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Paired mesoderm homeobox protein 1

Master transcription factor of stromal fibroblasts for myofibroblastic lineage progression. Orchestrates the functional drift of fibroblasts into myofibroblastic phenotype via TGF-beta signaling by remodeling a super-enhancer landscape. Through this function, plays an essential role in wound healing process¹. Acts as a transcriptional regulator of muscle creatine kinase (MCK) and so has a role in the establishment of diverse mesodermal muscle types. The protein binds to an A/T-rich element in the muscle creatine enhancer². May play a role in homeostasis and regeneration of bone, white adipose tissue and derm³. Transcriptional activator, when transfected in fibroblastic or myoblastic cell lines. This activity may be masked by the C-terminal OAR domain. Transcriptional repressor, when transfected in fibroblastic or myoblastic cell lines.

AlphaFold DB , UniProt , Accession P63013, Species MOUSE (Mus musculus, Mouse), Gene Prrx1, Length 245 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.1	Low	56.8	Low	231 Å²	231	145.9 Å²	145.9	100%	1.138	77%	0.768	S	S	*	*				0	83.9	0	-65.9	175.9	154.4	0	0	106.5
2	T	50.9	Low	56.3	Low	137 Å²	137	147.6 Å²	147.6	84%	0.84	77%	0.769	S	S	*	*				51.2	105.7	97.6	68.2	0	0	0	0	112.4
3	S	58.1	Low	56.3	Low	107 Å²	107	145.1 Å²	145.1	75%	0.748	77%	0.767	S	S	*	*			trans	-173.4	111.5	132.4	-150.1	0	0	0	0	111.4
4	S	56.7	Low	56.1	Low	110 Å²	110	139.8 Å²	139.8	77%	0.769	75%	0.754	S	S	*	*			trans	-91.2	137	157.8	169.6	0	0	0	0	106.8
5	Y	60.1	Low	56.1	Low	218 Å²	218	142.1 Å²	142.1	86%	0.855	77%	0.765	S	S	*	*			trans	-143.5	112.4	157.2	-98.6	-84.1	0	0	0	109.8
6	G	54.3	Low	55.8	Low	60 Å²	60	138.3 Å²	138.3	62%	0.619	77%	0.769	S	S	*	*			trans	-90.3	-151.5	158.4	0	0	0	0	0	111.3
7	H	59.3	Low	55.4	Low	176 Å²	176	135.1 Å²	135.1	82%	0.815	78%	0.775	S	S	*	*			trans	85.7	135	176.3	-121.1	-121.3	0	0	0	115.2
8	V	58.5	Low	54.9	Low	96 Å²	96	140.2 Å²	140.2	58%	0.582	78%	0.779	S	S	*	*			cis	175.7	178.3	-18.8	135.3	0	0	0	0	105
9	L	60.3	Low	54.6	Low	133 Å²	133	140.4 Å²	140.4	70%	0.696	78%	0.778	S	S	*	*			trans	93.8	128.6	166.2	-70.7	115.4	0	0	0	114.8
10	E	54.5	Low	54.5	Low	128 Å²	128	141.6 Å²	141.6	60%	0.598	78%	0.783	S	S	*	*			cis	-176.7	150.4	12.5	167.7	155.7	101.1	0	0	112.4
11	R	54.5	Low	54.5	Low	209 Å²	209	139.4 Å²	139.4	79%	0.789	78%	0.778	S	S	*	*			trans	86.4	98.6	150.5	-90.1	169.7	-143.9	-172.5	16.1	122.8
12	Q	50.1	Low	54.2	Low	166 Å²	166	134 Å²	134	78%	0.776	76%	0.76	S	S	*	*			trans	-60	172	133.1	-84.3	-106.8	3.7	0	0	111.3
13	P	56	Low	53.9	Low	115 Å²	115	130.7 Å²	130.7	75%	0.747	75%	0.753	S	S	*	*			cis	-153.5	174.9	37.2	41.8	-18.6	0	0	0	120.1
14	A	53.6	Low	53.2	Low	71 Å²	71	132.6 Å²	132.6	59%	0.587	75%	0.754	S	S	*	*			trans	108.1	125.7	130.8	0	0	0	0	0	121.3
15	L	57	Low	52.8	Low	175 Å²	175	133.8 Å²	133.8	92%	0.916	75%	0.751	S	S	*	*			trans	109.3	115.5	138.4	-51	-170.9	0	0	0	120.4
16	G	50.5	Low	52.2	Low	80 Å²	80	130 Å²	130	83%	0.825	75%	0.746	S	S	*	*			trans	92.9	108.2	153.3	0	0	0	0	0	115.2
17	G	48.7	Very low	52.1	Low	85 Å²	85	132.8 Å²	132.8	88%	0.876	75%	0.751	S	S	*	*				72	124.2	54.1	0	0	0	0	0	110
18	R	47	Very low	51.7	Low	226 Å²	226	132.2 Å²	132.2	85%	0.853	75%	0.754	S	S	*	*			cis	178.3	135.8	9.3	166.9	-171.6	163.9	-137	-8.1	104.7
19	L	50.2	Low	51.2	Low	144 Å²	144	133.5 Å²	133.5	75%	0.754	75%	0.753	S	S	*	*			trans	57.1	108.8	161	-74.4	160.1	0	0	0	119.4
20	D	52.3	Low	50.9	Low	164 Å²	164	131.7 Å²	131.7	88%	0.877	76%	0.758	S	S	*	*			trans	-133.2	132	145	-162.3	-137.2	0	0	0	110.2
21	S	54.3	Low	50.8	Low	96 Å²	96	135.2 Å²	135.2	67%	0.671	77%	0.771	S	S	*	*			trans	-80	-169.7	172	-127	0	0	0	0	109.1
22	P	51.2	Low	51	Low	119 Å²	119	131.6 Å²	131.6	77%	0.773	76%	0.761	S	S	*	*			cis	-124.9	161.2	-5	28	-5.5	0	0	0	111.8
23	G	44.4	Very low	51.2	Low	66 Å²	66	130.5 Å²	130.5	68%	0.68	76%	0.76	S	S	*	*			cis	92.1	61.5	49.2	0	0	0	0	0	112	L25	G23-L25 PolarHBondContact O-N 3.24Å
24	N	42.8	Very low	51.2	Low	147 Å²	147	131 Å²	131	79%	0.786	75%	0.751	S	S	*	*			trans	10.2	98.8	147.1	-163.5	-19.8	0	0	0	117
25	L	49.8	Very low	51.6	Low	135 Å²	135	129.8 Å²	129.8	71%	0.707	74%	0.738	S	S	*	*			trans	-134.8	-17.7	171.8	-167.3	55.4	0	0	0	116.4	G23	G23-L25 PolarHBondContact O-N 3.24Å
26	D	46.9	Very low	51.8	Low	139 Å²	139	121.5 Å²	121.5	74%	0.743	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-99	10.3	-167.8	-64.5	-64.5	0	0	0	117.1	L28	D26-L28 VanDerWaalsContact C-N 3.32Å; D26-L28 PolarHBondContact O-N 3.24Å
27	T	52.9	Low	52.2	Low	119 Å²	119	120.6 Å²	120.6	73%	0.73	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-83.6	-5.2	176	-54.4	0	0	0	0	113.1
28	L	49.3	Very low	52.8	Low	164 Å²	164	122.7 Å²	122.7	86%	0.859	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-99.9	3.5	-172.4	-82	168.5	0	0	0	116.4	D26	D26-L28 VanDerWaalsContact C-N 3.32Å; D26-L28 PolarHBondContact O-N 3.24Å
29	Q	48.4	Very low	53.3	Low	122 Å²	122	112.7 Å²	112.7	57%	0.57	63%	0.626	S	S	*	*			trans	-96.2	2.1	176.7	-64.6	-149.9	26.5	0	0	115.3	K31	Q29-K31 PolarHBondContact O-N 2.98Å
30	A	55.1	Low	53.7	Low	96 Å²	96	106 Å²	106	79%	0.793	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	20	-171.4	0	0	0	0	0	116.8
31	K	52.6	Low	53.8	Low	202 Å²	202	104.5 Å²	104.5	88%	0.878	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.3	12.3	-175.4	-85.6	171.3	161.6	177.4	0	115.1	Q29 N33	Q29-K31 PolarHBondContact O-N 2.98Å; K31-N33 PolarHBondContact O-N 3.28Å
32	K	57.6	Low	53.8	Low	132 Å²	132	102.5 Å²	102.5	57%	0.574	56%	0.564	S	S	*	*	S	Bend	trans	-88.6	99.1	176.3	-65.5	176.9	-176.7	171.2	0	109.8
33	N	55.2	Low	53.5	Low	143 Å²	143	105.4 Å²	105.4	77%	0.765	57%	0.568	S	S	*	*			trans	22.3	118.1	163.2	-56.9	-37.1	0	0	0	118.5	K31 S35	K31-N33 PolarHBondContact O-N 3.28Å; N33-S35 PolarHBondContact O-N 3.03Å
34	F	56.2	Low	53.5	Low	127 Å²	127	111.1 Å²	111.1	56%	0.557	58%	0.577	S	S	*	*			trans	-60.8	93.9	174.9	-175.9	-105.9	0	0	0	111.5	T116 V123	F34-T116 HydrophobicContact CE2-CG2 3.95Å; F34-T116 HydrophobicContact CZ-CG2 4Å; F34-V123 HydrophobicContact CD1-CG2 4.07Å; F34-V123 HydrophobicContact CE1-CB 4.42Å; F34-V123 HydrophobicContact CE1-CG2 3.26Å; F34-V123 HydrophobicContact CZ-CG2 3.73Å
35	S	61.7	Low	53.6	Low	44 Å²	44	108.3 Å²	108.3	31%	0.308	57%	0.574	S	S	.	*			trans	-131.1	134.6	173.1	176	0	0	0	0	109.5	N33 S37 H38 L39	N33-S35 PolarHBondContact O-N 3.03Å; S35-S37 PolarHBondContact O-N 2.79Å; S35-S37 VanDerWaalsContact O-N 3.16Å; S35-H38 CarbonylContact O-C 3.58Å; S35-H38 PolarHBondContact O-N 3.5Å; S35-L39 PolarHBondContact O-N 3.16Å
36	V	60.2	Low	53.3	Low	1 Å²	1	104.8 Å²	104.8	1%	0.006	57%	0.57	C	S	.	*	T	Hydrogen-bonded Turn	trans	-56.6	-32.3	179.2	-176.9	0	0	0	0	111.7	H38 L39 L40 V123 D126	V36-H38 PolarHBondContact O-N 3.41Å; V36-L39 CarbonylContact O-C 3.49Å; V36-L39 WeakPolarHBondContact O-CA 3.44Å; V36-L39 WeakPolarHBondContact O-CB 3.49Å; V36-L39 PolarHBondContact O-N 3.39Å; V36-L40 HydrophobicContact CG1-CD1 3.47Å; V36-L40 VanDerWaalsContact CG1-CD1 3.47Å; V36-L40 HydrophobicContact CG1-CG 4.05Å; V36-L40 WeakPolarHBondContact O-CB 3.43Å; V36-L40 PolarHBondContact O-N 2.87Å; V36-L40 VanDerWaalsContact O-N 3.08Å; V36-V123 HydrophobicContact CG2-CB 3.77Å; V36-V123 HydrophobicContact CG2-CG1 3.58Å; V36-V123 HydrophobicContact CG2-CG2 3.61Å; V36-D126 HydrophobicContact CB-CB 4.3Å; V36-D126 VanDerWaalsContact CB-OD2 3.27Å; V36-D126 WeakPolarHBondContact CB-OD2 3.49Å; V36-D126 HydrophobicContact CG1-CB 4.46Å; V36-D126 VanDerWaalsContact CG1-OD2 3.26Å; V36-D126 WeakPolarHBondContact CG1-OD2 3.48Å; V36-D126 HydrophobicContact CG2-CB 4.13Å
37	S	60	Low	53	Low	62 Å²	62	104.7 Å²	104.7	43%	0.434	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.6	-42.8	174.6	-57.1	0	0	0	0	112.1	S35 L39 R130	S35-S37 PolarHBondContact O-N 2.79Å; S35-S37 VanDerWaalsContact O-N 3.16Å; S37-L39 VanDerWaalsContact C-N 3.32Å; S37-R130 PolarHBondContact OG-NH2 3.27Å; S37-R130 VanDerWaalsContact OG-NH2 3.09Å
38	H	59.7	Low	52.8	Low	128 Å²	128	107.2 Å²	107.2	59%	0.593	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-21.8	172.3	-85.9	67.3	0	0	0	112.6	S35 V36 L40 R115	S35-H38 CarbonylContact O-C 3.58Å; S35-H38 PolarHBondContact O-N 3.5Å; V36-H38 PolarHBondContact O-N 3.41Å; H38-L40 VanDerWaalsContact C-N 3.25Å; H38-L40 PolarHBondContact O-N 3.21Å; H38-R115 PolarHBondContact O-NH2 3.33Å
39	L	58.2	Low	52.6	Low	17 Å²	17	105 Å²	105	9%	0.089	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	-9	178.3	-152.5	71.5	0	0	0	113	S35 V36 S37 V112 R115	S35-L39 PolarHBondContact O-N 3.16Å; V36-L39 CarbonylContact O-C 3.49Å; V36-L39 WeakPolarHBondContact O-CA 3.44Å; V36-L39 WeakPolarHBondContact O-CB 3.49Å; V36-L39 PolarHBondContact O-N 3.39Å; S37-L39 VanDerWaalsContact C-N 3.32Å; L39-V112 HydrophobicContact CD2-CB 4.18Å; L39-V112 HydrophobicContact CD2-CG1 3.75Å; L39-V112 HydrophobicContact CD2-CG2 4.01Å; L39-R115 VanDerWaalsContact C-NH2 3.34Å; L39-R115 HydrophobicContact CD1-CB 3.42Å; L39-R115 VanDerWaalsContact CD1-CB 3.42Å; L39-R115 HydrophobicContact CD1-CG 3.42Å; L39-R115 VanDerWaalsContact CD1-CG 3.42Å; L39-R115 HydrophobicContact CD2-CB 4.36Å; L39-R115 HydrophobicContact CG-CB 4.09Å; L39-R115 HydrophobicContact CG-CG 4.15Å; L39-R115 PolarHBondContact O-NE 3.5Å; L39-R115 PolarHBondContact O-NH1 3.27Å; L39-R115 PolarHBondContact O-NH2 2.99Å
40	L	59.6	Low	52.2	Low	4 Å²	4	103.4 Å²	103.4	2%	0.021	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-129.4	-15	-168.4	-77.8	-175.8	0	0	0	114.8	V36 H38 L42 R111 V112 L127	V36-L40 HydrophobicContact CG1-CD1 3.47Å; V36-L40 VanDerWaalsContact CG1-CD1 3.47Å; V36-L40 HydrophobicContact CG1-CG 4.05Å; V36-L40 WeakPolarHBondContact O-CB 3.43Å; V36-L40 PolarHBondContact O-N 2.87Å; V36-L40 VanDerWaalsContact O-N 3.08Å; H38-L40 VanDerWaalsContact C-N 3.25Å; H38-L40 PolarHBondContact O-N 3.21Å; L40-L42 HydrophobicContact CB-CB 4.01Å; L40-L42 HydrophobicContact CB-CD1 3.57Å; L40-L42 HydrophobicContact CB-CG 4.06Å; L40-L42 HydrophobicContact CD1-CD1 3.59Å; L40-L42 HydrophobicContact CD2-CD1 4.01Å; L40-L42 HydrophobicContact CG-CD1 3.91Å; L40-L42 WeakPolarHBondContact O-CG 3.2Å; L40-L42 PolarHBondContact O-N 3.47Å; L40-R111 HydrophobicContact CD2-CB 4.19Å; L40-R111 PolarHBondContact O-NH1 3.2Å; L40-V112 HydrophobicContact CD1-CG2 4.33Å; L40-V112 HydrophobicContact CD2-CG2 3.6Å; L40-V112 HydrophobicContact CG-CG2 4.17Å; L40-L127 HydrophobicContact CD1-CD1 3.97Å
41	D	54.4	Low	51.4	Low	131 Å²	131	103.5 Å²	103.5	70%	0.701	58%	0.577	S	S	*	*			trans	33.1	40.4	-171.8	-75.8	-22.4	0	0	0	111.3	E43	D41-E43 VanDerWaalsContact C-N 3.34Å; D41-E43 PolarHBondContact O-N 3.05Å
42	L	53.4	Low	50.9	Low	55 Å²	55	103.7 Å²	103.7	29%	0.288	58%	0.581	S	S	.	*			trans	-92.8	84.8	-175	-98.2	157.2	0	0	0	104.7	L40 E44	L40-L42 HydrophobicContact CB-CB 4.01Å; L40-L42 HydrophobicContact CB-CD1 3.57Å; L40-L42 HydrophobicContact CB-CG 4.06Å; L40-L42 HydrophobicContact CD1-CD1 3.59Å; L40-L42 HydrophobicContact CD2-CD1 4.01Å; L40-L42 HydrophobicContact CG-CD1 3.91Å; L40-L42 WeakPolarHBondContact O-CG 3.2Å; L40-L42 PolarHBondContact O-N 3.47Å; L42-E44 PolarHBondContact O-N 3.45Å
43	E	45.7	Very low	50.2	Low	180 Å²	180	102.2 Å²	102.2	84%	0.841	59%	0.593	S	S	*	*			trans	-41.5	107	150.5	42.3	-170	144.8	0	0	109	D41 A45	D41-E43 VanDerWaalsContact C-N 3.34Å; D41-E43 PolarHBondContact O-N 3.05Å; E43-A45 PolarHBondContact O-N 3.37Å
44	E	44.1	Very low	49.7	Very low	186 Å²	186	101.8 Å²	101.8	87%	0.869	59%	0.591	S	S	*	*			trans	29.3	62.1	150.6	-151.7	173.1	155.1	0	0	118	L42 G46	L42-E44 PolarHBondContact O-N 3.45Å; E44-G46 PolarHBondContact O-N 2.82Å
45	A	44.7	Very low	49.4	Very low	87 Å²	87	103.4 Å²	103.4	72%	0.719	60%	0.6	S	S	*	*			trans	-90.1	54.4	158.6	0	0	0	0	0	109.8	E43	E43-A45 PolarHBondContact O-N 3.37Å
46	G	42.4	Very low	48.5	Very low	62 Å²	62	105.9 Å²	105.9	64%	0.639	62%	0.617	S	S	*	*			trans	-113.6	76	178.2	0	0	0	0	0	110.9	E44	E44-G46 PolarHBondContact O-N 2.82Å
47	D	41.3	Very low	48	Very low	136 Å²	136	112.7 Å²	112.7	73%	0.727	66%	0.658	S	S	*	*			trans	-174.5	85.8	144.9	-152.7	25.7	0	0	0	110.7	V49	D47-V49 WeakPolarHBondContact OD1-CG2 3.34Å
48	M	48.6	Very low	47.1	Very low	173 Å²	173	113 Å²	113	85%	0.852	67%	0.672	S	S	*	*			trans	-135.6	84.3	162.5	-63.5	-167.9	-168.1	0	0	108
49	V	46	Very low	46.4	Very low	116 Å²	116	115.9 Å²	115.9	70%	0.703	69%	0.686	S	S	*	*			trans	-64.4	136.2	-176.5	170.1	0	0	0	0	112.9	D47	D47-V49 WeakPolarHBondContact OD1-CG2 3.34Å
50	A	39.5	Very low	45.8	Very low	90 Å²	90	119.7 Å²	119.7	74%	0.744	72%	0.72	S	S	*	*			trans	53	121.8	147.7	0	0	0	0	0	121.5
51	A	38.2	Very low	45	Very low	97 Å²	97	123 Å²	123	80%	0.802	75%	0.754	S	S	*	*				-179.9	91.7	121.4	0	0	0	0	0	111.3
52	Q	42.2	Very low	44.7	Very low	207 Å²	207	128.5 Å²	128.5	97%	0.967	77%	0.765	S	S	*	*			trans	-161.2	68.2	148.2	-104.3	-168	-68.3	0	0	109.2
53	A	42.1	Very low	44.4	Very low	100 Å²	100	131.2 Å²	131.2	83%	0.826	79%	0.789	S	S	*	*			trans	-71.2	157.5	151.8	0	0	0	0	0	108
54	D	45.8	Very low	44.6	Very low	134 Å²	134	129.9 Å²	129.9	72%	0.717	79%	0.787	S	S	*	*			cis	-180	177.3	-1.7	176.4	36	0	0	0	105.1
55	E	48.5	Very low	45	Very low	162 Å²	162	128.2 Å²	128.2	76%	0.757	78%	0.783	S	S	*	*			trans	86.6	132.3	163.4	-51.7	-91	70.4	0	0	116.9
56	S	44.5	Very low	44.9	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	79%	0.792	S	S	*	*			cis	-174.1	117.6	2.7	173.7	0	0	0	0	107.2
57	V	48	Very low	45.5	Very low	143 Å²	143	135.6 Å²	135.6	87%	0.867	80%	0.798	S	S	*	*				61.6	125.8	107	-177.4	0	0	0	0	118.5
58	G	42.8	Very low	45.8	Very low	70 Å²	70	135 Å²	135	72%	0.722	80%	0.802	S	S	*	*			trans	133.6	148.7	147.5	0	0	0	0	0	116.4
59	E	45.3	Very low	45.5	Very low	187 Å²	187	130.4 Å²	130.4	87%	0.874	80%	0.799	S	S	*	*				-149.2	147.5	-81.5	173.4	160	130.1	0	0	107.6
60	A	43.8	Very low	45.9	Very low	98 Å²	98	132.4 Å²	132.4	81%	0.81	81%	0.805	S	S	*	*			trans	41	140.4	154.9	0	0	0	0	0	125.3
61	G	43.1	Very low	46.8	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	81%	0.81	S	S	*	*			trans	138	68.4	152	0	0	0	0	0	114.9
62	R	49.2	Very low	47.5	Very low	247 Å²	247	135.8 Å²	135.8	93%	0.932	81%	0.811	S	S	*	*				61.4	120.4	96.2	-70.3	-172	116.8	166.2	2.2	118
63	S	46	Very low	47.9	Very low	113 Å²	113	129.2 Å²	129.2	79%	0.79	80%	0.8	S	S	*	*			trans	70.1	146.5	146.5	-120.3	0	0	0	0	117.1
64	L	50.4	Low	48.3	Very low	151 Å²	151	129.8 Å²	129.8	79%	0.791	80%	0.798	S	S	*	*			cis	-163.9	151.8	24.1	-176.1	69.9	0	0	0	108.3
65	L	51.6	Low	48.5	Very low	152 Å²	152	130 Å²	130	80%	0.796	80%	0.799	S	S	*	*			trans	-49.5	148.6	171.4	-73.8	114	0	0	0	114
66	E	43.9	Very low	49.1	Very low	193 Å²	193	127.8 Å²	127.8	90%	0.902	80%	0.797	S	S	*	*				-173.6	159.3	100.9	-160.3	156.2	110.8	0	0	111.2
67	S	55	Low	49.2	Very low	110 Å²	110	128.6 Å²	128.6	77%	0.769	80%	0.799	S	S	*	*			trans	-98.3	179.2	-157.1	-106.2	0	0	0	0	113.6
68	P	48.3	Very low	49.2	Very low	124 Å²	124	129.7 Å²	129.7	81%	0.805	80%	0.795	S	S	*	*			trans	-100.5	159.6	-145.9	39.2	-35.7	0	0	0	115.5
69	G	41.3	Very low	49.5	Very low	77 Å²	77	133.2 Å²	133.2	79%	0.794	79%	0.793	S	S	*	*			trans	-130.3	138.9	171.4	0	0	0	0	0	111.5
70	L	53.8	Low	49.6	Very low	157 Å²	157	131 Å²	131	82%	0.822	79%	0.787	S	S	*	*			trans	-87.3	172.1	-163.6	-61.8	162.2	0	0	0	113.6
71	T	58.4	Low	49.7	Very low	138 Å²	138	134 Å²	134	85%	0.847	79%	0.789	S	S	*	*			trans	78.3	146.5	158.8	79.4	0	0	0	0	114.4
72	S	54.5	Low	49.9	Very low	120 Å²	120	136.9 Å²	136.9	84%	0.839	79%	0.788	S	S	*	*			cis	180	143.8	-5.8	164.2	0	0	0	0	104.8
73	G	50.5	Low	50	Low	70 Å²	70	133 Å²	133	72%	0.722	78%	0.78	S	S	*	*			trans	110	98.6	156.4	0	0	0	0	0	118.2
74	S	49.4	Very low	50.2	Low	112 Å²	112	135.3 Å²	135.3	78%	0.783	78%	0.783	S	S	*	*			trans	23.4	125.5	140.4	-145.5	0	0	0	0	122.3
75	D	51	Low	49.9	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	79%	0.785	S	S	*	*			trans	7.3	135	138.6	-73.2	-80.8	0	0	0	118
76	T	61	Low	49.4	Very low	116 Å²	116	132.8 Å²	132.8	71%	0.712	78%	0.778	S	S	*	*			cis	178.6	-175.2	30.3	27.8	0	0	0	0	107.2
77	P	46.6	Very low	49.6	Very low	112 Å²	112	132.4 Å²	132.4	73%	0.727	78%	0.776	S	S	*	*				-134.4	143.3	-66.8	37.4	-19.2	0	0	0	112.6
78	Q	47.3	Very low	49.4	Very low	167 Å²	167	133.7 Å²	133.7	78%	0.78	77%	0.77	S	S	*	*			trans	-160.9	126.6	163.1	-146.9	166.6	-84.9	0	0	116
79	Q	50.3	Low	49.4	Very low	144 Å²	144	135.3 Å²	135.3	67%	0.673	76%	0.764	S	S	*	*			trans	74.9	119.7	144.7	-79.6	164.3	-14.9	0	0	123.1
80	D	46.5	Very low	50.1	Low	140 Å²	140	141.4 Å²	141.4	75%	0.749	77%	0.769	S	S	*	*			trans	61.6	110.2	131.2	-58.4	-31.9	0	0	0	120.6
81	N	46.5	Very low	50.3	Low	160 Å²	160	144 Å²	144	86%	0.856	77%	0.774	S	S	*	*				-169.9	124.1	118.3	-139.4	-12.4	0	0	0	112.7
82	D	47.6	Very low	50.6	Low	134 Å²	134	148.9 Å²	148.9	72%	0.717	78%	0.777	S	S	*	*			trans	-63	138.6	171.2	-68.4	-85.2	0	0	0	113.8
83	Q	50	Low	51.3	Low	164 Å²	164	153.2 Å²	153.2	77%	0.766	78%	0.78	S	S	*	*				168	113.7	120.8	-94.7	151.1	81.9	0	0	113.9
84	L	50.6	Low	52.6	Low	163 Å²	163	158 Å²	158	85%	0.853	78%	0.784	S	S	*	*				43	105.2	126.2	-55.9	169.7	0	0	0	118
85	N	44.9	Very low	54.1	Low	158 Å²	158	162 Å²	162	85%	0.845	78%	0.782	S	S	*	*				-171.1	121.6	110.2	-157.8	7.1	0	0	0	111.8
86	S	39.9	Very low	55.5	Low	91 Å²	91	165.2 Å²	165.2	64%	0.636	78%	0.784	S	S	*	*			trans	-57	135.6	168.1	-53.7	0	0	0	0	111.9
87	E	49.2	Very low	56.7	Low	186 Å²	186	166.4 Å²	166.4	87%	0.869	79%	0.785	S	S	*	*			trans	-166.9	94.9	134.8	-98	-51.6	117.9	0	0	107.4
88	E	50.1	Low	58.7	Low	136 Å²	136	170.9 Å²	170.9	64%	0.636	79%	0.788	S	S	*	*			trans	-57.6	141.2	178.2	-78.7	-179.5	110.6	0	0	113.5
89	K	47.7	Very low	60.8	Low	158 Å²	158	165 Å²	165	69%	0.687	76%	0.764	S	S	*	*				50.1	102	129.4	-55.1	169	-176.2	160.4	0	116.6
90	K	55.8	Low	62.9	Low	206 Å²	206	164.1 Å²	164.1	90%	0.896	77%	0.768	S	S	*	*			trans	161.3	70.6	130.1	-82.6	152	-167.4	170.6	0	111.8
91	K	59.1	Low	65.2	Low	212 Å²	212	160.4 Å²	160.4	92%	0.922	75%	0.745	S	S	*	*			trans	-106.7	59.7	164.4	-67.6	-174.3	-179	177	0	110.9	K93	K91-K93 PolarHBondContact O-N 3.21Å
92	R	65.2	Low	67.6	Low	240 Å²	240	156.4 Å²	156.4	91%	0.906	72%	0.724	S	S	*	*			trans	-68.4	116.3	163.2	-78.2	-172.7	170.7	-174.7	-1.4	107.2	Q94	R92-Q94 PolarHBondContact O-N 2.99Å
93	K	68.5	Low	69.9	Low	211 Å²	211	153.9 Å²	153.9	92%	0.917	72%	0.717	S	S	*	*			trans	-46.9	106.8	-176.9	-135.9	96	168	-178	0	110.9	K91 R95	K91-K93 PolarHBondContact O-N 3.21Å; K93-R95 PolarHBondContact O-N 3Å
94	Q	78.7	Confident	72.1	Confident	171 Å²	171	149.6 Å²	149.6	80%	0.799	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-63.5	118.4	171.3	-176.6	66.1	16.2	0	0	108.3	R92 R96	R92-Q94 PolarHBondContact O-N 2.99Å; Q94-R96 PolarHBondContact O-N 2.7Å
95	R	79.7	Confident	74.3	Confident	195 Å²	195	143 Å²	143	74%	0.736	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-67.7	133.1	177.3	-151.7	176.7	99.4	-154.3	3.8	108.6	K93	K93-R95 PolarHBondContact O-N 3Å
96	R	79.9	Confident	76.8	Confident	206 Å²	206	138.9 Å²	138.9	78%	0.777	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-56.9	138.9	179.4	-164.2	-178	-64.8	177.7	-0.6	110.6	Q94 R98	Q94-R96 PolarHBondContact O-N 2.7Å; R96-R98 PolarHBondContact O-N 3.44Å
97	N	86.1	Confident	79.5	Confident	140 Å²	140	140 Å²	140	75%	0.749	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-53.2	127.3	175.2	-68.6	-39.4	0	0	0	110.7
98	R	88.9	Confident	81.7	Confident	207 Å²	207	131.3 Å²	131.3	78%	0.781	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-87.7	131.5	178.2	-178.6	178.6	-179.4	173	0.9	108.6	R96	R96-R98 PolarHBondContact O-N 3.44Å
99	T	91.3	Very high	83.9	Confident	44 Å²	44	124.8 Å²	124.8	27%	0.27	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-78.2	134.8	174.1	-55.2	0	0	0	0	110.2	F101 L133 R137	T99-F101 HydrophobicContact CG2-CD1 4.24Å; T99-F101 HydrophobicContact CG2-CE1 3.86Å; T99-F101 HydrophobicContact CG2-CZ 4.23Å; T99-L133 HydrophobicContact CG2-CD2 4.07Å; T99-R137 HydrophobicContact CG2-CG 4.46Å; T99-R137 VanDerWaalsContact OG1-CD 3.24Å; T99-R137 WeakPolarHBondContact OG1-CD 3.06Å; T99-R137 PolarHBondContact OG1-NH1 3.48Å
100	T	95.3	Very high	86.3	Confident	124 Å²	124	119.8 Å²	119.8	76%	0.761	55%	0.551	S	S	*	*			trans	-109.1	124.9	169.7	49.8	0	0	0	0	108.6
101	F	94.9	Very high	88.2	Confident	62 Å²	62	113.3 Å²	113.3	27%	0.272	52%	0.521	S	S	.	.			trans	-88.6	138.6	178	-54	-71.7	0	0	0	109.9	T99 Q105 L106 L109 L133 W141	T99-F101 HydrophobicContact CG2-CD1 4.24Å; T99-F101 HydrophobicContact CG2-CE1 3.86Å; T99-F101 HydrophobicContact CG2-CZ 4.23Å; F101-Q105 VanDerWaalsContact CA-OE1 3.28Å; F101-Q105 HydrophobicContact CB-CB 4.45Å; F101-L106 HydrophobicContact CB-CD1 4.45Å; F101-L106 HydrophobicContact CB-CD2 3.74Å; F101-L106 HydrophobicContact CB-CG 3.82Å; F101-L106 HydrophobicContact CD2-CD2 4.2Å; F101-L106 HydrophobicContact CG-CD2 4.16Å; F101-L109 HydrophobicContact CD1-CD1 4.44Å; F101-L133 HydrophobicContact CD1-CD1 3.64Å; F101-L133 HydrophobicContact CD1-CD2 4Å; F101-L133 HydrophobicContact CD1-CG 4.47Å; F101-L133 HydrophobicContact CE1-CD1 3.48Å; F101-L133 VanDerWaalsContact CE1-CD1 3.48Å; F101-L133 HydrophobicContact CE1-CD2 3.92Å; F101-L133 HydrophobicContact CE1-CG 4.36Å; F101-W141 AromaticContact CD2-CD1 3.93Å; F101-W141 AromaticContact CE2-CD1 3.61Å; F101-W141 HydrophobicContact CE2-CG 4.49Å; F101-W141 HydrophobicContact CZ-CB 4.21Å; F101-W141 AromaticContact CZ-CD1 3.93Å; F101-W141 HydrophobicContact CZ-CG 4.46Å
102	N	96.2	Very high	89.9	Confident	76 Å²	76	103.2 Å²	103.2	41%	0.406	48%	0.477	S	S	.	.			trans	-77.6	172.3	170.1	70.5	25.1	0	0	0	110.6	S104 Q105 L106	N102-S104 PolarHBondContact OD1-N 2.92Å; N102-S104 PolarHBondContact OD1-OG 3.06Å; N102-Q105 VanDerWaalsContact CG-CD 3.44Å; N102-Q105 WeakPolarHBondContact OD1-CA 3.45Å; N102-Q105 WeakPolarHBondContact OD1-CB 3.48Å; N102-Q105 WeakPolarHBondContact OD1-CG 3.33Å; N102-Q105 PolarHBondContact OD1-N 3.31Å; N102-Q105 PolarHBondContact OD1-OE1 3.46Å; N102-L106 WeakPolarHBondContact O-CG 3.4Å; N102-L106 PolarHBondContact O-N 2.94Å
103	S	96.8	Very high	91.4	Very high	82 Å²	82	92 Å²	92	57%	0.573	44%	0.435	S	S	*	.	H	α-helix	trans	-63.6	-43.2	-178.5	-168.6	0	0	0	0	112.7	L106 Q107	S103-L106 PolarHBondContact O-N 2.89Å; S103-Q107 WeakPolarHBondContact O-CG 3.48Å; S103-Q107 PolarHBondContact O-N 2.89Å
104	S	95.3	Very high	92.7	Very high	74 Å²	74	88.7 Å²	88.7	52%	0.517	42%	0.423	S	S	.	.	H	α-helix	trans	-66.5	-39.2	-178.2	55.2	0	0	0	0	113	N102 Q107 A108	N102-S104 PolarHBondContact OD1-N 2.92Å; N102-S104 PolarHBondContact OD1-OG 3.06Å; S104-Q107 PolarHBondContact O-N 3.16Å; S104-A108 PolarHBondContact O-N 3.35Å
105	Q	97.1	Very high	93.4	Very high	23 Å²	23	86.3 Å²	86.3	11%	0.107	41%	0.407	C	S	.	.	H	α-helix	trans	-58.5	-48.2	171.4	-74.7	167.2	-16.4	0	0	110.5	F101 N102 Q107 A108 L109 V131	F101-Q105 VanDerWaalsContact CA-OE1 3.28Å; F101-Q105 HydrophobicContact CB-CB 4.45Å; N102-Q105 VanDerWaalsContact CG-CD 3.44Å; N102-Q105 WeakPolarHBondContact OD1-CA 3.45Å; N102-Q105 WeakPolarHBondContact OD1-CB 3.48Å; N102-Q105 WeakPolarHBondContact OD1-CG 3.33Å; N102-Q105 PolarHBondContact OD1-N 3.31Å; N102-Q105 PolarHBondContact OD1-OE1 3.46Å; Q105-Q107 PolarHBondContact O-N 3.01Å; Q105-A108 PolarHBondContact O-N 3.45Å; Q105-L109 WeakPolarHBondContact O-CB 3.35Å; Q105-L109 WeakPolarHBondContact O-CD1 3.22Å; Q105-L109 WeakPolarHBondContact O-CG 3.35Å; Q105-L109 PolarHBondContact O-N 3.28Å; Q105-V131 HydrophobicContact CG-CB 4.02Å; Q105-V131 WeakPolarHBondContact CG-O 3.33Å; Q105-V131 PolarHBondContact NE2-O 3Å
106	L	97.5	Very high	94.1	Very high	73 Å²	73	78.4 Å²	78.4	38%	0.382	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-42	178.6	-70	174.3	0	0	0	111.8	F101 N102 S103 L109 E110	F101-L106 HydrophobicContact CB-CD1 4.45Å; F101-L106 HydrophobicContact CB-CD2 3.74Å; F101-L106 HydrophobicContact CB-CG 3.82Å; F101-L106 HydrophobicContact CD2-CD2 4.2Å; F101-L106 HydrophobicContact CG-CD2 4.16Å; N102-L106 WeakPolarHBondContact O-CG 3.4Å; N102-L106 PolarHBondContact O-N 2.94Å; S103-L106 PolarHBondContact O-N 2.89Å; L106-L109 PolarHBondContact O-N 3.42Å; L106-E110 WeakPolarHBondContact O-CB 3.41Å; L106-E110 PolarHBondContact O-N 2.98Å
107	Q	96	Very high	94.9	Very high	113 Å²	113	71.4 Å²	71.4	53%	0.528	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-44.2	176.7	-71.2	174.2	13.8	0	0	112	S103 S104 Q105 E110 R111	S103-Q107 WeakPolarHBondContact O-CG 3.48Å; S103-Q107 PolarHBondContact O-N 2.89Å; S104-Q107 PolarHBondContact O-N 3.16Å; Q105-Q107 PolarHBondContact O-N 3.01Å; Q107-E110 PolarHBondContact O-N 3.27Å; Q107-R111 WeakPolarHBondContact O-CB 3.24Å; Q107-R111 VanDerWaalsContact O-CG 3.32Å; Q107-R111 WeakPolarHBondContact O-CG 3.44Å; Q107-R111 PolarHBondContact O-N 3.29Å; Q107-R111 PolarHBondContact O-NE 3.02Å
108	A	95.2	Very high	95.5	Very high	4 Å²	4	72.3 Å²	72.3	3%	0.033	35%	0.35	C	S	.	.	H	α-helix	trans	-63.5	-44.1	176.3	0	0	0	0	0	112	S104 Q105 E110 R111 V112 V131	S104-A108 PolarHBondContact O-N 3.35Å; Q105-A108 PolarHBondContact O-N 3.45Å; A108-E110 PolarHBondContact O-N 2.87Å; A108-R111 PolarHBondContact O-N 2.89Å; A108-V112 PolarHBondContact O-N 3.3Å; A108-V131 HydrophobicContact CB-CG1 3.61Å
109	L	97.4	Very high	95.8	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.8	-42.3	176.6	-71.4	163	0	0	0	112	F101 Q105 L106 V112 F113 L127 L133 V138 W141 F142	F101-L109 HydrophobicContact CD1-CD1 4.44Å; Q105-L109 WeakPolarHBondContact O-CB 3.35Å; Q105-L109 WeakPolarHBondContact O-CD1 3.22Å; Q105-L109 WeakPolarHBondContact O-CG 3.35Å; Q105-L109 PolarHBondContact O-N 3.28Å; L106-L109 PolarHBondContact O-N 3.42Å; L109-V112 PolarHBondContact O-N 3.16Å; L109-F113 WeakPolarHBondContact O-CB 3.49Å; L109-F113 PolarHBondContact O-N 2.81Å; L109-L127 HydrophobicContact CD2-CD2 3.76Å; L109-L127 HydrophobicContact CD2-CG 4.31Å; L109-L133 HydrophobicContact CD1-CD1 4.32Å; L109-V138 HydrophobicContact CD2-CG1 4.09Å; L109-V138 HydrophobicContact CD2-CG2 4.3Å; L109-W141 HydrophobicContact CB-CD2 3.96Å; L109-W141 HydrophobicContact CB-CE3 3.94Å; L109-W141 HydrophobicContact CB-CH2 3.61Å; L109-W141 HydrophobicContact CB-CZ2 3.58Å; L109-W141 HydrophobicContact CB-CZ3 3.78Å; L109-W141 HydrophobicContact CD1-CD2 3.89Å; L109-W141 HydrophobicContact CD1-CG 3.89Å; L109-W141 HydrophobicContact CD2-CD2 4.17Å; L109-W141 HydrophobicContact CD2-CE3 4.04Å; L109-W141 HydrophobicContact CD2-CG 4.49Å; L109-W141 HydrophobicContact CG-CD2 4.24Å; L109-W141 HydrophobicContact CG-CE3 4.4Å; L109-F142 HydrophobicContact CD2-CE2 4.06Å
110	E	97.4	Very high	96	Very high	52 Å²	52	65.6 Å²	65.6	24%	0.243	33%	0.329	C	S	.	.	H	α-helix	trans	-68.4	-40.6	178.4	-162.7	66.5	-150.3	0	0	112	L106 Q107 A108 V112 F113 E114 R145	L106-E110 WeakPolarHBondContact O-CB 3.41Å; L106-E110 PolarHBondContact O-N 2.98Å; Q107-E110 PolarHBondContact O-N 3.27Å; A108-E110 PolarHBondContact O-N 2.87Å; E110-V112 VanDerWaalsContact C-N 3.29Å; E110-V112 PolarHBondContact O-N 2.87Å; E110-F113 WeakPolarHBondContact O-CA 3.41Å; E110-F113 WeakPolarHBondContact O-CB 3.41Å; E110-F113 PolarHBondContact O-N 2.79Å; E110-E114 WeakPolarHBondContact O-CG 3.46Å; E110-E114 PolarHBondContact O-N 3.1Å; E110-R145 IonicContact OE1-CZ 2.75Å; E110-R145 VanDerWaalsContact OE1-CZ 3.28Å; E110-R145 IonicContact OE1-NE 3.67Å; E110-R145 PolarHBondContact OE1-NE 3.15Å; E110-R145 VanDerWaalsContact OE1-NE 3.09Å; E110-R145 IonicContact OE1-NH2 3.65Å; E110-R145 PolarHBondContact OE1-NH2 2.94Å; E110-R145 IonicContact OE2-CZ 3.98Å; E110-R145 IonicContact OE2-NE 3.28Å; E110-R145 PolarHBondContact OE2-NE 3.1Å; E110-R145 IonicContact OE2-NH2 3.96Å
111	R	95.3	Very high	96	Very high	71 Å²	71	61.6 Å²	61.6	27%	0.268	31%	0.308	S	S	.	.	H	α-helix	trans	-58.5	-37.8	174.5	-78.4	-176.3	-72.4	134.6	-8.9	113.1	L40 Q107 A108 R115	L40-R111 HydrophobicContact CD2-CB 4.19Å; L40-R111 PolarHBondContact O-NH1 3.2Å; Q107-R111 WeakPolarHBondContact O-CB 3.24Å; Q107-R111 VanDerWaalsContact O-CG 3.32Å; Q107-R111 WeakPolarHBondContact O-CG 3.44Å; Q107-R111 PolarHBondContact O-N 3.29Å; Q107-R111 PolarHBondContact O-NE 3.02Å; A108-R111 PolarHBondContact O-N 2.89Å; R111-R115 VanDerWaalsContact O-CD 3.31Å; R111-R115 WeakPolarHBondContact O-CD 3.26Å
112	V	95.5	Very high	96.1	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-41.5	172.2	175.3	0	0	0	0	110.7	L39 L40 A108 L109 E110 E114 R115 T116 V123 L127 F142	L39-V112 HydrophobicContact CD2-CB 4.18Å; L39-V112 HydrophobicContact CD2-CG1 3.75Å; L39-V112 HydrophobicContact CD2-CG2 4.01Å; L40-V112 HydrophobicContact CD1-CG2 4.33Å; L40-V112 HydrophobicContact CD2-CG2 3.6Å; L40-V112 HydrophobicContact CG-CG2 4.17Å; A108-V112 PolarHBondContact O-N 3.3Å; L109-V112 PolarHBondContact O-N 3.16Å; E110-V112 VanDerWaalsContact C-N 3.29Å; E110-V112 PolarHBondContact O-N 2.87Å; V112-E114 VanDerWaalsContact C-N 3.32Å; V112-E114 PolarHBondContact O-N 3.19Å; V112-R115 PolarHBondContact O-N 2.99Å; V112-R115 VanDerWaalsContact O-N 3.14Å; V112-T116 HydrophobicContact CG1-CG2 4.39Å; V112-T116 PolarHBondContact O-N 2.96Å; V112-V123 HydrophobicContact CG1-CG1 4.37Å; V112-L127 HydrophobicContact CB-CD2 4.09Å; V112-L127 HydrophobicContact CG1-CD2 4.22Å; V112-L127 HydrophobicContact CG2-CD1 3.91Å; V112-L127 HydrophobicContact CG2-CD2 3.78Å; V112-L127 HydrophobicContact CG2-CG 4.44Å; V112-F142 HydrophobicContact CB-CZ 4.04Å; V112-F142 HydrophobicContact CG1-CE1 4.31Å; V112-F142 HydrophobicContact CG1-CZ 3.66Å
113	F	96.8	Very high	96	Very high	5 Å²	5	61.1 Å²	61.1	2%	0.022	30%	0.303	C	S	.	.	H	α-helix	trans	-59.4	-41.3	179.8	-171.3	-97.7	0	0	0	112.5	L109 E110 R115 T116 H117 W141 F142 R145 R146 F149	L109-F113 WeakPolarHBondContact O-CB 3.49Å; L109-F113 PolarHBondContact O-N 2.81Å; E110-F113 WeakPolarHBondContact O-CA 3.41Å; E110-F113 WeakPolarHBondContact O-CB 3.41Å; E110-F113 PolarHBondContact O-N 2.79Å; F113-R115 PolarHBondContact O-N 3.38Å; F113-T116 WeakPolarHBondContact CA-O 3.36Å; F113-T116 CarbonylContact O-C 3.3Å; F113-T116 VanDerWaalsContact O-C 3.3Å; F113-T116 PolarHBondContact O-N 3.12Å; F113-H117 AromaticContact CD1-CD2 3.55Å; F113-H117 AromaticContact CD1-NE2 3.81Å; F113-H117 HydrophobicContact CD2-CB 4.47Å; F113-H117 AromaticContact CD2-CD2 3.74Å; F113-H117 AromaticContact CE1-CD2 3.2Å; F113-H117 WeakPolarHBondContact CE1-CD2 3.32Å; F113-H117 AromaticContact CE1-NE2 3.27Å; F113-H117 VanDerWaalsContact CE1-NE2 3.27Å; F113-H117 WeakPolarHBondContact CE1-NE2 3.39Å; F113-H117 HydrophobicContact CE2-CB 3.93Å; F113-H117 AromaticContact CE2-CD2 3.41Å; F113-H117 VanDerWaalsContact CE2-CD2 3.41Å; F113-H117 WeakPolarHBondContact CE2-CD2 3.47Å; F113-H117 AromaticContact CE2-CG 3.87Å; F113-H117 AromaticContact CG-CD2 3.8Å; F113-H117 HydrophobicContact CZ-CB 4.27Å; F113-H117 AromaticContact CZ-CD2 3.11Å; F113-H117 WeakPolarHBondContact CZ-CD2 3.45Å; F113-H117 AromaticContact CZ-CG 3.73Å; F113-H117 AromaticContact CZ-NE2 3.54Å; F113-H117 PolarHBondContact O-CD2 3.38Å; F113-W141 HydrophobicContact CB-CH2 4.17Å; F113-W141 HydrophobicContact CB-CZ3 4.21Å; F113-W141 HydrophobicContact CD2-CZ3 4.33Å; F113-F142 HydrophobicContact CB-CE1 4.13Å; F113-F142 AromaticContact CD2-CD1 3.9Å; F113-F142 HydrophobicContact CD2-CD1 3.9Å; F113-F142 AromaticContact CD2-CE1 3.85Å; F113-F142 HydrophobicContact CD2-CE1 3.85Å; F113-R145 HydrophobicContact CD1-CG 3.98Å; F113-R145 HydrophobicContact CD2-CB 4.18Å; F113-R145 HydrophobicContact CD2-CG 3.51Å; F113-R145 HydrophobicContact CE1-CG 3.88Å; F113-R145 HydrophobicContact CE2-CB 3.96Å; F113-R145 HydrophobicContact CE2-CG 3.4Å; F113-R145 VanDerWaalsContact CE2-CG 3.4Å; F113-R145 HydrophobicContact CG-CG 3.82Å; F113-R145 HydrophobicContact CZ-CB 4.48Å; F113-R145 HydrophobicContact CZ-CG 3.6Å; F113-R146 HydrophobicContact CE2-CG 4.03Å; F113-F149 HydrophobicContact CE1-CD2 4.3Å; F113-F149 HydrophobicContact CZ-CB 4.18Å; F113-F149 HydrophobicContact CZ-CD2 4.39Å; F113-F149 HydrophobicContact CZ-CG 4.38Å
114	E	95.9	Very high	96	Very high	141 Å²	141	59.5 Å²	59.5	66%	0.659	28%	0.284	S	S	*	.	H	α-helix	trans	-58.9	-33.3	176.2	-72.5	171.9	173.3	0	0	113.1	E110 V112	E110-E114 WeakPolarHBondContact O-CG 3.46Å; E110-E114 PolarHBondContact O-N 3.1Å; V112-E114 VanDerWaalsContact C-N 3.32Å; V112-E114 PolarHBondContact O-N 3.19Å
115	R	92.6	Very high	96.1	Very high	120 Å²	120	60.8 Å²	60.8	45%	0.453	28%	0.282	S	S	.	.	H	α-helix	trans	-84.8	-39.4	175	-78.9	120.2	142	159.2	-1	113.2	H38 L39 R111 V112 F113	H38-R115 PolarHBondContact O-NH2 3.33Å; L39-R115 VanDerWaalsContact C-NH2 3.34Å; L39-R115 HydrophobicContact CD1-CB 3.42Å; L39-R115 VanDerWaalsContact CD1-CB 3.42Å; L39-R115 HydrophobicContact CD1-CG 3.42Å; L39-R115 VanDerWaalsContact CD1-CG 3.42Å; L39-R115 HydrophobicContact CD2-CB 4.36Å; L39-R115 HydrophobicContact CG-CB 4.09Å; L39-R115 HydrophobicContact CG-CG 4.15Å; L39-R115 PolarHBondContact O-NE 3.5Å; L39-R115 PolarHBondContact O-NH1 3.27Å; L39-R115 PolarHBondContact O-NH2 2.99Å; R111-R115 VanDerWaalsContact O-CD 3.31Å; R111-R115 WeakPolarHBondContact O-CD 3.26Å; V112-R115 PolarHBondContact O-N 2.99Å; V112-R115 VanDerWaalsContact O-N 3.14Å; F113-R115 PolarHBondContact O-N 3.38Å
116	T	95.2	Very high	96	Very high	29 Å²	29	60.4 Å²	60.4	18%	0.178	28%	0.28	C	S	.	.			trans	-150.7	127.6	176.2	-178.9	0	0	0	0	112.6	F34 V112 F113 Y118 P119	F34-T116 HydrophobicContact CE2-CG2 3.95Å; F34-T116 HydrophobicContact CZ-CG2 4Å; V112-T116 HydrophobicContact CG1-CG2 4.39Å; V112-T116 PolarHBondContact O-N 2.96Å; F113-T116 WeakPolarHBondContact CA-O 3.36Å; F113-T116 CarbonylContact O-C 3.3Å; F113-T116 VanDerWaalsContact O-C 3.3Å; F113-T116 PolarHBondContact O-N 3.12Å; T116-Y118 VanDerWaalsContact C-N 3.27Å; T116-Y118 PolarHBondContact O-N 3.14Å; T116-Y118 PolarHBondContact OG1-N 3.47Å; T116-Y118 PolarHBondContact OG1-O 3.08Å; T116-P119 HydrophobicContact CG2-CB 4.28Å
117	H	96.5	Very high	95.9	Very high	60 Å²	60	57 Å²	57	28%	0.278	26%	0.262	S	S	.	.	S	Bend	trans	-75.7	-17.1	172.5	-58.7	154	0	0	0	113.1	F113 R146 F149	F113-H117 AromaticContact CD1-CD2 3.55Å; F113-H117 AromaticContact CD1-NE2 3.81Å; F113-H117 HydrophobicContact CD2-CB 4.47Å; F113-H117 AromaticContact CD2-CD2 3.74Å; F113-H117 AromaticContact CE1-CD2 3.2Å; F113-H117 WeakPolarHBondContact CE1-CD2 3.32Å; F113-H117 AromaticContact CE1-NE2 3.27Å; F113-H117 VanDerWaalsContact CE1-NE2 3.27Å; F113-H117 WeakPolarHBondContact CE1-NE2 3.39Å; F113-H117 HydrophobicContact CE2-CB 3.93Å; F113-H117 AromaticContact CE2-CD2 3.41Å; F113-H117 VanDerWaalsContact CE2-CD2 3.41Å; F113-H117 WeakPolarHBondContact CE2-CD2 3.47Å; F113-H117 AromaticContact CE2-CG 3.87Å; F113-H117 AromaticContact CG-CD2 3.8Å; F113-H117 HydrophobicContact CZ-CB 4.27Å; F113-H117 AromaticContact CZ-CD2 3.11Å; F113-H117 WeakPolarHBondContact CZ-CD2 3.45Å; F113-H117 AromaticContact CZ-CG 3.73Å; F113-H117 AromaticContact CZ-NE2 3.54Å; F113-H117 PolarHBondContact O-CD2 3.38Å; H117-R146 HydrophobicContact CB-CG 4.32Å; H117-R146 VanDerWaalsContact O-CD 3.32Å; H117-R146 WeakPolarHBondContact O-CD 3.44Å; H117-R146 PolarHBondContact O-NH1 3.36Å; H117-F149 AromaticContact CE1-CE2 3.88Å; H117-F149 AromaticContact CE1-CZ 3.79Å
118	Y	97.7	Very high	95.9	Very high	159 Å²	159	51.8 Å²	51.8	62%	0.624	24%	0.239	S	C	*	.	S	Bend	trans	-127.2	72	-175.5	-63.4	-85.2	0	0	0	110.3	T116 R146	T116-Y118 VanDerWaalsContact C-N 3.27Å; T116-Y118 PolarHBondContact O-N 3.14Å; T116-Y118 PolarHBondContact OG1-N 3.47Å; T116-Y118 PolarHBondContact OG1-O 3.08Å; Y118-R146 VanDerWaalsContact CE1-NE 3.32Å; Y118-R146 VanDerWaalsContact CZ-CD 3.4Å
119	P	94.9	Very high	96	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.032	26%	0.264	C	S	.	.			trans	-67.2	138.3	174.9	28.6	-35.7	0	0	0	111.2	T116 V123 R124 F142	T116-P119 HydrophobicContact CG2-CB 4.28Å; P119-V123 HydrophobicContact CB-CB 4.1Å; P119-V123 HydrophobicContact CB-CG1 3.55Å; P119-R124 HydrophobicContact CB-CG 3.97Å; P119-R124 HydrophobicContact CG-CG 3.76Å; P119-R124 PolarHBondContact O-NH1 3.49Å; P119-R124 VanDerWaalsContact O-NH1 3.14Å; P119-F142 HydrophobicContact CG-CD1 3.69Å; P119-F142 HydrophobicContact CG-CD2 3.96Å; P119-F142 HydrophobicContact CG-CE1 3.63Å; P119-F142 HydrophobicContact CG-CE2 3.93Å; P119-F142 HydrophobicContact CG-CG 3.87Å; P119-F142 HydrophobicContact CG-CZ 3.78Å
120	D	96.3	Very high	95.8	Very high	105 Å²	105	62.7 Å²	62.7	56%	0.561	28%	0.279	S	S	*	.			trans	-67.1	164.2	174.1	-169.1	19	0	0	0	112.1	F122 V123 R124	D120-F122 VanDerWaalsContact C-N 3.35Å; D120-F122 PolarHBondContact O-N 2.97Å; D120-V123 PolarHBondContact O-N 2.72Å; D120-V123 VanDerWaalsContact O-N 3.12Å; D120-R124 WeakPolarHBondContact O-CG 3.36Å; D120-R124 PolarHBondContact O-N 2.97Å
121	A	96.2	Very high	95.7	Very high	39 Å²	39	61 Å²	61	32%	0.322	27%	0.272	S	S	.	.	H	α-helix	trans	-51.4	-51	-179.9	0	0	0	0	0	111.8	V123 R124 E125	A121-V123 VanDerWaalsContact C-N 3.32Å; A121-V123 PolarHBondContact O-N 3.43Å; A121-R124 PolarHBondContact O-N 2.95Å; A121-R124 VanDerWaalsContact O-N 3.12Å; A121-E125 WeakPolarHBondContact O-CG 3.44Å; A121-E125 PolarHBondContact O-N 3.33Å
122	F	95.2	Very high	95.8	Very high	126 Å²	126	62.9 Å²	62.9	55%	0.553	29%	0.288	S	S	*	.	H	α-helix	trans	-59	-41.6	178.5	179.1	-99.2	0	0	0	112.7	D120 E125 D126	D120-F122 VanDerWaalsContact C-N 3.35Å; D120-F122 PolarHBondContact O-N 2.97Å; F122-E125 PolarHBondContact O-N 3.44Å; F122-D126 PolarHBondContact O-N 3.13Å
123	V	94.4	Very high	95.8	Very high	3 Å²	3	64.3 Å²	64.3	2%	0.018	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-40.2	177.5	167.3	0	0	0	0	111.6	F34 V36 V112 P119 D120 A121 L127	F34-V123 HydrophobicContact CD1-CG2 4.07Å; F34-V123 HydrophobicContact CE1-CB 4.42Å; F34-V123 HydrophobicContact CE1-CG2 3.26Å; F34-V123 HydrophobicContact CZ-CG2 3.73Å; V36-V123 HydrophobicContact CG2-CB 3.77Å; V36-V123 HydrophobicContact CG2-CG1 3.58Å; V36-V123 HydrophobicContact CG2-CG2 3.61Å; V112-V123 HydrophobicContact CG1-CG1 4.37Å; P119-V123 HydrophobicContact CB-CB 4.1Å; P119-V123 HydrophobicContact CB-CG1 3.55Å; D120-V123 PolarHBondContact O-N 2.72Å; D120-V123 VanDerWaalsContact O-N 3.12Å; A121-V123 VanDerWaalsContact C-N 3.32Å; A121-V123 PolarHBondContact O-N 3.43Å; V123-L127 VanDerWaalsContact O-CB 3.28Å; V123-L127 WeakPolarHBondContact O-CB 3.15Å; V123-L127 PolarHBondContact O-N 2.94Å
124	R	96.8	Very high	95.8	Very high	47 Å²	47	68 Å²	68	18%	0.177	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-40.9	177	-68	-162.4	-56.6	-108.3	7.1	111.6	P119 D120 A121 A128 E135 V138	P119-R124 HydrophobicContact CB-CG 3.97Å; P119-R124 HydrophobicContact CG-CG 3.76Å; P119-R124 PolarHBondContact O-NH1 3.49Å; P119-R124 VanDerWaalsContact O-NH1 3.14Å; D120-R124 WeakPolarHBondContact O-CG 3.36Å; D120-R124 PolarHBondContact O-N 2.97Å; A121-R124 PolarHBondContact O-N 2.95Å; A121-R124 VanDerWaalsContact O-N 3.12Å; R124-A128 WeakPolarHBondContact O-CB 3.35Å; R124-A128 PolarHBondContact O-N 3.25Å; R124-E135 HydrophobicContact CB-CG 4.11Å; R124-E135 IonicContact CZ-OE1 2.67Å; R124-E135 IonicContact NE-OE1 3.09Å; R124-E135 PolarHBondContact NE-OE1 2.92Å; R124-E135 IonicContact NH2-OE1 2.81Å; R124-E135 PolarHBondContact NH2-OE1 3.4Å; R124-V138 HydrophobicContact CB-CG1 4.22Å; R124-V138 HydrophobicContact CG-CG1 4.22Å
125	E	97.2	Very high	95.8	Very high	102 Å²	102	63.9 Å²	63.9	48%	0.477	30%	0.299	S	S	.	.	H	α-helix	trans	-63.8	-45.7	177.1	-72.8	173.7	-170.4	0	0	112.1	A121 F122 A128 R129 E135	A121-E125 WeakPolarHBondContact O-CG 3.44Å; A121-E125 PolarHBondContact O-N 3.33Å; F122-E125 PolarHBondContact O-N 3.44Å; E125-A128 PolarHBondContact O-N 3.38Å; E125-R129 PolarHBondContact O-N 3.08Å; E125-R129 VanDerWaalsContact O-N 3.08Å; E125-E135 HydrophobicContact CG-CB 4.38Å; E125-E135 HydrophobicContact CG-CG 3.95Å
126	D	94.9	Very high	96	Very high	15 Å²	15	60.3 Å²	60.3	8%	0.08	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-43.4	177	-168	65	0	0	0	112.3	V36 F122 A128 R129 R130	V36-D126 HydrophobicContact CB-CB 4.3Å; V36-D126 VanDerWaalsContact CB-OD2 3.27Å; V36-D126 WeakPolarHBondContact CB-OD2 3.49Å; V36-D126 HydrophobicContact CG1-CB 4.46Å; V36-D126 VanDerWaalsContact CG1-OD2 3.26Å; V36-D126 WeakPolarHBondContact CG1-OD2 3.48Å; V36-D126 HydrophobicContact CG2-CB 4.13Å; F122-D126 PolarHBondContact O-N 3.13Å; D126-A128 PolarHBondContact O-N 3.41Å; D126-R129 PolarHBondContact O-N 3.48Å; D126-R129 IonicContact OD1-CZ 3.33Å; D126-R129 IonicContact OD1-NH1 2.81Å; D126-R129 PolarHBondContact OD1-NH1 2.87Å; D126-R129 IonicContact OD1-NH2 2.96Å; D126-R129 PolarHBondContact OD1-NH2 2.88Å; D126-R130 WeakPolarHBondContact O-CG 3.42Å; D126-R130 PolarHBondContact O-N 3.12Å; D126-R130 VanDerWaalsContact O-N 3.1Å; D126-R130 IonicContact OD1-NE 3.1Å; D126-R130 IonicContact OD1-NH2 2.9Å; D126-R130 IonicContact OD2-CZ 3.2Å; D126-R130 IonicContact OD2-NE 3.39Å; D126-R130 PolarHBondContact OD2-NE 3.4Å; D126-R130 IonicContact OD2-NH2 2.71Å; D126-R130 PolarHBondContact OD2-NH2 2.71Å; D126-R130 VanDerWaalsContact OD2-NH2 3.1Å
127	L	95.5	Very high	96.2	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.6	-45.1	175.5	-177.1	59.7	0	0	0	111.4	L40 L109 V112 V123 R129 R130 V131 V138 F142	L40-L127 HydrophobicContact CD1-CD1 3.97Å; L109-L127 HydrophobicContact CD2-CD2 3.76Å; L109-L127 HydrophobicContact CD2-CG 4.31Å; V112-L127 HydrophobicContact CB-CD2 4.09Å; V112-L127 HydrophobicContact CG1-CD2 4.22Å; V112-L127 HydrophobicContact CG2-CD1 3.91Å; V112-L127 HydrophobicContact CG2-CD2 3.78Å; V112-L127 HydrophobicContact CG2-CG 4.44Å; V123-L127 VanDerWaalsContact O-CB 3.28Å; V123-L127 WeakPolarHBondContact O-CB 3.15Å; V123-L127 PolarHBondContact O-N 2.94Å; L127-R129 VanDerWaalsContact C-N 3.33Å; L127-R129 PolarHBondContact O-N 3.48Å; L127-R130 PolarHBondContact O-N 3.08Å; L127-R130 VanDerWaalsContact O-N 3.15Å; L127-V131 HydrophobicContact CD1-CG1 3.94Å; L127-V131 WeakPolarHBondContact O-CG2 3.28Å; L127-V131 PolarHBondContact O-N 2.9Å; L127-V138 HydrophobicContact CD2-CG1 4.02Å; L127-F142 HydrophobicContact CD2-CE2 3.86Å; L127-F142 HydrophobicContact CD2-CZ 4.26Å
128	A	96.7	Very high	96.2	Very high	4 Å²	4	59.2 Å²	59.2	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-56.7	-45.2	178.8	0	0	0	0	0	112	R124 E125 D126 V131 N132 L133 V138	R124-A128 WeakPolarHBondContact O-CB 3.35Å; R124-A128 PolarHBondContact O-N 3.25Å; E125-A128 PolarHBondContact O-N 3.38Å; D126-A128 PolarHBondContact O-N 3.41Å; A128-V131 PolarHBondContact O-N 3.38Å; A128-N132 PolarHBondContact O-N 3Å; A128-N132 VanDerWaalsContact O-N 3.13Å; A128-L133 CarbonylContact C-O 3.46Å; A128-L133 WeakPolarHBondContact CB-O 3.4Å; A128-L133 PolarHBondContact O-N 3.45Å; A128-L133 VanDerWaalsContact O-O 3.11Å; A128-V138 HydrophobicContact CB-CG2 3.75Å
129	R	96.5	Very high	96.2	Very high	150 Å²	150	55.1 Å²	55.1	57%	0.566	27%	0.272	S	S	*	.	H	α-helix	trans	-59.3	-47.9	173.9	-74.9	-172	-78.1	97.2	-2.1	111.9	E125 D126 L127 V131 N132	E125-R129 PolarHBondContact O-N 3.08Å; E125-R129 VanDerWaalsContact O-N 3.08Å; D126-R129 PolarHBondContact O-N 3.48Å; D126-R129 IonicContact OD1-CZ 3.33Å; D126-R129 IonicContact OD1-NH1 2.81Å; D126-R129 PolarHBondContact OD1-NH1 2.87Å; D126-R129 IonicContact OD1-NH2 2.96Å; D126-R129 PolarHBondContact OD1-NH2 2.88Å; L127-R129 VanDerWaalsContact C-N 3.33Å; L127-R129 PolarHBondContact O-N 3.48Å; R129-V131 VanDerWaalsContact C-N 3.33Å; R129-V131 PolarHBondContact O-N 3.37Å; R129-N132 PolarHBondContact O-N 3.38Å; R129-N132 PolarHBondContact O-OD1 2.92Å
130	R	94	Very high	96.3	Very high	84 Å²	84	58 Å²	58	32%	0.317	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-33.3	-177.8	-69.6	174.6	-172.2	-91.3	-0.2	114.1	S37 D126 L127	S37-R130 PolarHBondContact OG-NH2 3.27Å; S37-R130 VanDerWaalsContact OG-NH2 3.09Å; D126-R130 WeakPolarHBondContact O-CG 3.42Å; D126-R130 PolarHBondContact O-N 3.12Å; D126-R130 VanDerWaalsContact O-N 3.1Å; D126-R130 IonicContact OD1-NE 3.1Å; D126-R130 IonicContact OD1-NH2 2.9Å; D126-R130 IonicContact OD2-CZ 3.2Å; D126-R130 IonicContact OD2-NE 3.39Å; D126-R130 PolarHBondContact OD2-NE 3.4Å; D126-R130 IonicContact OD2-NH2 2.71Å; D126-R130 PolarHBondContact OD2-NH2 2.71Å; D126-R130 VanDerWaalsContact OD2-NH2 3.1Å; L127-R130 PolarHBondContact O-N 3.08Å; L127-R130 VanDerWaalsContact O-N 3.15Å
131	V	95.1	Very high	96.4	Very high	15 Å²	15	54.1 Å²	54.1	9%	0.091	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	9.9	-175.5	-51.4	0	0	0	0	113.2	Q105 A108 L127 A128 R129 L133	Q105-V131 HydrophobicContact CG-CB 4.02Å; Q105-V131 WeakPolarHBondContact CG-O 3.33Å; Q105-V131 PolarHBondContact NE2-O 3Å; A108-V131 HydrophobicContact CB-CG1 3.61Å; L127-V131 HydrophobicContact CD1-CG1 3.94Å; L127-V131 WeakPolarHBondContact O-CG2 3.28Å; L127-V131 PolarHBondContact O-N 2.9Å; A128-V131 PolarHBondContact O-N 3.38Å; R129-V131 VanDerWaalsContact C-N 3.33Å; R129-V131 PolarHBondContact O-N 3.37Å; V131-L133 HydrophobicContact CG2-CB 4.11Å; V131-L133 HydrophobicContact CG2-CD1 3.56Å; V131-L133 HydrophobicContact CG2-CG 3.81Å; V131-L133 PolarHBondContact O-N 2.89Å
132	N	96.7	Very high	96.6	Very high	112 Å²	112	52.3 Å²	52.3	60%	0.599	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	50.5	-179.5	-62.1	-25.1	0	0	0	113.4	A128 R129	A128-N132 PolarHBondContact O-N 3Å; A128-N132 VanDerWaalsContact O-N 3.13Å; R129-N132 PolarHBondContact O-N 3.38Å; R129-N132 PolarHBondContact O-OD1 2.92Å
133	L	95.4	Very high	96.7	Very high	29 Å²	29	50.9 Å²	50.9	15%	0.152	25%	0.246	C	C	.	.			trans	-126.7	164.2	174.9	-65.3	174.7	0	0	0	110.2	T99 F101 L109 A128 V131 R137 V138	T99-L133 HydrophobicContact CG2-CD2 4.07Å; F101-L133 HydrophobicContact CD1-CD1 3.64Å; F101-L133 HydrophobicContact CD1-CD2 4Å; F101-L133 HydrophobicContact CD1-CG 4.47Å; F101-L133 HydrophobicContact CE1-CD1 3.48Å; F101-L133 VanDerWaalsContact CE1-CD1 3.48Å; F101-L133 HydrophobicContact CE1-CD2 3.92Å; F101-L133 HydrophobicContact CE1-CG 4.36Å; L109-L133 HydrophobicContact CD1-CD1 4.32Å; A128-L133 CarbonylContact C-O 3.46Å; A128-L133 WeakPolarHBondContact CB-O 3.4Å; A128-L133 PolarHBondContact O-N 3.45Å; A128-L133 VanDerWaalsContact O-O 3.11Å; V131-L133 HydrophobicContact CG2-CB 4.11Å; V131-L133 HydrophobicContact CG2-CD1 3.56Å; V131-L133 HydrophobicContact CG2-CG 3.81Å; V131-L133 PolarHBondContact O-N 2.89Å; L133-R137 HydrophobicContact CB-CB 4.33Å; L133-V138 HydrophobicContact CB-CG2 4.26Å; L133-V138 HydrophobicContact CD1-CG2 4.36Å
134	T	96.9	Very high	96.9	Very high	84 Å²	84	55.8 Å²	55.8	52%	0.515	27%	0.273	S	S	.	.			trans	-78.7	150.8	167.2	75.8	0	0	0	0	110.7	A136 R137 V138	T134-A136 PolarHBondContact O-N 3.42Å; T134-R137 WeakPolarHBondContact O-CA 3.38Å; T134-R137 WeakPolarHBondContact O-CB 3.49Å; T134-R137 PolarHBondContact O-N 3.02Å; T134-R137 WeakPolarHBondContact OG1-CG 2.99Å; T134-R137 PolarHBondContact OG1-N 3Å; T134-V138 PolarHBondContact O-N 3.19Å; T134-V138 VanDerWaalsContact O-N 3.16Å
135	E	97.8	Very high	96.9	Very high	54 Å²	54	56.4 Å²	56.4	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-50.7	-43.3	173.6	-176.4	-79.1	160.9	0	0	110.8	R124 E125 R137 V138 Q139	R124-E135 HydrophobicContact CB-CG 4.11Å; R124-E135 IonicContact CZ-OE1 2.67Å; R124-E135 IonicContact NE-OE1 3.09Å; R124-E135 PolarHBondContact NE-OE1 2.92Å; R124-E135 IonicContact NH2-OE1 2.81Å; R124-E135 PolarHBondContact NH2-OE1 3.4Å; E125-E135 HydrophobicContact CG-CB 4.38Å; E125-E135 HydrophobicContact CG-CG 3.95Å; E135-R137 PolarHBondContact O-N 3.38Å; E135-V138 CarbonylContact O-C 3.59Å; E135-V138 WeakPolarHBondContact O-CB 3.44Å; E135-V138 PolarHBondContact O-N 3.26Å; E135-V138 VanDerWaalsContact O-N 3.08Å; E135-Q139 WeakPolarHBondContact O-CB 3.32Å; E135-Q139 PolarHBondContact O-N 3.48Å
136	A	96.8	Very high	97	Very high	45 Å²	45	53.5 Å²	53.5	37%	0.372	26%	0.26	S	S	.	.	H	α-helix	trans	-59.1	-33.2	177.8	0	0	0	0	0	112.8	T134 V140	T134-A136 PolarHBondContact O-N 3.42Å; A136-V140 WeakPolarHBondContact O-CB 3.2Å; A136-V140 VanDerWaalsContact O-CG2 3.26Å; A136-V140 WeakPolarHBondContact O-CG2 3.38Å; A136-V140 PolarHBondContact O-N 2.89Å
137	R	97.4	Very high	97.1	Very high	65 Å²	65	54.3 Å²	54.3	25%	0.245	27%	0.268	C	S	.	.	H	α-helix	trans	-72.7	-41	175.8	-69.6	-61.1	136.1	141.7	-4.6	112.3	T99 L133 T134 E135 Q139 V140 W141	T99-R137 HydrophobicContact CG2-CG 4.46Å; T99-R137 VanDerWaalsContact OG1-CD 3.24Å; T99-R137 WeakPolarHBondContact OG1-CD 3.06Å; T99-R137 PolarHBondContact OG1-NH1 3.48Å; L133-R137 HydrophobicContact CB-CB 4.33Å; T134-R137 WeakPolarHBondContact O-CA 3.38Å; T134-R137 WeakPolarHBondContact O-CB 3.49Å; T134-R137 PolarHBondContact O-N 3.02Å; T134-R137 WeakPolarHBondContact OG1-CG 2.99Å; T134-R137 PolarHBondContact OG1-N 3Å; E135-R137 PolarHBondContact O-N 3.38Å; R137-Q139 VanDerWaalsContact C-N 3.35Å; R137-V140 PolarHBondContact O-N 2.79Å; R137-W141 WeakPolarHBondContact O-CB 3.46Å; R137-W141 PolarHBondContact O-N 2.87Å
138	V	97.6	Very high	97.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-47.4	172.1	177.2	0	0	0	0	109.7	L109 R124 L127 A128 L133 T134 E135 V140 W141 F142	L109-V138 HydrophobicContact CD2-CG1 4.09Å; L109-V138 HydrophobicContact CD2-CG2 4.3Å; R124-V138 HydrophobicContact CB-CG1 4.22Å; R124-V138 HydrophobicContact CG-CG1 4.22Å; L127-V138 HydrophobicContact CD2-CG1 4.02Å; A128-V138 HydrophobicContact CB-CG2 3.75Å; L133-V138 HydrophobicContact CB-CG2 4.26Å; L133-V138 HydrophobicContact CD1-CG2 4.36Å; T134-V138 PolarHBondContact O-N 3.19Å; T134-V138 VanDerWaalsContact O-N 3.16Å; E135-V138 CarbonylContact O-C 3.59Å; E135-V138 WeakPolarHBondContact O-CB 3.44Å; E135-V138 PolarHBondContact O-N 3.26Å; E135-V138 VanDerWaalsContact O-N 3.08Å; V138-V140 PolarHBondContact O-N 2.93Å; V138-W141 WeakPolarHBondContact O-CB 3.37Å; V138-W141 PolarHBondContact O-N 3.37Å; V138-W141 VanDerWaalsContact O-N 3.12Å; V138-F142 HydrophobicContact CG1-CD2 3.67Å; V138-F142 HydrophobicContact CG1-CE2 3.7Å; V138-F142 WeakPolarHBondContact O-CD2 3.39Å; V138-F142 PolarHBondContact O-N 2.99Å
139	Q	97.8	Very high	97.2	Very high	73 Å²	73	63.7 Å²	63.7	34%	0.341	31%	0.309	S	S	.	.	H	α-helix	trans	-56.2	-47.9	176.6	-179.1	173.1	-101.5	0	0	112.3	E135 R137 W141 F142 Q143	E135-Q139 WeakPolarHBondContact O-CB 3.32Å; E135-Q139 PolarHBondContact O-N 3.48Å; R137-Q139 VanDerWaalsContact C-N 3.35Å; Q139-W141 VanDerWaalsContact C-N 3.35Å; Q139-F142 PolarHBondContact O-N 3.17Å; Q139-Q143 WeakPolarHBondContact O-CG 3.26Å; Q139-Q143 PolarHBondContact O-N 3.12Å
140	V	97.8	Very high	97.2	Very high	66 Å²	66	61.8 Å²	61.8	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-37.9	177.2	170.7	0	0	0	0	111.4	A136 R137 V138 Q143 N144	A136-V140 WeakPolarHBondContact O-CB 3.2Å; A136-V140 VanDerWaalsContact O-CG2 3.26Å; A136-V140 WeakPolarHBondContact O-CG2 3.38Å; A136-V140 PolarHBondContact O-N 2.89Å; R137-V140 PolarHBondContact O-N 2.79Å; V138-V140 PolarHBondContact O-N 2.93Å; V140-Q143 PolarHBondContact O-N 3.39Å; V140-N144 WeakPolarHBondContact O-CB 3.47Å; V140-N144 PolarHBondContact O-N 2.77Å; V140-N144 PolarHBondContact O-ND2 3.03Å
141	W	98.3	Very high	97.1	Very high	23 Å²	23	66.1 Å²	66.1	9%	0.087	32%	0.318	C	S	.	.	H	α-helix	trans	-60.8	-49.7	175.3	-175.3	98.7	0	0	0	111.1	F101 L109 F113 R137 V138 Q139 Q143 N144 R145	F101-W141 AromaticContact CD2-CD1 3.93Å; F101-W141 AromaticContact CE2-CD1 3.61Å; F101-W141 HydrophobicContact CE2-CG 4.49Å; F101-W141 HydrophobicContact CZ-CB 4.21Å; F101-W141 AromaticContact CZ-CD1 3.93Å; F101-W141 HydrophobicContact CZ-CG 4.46Å; L109-W141 HydrophobicContact CB-CD2 3.96Å; L109-W141 HydrophobicContact CB-CE3 3.94Å; L109-W141 HydrophobicContact CB-CH2 3.61Å; L109-W141 HydrophobicContact CB-CZ2 3.58Å; L109-W141 HydrophobicContact CB-CZ3 3.78Å; L109-W141 HydrophobicContact CD1-CD2 3.89Å; L109-W141 HydrophobicContact CD1-CG 3.89Å; L109-W141 HydrophobicContact CD2-CD2 4.17Å; L109-W141 HydrophobicContact CD2-CE3 4.04Å; L109-W141 HydrophobicContact CD2-CG 4.49Å; L109-W141 HydrophobicContact CG-CD2 4.24Å; L109-W141 HydrophobicContact CG-CE3 4.4Å; F113-W141 HydrophobicContact CB-CH2 4.17Å; F113-W141 HydrophobicContact CB-CZ3 4.21Å; F113-W141 HydrophobicContact CD2-CZ3 4.33Å; R137-W141 WeakPolarHBondContact O-CB 3.46Å; R137-W141 PolarHBondContact O-N 2.87Å; V138-W141 WeakPolarHBondContact O-CB 3.37Å; V138-W141 PolarHBondContact O-N 3.37Å; V138-W141 VanDerWaalsContact O-N 3.12Å; Q139-W141 VanDerWaalsContact C-N 3.35Å; W141-Q143 VanDerWaalsContact C-N 3.34Å; W141-Q143 PolarHBondContact O-N 2.73Å; W141-N144 PolarHBondContact O-N 2.99Å; W141-R145 HydrophobicContact CD2-CB 4.49Å; W141-R145 HydrophobicContact CE3-CB 4.14Å; W141-R145 HydrophobicContact CH2-CB 4.09Å; W141-R145 HydrophobicContact CH2-CG 3.74Å; W141-R145 HydrophobicContact CZ2-CB 4.47Å; W141-R145 HydrophobicContact CZ2-CG 4.29Å; W141-R145 HydrophobicContact CZ3-CB 3.92Å; W141-R145 HydrophobicContact CZ3-CG 3.96Å; W141-R145 WeakPolarHBondContact O-CB 3.33Å; W141-R145 PolarHBondContact O-N 3.43Å
142	F	98.5	Very high	97	Very high	1 Å²	1	69.5 Å²	69.5	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-62.4	-39	178.1	-89	-86.4	0	0	0	112.3	L109 V112 F113 P119 L127 V138 Q139 R145 R146	L109-F142 HydrophobicContact CD2-CE2 4.06Å; V112-F142 HydrophobicContact CB-CZ 4.04Å; V112-F142 HydrophobicContact CG1-CE1 4.31Å; V112-F142 HydrophobicContact CG1-CZ 3.66Å; F113-F142 HydrophobicContact CB-CE1 4.13Å; F113-F142 AromaticContact CD2-CD1 3.9Å; F113-F142 HydrophobicContact CD2-CD1 3.9Å; F113-F142 AromaticContact CD2-CE1 3.85Å; F113-F142 HydrophobicContact CD2-CE1 3.85Å; P119-F142 HydrophobicContact CG-CD1 3.69Å; P119-F142 HydrophobicContact CG-CD2 3.96Å; P119-F142 HydrophobicContact CG-CE1 3.63Å; P119-F142 HydrophobicContact CG-CE2 3.93Å; P119-F142 HydrophobicContact CG-CG 3.87Å; P119-F142 HydrophobicContact CG-CZ 3.78Å; L127-F142 HydrophobicContact CD2-CE2 3.86Å; L127-F142 HydrophobicContact CD2-CZ 4.26Å; V138-F142 HydrophobicContact CG1-CD2 3.67Å; V138-F142 HydrophobicContact CG1-CE2 3.7Å; V138-F142 WeakPolarHBondContact O-CD2 3.39Å; V138-F142 PolarHBondContact O-N 2.99Å; Q139-F142 PolarHBondContact O-N 3.17Å; F142-R145 PolarHBondContact O-N 3.06Å; F142-R146 WeakPolarHBondContact O-CB 3.37Å; F142-R146 WeakPolarHBondContact O-CG 3.18Å; F142-R146 PolarHBondContact O-N 2.87Å
143	Q	98.3	Very high	96.5	Very high	96 Å²	96	68.7 Å²	68.7	45%	0.449	33%	0.328	S	S	.	.	H	α-helix	trans	-59.7	-48.3	173.4	-76.4	-179.2	79.4	0	0	112.1	Q139 V140 W141 R146 A147	Q139-Q143 WeakPolarHBondContact O-CG 3.26Å; Q139-Q143 PolarHBondContact O-N 3.12Å; V140-Q143 PolarHBondContact O-N 3.39Å; W141-Q143 VanDerWaalsContact C-N 3.34Å; W141-Q143 PolarHBondContact O-N 2.73Å; Q143-R146 PolarHBondContact O-N 3.01Å; Q143-A147 WeakPolarHBondContact O-CB 3.27Å; Q143-A147 PolarHBondContact O-N 3.29Å
144	N	98.2	Very high	96.1	Very high	106 Å²	106	75.7 Å²	75.7	57%	0.567	35%	0.353	S	S	*	.	H	α-helix	trans	-65.7	-39.4	177.8	-74.4	-32.2	0	0	0	112	V140 W141 A147 K148	V140-N144 WeakPolarHBondContact O-CB 3.47Å; V140-N144 PolarHBondContact O-N 2.77Å; V140-N144 PolarHBondContact O-ND2 3.03Å; W141-N144 PolarHBondContact O-N 2.99Å; N144-A147 WeakPolarHBondContact O-CB 3.45Å; N144-A147 PolarHBondContact O-N 3.48Å; N144-K148 PolarHBondContact O-N 3.09Å
145	R	98.3	Very high	95.6	Very high	60 Å²	60	74.2 Å²	74.2	23%	0.226	35%	0.349	C	S	.	.	H	α-helix	trans	-63.7	-45.8	177.6	-171.6	68.9	-174.5	99.5	-3.8	111.2	E110 F113 W141 F142 A147 K148 F149	E110-R145 IonicContact OE1-CZ 2.75Å; E110-R145 VanDerWaalsContact OE1-CZ 3.28Å; E110-R145 IonicContact OE1-NE 3.67Å; E110-R145 PolarHBondContact OE1-NE 3.15Å; E110-R145 VanDerWaalsContact OE1-NE 3.09Å; E110-R145 IonicContact OE1-NH2 3.65Å; E110-R145 PolarHBondContact OE1-NH2 2.94Å; E110-R145 IonicContact OE2-CZ 3.98Å; E110-R145 IonicContact OE2-NE 3.28Å; E110-R145 PolarHBondContact OE2-NE 3.1Å; E110-R145 IonicContact OE2-NH2 3.96Å; F113-R145 HydrophobicContact CD1-CG 3.98Å; F113-R145 HydrophobicContact CD2-CB 4.18Å; F113-R145 HydrophobicContact CD2-CG 3.51Å; F113-R145 HydrophobicContact CE1-CG 3.88Å; F113-R145 HydrophobicContact CE2-CB 3.96Å; F113-R145 HydrophobicContact CE2-CG 3.4Å; F113-R145 VanDerWaalsContact CE2-CG 3.4Å; F113-R145 HydrophobicContact CG-CG 3.82Å; F113-R145 HydrophobicContact CZ-CB 4.48Å; F113-R145 HydrophobicContact CZ-CG 3.6Å; W141-R145 HydrophobicContact CD2-CB 4.49Å; W141-R145 HydrophobicContact CE3-CB 4.14Å; W141-R145 HydrophobicContact CH2-CB 4.09Å; W141-R145 HydrophobicContact CH2-CG 3.74Å; W141-R145 HydrophobicContact CZ2-CB 4.47Å; W141-R145 HydrophobicContact CZ2-CG 4.29Å; W141-R145 HydrophobicContact CZ3-CB 3.92Å; W141-R145 HydrophobicContact CZ3-CG 3.96Å; W141-R145 WeakPolarHBondContact O-CB 3.33Å; W141-R145 PolarHBondContact O-N 3.43Å; F142-R145 PolarHBondContact O-N 3.06Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 2.96Å; R145-K148 PolarHBondContact O-N 2.75Å; R145-F149 WeakPolarHBondContact O-CB 3.41Å; R145-F149 PolarHBondContact O-N 3.26Å
146	R	98.1	Very high	95	Very high	41 Å²	41	77.1 Å²	77.1	16%	0.155	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-39.4	172.1	-73.1	-165	-61.8	-91.1	3.8	112.5	F113 H117 Y118 F142 Q143 F149 R150	F113-R146 HydrophobicContact CE2-CG 4.03Å; H117-R146 HydrophobicContact CB-CG 4.32Å; H117-R146 VanDerWaalsContact O-CD 3.32Å; H117-R146 WeakPolarHBondContact O-CD 3.44Å; H117-R146 PolarHBondContact O-NH1 3.36Å; Y118-R146 VanDerWaalsContact CE1-NE 3.32Å; Y118-R146 VanDerWaalsContact CZ-CD 3.4Å; F142-R146 WeakPolarHBondContact O-CB 3.37Å; F142-R146 WeakPolarHBondContact O-CG 3.18Å; F142-R146 PolarHBondContact O-N 2.87Å; Q143-R146 PolarHBondContact O-N 3.01Å; R146-F149 PolarHBondContact O-N 2.91Å; R146-R150 WeakPolarHBondContact O-CG 3.34Å; R146-R150 PolarHBondContact O-N 3.22Å
147	A	98	Very high	94.3	Very high	32 Å²	32	80 Å²	80	26%	0.264	37%	0.372	S	S	.	.	H	α-helix	trans	-63.5	-42.1	175.9	0	0	0	0	0	111.7	Q143 N144 R145 R151	Q143-A147 WeakPolarHBondContact O-CB 3.27Å; Q143-A147 PolarHBondContact O-N 3.29Å; N144-A147 WeakPolarHBondContact O-CB 3.45Å; N144-A147 PolarHBondContact O-N 3.48Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 2.96Å; A147-R151 WeakPolarHBondContact O-CB 3.38Å; A147-R151 PolarHBondContact O-N 3.1Å
148	K	97.3	Very high	93.6	Very high	131 Å²	131	79.7 Å²	79.7	57%	0.57	38%	0.384	S	S	*	.	H	α-helix	trans	-63.9	-44.2	173.9	-172	-179.1	179.1	-173.2	0	111.3	N144 R145 R151 N152	N144-K148 PolarHBondContact O-N 3.09Å; R145-K148 PolarHBondContact O-N 2.75Å; K148-R151 PolarHBondContact O-N 2.89Å; K148-N152 WeakPolarHBondContact O-CB 3.11Å; K148-N152 PolarHBondContact O-N 3.35Å
149	F	96.3	Very high	92.8	Very high	71 Å²	71	85.4 Å²	85.4	31%	0.311	41%	0.414	S	S	.	.	H	α-helix	trans	-55.6	-53.7	177.1	-177.9	-93.7	0	0	0	111.4	F113 H117 R145 R146 R151 N152 E153	F113-F149 HydrophobicContact CE1-CD2 4.3Å; F113-F149 HydrophobicContact CZ-CB 4.18Å; F113-F149 HydrophobicContact CZ-CD2 4.39Å; F113-F149 HydrophobicContact CZ-CG 4.38Å; H117-F149 AromaticContact CE1-CE2 3.88Å; H117-F149 AromaticContact CE1-CZ 3.79Å; R145-F149 WeakPolarHBondContact O-CB 3.41Å; R145-F149 PolarHBondContact O-N 3.26Å; R146-F149 PolarHBondContact O-N 2.91Å; F149-R151 VanDerWaalsContact C-N 3.33Å; F149-R151 PolarHBondContact O-N 2.93Å; F149-N152 WeakPolarHBondContact O-CB 3.5Å; F149-N152 PolarHBondContact O-N 2.99Å; F149-N152 VanDerWaalsContact O-N 3.13Å; F149-E153 VanDerWaalsContact CE1-CD 3.46Å; F149-E153 HydrophobicContact CE1-CG 4.35Å; F149-E153 WeakPolarHBondContact CE1-OE1 3.41Å; F149-E153 VanDerWaalsContact CZ-OE1 3.24Å; F149-E153 WeakPolarHBondContact CZ-OE1 3.48Å; F149-E153 PolarHBondContact O-N 2.91Å; F149-E153 VanDerWaalsContact O-N 3.12Å
150	R	95.9	Very high	91.8	Very high	110 Å²	110	88.6 Å²	88.6	42%	0.415	43%	0.427	S	S	.	.	H	α-helix	trans	-62	-36.6	176.5	-67.3	-166.2	-55.3	-88.9	2.4	113.4	R146 N152 R154	R146-R150 WeakPolarHBondContact O-CG 3.34Å; R146-R150 PolarHBondContact O-N 3.22Å; R150-N152 VanDerWaalsContact C-N 3.33Å; R150-R154 WeakPolarHBondContact O-CG 3.44Å; R150-R154 PolarHBondContact O-N 3.01Å; R150-R154 VanDerWaalsContact O-N 3.16Å
151	R	93.5	Very high	90.6	Very high	174 Å²	174	90.4 Å²	90.4	66%	0.657	44%	0.435	S	S	*	.	H	α-helix	trans	-65.1	-39.8	176.5	-173.5	-178.2	-68.7	122.5	-1.8	110.9	A147 K148 F149 R154 A155	A147-R151 WeakPolarHBondContact O-CB 3.38Å; A147-R151 PolarHBondContact O-N 3.1Å; K148-R151 PolarHBondContact O-N 2.89Å; F149-R151 VanDerWaalsContact C-N 3.33Å; F149-R151 PolarHBondContact O-N 2.93Å; R151-R154 PolarHBondContact O-N 3.48Å; R151-A155 WeakPolarHBondContact O-CB 3.33Å; R151-A155 PolarHBondContact O-N 3.18Å
152	N	91.6	Very high	89.4	Confident	87 Å²	87	91.9 Å²	91.9	47%	0.465	45%	0.452	S	S	.	.	H	α-helix	trans	-64.9	-44.3	179.7	-159.9	73.8	0	0	0	111.5	K148 F149 R150 R154 A155 M156	K148-N152 WeakPolarHBondContact O-CB 3.11Å; K148-N152 PolarHBondContact O-N 3.35Å; F149-N152 WeakPolarHBondContact O-CB 3.5Å; F149-N152 PolarHBondContact O-N 2.99Å; F149-N152 VanDerWaalsContact O-N 3.13Å; R150-N152 VanDerWaalsContact C-N 3.33Å; N152-R154 PolarHBondContact O-N 3.34Å; N152-A155 PolarHBondContact O-N 3.43Å; N152-M156 WeakPolarHBondContact ND2-CE 3.46Å; N152-M156 WeakPolarHBondContact O-CG 3.32Å; N152-M156 PolarHBondContact O-N 2.9Å
153	E	87.3	Confident	88.1	Confident	95 Å²	95	95.3 Å²	95.3	44%	0.444	48%	0.475	S	S	.	.	H	α-helix	trans	-60.2	-45.3	174.9	-67.6	179.4	149.6	0	0	112.2	F149 A155 M156 L157	F149-E153 VanDerWaalsContact CE1-CD 3.46Å; F149-E153 HydrophobicContact CE1-CG 4.35Å; F149-E153 WeakPolarHBondContact CE1-OE1 3.41Å; F149-E153 VanDerWaalsContact CZ-OE1 3.24Å; F149-E153 WeakPolarHBondContact CZ-OE1 3.48Å; F149-E153 PolarHBondContact O-N 2.91Å; F149-E153 VanDerWaalsContact O-N 3.12Å; E153-A155 PolarHBondContact O-N 2.89Å; E153-M156 PolarHBondContact O-N 3.29Å; E153-L157 PolarHBondContact O-N 2.99Å; E153-L157 VanDerWaalsContact O-N 3.16Å
154	R	86.9	Confident	86.5	Confident	176 Å²	176	96.3 Å²	96.3	66%	0.664	48%	0.483	S	S	*	.	H	α-helix	trans	-64.7	-38.8	175.9	-70.9	179.9	-163.4	178.9	1.1	112.6	R150 R151 N152 M156 L157 A158	R150-R154 WeakPolarHBondContact O-CG 3.44Å; R150-R154 PolarHBondContact O-N 3.01Å; R150-R154 VanDerWaalsContact O-N 3.16Å; R151-R154 PolarHBondContact O-N 3.48Å; N152-R154 PolarHBondContact O-N 3.34Å; R154-M156 VanDerWaalsContact C-N 3.32Å; R154-L157 PolarHBondContact O-N 3.35Å; R154-A158 WeakPolarHBondContact O-CB 3.34Å; R154-A158 PolarHBondContact O-N 3.16Å
155	A	87	Confident	84.9	Confident	53 Å²	53	97.7 Å²	97.7	44%	0.438	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-39.1	177.2	0	0	0	0	0	111.3	R151 N152 E153 L157 A158 N159	R151-A155 WeakPolarHBondContact O-CB 3.33Å; R151-A155 PolarHBondContact O-N 3.18Å; N152-A155 PolarHBondContact O-N 3.43Å; E153-A155 PolarHBondContact O-N 2.89Å; A155-L157 PolarHBondContact O-N 3.24Å; A155-A158 PolarHBondContact O-N 3.42Å; A155-N159 VanDerWaalsContact O-CB 3.32Å; A155-N159 WeakPolarHBondContact O-CB 3.31Å; A155-N159 PolarHBondContact O-N 2.84Å
156	M	83.2	Confident	83	Confident	115 Å²	115	102.9 Å²	102.9	57%	0.567	51%	0.514	S	S	*	.	H	α-helix	trans	-62.7	-41	174.4	-71.1	-175.4	173.7	0	0	112.2	N152 E153 R154 K160	N152-M156 WeakPolarHBondContact ND2-CE 3.46Å; N152-M156 WeakPolarHBondContact O-CG 3.32Å; N152-M156 PolarHBondContact O-N 2.9Å; E153-M156 PolarHBondContact O-N 3.29Å; R154-M156 VanDerWaalsContact C-N 3.32Å; M156-K160 WeakPolarHBondContact O-CG 3.32Å; M156-K160 PolarHBondContact O-N 3.01Å
157	L	82.4	Confident	81.2	Confident	105 Å²	105	104.5 Å²	104.5	55%	0.55	53%	0.532	S	S	.	.	H	α-helix	trans	-69.4	-41.2	175.7	-66.3	174.2	0	0	0	112.5	E153 R154 A155 N159 K160 N161	E153-L157 PolarHBondContact O-N 2.99Å; E153-L157 VanDerWaalsContact O-N 3.16Å; R154-L157 PolarHBondContact O-N 3.35Å; A155-L157 PolarHBondContact O-N 3.24Å; L157-N159 VanDerWaalsContact C-N 3.34Å; L157-K160 PolarHBondContact O-N 3.43Å; L157-N161 PolarHBondContact O-N 3.18Å; L157-N161 VanDerWaalsContact O-N 3.13Å; L157-N161 PolarHBondContact O-ND2 3.44Å
158	A	83.5	Confident	79.3	Confident	59 Å²	59	112 Å²	112	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-64.7	-39	177.1	0	0	0	0	0	111.6	R154 A155 N161 A162	R154-A158 WeakPolarHBondContact O-CB 3.34Å; R154-A158 PolarHBondContact O-N 3.16Å; A155-A158 PolarHBondContact O-N 3.42Å; A158-N161 PolarHBondContact O-N 2.96Å; A158-A162 WeakPolarHBondContact O-CB 3.49Å; A158-A162 PolarHBondContact O-N 3.02Å
159	N	80.3	Confident	77.4	Confident	119 Å²	119	109.5 Å²	109.5	64%	0.636	55%	0.554	S	S	*	*	H	α-helix	trans	-68.6	-34.7	178.6	-156.4	52	0	0	0	112.2	A155 L157 A162 S163	A155-N159 VanDerWaalsContact O-CB 3.32Å; A155-N159 WeakPolarHBondContact O-CB 3.31Å; A155-N159 PolarHBondContact O-N 2.84Å; L157-N159 VanDerWaalsContact C-N 3.34Å; N159-A162 PolarHBondContact O-N 3.02Å; N159-S163 WeakPolarHBondContact O-CB 3.46Å; N159-S163 PolarHBondContact O-N 3.39Å
160	K	76.3	Confident	75.4	Confident	141 Å²	141	108.9 Å²	108.9	61%	0.613	57%	0.567	S	S	*	*	H	α-helix	trans	-63.4	-45.2	172	-72.5	175.5	-179.5	-174.6	0	111.8	M156 L157 S163 L164	M156-K160 WeakPolarHBondContact O-CG 3.32Å; M156-K160 PolarHBondContact O-N 3.01Å; L157-K160 PolarHBondContact O-N 3.43Å; K160-S163 PolarHBondContact O-N 3.46Å; K160-L164 PolarHBondContact O-N 3.45Å
161	N	73.3	Confident	73.4	Confident	104 Å²	104	110.8 Å²	110.8	56%	0.556	59%	0.586	S	S	*	*	H	α-helix	trans	-67.8	-39.1	176.9	-74.6	-69.9	0	0	0	112.4	L157 A158 S163 L164 L165	L157-N161 PolarHBondContact O-N 3.18Å; L157-N161 VanDerWaalsContact O-N 3.13Å; L157-N161 PolarHBondContact O-ND2 3.44Å; A158-N161 PolarHBondContact O-N 2.96Å; N161-S163 VanDerWaalsContact C-N 3.31Å; N161-S163 PolarHBondContact O-N 3.08Å; N161-L164 PolarHBondContact O-N 3.41Å; N161-L165 WeakPolarHBondContact O-CB 3.42Å; N161-L165 PolarHBondContact O-N 2.96Å
162	A	72.9	Confident	71.4	Confident	54 Å²	54	107.6 Å²	107.6	45%	0.446	59%	0.585	S	S	.	*	H	α-helix	trans	-62.1	-40.3	173.9	0	0	0	0	0	111.2	A158 N159 K166	A158-A162 WeakPolarHBondContact O-CB 3.49Å; A158-A162 PolarHBondContact O-N 3.02Å; N159-A162 PolarHBondContact O-N 3.02Å; A162-K166 WeakPolarHBondContact O-CB 3.49Å; A162-K166 PolarHBondContact O-N 2.88Å
163	S	71.4	Confident	69.5	Low	72 Å²	72	109 Å²	109	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-64.7	-42.5	174.5	-167.9	0	0	0	0	112.1	N159 K160 N161 K166 S167	N159-S163 WeakPolarHBondContact O-CB 3.46Å; N159-S163 PolarHBondContact O-N 3.39Å; K160-S163 PolarHBondContact O-N 3.46Å; N161-S163 VanDerWaalsContact C-N 3.31Å; N161-S163 PolarHBondContact O-N 3.08Å; S163-K166 WeakPolarHBondContact O-CB 3.34Å; S163-K166 PolarHBondContact O-N 2.91Å; S163-S167 PolarHBondContact O-N 3.21Å; S163-S167 PolarHBondContact O-OG 3.32Å; S163-S167 VanDerWaalsContact O-OG 3.06Å
164	L	65.8	Low	67.6	Low	118 Å²	118	109.4 Å²	109.4	62%	0.618	62%	0.617	S	S	*	*	H	α-helix	trans	-68.1	-40	178.5	-75.1	178.4	0	0	0	112.9	K160 N161 K166 S167 Y168	K160-L164 PolarHBondContact O-N 3.45Å; N161-L164 PolarHBondContact O-N 3.41Å; L164-K166 VanDerWaalsContact C-N 3.3Å; L164-K166 PolarHBondContact O-N 2.67Å; L164-S167 PolarHBondContact O-N 2.81Å; L164-Y168 PolarHBondContact O-N 3.49Å
165	L	63.9	Low	65.9	Low	134 Å²	134	107.1 Å²	107.1	70%	0.702	62%	0.622	S	S	*	*	H	α-helix	trans	-68.5	-33.6	175.6	-149	77.6	0	0	0	111.4	N161 S167 Y168 S169	N161-L165 WeakPolarHBondContact O-CB 3.42Å; N161-L165 PolarHBondContact O-N 2.96Å; L165-S167 VanDerWaalsContact C-N 3.34Å; L165-Y168 PolarHBondContact O-N 2.99Å; L165-S169 VanDerWaalsContact O-CB 3.3Å; L165-S169 WeakPolarHBondContact O-CB 3.42Å; L165-S169 PolarHBondContact O-N 3.03Å
166	K	58.8	Low	64.1	Low	170 Å²	170	113.3 Å²	113.3	74%	0.739	64%	0.642	S	S	*	*	H	α-helix	trans	-64	-39.4	172.2	-166.6	84.7	176.5	-175.2	0	111.3	A162 S163 L164	A162-K166 WeakPolarHBondContact O-CB 3.49Å; A162-K166 PolarHBondContact O-N 2.88Å; S163-K166 WeakPolarHBondContact O-CB 3.34Å; S163-K166 PolarHBondContact O-N 2.91Å; L164-K166 VanDerWaalsContact C-N 3.3Å; L164-K166 PolarHBondContact O-N 2.67Å
167	S	60.1	Low	62.7	Low	74 Å²	74	115.6 Å²	115.6	52%	0.517	65%	0.652	S	S	.	*	H	α-helix	trans	-70	-37.9	176.7	-61.2	0	0	0	0	112.8	S163 L164 L165	S163-S167 PolarHBondContact O-N 3.21Å; S163-S167 PolarHBondContact O-OG 3.32Å; S163-S167 VanDerWaalsContact O-OG 3.06Å; L164-S167 PolarHBondContact O-N 2.81Å; L165-S167 VanDerWaalsContact C-N 3.34Å
168	Y	57.1	Low	61.5	Low	189 Å²	189	115.4 Å²	115.4	74%	0.741	66%	0.656	S	S	*	*	H	α-helix	trans	-78.5	-22.8	179.8	-134.4	-94.1	0	0	0	113.7	L164 L165 G170	L164-Y168 PolarHBondContact O-N 3.49Å; L165-Y168 PolarHBondContact O-N 2.99Å; Y168-G170 VanDerWaalsContact C-N 3.3Å
169	S	57.8	Low	60.2	Low	80 Å²	80	120.2 Å²	120.2	56%	0.559	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-1.8	176.6	-158	0	0	0	0	113.6	L165	L165-S169 VanDerWaalsContact O-CB 3.3Å; L165-S169 WeakPolarHBondContact O-CB 3.42Å; L165-S169 PolarHBondContact O-N 3.03Å
170	G	54.6	Low	59.5	Low	58 Å²	58	120.6 Å²	120.6	60%	0.598	68%	0.678	S	S	*	*	S	Bend	trans	-85	-26.9	178.8	0	0	0	0	0	114.7	Y168	Y168-G170 VanDerWaalsContact C-N 3.3Å
171	D	54.4	Low	58.7	Low	149 Å²	149	119.1 Å²	119.1	80%	0.797	68%	0.684	S	S	*	*	S	Bend	trans	-115.9	-5.2	-168.9	-72.2	-52	0	0	0	115.1
172	V	51.9	Low	58.2	Low	107 Å²	107	125.3 Å²	125.3	65%	0.648	70%	0.699	S	S	*	*	S	Bend	trans	-131.3	42.9	-174.3	-162.6	0	0	0	0	113.1
173	T	50.1	Low	57.6	Low	116 Å²	116	128.3 Å²	128.3	71%	0.712	71%	0.714	S	S	*	*			trans	-143.8	56.1	164.9	65.3	0	0	0	0	111.8
174	A	48.8	Very low	57	Low	104 Å²	104	128.8 Å²	128.8	86%	0.86	72%	0.722	S	S	*	*			trans	-112.9	16.8	165	0	0	0	0	0	112.3
175	V	50.1	Low	56.6	Low	129 Å²	129	129.3 Å²	129.3	78%	0.782	73%	0.733	S	S	*	*	S	Bend	trans	-95.2	102.7	172.8	-177.1	0	0	0	0	108.5	Q177	V175-Q177 PolarHBondContact O-N 3.09Å; V175-Q177 VanDerWaalsContact O-N 3.08Å
176	E	50.1	Low	56.5	Low	183 Å²	183	133.5 Å²	133.5	86%	0.855	74%	0.739	S	S	*	*			trans	-26.3	99.9	164.5	-170.7	-173.3	150	0	0	113.1
177	Q	53.8	Low	56.3	Low	163 Å²	163	131 Å²	131	76%	0.762	74%	0.74	S	S	*	*			trans	-87.3	126.4	164.3	-77.9	-81.7	-20.9	0	0	107.6	V175 I179	V175-Q177 PolarHBondContact O-N 3.09Å; V175-Q177 VanDerWaalsContact O-N 3.08Å; Q177-I179 PolarHBondContact O-N 3.13Å
178	P	57.4	Low	56.1	Low	100 Å²	100	133.7 Å²	133.7	65%	0.649	75%	0.754	S	S	*	*			trans	-55.3	126.2	179	-22.1	30.8	0	0	0	110.8	V180	P178-V180 PolarHBondContact O-N 3.26Å
179	I	55.1	Low	55.7	Low	160 Å²	160	131.3 Å²	131.3	82%	0.821	75%	0.754	S	S	*	*			trans	-54.7	106.2	174.7	-97.7	74.8	0	0	0	108.2	Q177	Q177-I179 PolarHBondContact O-N 3.13Å
180	V	65.9	Low	55.3	Low	127 Å²	127	138.6 Å²	138.6	77%	0.77	77%	0.771	S	S	*	*			trans	-83.7	124	161.4	-167	0	0	0	0	106.1	P178 R182	P178-V180 PolarHBondContact O-N 3.26Å; V180-R182 PolarHBondContact O-N 3.48Å
181	P	60.4	Low	55.5	Low	111 Å²	111	142.8 Å²	142.8	72%	0.721	78%	0.779	S	S	*	*			trans	-56.9	110	178.2	-24.5	33.7	0	0	0	110.5	P183	P181-P183 WeakPolarHBondContact O-CD 3.35Å
182	R	61.3	Low	55.2	Low	234 Å²	234	141 Å²	141	88%	0.883	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.9	125.8	174.6	-171.1	170.2	-166.5	156.9	4.5	108.4	V180 A184	V180-R182 PolarHBondContact O-N 3.48Å; R182-A184 PolarHBondContact O-N 2.96Å
183	P	59.6	Low	55.1	Low	117 Å²	117	146.3 Å²	146.3	76%	0.76	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-58.5	127.1	173.3	-20	30.8	0	0	0	109.6	P181	P181-P183 WeakPolarHBondContact O-CD 3.35Å
184	A	59.2	Low	54.9	Low	82 Å²	82	143.4 Å²	143.4	68%	0.678	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-54.3	142.6	177.2	0	0	0	0	0	111.2	R182 R186	R182-A184 PolarHBondContact O-N 2.96Å; A184-R186 PolarHBondContact O-N 3.16Å; A184-R186 VanDerWaalsContact O-N 3.1Å
185	P	58.8	Low	55	Low	128 Å²	128	145.3 Å²	145.3	83%	0.831	78%	0.781	S	S	*	*			trans	-66.9	113.6	173.3	27.5	-29.3	0	0	0	108.4
186	R	60.5	Low	54.8	Low	222 Å²	222	143.8 Å²	143.8	84%	0.838	78%	0.782	S	S	*	*			trans	-59.3	134.4	168.9	-68.5	-93.4	178.7	164.3	-2.6	108	A184 T188	A184-R186 PolarHBondContact O-N 3.16Å; A184-R186 VanDerWaalsContact O-N 3.1Å; R186-T188 PolarHBondContact O-N 3.21Å
187	P	54.8	Low	54.8	Low	118 Å²	118	140.5 Å²	140.5	77%	0.766	78%	0.779	S	S	*	*			trans	-70.1	102.5	169.7	29.3	-28.2	0	0	0	106.4	D189	P187-D189 PolarHBondContact O-N 2.72Å
188	T	56.6	Low	54.8	Low	130 Å²	130	138.5 Å²	138.5	80%	0.798	78%	0.78	S	S	*	*			trans	-68.6	121.9	173.8	-60.3	0	0	0	0	108.1	R186	R186-T188 PolarHBondContact O-N 3.21Å
189	D	49.3	Very low	54.2	Low	140 Å²	140	143.9 Å²	143.9	75%	0.749	79%	0.789	S	S	*	*			trans	-45.1	132.8	-179.3	-63	-73.6	0	0	0	112.8	P187 L191	P187-D189 PolarHBondContact O-N 2.72Å; D189-L191 VanDerWaalsContact C-N 3.32Å; D189-L191 PolarHBondContact O-N 3.28Å
190	Y	49.3	Very low	53.6	Low	232 Å²	232	140.7 Å²	140.7	91%	0.91	78%	0.781	S	S	*	*			trans	-55.1	93.8	164.8	-87.1	-101.5	0	0	0	109.4	S192	Y190-S192 VanDerWaalsContact C-N 3.27Å; Y190-S192 PolarHBondContact O-N 3.06Å
191	L	58.2	Low	52.6	Low	146 Å²	146	138 Å²	138	76%	0.764	77%	0.773	S	S	*	*			trans	-69.8	97.2	155.8	-75.1	167.2	0	0	0	106.7	D189 W193	D189-L191 VanDerWaalsContact C-N 3.32Å; D189-L191 PolarHBondContact O-N 3.28Å; L191-W193 PolarHBondContact O-N 2.89Å
192	S	47.4	Very low	51.9	Low	112 Å²	112	141.3 Å²	141.3	78%	0.783	78%	0.78	S	S	*	*			trans	-62.9	105.3	173.8	-178.4	0	0	0	0	109.8	Y190 G194	Y190-S192 VanDerWaalsContact C-N 3.27Å; Y190-S192 PolarHBondContact O-N 3.06Å; S192-G194 PolarHBondContact O-N 2.87Å
193	W	51.5	Low	51.1	Low	218 Å²	218	134 Å²	134	83%	0.826	77%	0.77	S	S	*	*			trans	-94	93.6	169.3	-66.6	77.8	0	0	0	108.9	L191	L191-W193 PolarHBondContact O-N 2.89Å
194	G	45	Very low	50.2	Low	55 Å²	55	134.8 Å²	134.8	57%	0.567	77%	0.773	S	S	*	*			trans	96.6	131	145.5	0	0	0	0	0	118.2	S192	S192-G194 PolarHBondContact O-N 2.87Å
195	T	50.9	Low	49.5	Very low	144 Å²	144	140.8 Å²	140.8	88%	0.883	78%	0.779	S	S	*	*			trans	95.2	97.4	149.1	68.3	0	0	0	0	119
196	A	46.7	Very low	48.5	Very low	97 Å²	97	139.6 Å²	139.6	80%	0.802	77%	0.774	S	S	*	*				68.8	117	125.8	0	0	0	0	0	120.9
197	S	49	Very low	47.7	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	77%	0.773	S	S	*	*			trans	61.5	122.2	139.7	-141.9	0	0	0	0	119.9
198	P	54.2	Low	47.1	Very low	122 Å²	122	134 Å²	134	79%	0.792	77%	0.773	S	S	*	*			trans	-92.8	105.5	172.4	34.6	-24.9	0	0	0	110.1
199	Y	44.5	Very low	46.6	Very low	212 Å²	212	133.9 Å²	133.9	83%	0.831	78%	0.776	S	S	*	*			trans	-153.5	116.8	154.2	-146.3	-102.1	0	0	0	110.5
200	S	43.1	Very low	46.2	Very low	94 Å²	94	130.8 Å²	130.8	66%	0.657	77%	0.77	S	S	*	*			trans	38.3	119.1	151.8	-73.4	0	0	0	0	120.8
201	A	44.9	Very low	46	Very low	71 Å²	71	127.4 Å²	127.4	59%	0.587	77%	0.768	S	S	*	*				91.2	117.1	124.6	0	0	0	0	0	119
202	M	45.8	Very low	45.2	Very low	179 Å²	179	127.6 Å²	127.6	88%	0.882	77%	0.769	S	S	*	*			trans	49.1	103.8	144.2	69.6	-133.8	160	0	0	119.8
203	A	44.4	Very low	45.1	Very low	80 Å²	80	126.7 Å²	126.7	66%	0.661	76%	0.763	S	S	*	*			trans	-157.4	103.1	145.1	0	0	0	0	0	111.2	Y205	A203-Y205 HydrophobicContact CB-CE1 4.17Å
204	T	40.3	Very low	44.8	Very low	135 Å²	135	123 Å²	123	83%	0.828	77%	0.767	S	S	*	*			trans	-68.8	126.2	168.9	-25.7	0	0	0	0	109.4
205	Y	44.4	Very low	45	Very low	207 Å²	207	124.8 Å²	124.8	81%	0.812	78%	0.776	S	S	*	*			trans	-140.3	104.1	154.9	28.4	-97.6	0	0	0	109.9	A203 A207	A203-Y205 HydrophobicContact CB-CE1 4.17Å; Y205-A207 PolarHBondContact O-N 3.14Å
206	S	37	Very low	44.8	Very low	103 Å²	103	125 Å²	125	72%	0.72	77%	0.767	S	S	*	*			trans	-69.2	117.8	169.7	-53.2	0	0	0	0	109.4
207	A	44.2	Very low	44.9	Very low	100 Å²	100	124.5 Å²	124.5	83%	0.826	77%	0.772	S	S	*	*			trans	-103.9	84.9	165.2	0	0	0	0	0	108.8	Y205 C209	Y205-A207 PolarHBondContact O-N 3.14Å; A207-C209 PolarHBondContact O-N 3.41Å
208	T	43.3	Very low	45.4	Very low	124 Å²	124	124.4 Å²	124.4	76%	0.761	76%	0.761	S	S	*	*			trans	-78.8	111.2	174.1	-29.7	0	0	0	0	108.7	A210	T208-A210 HydrophobicContact CG2-CB 4.39Å
209	C	44.4	Very low	45.9	Very low	127 Å²	127	124 Å²	124	86%	0.858	75%	0.753	S	S	*	*			trans	-122.7	72	156.2	60.8	0	0	0	0	108.6	A207	A207-C209 PolarHBondContact O-N 3.41Å
210	A	42	Very low	47.1	Very low	75 Å²	75	121.4 Å²	121.4	62%	0.62	75%	0.75	S	S	*	*			trans	-83.1	115.3	165.2	0	0	0	0	0	107.9	T208	T208-A210 HydrophobicContact CG2-CB 4.39Å
211	N	45	Very low	48.3	Very low	161 Å²	161	120.1 Å²	120.1	86%	0.861	75%	0.745	S	S	*	*			trans	-127.9	94.2	152.5	-142.6	6.6	0	0	0	107	S213	N211-S213 PolarHBondContact O-N 3.3Å
212	N	42	Very low	49.9	Very low	149 Å²	149	121.7 Å²	121.7	80%	0.797	74%	0.744	S	S	*	*			trans	-74.5	113.8	-178.2	-84.4	-10.4	0	0	0	109.7
213	S	43.7	Very low	51.9	Low	94 Å²	94	115.6 Å²	115.6	66%	0.657	72%	0.718	S	S	*	*			trans	-117.3	109	153.3	-70	0	0	0	0	107.2	N211 A215	N211-S213 PolarHBondContact O-N 3.3Å; S213-A215 PolarHBondContact O-N 3.3Å
214	P	46	Very low	53.8	Low	140 Å²	140	117.1 Å²	117.1	91%	0.909	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	21.7	-167.7	30.1	-34.4	0	0	0	114.8
215	A	49.8	Very low	56.1	Low	92 Å²	92	113.3 Å²	113.3	76%	0.76	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	3.1	-172.5	0	0	0	0	0	115	S213	S213-A215 PolarHBondContact O-N 3.3Å
216	Q	46.7	Very low	58.4	Low	149 Å²	149	106.6 Å²	106.6	70%	0.696	68%	0.675	S	S	*	*			trans	-125.9	71.4	-170.4	-68.5	-174.5	-30.2	0	0	112.5	I218	Q216-I218 HydrophobicContact CB-CD1 4.04Å; Q216-I218 HydrophobicContact CB-CG1 4.17Å; Q216-I218 HydrophobicContact CG-CD1 4.09Å; Q216-I218 PolarHBondContact O-N 3.11Å
217	G	47.6	Very low	61	Low	87 Å²	87	106 Å²	106	90%	0.897	66%	0.663	S	S	*	*			trans	-68.8	43.7	160.6	0	0	0	0	0	112.5	N219	G217-N219 PolarHBondContact O-N 3.12Å
218	I	59.6	Low	63.3	Low	112 Å²	112	109.7 Å²	109.7	57%	0.574	66%	0.655	S	S	*	*			trans	-75.2	99.6	176.9	-59.7	168.3	0	0	0	105.9	Q216 M220	Q216-I218 HydrophobicContact CB-CD1 4.04Å; Q216-I218 HydrophobicContact CB-CG1 4.17Å; Q216-I218 HydrophobicContact CG-CD1 4.09Å; Q216-I218 PolarHBondContact O-N 3.11Å; I218-M220 PolarHBondContact O-N 2.99Å
219	N	65.3	Low	65.5	Low	114 Å²	114	108.9 Å²	108.9	61%	0.61	65%	0.646	S	S	*	*			trans	-3.1	100.6	163.4	-108.6	-70.4	0	0	0	111.8	G217 A221 N222	G217-N219 PolarHBondContact O-N 3.12Å; N219-A221 PolarHBondContact O-N 3.49Å; N219-N222 PolarHBondContact O-N 3.3Å
220	M	69.8	Low	67.7	Low	156 Å²	156	110 Å²	110	77%	0.768	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-55	-28.9	-174.8	-148.7	161.3	-75.8	0	0	111	I218 N222 S223 N226	I218-M220 PolarHBondContact O-N 2.99Å; M220-N222 PolarHBondContact O-N 3.27Å; M220-N222 VanDerWaalsContact O-N 3.17Å; M220-S223 WeakPolarHBondContact O-CB 3.45Å; M220-S223 PolarHBondContact O-N 3.49Å; M220-N226 PolarHBondContact O-ND2 2.85Å
221	A	68.5	Low	69.8	Low	68 Å²	68	109.3 Å²	109.3	56%	0.562	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-52.6	-29.2	170.3	0	0	0	0	0	115.1	N219	N219-A221 PolarHBondContact O-N 3.49Å
222	N	78.8	Confident	72	Confident	104 Å²	104	109.1 Å²	109.1	56%	0.556	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-97.7	2.5	178.1	-69.7	-37.6	0	0	0	113.7	N219 M220	N219-N222 PolarHBondContact O-N 3.3Å; M220-N222 PolarHBondContact O-N 3.27Å; M220-N222 VanDerWaalsContact O-N 3.17Å
223	S	87.7	Confident	74.1	Confident	50 Å²	50	107.3 Å²	107.3	35%	0.35	61%	0.608	S	S	.	*	S	Bend	trans	-59.7	141.1	174.9	176.6	0	0	0	0	110.8	M220 A225 N226 L227	M220-S223 WeakPolarHBondContact O-CB 3.45Å; M220-S223 PolarHBondContact O-N 3.49Å; S223-A225 PolarHBondContact O-N 3.32Å; S223-A225 VanDerWaalsContact O-N 3.08Å; S223-A225 PolarHBondContact OG-N 2.88Å; S223-N226 PolarHBondContact O-N 3.49Å; S223-L227 PolarHBondContact O-N 3.33Å
224	I	83.6	Confident	76.1	Confident	112 Å²	112	110.6 Å²	110.6	57%	0.574	61%	0.608	S	S	*	*	H	α-helix	trans	-52	-34.6	175.9	-67	170.3	0	0	0	111.1	R228	I224-R228 HydrophobicContact CG2-CG 4.34Å; I224-R228 WeakPolarHBondContact O-CB 3.2Å; I224-R228 VanDerWaalsContact O-CG 3.22Å; I224-R228 WeakPolarHBondContact O-CG 3.24Å; I224-R228 PolarHBondContact O-N 3.16Å
225	A	89.2	Confident	77.8	Confident	55 Å²	55	107 Å²	107	46%	0.455	59%	0.586	S	S	.	*	H	α-helix	trans	-62.4	-49.8	176.1	0	0	0	0	0	111.9	S223 R228 L229	S223-A225 PolarHBondContact O-N 3.32Å; S223-A225 VanDerWaalsContact O-N 3.08Å; S223-A225 PolarHBondContact OG-N 2.88Å; A225-R228 PolarHBondContact O-N 3.39Å; A225-L229 WeakPolarHBondContact O-CG 3.41Å; A225-L229 PolarHBondContact O-N 3.35Å
226	N	92.5	Very high	79.5	Confident	66 Å²	66	107.6 Å²	107.6	35%	0.353	58%	0.576	S	S	.	*	H	α-helix	trans	-65.9	-41.1	178	-78	-54.4	0	0	0	112.3	M220 S223 R228 L229 K230	M220-N226 PolarHBondContact O-ND2 2.85Å; S223-N226 PolarHBondContact O-N 3.49Å; N226-R228 VanDerWaalsContact C-N 3.32Å; N226-R228 PolarHBondContact O-N 2.83Å; N226-L229 PolarHBondContact O-N 2.91Å; N226-K230 WeakPolarHBondContact O-CB 3.27Å; N226-K230 PolarHBondContact O-N 3.3Å
227	L	91.8	Very high	80.9	Confident	91 Å²	91	104.9 Å²	104.9	48%	0.476	56%	0.563	S	S	.	*	H	α-helix	trans	-61.8	-39.3	174.6	-68	174.8	0	0	0	112.1	S223 A231	S223-L227 PolarHBondContact O-N 3.33Å; L227-A231 WeakPolarHBondContact O-CB 3.36Å; L227-A231 PolarHBondContact O-N 3.38Å
228	R	91.3	Very high	82.3	Confident	177 Å²	177	110.2 Å²	110.2	67%	0.668	56%	0.556	S	S	*	*	H	α-helix	trans	-66.6	-40.9	175	-78.7	174.7	174.6	161.4	0.1	112.4	I224 A225 N226 A231 K232	I224-R228 HydrophobicContact CG2-CG 4.34Å; I224-R228 WeakPolarHBondContact O-CB 3.2Å; I224-R228 VanDerWaalsContact O-CG 3.22Å; I224-R228 WeakPolarHBondContact O-CG 3.24Å; I224-R228 PolarHBondContact O-N 3.16Å; A225-R228 PolarHBondContact O-N 3.39Å; N226-R228 VanDerWaalsContact C-N 3.32Å; N226-R228 PolarHBondContact O-N 2.83Å; R228-A231 PolarHBondContact O-N 2.84Å; R228-K232 WeakPolarHBondContact O-CG 3.35Å; R228-K232 PolarHBondContact O-N 3.13Å
229	L	90.6	Very high	82.6	Confident	108 Å²	108	110.7 Å²	110.7	57%	0.565	56%	0.56	S	S	*	*	H	α-helix	trans	-62	-49.4	175	-72.5	170.3	0	0	0	110.6	A225 N226 A231 K232 E233	A225-L229 WeakPolarHBondContact O-CG 3.41Å; A225-L229 PolarHBondContact O-N 3.35Å; N226-L229 PolarHBondContact O-N 2.91Å; L229-A231 VanDerWaalsContact C-N 3.32Å; L229-A231 PolarHBondContact O-N 3.18Å; L229-K232 WeakPolarHBondContact O-CB 3.34Å; L229-K232 PolarHBondContact O-N 2.91Å; L229-K232 VanDerWaalsContact O-N 3.16Å; L229-E233 WeakPolarHBondContact O-CB 3.03Å; L229-E233 PolarHBondContact O-N 2.81Å
230	K	89.5	Confident	82.5	Confident	151 Å²	151	112.2 Å²	112.2	66%	0.657	56%	0.564	S	S	*	*	H	α-helix	trans	-59.9	-38.8	176.8	-170.7	171.1	-175.7	170.7	0	112.9	N226 E233 Y234	N226-K230 WeakPolarHBondContact O-CB 3.27Å; N226-K230 PolarHBondContact O-N 3.3Å; K230-E233 PolarHBondContact O-N 2.92Å; K230-Y234 WeakPolarHBondContact O-CB 3.32Å; K230-Y234 PolarHBondContact O-N 3.22Å
231	A	87.2	Confident	81.9	Confident	59 Å²	59	110.5 Å²	110.5	49%	0.488	56%	0.562	S	S	.	*	H	α-helix	trans	-68.2	-38.7	176.1	0	0	0	0	0	112.7	L227 R228 L229 S235	L227-A231 WeakPolarHBondContact O-CB 3.36Å; L227-A231 PolarHBondContact O-N 3.38Å; R228-A231 PolarHBondContact O-N 2.84Å; L229-A231 VanDerWaalsContact C-N 3.32Å; L229-A231 PolarHBondContact O-N 3.18Å; A231-S235 WeakPolarHBondContact O-CB 3.41Å; A231-S235 PolarHBondContact O-N 3.49Å
232	K	90.2	Very high	81.6	Confident	157 Å²	157	112.6 Å²	112.6	68%	0.683	57%	0.569	S	S	*	*	H	α-helix	trans	-63.1	-45	172.8	-80.4	-177.8	169.9	-171.7	0	111.2	R228 L229 S235 L236	R228-K232 WeakPolarHBondContact O-CG 3.35Å; R228-K232 PolarHBondContact O-N 3.13Å; L229-K232 WeakPolarHBondContact O-CB 3.34Å; L229-K232 PolarHBondContact O-N 2.91Å; L229-K232 VanDerWaalsContact O-N 3.16Å; K232-S235 PolarHBondContact O-N 3.29Å; K232-L236 PolarHBondContact O-N 3.47Å
233	E	86	Confident	80.7	Confident	111 Å²	111	114.1 Å²	114.1	52%	0.519	58%	0.583	S	S	.	*	H	α-helix	trans	-58.6	-53.9	176.3	-157.9	-160.3	125.6	0	0	110.2	L229 K230 S235 L236 Q237	L229-E233 WeakPolarHBondContact O-CB 3.03Å; L229-E233 PolarHBondContact O-N 2.81Å; K230-E233 PolarHBondContact O-N 2.92Å; E233-S235 VanDerWaalsContact C-N 3.28Å; E233-S235 PolarHBondContact O-N 2.97Å; E233-L236 WeakPolarHBondContact O-CA 3.21Å; E233-L236 WeakPolarHBondContact O-CB 3.45Å; E233-L236 PolarHBondContact O-N 3.33Å; E233-Q237 PolarHBondContact O-N 3.36Å; E233-Q237 PolarHBondContact O-OE1 3.08Å; E233-Q237 PolarHBondContact OE1-NE2 3.05Å
234	Y	86.8	Confident	79.5	Confident	163 Å²	163	118.3 Å²	118.3	64%	0.639	61%	0.606	S	S	*	*	H	α-helix	trans	-55.7	-40.6	178.2	-173.4	-92.7	0	0	0	113	K230 L236 Q237 R238	K230-Y234 WeakPolarHBondContact O-CB 3.32Å; K230-Y234 PolarHBondContact O-N 3.22Å; Y234-L236 VanDerWaalsContact C-N 3.27Å; Y234-L236 PolarHBondContact O-N 2.94Å; Y234-Q237 PolarHBondContact O-N 3.47Å; Y234-R238 PolarHBondContact O-N 2.99Å
235	S	82.1	Confident	77.8	Confident	65 Å²	65	124.1 Å²	124.1	46%	0.455	64%	0.638	S	S	.	*	H	α-helix	trans	-66.6	-29.5	175	-170.3	0	0	0	0	112.6	A231 K232 E233 N239	A231-S235 WeakPolarHBondContact O-CB 3.41Å; A231-S235 PolarHBondContact O-N 3.49Å; K232-S235 PolarHBondContact O-N 3.29Å; E233-S235 VanDerWaalsContact C-N 3.28Å; E233-S235 PolarHBondContact O-N 2.97Å; S235-N239 PolarHBondContact O-ND2 2.97Å
236	L	84.2	Confident	77.2	Confident	105 Å²	105	127.6 Å²	127.6	55%	0.55	65%	0.647	S	S	.	*	H	α-helix	trans	-72.4	-45.6	175.6	-164.7	67.6	0	0	0	110.4	K232 E233 Y234 R238 N239 Q240	K232-L236 PolarHBondContact O-N 3.47Å; E233-L236 WeakPolarHBondContact O-CA 3.21Å; E233-L236 WeakPolarHBondContact O-CB 3.45Å; E233-L236 PolarHBondContact O-N 3.33Å; Y234-L236 VanDerWaalsContact C-N 3.27Å; Y234-L236 PolarHBondContact O-N 2.94Å; L236-R238 PolarHBondContact O-N 2.91Å; L236-N239 PolarHBondContact O-N 3.5Å; L236-Q240 WeakPolarHBondContact O-CG 3.44Å
237	Q	77.1	Confident	76.4	Confident	92 Å²	92	130.8 Å²	130.8	43%	0.43	66%	0.662	S	S	.	*	H	α-helix	trans	-66.9	-36.6	178.9	-73	112.7	2.2	0	0	113.6	E233 Y234 N239 Q240	E233-Q237 PolarHBondContact O-N 3.36Å; E233-Q237 PolarHBondContact O-OE1 3.08Å; E233-Q237 PolarHBondContact OE1-NE2 3.05Å; Y234-Q237 PolarHBondContact O-N 3.47Å; Q237-N239 VanDerWaalsContact C-N 3.29Å; Q237-N239 PolarHBondContact O-N 2.83Å; Q237-Q240 PolarHBondContact O-N 3.25Å; Q237-Q240 VanDerWaalsContact O-N 3.16Å
238	R	75.5	Confident	75.5	Confident	198 Å²	198	133 Å²	133	75%	0.747	67%	0.673	S	S	*	*	H	α-helix	trans	-68.1	-27.2	179.4	-167.8	-175.4	-179.2	-129.8	0.9	113.4	Y234 L236	Y234-R238 PolarHBondContact O-N 2.99Å; L236-R238 PolarHBondContact O-N 2.91Å
239	N	67.4	Low	74.6	Confident	123 Å²	123	130.4 Å²	130.4	66%	0.658	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-3.4	176.4	-72.4	-52.4	0	0	0	112.9	S235 L236 Q237 V241	S235-N239 PolarHBondContact O-ND2 2.97Å; L236-N239 PolarHBondContact O-N 3.5Å; Q237-N239 VanDerWaalsContact C-N 3.29Å; Q237-N239 PolarHBondContact O-N 2.83Å; N239-V241 PolarHBondContact O-N 3.06Å
240	Q	63.5	Low	73.6	Confident	146 Å²	146	131.8 Å²	131.8	68%	0.682	68%	0.68	S	S	*	*			trans	-86.6	89.3	169.2	-55.2	-152.2	106.7	0	0	108.3	L236 Q237 P242	L236-Q240 WeakPolarHBondContact O-CG 3.44Å; Q237-Q240 PolarHBondContact O-N 3.25Å; Q237-Q240 VanDerWaalsContact O-N 3.16Å; Q240-P242 WeakPolarHBondContact O-CD 3.3Å
241	V	56	Low	72.5	Confident	120 Å²	120	130.5 Å²	130.5	73%	0.727	68%	0.681	S	S	*	*			trans	-59.9	124.7	165.5	-177.5	0	0	0	0	106.9	N239 T243	N239-V241 PolarHBondContact O-N 3.06Å; V241-T243 PolarHBondContact O-N 3.5Å
242	P	62.1	Low	71.5	Confident	111 Å²	111	135.6 Å²	135.6	72%	0.721	70%	0.695	S	S	*	*			trans	-60.9	109.3	175.3	-20.4	31.8	0	0	0	109.4	Q240 V244	Q240-P242 WeakPolarHBondContact O-CD 3.3Å; P242-V244 PolarHBondContact O-N 3.4Å
243	T	60.9	Low	70.1	Confident	137 Å²	137	134 Å²	134	84%	0.84	70%	0.696	S	S	*	*			trans	-74.5	106.1	165.3	54	0	0	0	0	106.7	V241	V241-T243 PolarHBondContact O-N 3.5Å
244	V	61.9	Low	68.7	Low	138 Å²	138	135.9 Å²	135.9	84%	0.836	71%	0.711	S	S	*	*			trans	-69.2	129.8	168.6	-66	0	0	0	0	108.6	P242	P242-V244 PolarHBondContact O-N 3.4Å
245	N	47.4	Very low	67.1	Low	233 Å²	233	133.5 Å²	133.5	100%	1.246	72%	0.717	S	S	*	*			trans	-140.3	0	159	-165.4	72.2	0	0	0	108.3

Retrieved 245 of 245 residues in 151.6 ms (Link to these results)

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