CE1-CB 3.81Å; Y110-C127 HydrophobicContact CG-CB 4.07Å; L123-C127 WeakPolarHBondContact O-CB 3.03Å; L123-C127 PolarHBondContact O-N 3.24Å; V124-C127 PolarHBondContact O-N 3.09Å; C127-A130 PolarHBondContact O-N 3.5Å; C127-T131 VanDerWaalsContact O-CB 3.31Å; C127-T131 WeakPolarHBondContact O-CB 3.15Å; C127-T131 PolarHBondContact O-N 3.3Å; C127-T131 PolarHBondContact O-OG1 2.03Å; C127-C161 HydrophobicContact CB-CB 3.72Å; C127-C161 WeakPolarHBondContact CB-SG 3.45Å; C127-C161 WeakPolarHBondContact SG-CB 3.24Å; C127-C161 CovalentContact SG-SG 2.05Å; C127-C161 PolarHBondContact SG-SG 3.3Å
128	V	91.6	Very high	87.5	Confident	14 Å²	14	54.7 Å²	54.7	9%	0.085	31%	0.306	C	S	.	.	H	α-helix	trans	-62.4	-46.2	177.5	171.4	0	0	0	0	111	V124 T125 T131 Q132 W154 I157 C161	V124-V128 VanDerWaalsContact O-CG2 3.25Å; V124-V128 WeakPolarHBondContact O-CG2 3.37Å; V124-V128 PolarHBondContact O-N 3.5Å; T125-V128 PolarHBondContact O-N 3.4Å; V128-T131 PolarHBondContact O-N 2.79Å; V128-Q132 PolarHBondContact O-N 2.9Å; V128-W154 HydrophobicContact CG1-CH2 3.2Å; V128-W154 HydrophobicContact CG1-CZ2 3.86Å; V128-W154 HydrophobicContact CG1-CZ3 3.67Å; V128-I157 HydrophobicContact CG2-CG2 4.19Å; V128-C161 HydrophobicContact CG2-CB 4.39Å
129	N	92.3	Very high	87.5	Confident	87 Å²	87	55.5 Å²	55.5	47%	0.465	31%	0.31	S	S	.	.	H	α-helix	trans	-62.8	-44.3	179.2	-72.1	-14.2	0	0	0	112	T125 S126 T131 Q132 A133	T125-N129 WeakPolarHBondContact O-CB 3.23Å; T125-N129 VanDerWaalsContact O-CG 3.24Å; T125-N129 PolarHBondContact O-N 2.99Å; T125-N129 PolarHBondContact O-ND2 3.49Å; S126-N129 PolarHBondContact O-N 2.91Å; N129-T131 VanDerWaalsContact C-N 3.33Å; N129-T131 PolarHBondContact O-N 3.01Å; N129-Q132 PolarHBondContact O-N 2.86Å; N129-A133 WeakPolarHBondContact O-CB 3.4Å; N129-A133 PolarHBondContact O-N 3.5Å
130	A	91.4	Very high	87.2	Confident	20 Å²	20	55.9 Å²	55.9	17%	0.165	31%	0.314	C	S	.	.	H	α-helix	trans	-62.6	-41.9	175.6	0	0	0	0	0	111.3	Y110 S126 C127 Q132 A133 A134	Y110-A130 HydrophobicContact CD2-CB 3.81Å; Y110-A130 HydrophobicContact CE2-CB 3.58Å; S126-A130 VanDerWaalsContact O-CB 3.26Å; S126-A130 WeakPolarHBondContact O-CB 3.1Å; S126-A130 PolarHBondContact O-N 3.48Å; C127-A130 PolarHBondContact O-N 3.5Å; A130-Q132 PolarHBondContact O-N 3.38Å; A130-A133 PolarHBondContact O-N 3.31Å; A130-A134 VanDerWaalsContact O-CB 3.27Å; A130-A134 WeakPolarHBondContact O-CB 3.25Å; A130-A134 PolarHBondContact O-N 2.97Å
131	T	91.9	Very high	86.7	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.3	-42.1	178.3	-56	0	0	0	0	111.9	G76 F78 I108 C127 V128 N129 A134 N135 I157	G76-T131 WeakPolarHBondContact O-CA 3.49Å; F78-T131 HydrophobicContact CD1-CG2 4.06Å; F78-T131 HydrophobicContact CE1-CG2 3.34Å; F78-T131 HydrophobicContact CZ-CG2 4.07Å; I108-T131 HydrophobicContact CD1-CG2 4.04Å; I108-T131 HydrophobicContact CG1-CG2 4.44Å; I108-T131 WeakPolarHBondContact CG2-OG1 3.45Å; C127-T131 VanDerWaalsContact O-CB 3.31Å; C127-T131 WeakPolarHBondContact O-CB 3.15Å; C127-T131 PolarHBondContact O-N 3.3Å; C127-T131 PolarHBondContact O-OG1 2.03Å; V128-T131 PolarHBondContact O-N 2.79Å; N129-T131 VanDerWaalsContact C-N 3.33Å; N129-T131 PolarHBondContact O-N 3.01Å; T131-A134 PolarHBondContact O-N 3.48Å; T131-N135 PolarHBondContact O-N 2.93Å; T131-N135 VanDerWaalsContact O-N 3.09Å; T131-N135 PolarHBondContact O-ND2 3.43Å; T131-I157 HydrophobicContact CG2-CD1 4.01Å; T131-I157 HydrophobicContact CG2-CG1 4.34Å; T131-I157 HydrophobicContact CG2-CG2 4.09Å
132	Q	89.6	Confident	86	Confident	95 Å²	95	55.3 Å²	55.3	44%	0.444	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-42.9	176.2	-171.2	177.9	24.6	0	0	111.7	V128 N129 A130 Q136	V128-Q132 PolarHBondContact O-N 2.9Å; N129-Q132 PolarHBondContact O-N 2.86Å; A130-Q132 PolarHBondContact O-N 3.38Å; Q132-Q136 PolarHBondContact O-N 2.83Å
133	A	88.3	Confident	85	Confident	54 Å²	54	57.5 Å²	57.5	45%	0.446	31%	0.312	S	S	.	.	H	α-helix	trans	-69	-32.6	178.8	0	0	0	0	0	113	R74 N129 A130	R74-A133 PolarHBondContact NH2-O 2.84Å; N129-A133 WeakPolarHBondContact O-CB 3.4Å; N129-A133 PolarHBondContact O-N 3.5Å; A130-A133 PolarHBondContact O-N 3.31Å
134	A	87.4	Confident	83.7	Confident	22 Å²	22	65.3 Å²	65.3	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-76	-36.8	179	0	0	0	0	0	112.6	A130 T131	A130-A134 VanDerWaalsContact O-CB 3.27Å; A130-A134 WeakPolarHBondContact O-CB 3.25Å; A130-A134 PolarHBondContact O-N 2.97Å; T131-A134 PolarHBondContact O-N 3.48Å
135	N	86.8	Confident	82.4	Confident	22 Å²	22	71 Å²	71	12%	0.118	38%	0.378	C	S	.	.	S	Bend	trans	-113.3	29.6	-172.3	-52	-82.2	0	0	0	112.9	G76 F78 T131 A137 E138 F139	G76-N135 PolarHBondContact O-ND2 2.79Å; F78-N135 HydrophobicContact CD2-CB 3.99Å; F78-N135 WeakPolarHBondContact CD2-OD1 3.3Å; F78-N135 HydrophobicContact CE2-CB 3.55Å; F78-N135 HydrophobicContact CZ-CB 3.91Å; T131-N135 PolarHBondContact O-N 2.93Å; T131-N135 VanDerWaalsContact O-N 3.09Å; T131-N135 PolarHBondContact O-ND2 3.43Å; N135-A137 PolarHBondContact O-N 2.87Å; N135-A137 VanDerWaalsContact O-N 3.11Å; N135-E138 HydrophobicContact CB-CB 4.33Å; N135-E138 HydrophobicContact CB-CG 4.42Å; N135-E138 WeakPolarHBondContact O-CB 3.05Å; N135-E138 PolarHBondContact O-N 3.17Å; N135-F139 HydrophobicContact CB-CD2 4.28Å; N135-F139 HydrophobicContact CB-CE2 4.3Å; N135-F139 VanDerWaalsContact O-CD2 3.32Å; N135-F139 WeakPolarHBondContact O-CD2 3.38Å; N135-F139 PolarHBondContact O-N 3.07Å; N135-F139 VanDerWaalsContact O-N 3.1Å
136	Q	82.4	Confident	81.6	Confident	132 Å²	132	68.8 Å²	68.8	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-55.2	-33.9	-175.6	-168.4	176.4	17.8	0	0	113.1	Q132 F139 S140	Q132-Q136 PolarHBondContact O-N 2.83Å; Q136-F139 PolarHBondContact O-N 3.22Å; Q136-S140 VanDerWaalsContact O-CB 3.32Å; Q136-S140 WeakPolarHBondContact O-CB 3.23Å; Q136-S140 PolarHBondContact O-N 3.09Å; Q136-S140 PolarHBondContact O-OG 3.17Å
137	A	80.1	Confident	81.4	Confident	80 Å²	80	75.4 Å²	75.4	66%	0.661	39%	0.389	S	S	*	.	H	α-helix	trans	-64.2	-45	176.2	0	0	0	0	0	112.7	N135 S140 R141	N135-A137 PolarHBondContact O-N 2.87Å; N135-A137 VanDerWaalsContact O-N 3.11Å; A137-S140 PolarHBondContact O-N 3.12Å; A137-R141 WeakPolarHBondContact O-CB 3.45Å; A137-R141 PolarHBondContact O-N 3.48Å
138	E	80.6	Confident	81.3	Confident	70 Å²	70	76.9 Å²	76.9	33%	0.327	40%	0.397	S	S	.	.	H	α-helix	trans	-62.3	-46.5	176.2	-64.2	-83.2	-141.2	0	0	109.9	F78 K80 N135 S140 R141 E142	F78-E138 HydrophobicContact CE2-CB 4.36Å; K80-E138 IonicContact NZ-OE1 2.78Å; K80-E138 PolarHBondContact NZ-OE1 2.78Å; N135-E138 HydrophobicContact CB-CB 4.33Å; N135-E138 HydrophobicContact CB-CG 4.42Å; N135-E138 WeakPolarHBondContact O-CB 3.05Å; N135-E138 PolarHBondContact O-N 3.17Å; E138-S140 VanDerWaalsContact C-N 3.28Å; E138-S140 PolarHBondContact O-N 3.09Å; E138-R141 PolarHBondContact O-N 3.16Å; E138-E142 WeakPolarHBondContact O-CB 3.24Å; E138-E142 PolarHBondContact O-N 3Å; E138-E142 VanDerWaalsContact O-N 3.08Å
139	F	79.5	Confident	81.2	Confident	27 Å²	27	76.7 Å²	76.7	12%	0.118	40%	0.395	C	S	.	.	H	α-helix	trans	-63.6	-31.5	176.5	-79.1	-74.3	0	0	0	113.8	F78 N135 Q136 K143 L153 I157	F78-F139 HydrophobicContact CZ-CE2 4.05Å; F78-F139 HydrophobicContact CZ-CZ 4.32Å; N135-F139 HydrophobicContact CB-CD2 4.28Å; N135-F139 HydrophobicContact CB-CE2 4.3Å; N135-F139 VanDerWaalsContact O-CD2 3.32Å; N135-F139 WeakPolarHBondContact O-CD2 3.38Å; N135-F139 PolarHBondContact O-N 3.07Å; N135-F139 VanDerWaalsContact O-N 3.1Å; Q136-F139 PolarHBondContact O-N 3.22Å; F139-K143 WeakPolarHBondContact O-CB 3.44Å; F139-K143 PolarHBondContact O-N 2.89Å; F139-L153 HydrophobicContact CD1-CD2 4.04Å; F139-L153 HydrophobicContact CE1-CD2 3.61Å; F139-L153 HydrophobicContact CE1-CG 4.16Å; F139-L153 HydrophobicContact CZ-CD2 4.07Å; F139-L153 HydrophobicContact CZ-CG 4.44Å; F139-I157 HydrophobicContact CE1-CD1 4.24Å; F139-I157 HydrophobicContact CE2-CD1 4.3Å; F139-I157 HydrophobicContact CZ-CD1 3.44Å; F139-I157 VanDerWaalsContact CZ-CD1 3.44Å
140	S	78.5	Confident	81	Confident	70 Å²	70	76.4 Å²	76.4	49%	0.49	39%	0.391	S	S	.	.	H	α-helix	trans	-78.8	-38.4	-177.7	-59.5	0	0	0	0	112	Q136 A137 E138	Q136-S140 VanDerWaalsContact O-CB 3.32Å; Q136-S140 WeakPolarHBondContact O-CB 3.23Å; Q136-S140 PolarHBondContact O-N 3.09Å; Q136-S140 PolarHBondContact O-OG 3.17Å; A137-S140 PolarHBondContact O-N 3.12Å; E138-S140 VanDerWaalsContact C-N 3.28Å; E138-S140 PolarHBondContact O-N 3.09Å
141	R	74.9	Confident	81	Confident	187 Å²	187	83.2 Å²	83.2	71%	0.706	41%	0.412	S	S	*	.	H	α-helix	trans	-67	-46.5	176.3	-172.5	178.8	179.2	-175.4	-1.4	111.2	A137 E138 K143	A137-R141 WeakPolarHBondContact O-CB 3.45Å; A137-R141 PolarHBondContact O-N 3.48Å; E138-R141 PolarHBondContact O-N 3.16Å; R141-K143 PolarHBondContact O-N 3.4Å
142	E	72.3	Confident	81	Confident	37 Å²	37	83.3 Å²	83.3	17%	0.173	41%	0.413	C	S	.	.	H	α-helix	trans	-77.1	-23.5	-173.5	-139.6	66.3	-163	0	0	113.7	E138 Q144 D145 S146 H149	E138-E142 WeakPolarHBondContact O-CB 3.24Å; E138-E142 PolarHBondContact O-N 3Å; E138-E142 VanDerWaalsContact O-N 3.08Å; E142-Q144 PolarHBondContact O-N 3.4Å; E142-D145 PolarHBondContact O-N 3.45Å; E142-S146 PolarHBondContact O-N 2.91Å; E142-H149 HydrophobicContact CG-CB 4.29Å; E142-H149 WeakPolarHBondContact CG-CD2 2.99Å; E142-H149 IonicContact OE1-CE1 3.57Å; E142-H149 IonicContact OE1-CG 3.94Å; E142-H149 IonicContact OE1-ND1 3.48Å; E142-H149 PolarHBondContact OE1-ND1 3Å
143	K	67.2	Low	81.1	Confident	142 Å²	142	79.1 Å²	79.1	62%	0.617	39%	0.393	S	S	*	.	H	α-helix	trans	-62.7	-22.9	178.4	-178.2	177.7	-177.1	-171.9	0	113.1	F139 R141	F139-K143 WeakPolarHBondContact O-CB 3.44Å; F139-K143 PolarHBondContact O-N 2.89Å; R141-K143 PolarHBondContact O-N 3.4Å
144	Q	60.6	Low	81.2	Confident	167 Å²	167	82.1 Å²	82.1	78%	0.78	39%	0.394	S	S	*	.	H	α-helix	trans	-83.6	-33	178.7	-69.1	-70.2	-7.1	0	0	112.9	E142	E142-Q144 PolarHBondContact O-N 3.4Å
145	D	62.5	Low	81.5	Confident	142 Å²	142	86.8 Å²	86.8	76%	0.759	41%	0.406	S	S	*	.	H	α-helix	trans	-97.4	-30.6	-167.6	-92.8	-30.2	0	0	0	114.9	E142	E142-D145 PolarHBondContact O-N 3.45Å
146	S	74.6	Confident	81.8	Confident	31 Å²	31	85.7 Å²	85.7	22%	0.217	40%	0.401	C	S	.	.			trans	-157.4	119.8	173.3	72.8	0	0	0	0	116.6	E142 L148 H149 Q150	E142-S146 PolarHBondContact O-N 2.91Å; S146-L148 PolarHBondContact O-N 2.86Å; S146-H149 PolarHBondContact O-N 3.34Å; S146-H149 WeakPolarHBondContact OG-CB 3.44Å; S146-H149 PolarHBondContact OG-N 3.01Å; S146-Q150 PolarHBondContact O-N 3.15Å
147	K	86.7	Confident	82.2	Confident	185 Å²	185	79.5 Å²	79.5	80%	0.804	37%	0.371	S	S	*	.	H	α-helix	trans	-57.4	-31.1	171.1	-67.6	-179.2	-179.6	175.3	0	112.4	R151	K147-R151 PolarHBondContact O-N 3.39Å; K147-R151 VanDerWaalsContact O-N 3.12Å
148	L	88.8	Confident	82.8	Confident	31 Å²	31	80.7 Å²	80.7	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-71.3	-43.9	179.9	-175	62.7	0	0	0	111.6	E92 Y96 S146 Q150 R151 V152	E92-L148 HydrophobicContact CG-CD1 4.18Å; E92-L148 HydrophobicContact CG-CD2 3.95Å; Y96-L148 HydrophobicContact CD1-CG 4.49Å; Y96-L148 HydrophobicContact CD2-CD2 3.82Å; Y96-L148 HydrophobicContact CD2-CG 4.45Å; Y96-L148 HydrophobicContact CG-CD2 3.8Å; Y96-L148 HydrophobicContact CG-CG 4.16Å; S146-L148 PolarHBondContact O-N 2.86Å; L148-Q150 VanDerWaalsContact C-N 3.32Å; L148-Q150 PolarHBondContact O-N 2.64Å; L148-R151 PolarHBondContact O-N 3.09Å; L148-V152 WeakPolarHBondContact O-CG2 3.24Å; L148-V152 PolarHBondContact O-N 3.18Å
149	H	88.9	Confident	83.4	Confident	9 Å²	9	80 Å²	80	4%	0.042	36%	0.359	C	S	.	.	H	α-helix	trans	-58.6	-47.1	174.4	-174.8	115.9	0	0	0	110.6	Y96 F104 E142 S146 R151 V152 L153	Y96-H149 HydrophobicContact CE1-CB 4Å; Y96-H149 PolarHBondContact OH-ND1 2.72Å; F104-H149 AromaticContact CE1-CE1 3.82Å; F104-H149 AromaticContact CE1-NE2 3.67Å; F104-H149 AromaticContact CZ-CE1 3.74Å; F104-H149 AromaticContact CZ-ND1 3.74Å; E142-H149 HydrophobicContact CG-CB 4.29Å; E142-H149 WeakPolarHBondContact CG-CD2 2.99Å; E142-H149 IonicContact OE1-CE1 3.57Å; E142-H149 IonicContact OE1-CG 3.94Å; E142-H149 IonicContact OE1-ND1 3.48Å; E142-H149 PolarHBondContact OE1-ND1 3Å; S146-H149 PolarHBondContact O-N 3.34Å; S146-H149 WeakPolarHBondContact OG-CB 3.44Å; S146-H149 PolarHBondContact OG-N 3.01Å; H149-R151 VanDerWaalsContact C-N 3.28Å; H149-R151 PolarHBondContact O-N 3.4Å; H149-V152 PolarHBondContact O-N 3.01Å; H149-L153 VanDerWaalsContact O-CB 3.28Å; H149-L153 WeakPolarHBondContact O-CB 3.47Å; H149-L153 PolarHBondContact O-N 3.04Å
150	Q	88.6	Confident	84	Confident	82 Å²	82	79.6 Å²	79.6	38%	0.383	36%	0.357	S	S	.	.	H	α-helix	trans	-60.1	-39.6	179.7	-169	-177.7	-22.7	0	0	111.9	S146 L148 W154	S146-Q150 PolarHBondContact O-N 3.15Å; L148-Q150 VanDerWaalsContact C-N 3.32Å; L148-Q150 PolarHBondContact O-N 2.64Å; Q150-W154 WeakPolarHBondContact O-CB 3.3Å; Q150-W154 PolarHBondContact O-N 3.31Å
151	R	90.4	Very high	84.6	Confident	162 Å²	162	76.2 Å²	76.2	61%	0.611	33%	0.334	S	S	*	.	H	α-helix	trans	-63.6	-46.2	176	-172.8	-171.5	-66	164.9	-1	111.7	K147 L148 H149 R155	K147-R151 PolarHBondContact O-N 3.39Å; K147-R151 VanDerWaalsContact O-N 3.12Å; L148-R151 PolarHBondContact O-N 3.09Å; H149-R151 VanDerWaalsContact C-N 3.28Å; H149-R151 PolarHBondContact O-N 3.4Å; R151-R155 WeakPolarHBondContact O-CB 3.32Å; R151-R155 PolarHBondContact O-N 3.45Å; R151-R155 VanDerWaalsContact O-N 3.07Å
152	V	92.3	Very high	85.3	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-48.5	178.8	174.3	0	0	0	0	110.4	F89 Y96 Y97 F104 L148 H149 W154 R155 L156	F89-V152 HydrophobicContact CD1-CG1 4.08Å; F89-V152 HydrophobicContact CD2-CG1 4.4Å; F89-V152 HydrophobicContact CE1-CG1 4.06Å; F89-V152 HydrophobicContact CE2-CG1 4.38Å; F89-V152 HydrophobicContact CG-CG1 4.25Å; F89-V152 HydrophobicContact CZ-CG1 4.21Å; Y96-V152 HydrophobicContact CD1-CG2 4.28Å; Y97-V152 HydrophobicContact CD2-CG1 3.89Å; Y97-V152 HydrophobicContact CG-CG1 4.37Å; F104-V152 HydrophobicContact CD1-CG1 4.43Å; F104-V152 HydrophobicContact CE1-CB 4.12Å; F104-V152 HydrophobicContact CE1-CG1 3.7Å; F104-V152 HydrophobicContact CE2-CG1 4.32Å; F104-V152 HydrophobicContact CZ-CB 4.06Å; F104-V152 HydrophobicContact CZ-CG1 3.63Å; L148-V152 WeakPolarHBondContact O-CG2 3.24Å; L148-V152 PolarHBondContact O-N 3.18Å; H149-V152 PolarHBondContact O-N 3.01Å; V152-W154 PolarHBondContact O-N 3.28Å; V152-R155 PolarHBondContact O-N 3.49Å; V152-L156 VanDerWaalsContact O-CB 3.24Å; V152-L156 WeakPolarHBondContact O-CB 3.44Å; V152-L156 PolarHBondContact O-N 3Å
153	L	91.6	Very high	86.1	Confident	7 Å²	7	70.7 Å²	70.7	4%	0.037	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-46.4	178.7	-177.7	61.5	0	0	0	111.4	F78 F104 P105 F139 H149 R155 L156 I157	F78-L153 HydrophobicContact CZ-CD1 4.26Å; F104-L153 HydrophobicContact CD1-CB 4.29Å; F104-L153 HydrophobicContact CD1-CD1 3.91Å; F104-L153 HydrophobicContact CE1-CB 3.91Å; F104-L153 HydrophobicContact CE1-CD1 4.36Å; P105-L153 HydrophobicContact CG-CD1 4.16Å; F139-L153 HydrophobicContact CD1-CD2 4.04Å; F139-L153 HydrophobicContact CE1-CD2 3.61Å; F139-L153 HydrophobicContact CE1-CG 4.16Å; F139-L153 HydrophobicContact CZ-CD2 4.07Å; F139-L153 HydrophobicContact CZ-CG 4.44Å; H149-L153 VanDerWaalsContact O-CB 3.28Å; H149-L153 WeakPolarHBondContact O-CB 3.47Å; H149-L153 PolarHBondContact O-N 3.04Å; L153-R155 PolarHBondContact O-N 3.09Å; L153-L156 PolarHBondContact O-N 3.43Å; L153-I157 HydrophobicContact CD1-CD1 3.95Å; L153-I157 HydrophobicContact CD1-CG1 4.3Å; L153-I157 HydrophobicContact CG-CD1 3.86Å; L153-I157 VanDerWaalsContact O-CG1 3.25Å; L153-I157 WeakPolarHBondContact O-CG1 3.49Å; L153-I157 PolarHBondContact O-N 3.48Å
154	W	90.9	Very high	86.8	Confident	118 Å²	118	67.5 Å²	67.5	45%	0.447	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-43.6	179.1	-173.5	-108.6	0	0	0	112.2	V128 Q150 V152 L156 K158	V128-W154 HydrophobicContact CG1-CH2 3.2Å; V128-W154 HydrophobicContact CG1-CZ2 3.86Å; V128-W154 HydrophobicContact CG1-CZ3 3.67Å; Q150-W154 WeakPolarHBondContact O-CB 3.3Å; Q150-W154 PolarHBondContact O-N 3.31Å; V152-W154 PolarHBondContact O-N 3.28Å; W154-L156 VanDerWaalsContact C-N 3.33Å; W154-K158 PolarHBondContact O-N 3.28Å; W154-K158 VanDerWaalsContact O-N 3.11Å
155	R	92.9	Very high	87.7	Confident	119 Å²	119	65.3 Å²	65.3	45%	0.449	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-43.3	176.6	-172.6	70.3	-162.9	-151.3	2.8	110.9	F89 R151 V152 L153 K158 E159	F89-R155 HydrophobicContact CD1-CB 3.79Å; F89-R155 HydrophobicContact CD1-CG 3.75Å; F89-R155 HydrophobicContact CE1-CB 3.91Å; F89-R155 HydrophobicContact CE1-CG 3.96Å; R151-R155 WeakPolarHBondContact O-CB 3.32Å; R151-R155 PolarHBondContact O-N 3.45Å; R151-R155 VanDerWaalsContact O-N 3.07Å; V152-R155 PolarHBondContact O-N 3.49Å; L153-R155 PolarHBondContact O-N 3.09Å; R155-K158 WeakPolarHBondContact O-CB 3.36Å; R155-K158 PolarHBondContact O-N 2.88Å; R155-E159 IonicContact CZ-OE1 3.31Å; R155-E159 VanDerWaalsContact CZ-OE1 3.31Å; R155-E159 IonicContact NE-OE1 3.01Å; R155-E159 PolarHBondContact NE-OE1 3.5Å; R155-E159 IonicContact NH2-OE1 2.79Å; R155-E159 PolarHBondContact NH2-OE1 3.27Å; R155-E159 WeakPolarHBondContact O-CG 3.41Å; R155-E159 PolarHBondContact O-N 3.22Å
156	L	92.9	Very high	88.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-48.2	179.7	175.6	61.4	0	0	0	111.8	L85 I87 F89 Y97 F104 P105 V152 L153 W154 K158 E159 I160	L85-L156 HydrophobicContact CD1-CD1 3.61Å; I87-L156 HydrophobicContact CD1-CD1 3.36Å; F89-L156 HydrophobicContact CE1-CB 3.95Å; F89-L156 HydrophobicContact CZ-CB 4.03Å; F89-L156 HydrophobicContact CZ-CD1 4.14Å; Y97-L156 HydrophobicContact CE2-CD2 4.16Å; F104-L156 HydrophobicContact CB-CD2 3.56Å; F104-L156 HydrophobicContact CD1-CD2 3.78Å; F104-L156 HydrophobicContact CG-CD2 3.97Å; P105-L156 HydrophobicContact CG-CD2 4.19Å; P105-L156 WeakPolarHBondContact O-CD2 3.48Å; V152-L156 VanDerWaalsContact O-CB 3.24Å; V152-L156 WeakPolarHBondContact O-CB 3.44Å; V152-L156 PolarHBondContact O-N 3Å; L153-L156 PolarHBondContact O-N 3.43Å; W154-L156 VanDerWaalsContact C-N 3.33Å; L156-K158 VanDerWaalsContact C-N 3.27Å; L156-K158 PolarHBondContact O-N 3.29Å; L156-E159 PolarHBondContact O-N 2.88Å; L156-E159 VanDerWaalsContact O-N 3.15Å; L156-I160 HydrophobicContact CD1-CD1 3.86Å; L156-I160 HydrophobicContact CD1-CG1 4.15Å; L156-I160 HydrophobicContact CG-CD1 3.84Å; L156-I160 HydrophobicContact CG-CG1 4.49Å; L156-I160 WeakPolarHBondContact O-CG1 3.42Å; L156-I160 PolarHBondContact O-N 3.39Å
157	I	92.3	Very high	88.5	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-41.9	177	-70.3	167.3	0	0	0	110.7	F78 I108 V128 T131 F139 L153 E159 I160 C161	F78-I157 HydrophobicContact CE1-CD1 3.83Å; F78-I157 HydrophobicContact CE1-CG1 4.14Å; F78-I157 HydrophobicContact CZ-CD1 3.9Å; I108-I157 HydrophobicContact CD1-CB 4.25Å; I108-I157 HydrophobicContact CD1-CG1 4.18Å; I108-I157 HydrophobicContact CD1-CG2 3.82Å; V128-I157 HydrophobicContact CG2-CG2 4.19Å; T131-I157 HydrophobicContact CG2-CD1 4.01Å; T131-I157 HydrophobicContact CG2-CG1 4.34Å; T131-I157 HydrophobicContact CG2-CG2 4.09Å; F139-I157 HydrophobicContact CE1-CD1 4.24Å; F139-I157 HydrophobicContact CE2-CD1 4.3Å; F139-I157 HydrophobicContact CZ-CD1 3.44Å; F139-I157 VanDerWaalsContact CZ-CD1 3.44Å; L153-I157 HydrophobicContact CD1-CD1 3.95Å; L153-I157 HydrophobicContact CD1-CG1 4.3Å; L153-I157 HydrophobicContact CG-CD1 3.86Å; L153-I157 VanDerWaalsContact O-CG1 3.25Å; L153-I157 WeakPolarHBondContact O-CG1 3.49Å; L153-I157 PolarHBondContact O-N 3.48Å; I157-E159 VanDerWaalsContact C-N 3.34Å; I157-E159 PolarHBondContact O-N 3.34Å; I157-I160 PolarHBondContact O-N 2.94Å; I157-C161 WeakPolarHBondContact O-CB 3.43Å; I157-C161 PolarHBondContact O-N 3.02Å; I157-C161 PolarHBondContact O-SG 3.09Å; I157-C161 VanDerWaalsContact O-SG 3.41Å
158	K	92.4	Very high	87.6	Confident	106 Å²	106	56.7 Å²	56.7	46%	0.461	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-42.2	177	-170.2	176.7	-178.3	177.5	0	111.9	W154 R155 L156 S162	W154-K158 PolarHBondContact O-N 3.28Å; W154-K158 VanDerWaalsContact O-N 3.11Å; R155-K158 WeakPolarHBondContact O-CB 3.36Å; R155-K158 PolarHBondContact O-N 2.88Å; L156-K158 VanDerWaalsContact C-N 3.27Å; L156-K158 PolarHBondContact O-N 3.29Å; K158-S162 VanDerWaalsContact O-CB 3.23Å; K158-S162 WeakPolarHBondContact O-CB 3.32Å; K158-S162 PolarHBondContact O-N 3.33Å; K158-S162 PolarHBondContact O-OG 2.88Å
159	E	93.1	Very high	86.6	Confident	56 Å²	56	58.2 Å²	58.2	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-69.5	-40.5	177	-62.3	-53.2	156.6	0	0	112.4	I87 R155 L156 I157 C161 S162 A163	I87-E159 HydrophobicContact CD1-CB 3.85Å; I87-E159 HydrophobicContact CD1-CG 4.29Å; I87-E159 HydrophobicContact CG1-CB 4.39Å; I87-E159 HydrophobicContact CG1-CG 4.48Å; I87-E159 HydrophobicContact CG2-CG 3.82Å; R155-E159 IonicContact CZ-OE1 3.31Å; R155-E159 VanDerWaalsContact CZ-OE1 3.31Å; R155-E159 IonicContact NE-OE1 3.01Å; R155-E159 PolarHBondContact NE-OE1 3.5Å; R155-E159 IonicContact NH2-OE1 2.79Å; R155-E159 PolarHBondContact NH2-OE1 3.27Å; R155-E159 WeakPolarHBondContact O-CG 3.41Å; R155-E159 PolarHBondContact O-N 3.22Å; L156-E159 PolarHBondContact O-N 2.88Å; L156-E159 VanDerWaalsContact O-N 3.15Å; I157-E159 VanDerWaalsContact C-N 3.34Å; I157-E159 PolarHBondContact O-N 3.34Å; E159-C161 PolarHBondContact O-N 2.91Å; E159-S162 WeakPolarHBondContact CA-OG 3.3Å; E159-S162 PolarHBondContact O-N 3.38Å; E159-S162 PolarHBondContact O-OG 2.98Å; E159-S162 PolarHBondContact OE2-OG 3.26Å; E159-A163 WeakPolarHBondContact O-CB 3.27Å; E159-A163 PolarHBondContact O-N 2.97Å
160	I	91.7	Very high	85.2	Confident	17 Å²	17	63.2 Å²	63.2	9%	0.087	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-44.6	176.2	-66.1	168.7	0	0	0	110.5	L85 P105 I108 L156 I157	L85-I160 HydrophobicContact CD1-CD1 4.17Å; L85-I160 HydrophobicContact CD1-CG1 4.31Å; P105-I160 HydrophobicContact CG-CD1 4.46Å; P105-I160 WeakPolarHBondContact O-CD1 3.37Å; I108-I160 HydrophobicContact CB-CG2 4.04Å; I108-I160 HydrophobicContact CD1-CB 4.06Å; I108-I160 HydrophobicContact CD1-CG2 3.82Å; I108-I160 HydrophobicContact CG1-CG2 3.84Å; L156-I160 HydrophobicContact CD1-CD1 3.86Å; L156-I160 HydrophobicContact CD1-CG1 4.15Å; L156-I160 HydrophobicContact CG-CD1 3.84Å; L156-I160 HydrophobicContact CG-CG1 4.49Å; L156-I160 WeakPolarHBondContact O-CG1 3.42Å; L156-I160 PolarHBondContact O-N 3.39Å; I157-I160 PolarHBondContact O-N 2.94Å
161	C	90.5	Very high	83.7	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68.6	-34.4	177.1	-71.3	0	0	0	0	112.2	V124 C127 V128 I157 E159 A163 K164	V124-C161 HydrophobicContact CG1-CB 4.24Å; C127-C161 HydrophobicContact CB-CB 3.72Å; C127-C161 WeakPolarHBondContact CB-SG 3.45Å; C127-C161 WeakPolarHBondContact SG-CB 3.24Å; C127-C161 CovalentContact SG-SG 2.05Å; C127-C161 PolarHBondContact SG-SG 3.3Å; V128-C161 HydrophobicContact CG2-CB 4.39Å; I157-C161 WeakPolarHBondContact O-CB 3.43Å; I157-C161 PolarHBondContact O-N 3.02Å; I157-C161 PolarHBondContact O-SG 3.09Å; I157-C161 VanDerWaalsContact O-SG 3.41Å; E159-C161 PolarHBondContact O-N 2.91Å; C161-A163 VanDerWaalsContact C-N 3.33Å; C161-K164 WeakPolarHBondContact O-CB 3.48Å; C161-K164 PolarHBondContact O-N 3.39Å
162	S	90.4	Very high	82.1	Confident	37 Å²	37	66.9 Å²	66.9	26%	0.259	31%	0.313	S	S	.	.	H	α-helix	trans	-71.4	-28	179	77.4	0	0	0	0	113.4	K158 E159 K164	K158-S162 VanDerWaalsContact O-CB 3.23Å; K158-S162 WeakPolarHBondContact O-CB 3.32Å; K158-S162 PolarHBondContact O-N 3.33Å; K158-S162 PolarHBondContact O-OG 2.88Å; E159-S162 WeakPolarHBondContact CA-OG 3.3Å; E159-S162 PolarHBondContact O-N 3.38Å; E159-S162 PolarHBondContact O-OG 2.98Å; E159-S162 PolarHBondContact OE2-OG 3.26Å; S162-K164 VanDerWaalsContact C-N 3.29Å
163	A	88	Confident	80.3	Confident	71 Å²	71	68.7 Å²	68.7	59%	0.587	33%	0.332	S	S	*	.	H	α-helix	trans	-72.7	-21.1	174.6	0	0	0	0	0	112.9	E159 C161 H165	E159-A163 WeakPolarHBondContact O-CB 3.27Å; E159-A163 PolarHBondContact O-N 2.97Å; C161-A163 VanDerWaalsContact C-N 3.33Å; A163-H165 PolarHBondContact O-N 3.46Å; A163-H165 PolarHBondContact O-ND1 3.32Å; A163-H165 VanDerWaalsContact O-ND1 3.09Å
164	K	83.4	Confident	78.4	Confident	75 Å²	75	70.7 Å²	70.7	33%	0.326	35%	0.35	S	S	.	.			trans	-68.1	132.6	174	-62.6	-73.2	-174	167.2	0	109.6	I108 L123 C161 S162	I108-K164 WeakPolarHBondContact O-CE 3.47Å; I108-K164 PolarHBondContact O-NZ 2.95Å; L123-K164 HydrophobicContact CD2-CB 3.76Å; C161-K164 WeakPolarHBondContact O-CB 3.48Å; C161-K164 PolarHBondContact O-N 3.39Å; S162-K164 VanDerWaalsContact C-N 3.29Å
165	H	78.9	Confident	76.4	Confident	121 Å²	121	68.5 Å²	68.5	56%	0.56	36%	0.356	S	S	*	.			trans	-135.9	152.7	176.6	51.4	-82.2	0	0	0	108.8	A163	A163-H165 PolarHBondContact O-N 3.46Å; A163-H165 PolarHBondContact O-ND1 3.32Å; A163-H165 VanDerWaalsContact O-ND1 3.09Å
166	C	80.1	Confident	74.1	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.007	37%	0.371	C	S	.	.			trans	-101.5	139	173.5	-55.4	0	0	0	0	110	C113 L123 F168 W169	C113-C166 WeakPolarHBondContact CA-SG 3.46Å; C113-C166 HydrophobicContact CB-CB 3.66Å; C113-C166 WeakPolarHBondContact CB-SG 3.37Å; C113-C166 WeakPolarHBondContact SG-CA 3.08Å; C113-C166 WeakPolarHBondContact SG-CB 3.35Å; C113-C166 CovalentContact SG-SG 2.03Å; C113-C166 PolarHBondContact SG-SG 3.04Å; L123-C166 WeakPolarHBondContact CD1-SG 3.45Å; C166-F168 HydrophobicContact CB-CD1 3.39Å; C166-F168 HydrophobicContact CB-CE1 3.19Å; C166-F168 HydrophobicContact CB-CG 4.36Å; C166-F168 HydrophobicContact CB-CZ 4.04Å; C166-F168 PolarHBondContact O-N 2.96Å; C166-F168 VanDerWaalsContact O-N 3.16Å; C166-W169 PolarHBondContact O-N 3.48Å; C166-W169 VanDerWaalsContact O-N 3.09Å
167	D	73.5	Confident	72	Confident	125 Å²	125	79.7 Å²	79.7	67%	0.668	41%	0.409	S	S	*	.	H	α-helix	trans	-57.9	-33.1	-176.6	-63.1	-38.7	0	0	0	112.6	W169 L170	D167-W169 VanDerWaalsContact C-N 3.26Å; D167-W169 PolarHBondContact O-N 2.95Å; D167-L170 WeakPolarHBondContact O-CB 3.27Å; D167-L170 PolarHBondContact O-N 3.38Å
168	F	67.6	Low	69.7	Low	50 Å²	50	85.3 Å²	85.3	22%	0.219	44%	0.443	C	S	.	.	H	α-helix	trans	-65.5	-21.8	-180	73.6	-95.6	0	0	0	114.4	C166 L170 R172	C166-F168 HydrophobicContact CB-CD1 3.39Å; C166-F168 HydrophobicContact CB-CE1 3.19Å; C166-F168 HydrophobicContact CB-CG 4.36Å; C166-F168 HydrophobicContact CB-CZ 4.04Å; C166-F168 PolarHBondContact O-N 2.96Å; C166-F168 VanDerWaalsContact O-N 3.16Å; F168-L170 VanDerWaalsContact C-N 3.32Å; F168-R172 PolarHBondContact O-N 3.04Å
169	W	67.3	Low	67.7	Low	63 Å²	63	84.4 Å²	84.4	24%	0.239	46%	0.455	C	S	.	.	H	α-helix	trans	-71.3	-29.5	173.4	-68	-12.7	0	0	0	112.4	V118 K120 L123 C166 D167 G173	V118-W169 VanDerWaalsContact O-CZ2 3.23Å; V118-W169 WeakPolarHBondContact O-CZ2 3.46Å; V118-W169 PolarHBondContact O-NE1 2.85Å; K120-W169 HydrophobicContact CB-CE3 4.4Å; K120-W169 HydrophobicContact CB-CH2 3.68Å; K120-W169 HydrophobicContact CB-CZ2 4.28Å; K120-W169 HydrophobicContact CB-CZ3 3.68Å; K120-W169 HydrophobicContact CD-CZ3 4.38Å; K120-W169 HydrophobicContact CG-CH2 4.06Å; K120-W169 HydrophobicContact CG-CZ3 3.79Å; K120-W169 VanDerWaalsContact N-CZ2 3.33Å; L123-W169 HydrophobicContact CB-CH2 4.05Å; L123-W169 HydrophobicContact CD1-CH2 4.18Å; C166-W169 PolarHBondContact O-N 3.48Å; C166-W169 VanDerWaalsContact O-N 3.09Å; D167-W169 VanDerWaalsContact C-N 3.26Å; D167-W169 PolarHBondContact O-N 2.95Å; W169-G173 PolarHBondContact O-N 3.4Å
170	L	60.9	Low	65.6	Low	115 Å²	115	86.1 Å²	86.1	60%	0.602	47%	0.469	S	S	*	.	H	α-helix	trans	-68.5	-37.8	177.1	-63.6	170.6	0	0	0	110.7	D167 F168 A174	D167-L170 WeakPolarHBondContact O-CB 3.27Å; D167-L170 PolarHBondContact O-N 3.38Å; F168-L170 VanDerWaalsContact C-N 3.32Å; L170-A174 WeakPolarHBondContact O-CB 3.44Å; L170-A174 PolarHBondContact O-N 3.49Å; L170-A174 VanDerWaalsContact O-N 3.09Å
171	E	56.5	Low	63.8	Low	147 Å²	147	90.3 Å²	90.3	69%	0.687	49%	0.491	S	S	*	.	H	α-helix	trans	-71.3	-38.1	179	-67.1	-165.4	159.1	0	0	113.1	G173 A174 A175	E171-G173 VanDerWaalsContact C-N 3.26Å; E171-G173 PolarHBondContact O-N 3.3Å; E171-A174 PolarHBondContact O-N 2.99Å; E171-A174 VanDerWaalsContact O-N 3.09Å; E171-A175 PolarHBondContact O-N 3.11Å
172	R	57.7	Low	62.1	Low	173 Å²	173	97 Å²	97	65%	0.653	52%	0.523	S	S	*	.	H	α-helix	trans	-63.9	-32	178	-158.8	174.1	-116	167.9	1.3	112.2	F168	F168-R172 PolarHBondContact O-N 3.04Å
173	G	53.8	Low	60.5	Low	40 Å²	40	99.3 Å²	99.3	41%	0.412	54%	0.537	S	S	.	.	H	α-helix	trans	-78.9	-29	171.9	0	0	0	0	0	114.1	W169 E171	W169-G173 PolarHBondContact O-N 3.4Å; E171-G173 VanDerWaalsContact C-N 3.26Å; E171-G173 PolarHBondContact O-N 3.3Å
174	A	50.6	Low	59.2	Low	50 Å²	50	98.1 Å²	98.1	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-73	-37.2	176.6	0	0	0	0	0	112.3	L170 E171 L176 R177 V178	L170-A174 WeakPolarHBondContact O-CB 3.44Å; L170-A174 PolarHBondContact O-N 3.49Å; L170-A174 VanDerWaalsContact O-N 3.09Å; E171-A174 PolarHBondContact O-N 2.99Å; E171-A174 VanDerWaalsContact O-N 3.09Å; A174-L176 VanDerWaalsContact C-N 3.26Å; A174-L176 PolarHBondContact O-N 3.49Å; A174-R177 PolarHBondContact O-N 2.86Å; A174-V178 WeakPolarHBondContact O-CG2 3.25Å; A174-V178 PolarHBondContact O-N 3.22Å
175	A	49.3	Very low	58.1	Low	71 Å²	71	100.3 Å²	100.3	59%	0.587	54%	0.54	S	S	*	.	H	α-helix	trans	-60.9	-32.6	176.9	0	0	0	0	0	113	E171	E171-A175 PolarHBondContact O-N 3.11Å
176	L	45.3	Very low	57.3	Low	144 Å²	144	99.3 Å²	99.3	75%	0.754	54%	0.542	S	S	*	.	H	α-helix	trans	-73.1	-26.3	174.8	-161.6	84.7	0	0	0	112.7	A174	A174-L176 VanDerWaalsContact C-N 3.26Å; A174-L176 PolarHBondContact O-N 3.49Å
177	R	47.5	Very low	56.5	Low	211 Å²	211	102.6 Å²	102.6	80%	0.796	56%	0.564	S	S	*	*	H	α-helix	trans	-83.8	-15.9	179.8	-70.4	-176.2	176.9	-173	-0.4	113.8	A174 A179	A174-R177 PolarHBondContact O-N 2.86Å; R177-A179 PolarHBondContact O-N 2.99Å
178	V	45.5	Very low	56.3	Low	119 Å²	119	101.8 Å²	101.8	72%	0.721	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-12.1	176.5	174.2	0	0	0	0	112.3	A174	A174-V178 WeakPolarHBondContact O-CG2 3.25Å; A174-V178 PolarHBondContact O-N 3.22Å
179	A	49.3	Very low	56.5	Low	86 Å²	86	105 Å²	105	71%	0.711	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-1.6	-178.9	0	0	0	0	0	115.1	R177	R177-A179 PolarHBondContact O-N 2.99Å
180	V	49.1	Very low	56.7	Low	93 Å²	93	104.1 Å²	104.1	56%	0.564	59%	0.588	S	S	*	*			trans	-127.6	67.3	178	-169.9	0	0	0	0	109.7	Q182	V180-Q182 HydrophobicContact CG1-CB 3.89Å; V180-Q182 HydrophobicContact CG1-CG 4.15Å; V180-Q182 PolarHBondContact O-N 2.88Å
181	D	54.1	Low	57	Low	104 Å²	104	103.2 Å²	103.2	56%	0.556	58%	0.58	S	S	*	*			trans	-68.5	68.8	150.3	-94.2	-51.3	0	0	0	108.5	A184 M185	D181-A184 HydrophobicContact CB-CB 3.75Å; D181-A184 PolarHBondContact O-N 3.47Å; D181-M185 PolarHBondContact O-N 3.45Å; D181-M185 VanDerWaalsContact O-N 3.11Å
182	Q	54.9	Low	57.9	Low	141 Å²	141	100.4 Å²	100.4	66%	0.659	57%	0.573	S	S	*	*	H	α-helix	trans	-49.1	-36	170.2	-140.2	164.9	-54.6	0	0	112.9	V180 V186	V180-Q182 HydrophobicContact CG1-CB 3.89Å; V180-Q182 HydrophobicContact CG1-CG 4.15Å; V180-Q182 PolarHBondContact O-N 2.88Å; Q182-V186 WeakPolarHBondContact O-CG2 3.33Å; Q182-V186 PolarHBondContact O-N 3.41Å
183	P	56.8	Low	58.6	Low	85 Å²	85	101.2 Å²	101.2	55%	0.552	58%	0.576	S	S	*	*	H	α-helix	trans	-74	-33.6	175	26.7	-33.3	0	0	0	113.5	V186 C187	P183-V186 PolarHBondContact O-N 3.44Å; P183-C187 WeakPolarHBondContact O-CB 3.11Å; P183-C187 PolarHBondContact O-N 3.2Å; P183-C187 PolarHBondContact O-SG 3.35Å
184	A	60.2	Low	58.9	Low	46 Å²	46	105.1 Å²	105.1	38%	0.38	58%	0.581	S	S	.	*	H	α-helix	trans	-71.4	-39	-179.2	0	0	0	0	0	112	D181 C187 L188	D181-A184 HydrophobicContact CB-CB 3.75Å; D181-A184 PolarHBondContact O-N 3.47Å; A184-C187 PolarHBondContact O-N 3.47Å; A184-L188 WeakPolarHBondContact O-CG 3.23Å; A184-L188 PolarHBondContact O-N 3.15Å
185	M	60.3	Low	59.3	Low	122 Å²	122	109.5 Å²	109.5	60%	0.601	60%	0.597	S	S	*	*	H	α-helix	trans	-64.3	-40.7	174.9	-75.7	-69.6	-74.9	0	0	112.1	D181 L188 L189	D181-M185 PolarHBondContact O-N 3.45Å; D181-M185 VanDerWaalsContact O-N 3.11Å; M185-L188 PolarHBondContact O-N 2.99Å; M185-L189 WeakPolarHBondContact O-CG 3.42Å; M185-L189 PolarHBondContact O-N 2.96Å; M185-L189 VanDerWaalsContact O-N 3.11Å
186	V	63.3	Low	59.7	Low	99 Å²	99	112 Å²	112	60%	0.6	61%	0.605	S	S	*	*	H	α-helix	trans	-68.2	-38.8	176.4	173.3	0	0	0	0	111.3	Q182 P183 L189 G190	Q182-V186 WeakPolarHBondContact O-CG2 3.33Å; Q182-V186 PolarHBondContact O-N 3.41Å; P183-V186 PolarHBondContact O-N 3.44Å; V186-L189 PolarHBondContact O-N 3.38Å; V186-G190 PolarHBondContact O-N 3.41Å
187	C	63.3	Low	59.7	Low	71 Å²	71	114.8 Å²	114.8	48%	0.48	61%	0.61	S	S	.	*	H	α-helix	trans	-62.6	-47	174	-75.6	0	0	0	0	112	P183 A184 L189 G190 F191	P183-C187 WeakPolarHBondContact O-CB 3.11Å; P183-C187 PolarHBondContact O-N 3.2Å; P183-C187 PolarHBondContact O-SG 3.35Å; A184-C187 PolarHBondContact O-N 3.47Å; C187-L189 VanDerWaalsContact C-N 3.33Å; C187-L189 PolarHBondContact O-N 3.11Å; C187-G190 PolarHBondContact O-N 3.13Å; C187-F191 WeakPolarHBondContact O-CD2 3.39Å; C187-F191 PolarHBondContact O-N 3.3Å
188	L	69.1	Low	60.3	Low	108 Å²	108	110 Å²	110	57%	0.565	60%	0.601	S	S	*	*	H	α-helix	trans	-59.2	-42.9	178.1	-77.4	167.2	0	0	0	112	A184 M185 F191 V192	A184-L188 WeakPolarHBondContact O-CG 3.23Å; A184-L188 PolarHBondContact O-N 3.15Å; M185-L188 PolarHBondContact O-N 2.99Å; L188-F191 PolarHBondContact O-N 2.94Å; L188-V192 WeakPolarHBondContact O-CG2 3.21Å; L188-V192 PolarHBondContact O-N 3.03Å
189	L	71.8	Confident	61.1	Low	118 Å²	118	109.5 Å²	109.5	62%	0.618	60%	0.595	S	S	*	*	H	α-helix	trans	-64.5	-39.2	176.6	-71.1	168.3	0	0	0	112.4	M185 V186 C187 V192 W193	M185-L189 WeakPolarHBondContact O-CG 3.42Å; M185-L189 PolarHBondContact O-N 2.96Å; M185-L189 VanDerWaalsContact O-N 3.11Å; V186-L189 PolarHBondContact O-N 3.38Å; C187-L189 VanDerWaalsContact C-N 3.33Å; C187-L189 PolarHBondContact O-N 3.11Å; L189-V192 PolarHBondContact O-N 3.03Å; L189-W193 PolarHBondContact O-N 3.01Å
190	G	71.4	Confident	61.7	Low	43 Å²	43	110.8 Å²	110.8	44%	0.443	59%	0.588	S	S	.	*	H	α-helix	trans	-63.3	-40.7	173.6	0	0	0	0	0	113.1	V186 C187 F194	V186-G190 PolarHBondContact O-N 3.41Å; C187-G190 PolarHBondContact O-N 3.13Å; G190-F194 WeakPolarHBondContact O-CB 3.48Å; G190-F194 PolarHBondContact O-N 3.32Å; G190-F194 VanDerWaalsContact O-N 3.08Å
191	F	67.5	Low	62.5	Low	97 Å²	97	111.8 Å²	111.8	43%	0.425	59%	0.59	S	S	.	*	H	α-helix	trans	-64.7	-42.4	175	-82.1	-69.9	0	0	0	112.4	V28 C187 L188 F194 I195	V28-F191 HydrophobicContact CG1-CE1 3.81Å; V28-F191 HydrophobicContact CG1-CZ 3.68Å; C187-F191 WeakPolarHBondContact O-CD2 3.39Å; C187-F191 PolarHBondContact O-N 3.3Å; L188-F191 PolarHBondContact O-N 2.94Å; F191-F194 PolarHBondContact O-N 3.08Å; F191-I195 WeakPolarHBondContact O-CG1 3.44Å; F191-I195 PolarHBondContact O-N 3.19Å; F191-I195 VanDerWaalsContact O-N 3.13Å
192	V	76.3	Confident	63	Low	88 Å²	88	112.3 Å²	112.3	53%	0.533	59%	0.592	S	S	.	*	H	α-helix	trans	-64.8	-43.1	177.9	173.4	0	0	0	0	111.1	L188 L189 F194 I195 V196	L188-V192 WeakPolarHBondContact O-CG2 3.21Å; L188-V192 PolarHBondContact O-N 3.03Å; L189-V192 PolarHBondContact O-N 3.03Å; V192-F194 VanDerWaalsContact C-N 3.31Å; V192-F194 PolarHBondContact O-N 3.22Å; V192-I195 PolarHBondContact O-N 3.31Å; V192-V196 HydrophobicContact CG1-CG2 4.43Å; V192-V196 VanDerWaalsContact O-CG2 3.31Å; V192-V196 WeakPolarHBondContact O-CG2 3.37Å; V192-V196 PolarHBondContact O-N 3.4Å; V192-V196 VanDerWaalsContact O-N 3.11Å
193	W	71.6	Confident	63.5	Low	189 Å²	189	110.4 Å²	110.4	72%	0.716	59%	0.587	S	S	*	*	H	α-helix	trans	-59.4	-42.5	175.3	-174	-63.3	0	0	0	112.1	L189 I195 V196 K197	L189-W193 PolarHBondContact O-N 3.01Å; W193-I195 VanDerWaalsContact C-N 3.28Å; W193-I195 PolarHBondContact O-N 3.11Å; W193-V196 PolarHBondContact O-N 3.25Å; W193-K197 WeakPolarHBondContact O-CB 3.31Å; W193-K197 PolarHBondContact O-N 3.4Å
194	F	59.3	Low	64	Low	122 Å²	122	112.2 Å²	112.2	54%	0.535	59%	0.59	S	S	.	*	H	α-helix	trans	-70.9	-22.1	-178.4	-153.5	-88.6	0	0	0	113.3	G190 F191 V192	G190-F194 WeakPolarHBondContact O-CB 3.48Å; G190-F194 PolarHBondContact O-N 3.32Å; G190-F194 VanDerWaalsContact O-N 3.08Å; F191-F194 PolarHBondContact O-N 3.08Å; V192-F194 VanDerWaalsContact C-N 3.31Å; V192-F194 PolarHBondContact O-N 3.22Å
195	I	60.2	Low	64.3	Low	143 Å²	143	117.3 Å²	117.3	73%	0.733	61%	0.606	S	S	*	*	H	α-helix	trans	-82.8	-32.7	173.9	-69.8	177.5	0	0	0	111.3	F191 V192 W193 K197	F191-I195 WeakPolarHBondContact O-CG1 3.44Å; F191-I195 PolarHBondContact O-N 3.19Å; F191-I195 VanDerWaalsContact O-N 3.13Å; V192-I195 PolarHBondContact O-N 3.31Å; W193-I195 VanDerWaalsContact C-N 3.28Å; W193-I195 PolarHBondContact O-N 3.11Å; I195-K197 VanDerWaalsContact C-N 3.33Å
196	V	57.6	Low	64.7	Low	124 Å²	124	116.9 Å²	116.9	75%	0.752	61%	0.606	S	S	*	*	H	α-helix	trans	-83	-9.2	-177.8	177	0	0	0	0	112.4	V192 W193	V192-V196 HydrophobicContact CG1-CG2 4.43Å; V192-V196 VanDerWaalsContact O-CG2 3.31Å; V192-V196 WeakPolarHBondContact O-CG2 3.37Å; V192-V196 PolarHBondContact O-N 3.4Å; V192-V196 VanDerWaalsContact O-N 3.11Å; W193-V196 PolarHBondContact O-N 3.25Å
197	K	44.6	Very low	64.8	Low	201 Å²	201	118.5 Å²	118.5	87%	0.874	61%	0.607	S	S	*	*			trans	-118.7	0	-178.5	-171.5	154.4	177.7	61.6	0	113.3	W193 I195	W193-K197 WeakPolarHBondContact O-CB 3.31Å; W193-K197 PolarHBondContact O-N 3.4Å; I195-K197 VanDerWaalsContact C-N 3.33Å

Retrieved 197 of 197 residues in 172.2 ms (Link to these results)

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