A0A087YKW0_POEFO Loading...

CKLF-like MARVEL transmembrane domain containing 8b

AlphaFold DB , UniProt , Accession A0A087YKW0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 182 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	W	45.3	Very low	45	Very low	312 Å²	312	165 Å²	165	100%	1.182	82%	0.818	S	S	*	*				0	73.1	0	-71	93	0	0	0	109
2	E	40	Very low	45.6	Very low	161 Å²	161	163.1 Å²	163.1	75%	0.752	81%	0.811	S	S	*	*			trans	-55.3	142.4	157.1	-75.3	144.9	72.4	0	0	110	F4	E2-F4 HydrophobicContact CB-CD2 4.48Å
3	K	41.6	Very low	46	Very low	193 Å²	193	163.4 Å²	163.4	84%	0.839	81%	0.812	S	S	*	*				163.2	140.6	129.7	-89.9	164.5	175.6	-179.8	0	111.2
4	F	42.4	Very low	45.5	Very low	152 Å²	152	161.7 Å²	161.7	67%	0.667	81%	0.807	S	S	*	*			cis	-177.8	135.3	-18.8	-130.2	-104	0	0	0	100.7	E2	E2-F4 HydrophobicContact CB-CD2 4.48Å
5	T	45	Very low	45.8	Very low	108 Å²	108	166.3 Å²	166.3	66%	0.663	81%	0.811	S	S	*	*			trans	40.4	118.1	140.3	59.2	0	0	0	0	120.2
6	V	51.6	Low	45.9	Very low	125 Å²	125	164.1 Å²	164.1	76%	0.758	81%	0.811	S	S	*	*			trans	-38.7	135.1	141.5	-175.4	0	0	0	0	111.7	L8	V6-L8 HydrophobicContact CG1-CD1 4.49Å
7	P	49.8	Very low	46.3	Very low	119 Å²	119	160.4 Å²	160.4	77%	0.773	81%	0.812	S	S	*	*			trans	-106.3	115.8	152	30.8	-20.6	0	0	0	110.4
8	L	46.5	Very low	46.5	Very low	162 Å²	162	157.3 Å²	157.3	85%	0.848	82%	0.815	S	S	*	*			trans	-66	132.2	154.2	-79.9	102.8	0	0	0	108.8	V6	V6-L8 HydrophobicContact CG1-CD1 4.49Å
9	R	42.5	Very low	46.3	Very low	240 Å²	240	155.2 Å²	155.2	91%	0.906	82%	0.815	S	S	*	*			trans	-152.1	148.2	138.4	-107.8	-162.8	-172.3	-105.3	-0.6	112.3
10	P	50.4	Low	46.5	Very low	108 Å²	108	153.7 Å²	153.7	70%	0.701	82%	0.815	S	S	*	*			trans	-97.2	156.1	-163	38.4	-32.3	0	0	0	112.3
11	C	40.1	Very low	46.6	Very low	135 Å²	135	153 Å²	153	91%	0.912	82%	0.817	S	S	*	*			trans	-139.1	134.3	156	-124.2	0	0	0	0	109.9
12	I	52.6	Low	46.3	Very low	142 Å²	142	149.5 Å²	149.5	73%	0.728	80%	0.804	S	S	*	*			trans	-73.1	165.7	-176.4	-67	-172.2	0	0	0	110.7
13	M	50.7	Low	46.8	Very low	167 Å²	167	153.4 Å²	153.4	82%	0.823	81%	0.812	S	S	*	*			trans	89.7	133.8	172.9	-67.3	99.5	169.1	0	0	113.8
14	D	38.5	Very low	46.7	Very low	140 Å²	140	150.9 Å²	150.9	75%	0.749	81%	0.812	S	S	*	*			cis	-156.2	155	12.9	-149.6	-48.2	0	0	0	108.5	T16	D14-T16 PolarHBondContact O-N 3.36Å
15	R	50.7	Low	46.9	Very low	231 Å²	231	149.1 Å²	149.1	87%	0.872	82%	0.819	S	S	*	*			trans	-81.1	115	172	174.6	-172.9	-86.4	154.7	-7.8	107.3
16	T	46.7	Very low	47.6	Very low	130 Å²	130	149.6 Å²	149.6	80%	0.798	82%	0.824	S	S	*	*			trans	-147.2	124.8	156.8	-27.1	0	0	0	0	111.1	D14	D14-T16 PolarHBondContact O-N 3.36Å
17	A	53.1	Low	47.2	Very low	102 Å²	102	151.8 Å²	151.8	84%	0.843	83%	0.83	S	S	*	*			trans	-71.4	143.9	-173.6	0	0	0	0	0	113
18	A	50.3	Low	47.4	Very low	104 Å²	104	151.8 Å²	151.8	86%	0.86	83%	0.83	S	S	*	*			trans	-144.7	136.3	162.2	0	0	0	0	0	111.4
19	S	43	Very low	47.6	Very low	117 Å²	117	153.1 Å²	153.1	82%	0.818	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-71	161.9	-165.3	-140.3	0	0	0	0	115.6
20	P	50.2	Low	47.6	Very low	125 Å²	125	151.8 Å²	151.8	81%	0.812	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-87.5	146.4	-172.6	34.5	-31	0	0	0	114.6
21	T	48.8	Very low	47.9	Very low	141 Å²	141	152.8 Å²	152.8	87%	0.865	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-89.7	140.8	-177.8	-32.7	0	0	0	0	112.3
22	R	38.9	Very low	48.5	Very low	238 Å²	238	152.2 Å²	152.2	90%	0.898	82%	0.819	S	S	*	*			trans	-112.1	132.3	174.7	-162.4	179.4	-153.6	176	6.4	110.9
23	R	48.9	Very low	48.4	Very low	242 Å²	242	150.7 Å²	150.7	91%	0.913	82%	0.821	S	S	*	*			trans	-125.3	144.1	173.1	-84.6	-146	-83.9	-168.8	-6.6	111.7
24	V	40.3	Very low	48.2	Very low	141 Å²	141	148.2 Å²	148.2	86%	0.855	82%	0.816	S	S	*	*			trans	-145	148.7	166.8	-162.4	0	0	0	0	110.5
25	S	46.5	Very low	48.6	Very low	114 Å²	114	145.9 Å²	145.9	80%	0.797	81%	0.81	S	S	*	*			trans	-101.1	167	-163.4	-32.6	0	0	0	0	115.8
26	P	60.3	Low	48.5	Very low	119 Å²	119	141 Å²	141	77%	0.773	81%	0.807	S	S	*	*			trans	-122.1	161.1	179.2	39.9	-26.7	0	0	0	116.8
27	L	43	Very low	48.6	Very low	171 Å²	171	141.3 Å²	141.3	90%	0.895	80%	0.802	S	S	*	*			trans	167.3	166.5	151.5	-92.7	163.8	0	0	0	112.1
28	P	53.1	Low	48.3	Very low	118 Å²	118	139.1 Å²	139.1	77%	0.766	78%	0.784	S	S	*	*			cis	-129.3	169.3	-49	28.7	-7.8	0	0	0	115.5
29	Q	52	Low	48	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	78%	0.776	S	S	*	*			trans	-91	147.9	-178.7	-119.2	106	-11.7	0	0	115
30	F	42.3	Very low	48.2	Very low	212 Å²	212	142 Å²	142	93%	0.93	77%	0.769	S	S	*	*			trans	-138.2	134.2	160.9	-158.7	-96.7	0	0	0	110.7
31	N	55.6	Low	48.2	Very low	129 Å²	129	142.3 Å²	142.3	69%	0.69	76%	0.76	S	S	*	*			trans	-141.4	149.4	-170.1	-146.6	2	0	0	0	110.6
32	I	52.5	Low	48.2	Very low	124 Å²	124	141.7 Å²	141.7	64%	0.636	75%	0.747	S	S	*	*			trans	89.6	105.5	151.3	-52.7	146.8	0	0	0	118.6
33	S	51	Low	48.5	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	73%	0.727	S	S	*	*			trans	-174.2	92.2	132.4	-82.4	0	0	0	0	111.4
34	T	46.3	Very low	48.3	Very low	115 Å²	115	128.5 Å²	128.5	71%	0.706	71%	0.71	S	S	*	*			trans	-161.9	46.7	158.3	-17.3	0	0	0	0	110.9	T36	T34-T36 VanDerWaalsContact C-N 3.34Å; T34-T36 PolarHBondContact O-N 3.29Å
35	S	47.5	Very low	48.7	Very low	90 Å²	90	126.8 Å²	126.8	63%	0.629	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-0.3	-167.4	-53.1	0	0	0	0	115.4
36	T	49.4	Very low	49.1	Very low	130 Å²	130	124.3 Å²	124.3	80%	0.798	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	-30	-172.6	-47.6	0	0	0	0	114.2	T34	T34-T36 VanDerWaalsContact C-N 3.34Å; T34-T36 PolarHBondContact O-N 3.29Å
37	L	46.8	Very low	48.7	Very low	135 Å²	135	120.8 Å²	120.8	71%	0.707	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-18.5	171.8	-84.4	166.3	0	0	0	112.9
38	A	48.7	Very low	49.1	Very low	56 Å²	56	117 Å²	117	46%	0.463	64%	0.635	S	S	.	*	H	α-helix	trans	-76	-21.9	-175.9	0	0	0	0	0	113.7	H42	A38-H42 WeakPolarHBondContact O-CB 2.98Å; A38-H42 PolarHBondContact O-N 3.37Å
39	F	42.8	Very low	49.3	Very low	156 Å²	156	112.6 Å²	112.6	68%	0.684	61%	0.612	S	S	*	*	H	α-helix	trans	-79.9	-38.8	-175.5	-167	-101.9	0	0	0	112.9	F43	F39-F43 PolarHBondContact O-N 3.44Å
40	D	48.3	Very low	49.7	Very low	126 Å²	126	109.5 Å²	109.5	67%	0.674	60%	0.6	S	S	*	*	H	α-helix	trans	-80.5	-36.1	-176.6	-156.8	-105.6	0	0	0	112.4	T44	D40-T44 PolarHBondContact O-N 2.94Å; D40-T44 PolarHBondContact O-OG1 3.48Å
41	Q	49.7	Very low	50.5	Low	132 Å²	132	100.7 Å²	100.7	62%	0.617	56%	0.562	S	S	*	*	H	α-helix	trans	-78.8	-30.5	177.4	-163.1	167.7	-36.1	0	0	112.8	F43 T44 T45	Q41-F43 VanDerWaalsContact C-N 3.29Å; Q41-F43 PolarHBondContact O-N 2.76Å; Q41-T44 PolarHBondContact O-OG1 3.13Å; Q41-T45 WeakPolarHBondContact O-CA 3.25Å; Q41-T45 WeakPolarHBondContact O-CB 3.02Å; Q41-T45 PolarHBondContact O-N 3.37Å; Q41-T45 PolarHBondContact O-OG1 3.48Å
42	H	48.6	Very low	50.9	Low	128 Å²	128	99.9 Å²	99.9	59%	0.593	56%	0.557	S	S	*	*	H	α-helix	trans	-75.3	-18.1	176.1	-173.7	-101.7	0	0	0	112.9	A38 N46	A38-H42 WeakPolarHBondContact O-CB 2.98Å; A38-H42 PolarHBondContact O-N 3.37Å; H42-N46 PolarHBondContact CE1-ND2 2.9Å; H42-N46 PolarHBondContact ND1-ND2 3.17Å; H42-N46 VanDerWaalsContact O-CB 3.25Å; H42-N46 WeakPolarHBondContact O-CB 3.49Å; H42-N46 PolarHBondContact O-N 2.85Å; H42-N46 PolarHBondContact O-ND2 3.48Å
43	F	45.8	Very low	51.4	Low	111 Å²	111	99.1 Å²	99.1	49%	0.487	55%	0.551	S	S	.	*	H	α-helix	trans	-83.9	-36.5	175.3	-129.3	-88.6	0	0	0	112.4	F39 Q41 K48	F39-F43 PolarHBondContact O-N 3.44Å; Q41-F43 VanDerWaalsContact C-N 3.29Å; Q41-F43 PolarHBondContact O-N 2.76Å; F43-K48 HydrophobicContact CE1-CD 4.25Å
44	T	43.7	Very low	51.9	Low	91 Å²	91	96.1 Å²	96.1	56%	0.558	53%	0.533	S	S	*	.	H	α-helix	trans	-84.6	-25.4	176	46.5	0	0	0	0	113.3	D40 Q41	D40-T44 PolarHBondContact O-N 2.94Å; D40-T44 PolarHBondContact O-OG1 3.48Å; Q41-T44 PolarHBondContact O-OG1 3.13Å
45	T	49.1	Very low	52.8	Low	105 Å²	105	94.9 Å²	94.9	64%	0.644	52%	0.519	S	S	*	.	S	Bend	trans	-88.1	-10.2	170.9	-54.3	0	0	0	0	112.6	Q41	Q41-T45 WeakPolarHBondContact O-CA 3.25Å; Q41-T45 WeakPolarHBondContact O-CB 3.02Å; Q41-T45 PolarHBondContact O-N 3.37Å; Q41-T45 PolarHBondContact O-OG1 3.48Å
46	N	54.2	Low	53.8	Low	63 Å²	63	94.8 Å²	94.8	34%	0.337	51%	0.511	S	S	.	.	S	Bend	trans	-73.5	143.8	164.2	-106.9	-61.8	0	0	0	108.4	H42 K48 G49	H42-N46 PolarHBondContact CE1-ND2 2.9Å; H42-N46 PolarHBondContact ND1-ND2 3.17Å; H42-N46 VanDerWaalsContact O-CB 3.25Å; H42-N46 WeakPolarHBondContact O-CB 3.49Å; H42-N46 PolarHBondContact O-N 2.85Å; H42-N46 PolarHBondContact O-ND2 3.48Å; N46-K48 PolarHBondContact O-N 3.44Å; N46-G49 PolarHBondContact O-N 3.42Å
47	A	52.3	Low	54.6	Low	45 Å²	45	93.7 Å²	93.7	37%	0.372	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-5.3	-179.1	0	0	0	0	0	114.9	G49 I50 L51 Y98	A47-G49 VanDerWaalsContact C-N 3.33Å; A47-I50 PolarHBondContact O-N 2.69Å; A47-L51 PolarHBondContact O-N 3.38Å; A47-Y98 VanDerWaalsContact C-CE2 3.46Å; A47-Y98 HydrophobicContact CB-CD2 4.33Å; A47-Y98 HydrophobicContact CB-CE2 3.38Å; A47-Y98 WeakPolarHBondContact O-CE2 3.26Å
48	K	51	Low	55.3	Low	91 Å²	91	88.3 Å²	88.3	40%	0.396	47%	0.473	S	S	.	.	H	α-helix	trans	-62.5	-40.8	171.4	-66.1	-172.6	176.3	-172.8	0	110.1	F43 N46 L51 L52 Y98	F43-K48 HydrophobicContact CE1-CD 4.25Å; N46-K48 PolarHBondContact O-N 3.44Å; K48-L51 PolarHBondContact O-N 3.43Å; K48-L52 WeakPolarHBondContact O-CB 3.37Å; K48-L52 PolarHBondContact O-N 3.49Å; K48-Y98 WeakPolarHBondContact CA-OH 3.23Å; K48-Y98 HydrophobicContact CG-CE1 4.12Å; K48-Y98 WeakPolarHBondContact CG-OH 2.87Å; K48-Y98 VanDerWaalsContact N-CZ 3.3Å; K48-Y98 PolarHBondContact N-OH 3.47Å
49	G	58.3	Low	55.9	Low	26 Å²	26	87.1 Å²	87.1	27%	0.268	47%	0.466	S	S	.	.	H	α-helix	trans	-66.3	-43.4	177.5	0	0	0	0	0	112.3	N46 A47 L51 L52 Q53	N46-G49 PolarHBondContact O-N 3.42Å; A47-G49 VanDerWaalsContact C-N 3.33Å; G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 2.92Å; G49-L52 PolarHBondContact O-N 2.92Å; G49-Q53 VanDerWaalsContact O-CB 3.23Å; G49-Q53 WeakPolarHBondContact O-CB 3.09Å; G49-Q53 PolarHBondContact O-N 2.66Å
50	I	60.6	Low	57	Low	125 Å²	125	84.9 Å²	84.9	64%	0.641	46%	0.459	S	S	*	.	H	α-helix	trans	-65.2	-36.5	177.4	-62.9	166.8	0	0	0	110.7	A47 Q53 A54	A47-I50 PolarHBondContact O-N 2.69Å; I50-Q53 PolarHBondContact O-N 3.45Å; I50-A54 WeakPolarHBondContact O-CB 3.24Å; I50-A54 PolarHBondContact O-N 2.87Å
51	L	59.4	Low	57.6	Low	26 Å²	26	82.8 Å²	82.8	14%	0.136	45%	0.447	C	S	.	.	H	α-helix	trans	-72	-45.1	178.3	-160	96.1	0	0	0	112.9	A47 K48 G49 Q53 A54 E55 F95 Y98	A47-L51 PolarHBondContact O-N 3.38Å; K48-L51 PolarHBondContact O-N 3.43Å; G49-L51 VanDerWaalsContact C-N 3.29Å; G49-L51 PolarHBondContact O-N 2.92Å; L51-Q53 PolarHBondContact O-N 3.44Å; L51-A54 PolarHBondContact O-N 3.12Å; L51-A54 VanDerWaalsContact O-N 3.12Å; L51-E55 WeakPolarHBondContact O-CB 3.44Å; L51-E55 PolarHBondContact O-N 3.48Å; L51-F95 HydrophobicContact CD2-CD2 3.19Å; L51-F95 HydrophobicContact CD2-CE2 3.53Å; L51-F95 HydrophobicContact CD2-CG 4.2Å; L51-F95 HydrophobicContact CG-CD2 4.23Å; L51-Y98 HydrophobicContact CB-CD1 3.8Å; L51-Y98 HydrophobicContact CB-CD2 4.45Å; L51-Y98 HydrophobicContact CB-CE1 3.9Å; L51-Y98 HydrophobicContact CB-CG 4.1Å; L51-Y98 HydrophobicContact CD1-CD1 3.55Å; L51-Y98 HydrophobicContact CD1-CD2 3.86Å; L51-Y98 HydrophobicContact CD1-CE1 4.44Å; L51-Y98 HydrophobicContact CD1-CG 3.21Å; L51-Y98 HydrophobicContact CD2-CD1 3.2Å; L51-Y98 HydrophobicContact CD2-CE1 3.84Å; L51-Y98 HydrophobicContact CD2-CG 3.88Å; L51-Y98 HydrophobicContact CG-CD1 3.64Å; L51-Y98 HydrophobicContact CG-CE1 4.24Å; L51-Y98 HydrophobicContact CG-CG 3.86Å
52	L	63.1	Low	58.1	Low	112 Å²	112	78.1 Å²	78.1	59%	0.586	43%	0.428	S	S	*	.	H	α-helix	trans	-59.3	-39.4	174.5	-156.7	101.8	0	0	0	110	K48 G49 E55 I56	K48-L52 WeakPolarHBondContact O-CB 3.37Å; K48-L52 PolarHBondContact O-N 3.49Å; G49-L52 PolarHBondContact O-N 2.92Å; L52-E55 PolarHBondContact O-N 2.92Å; L52-I56 HydrophobicContact CD2-CD1 3.97Å; L52-I56 HydrophobicContact CG-CD1 4.23Å; L52-I56 WeakPolarHBondContact O-CB 3.43Å; L52-I56 WeakPolarHBondContact O-CD1 3.39Å; L52-I56 WeakPolarHBondContact O-CG1 3.2Å; L52-I56 PolarHBondContact O-N 3.47Å
53	Q	62.8	Low	58.9	Low	108 Å²	108	81.4 Å²	81.4	51%	0.505	44%	0.435	S	S	.	.	H	α-helix	trans	-64.2	-45.6	174.1	-167.7	67.5	26.2	0	0	111.9	G49 I50 L51 E55 I56 L57	G49-Q53 VanDerWaalsContact O-CB 3.23Å; G49-Q53 WeakPolarHBondContact O-CB 3.09Å; G49-Q53 PolarHBondContact O-N 2.66Å; I50-Q53 PolarHBondContact O-N 3.45Å; L51-Q53 PolarHBondContact O-N 3.44Å; Q53-E55 VanDerWaalsContact C-N 3.32Å; Q53-E55 PolarHBondContact O-N 3.11Å; Q53-I56 PolarHBondContact O-N 2.95Å; Q53-L57 HydrophobicContact CG-CD1 4.28Å; Q53-L57 WeakPolarHBondContact O-CB 3.16Å; Q53-L57 WeakPolarHBondContact O-CG 3.05Å; Q53-L57 PolarHBondContact O-N 3.25Å
54	A	61.7	Low	59.5	Low	47 Å²	47	81.5 Å²	81.5	39%	0.388	44%	0.439	S	S	.	.	H	α-helix	trans	-64.5	-36.4	177.7	0	0	0	0	0	112.2	I50 L51 L57 S58	I50-A54 WeakPolarHBondContact O-CB 3.24Å; I50-A54 PolarHBondContact O-N 2.87Å; L51-A54 PolarHBondContact O-N 3.12Å; L51-A54 VanDerWaalsContact O-N 3.12Å; A54-L57 PolarHBondContact O-N 3.34Å; A54-S58 WeakPolarHBondContact O-CB 3.37Å; A54-S58 PolarHBondContact O-N 3.5Å; A54-S58 PolarHBondContact O-OG 2.81Å
55	E	65.9	Low	60.3	Low	90 Å²	90	79.2 Å²	79.2	42%	0.421	42%	0.423	S	S	.	.	H	α-helix	trans	-73	-37.9	177.7	-174.2	157.8	176.9	0	0	112.8	L51 L52 Q53 S58 G59 F95	L51-E55 WeakPolarHBondContact O-CB 3.44Å; L51-E55 PolarHBondContact O-N 3.48Å; L52-E55 PolarHBondContact O-N 2.92Å; Q53-E55 VanDerWaalsContact C-N 3.32Å; Q53-E55 PolarHBondContact O-N 3.11Å; E55-S58 WeakPolarHBondContact CA-OG 3.47Å; E55-S58 PolarHBondContact O-N 2.83Å; E55-S58 PolarHBondContact O-OG 3.41Å; E55-G59 PolarHBondContact O-N 3.06Å; E55-F95 WeakPolarHBondContact OE2-CD2 3.46Å; E55-F95 WeakPolarHBondContact OE2-CE2 3.3Å
56	I	68.5	Low	60.9	Low	88 Å²	88	79.4 Å²	79.4	45%	0.451	42%	0.419	S	S	.	.	H	α-helix	trans	-65.8	-42.1	172	-67.8	163	0	0	0	110.1	L52 Q53 G59 M60	L52-I56 HydrophobicContact CD2-CD1 3.97Å; L52-I56 HydrophobicContact CG-CD1 4.23Å; L52-I56 WeakPolarHBondContact O-CB 3.43Å; L52-I56 WeakPolarHBondContact O-CD1 3.39Å; L52-I56 WeakPolarHBondContact O-CG1 3.2Å; L52-I56 PolarHBondContact O-N 3.47Å; Q53-I56 PolarHBondContact O-N 2.95Å; I56-G59 PolarHBondContact O-N 2.89Å; I56-M60 HydrophobicContact CG2-CG 4.36Å; I56-M60 WeakPolarHBondContact O-CB 3.47Å; I56-M60 VanDerWaalsContact O-CG 3.24Å; I56-M60 WeakPolarHBondContact O-CG 3.49Å; I56-M60 PolarHBondContact O-N 2.9Å
57	L	66	Low	61.1	Low	106 Å²	106	79.5 Å²	79.5	56%	0.555	44%	0.435	S	S	*	.	H	α-helix	trans	-64.1	-40	176.8	-72	172.8	0	0	0	111.9	Q53 A54 L61	Q53-L57 HydrophobicContact CG-CD1 4.28Å; Q53-L57 WeakPolarHBondContact O-CB 3.16Å; Q53-L57 WeakPolarHBondContact O-CG 3.05Å; Q53-L57 PolarHBondContact O-N 3.25Å; A54-L57 PolarHBondContact O-N 3.34Å; L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 PolarHBondContact O-N 2.74Å
58	S	60.6	Low	61.3	Low	23 Å²	23	80.1 Å²	80.1	16%	0.161	45%	0.446	C	S	.	.	H	α-helix	trans	-70.9	-40.5	177.9	69.2	0	0	0	0	112.2	A54 E55 L61 V62 T91	A54-S58 WeakPolarHBondContact O-CB 3.37Å; A54-S58 PolarHBondContact O-N 3.5Å; A54-S58 PolarHBondContact O-OG 2.81Å; E55-S58 WeakPolarHBondContact CA-OG 3.47Å; E55-S58 PolarHBondContact O-N 2.83Å; E55-S58 PolarHBondContact O-OG 3.41Å; S58-L61 PolarHBondContact O-N 2.94Å; S58-V62 WeakPolarHBondContact O-CG2 3.33Å; S58-V62 PolarHBondContact O-N 3.21Å; S58-T91 WeakPolarHBondContact CB-OG1 3.36Å; S58-T91 WeakPolarHBondContact OG-CG2 3.17Å
59	G	62.5	Low	61.4	Low	30 Å²	30	78.6 Å²	78.6	31%	0.309	45%	0.445	S	S	.	.	H	α-helix	trans	-59	-51.2	172.2	0	0	0	0	0	111.4	E55 I56 L61 V62 W63	E55-G59 PolarHBondContact O-N 3.06Å; I56-G59 PolarHBondContact O-N 2.89Å; G59-L61 VanDerWaalsContact C-N 3.3Å; G59-L61 PolarHBondContact O-N 3.43Å; G59-V62 PolarHBondContact O-N 3.17Å; G59-W63 WeakPolarHBondContact O-CB 3.35Å; G59-W63 PolarHBondContact O-N 3.24Å
60	M	64.3	Low	61	Low	110 Å²	110	83.8 Å²	83.8	54%	0.542	47%	0.466	S	S	.	.	H	α-helix	trans	-61.3	-38.7	176.6	-71.2	-61.1	-65.8	0	0	112.1	I56 W63 I64	I56-M60 HydrophobicContact CG2-CG 4.36Å; I56-M60 WeakPolarHBondContact O-CB 3.47Å; I56-M60 VanDerWaalsContact O-CG 3.24Å; I56-M60 WeakPolarHBondContact O-CG 3.49Å; I56-M60 PolarHBondContact O-N 2.9Å; M60-W63 PolarHBondContact O-N 3.49Å; M60-I64 HydrophobicContact CB-CD1 4.49Å; M60-I64 WeakPolarHBondContact O-CB 3.44Å; M60-I64 WeakPolarHBondContact O-CD1 3.14Å; M60-I64 WeakPolarHBondContact O-CG1 3.43Å; M60-I64 PolarHBondContact O-N 3.1Å
61	L	60.8	Low	60.7	Low	81 Å²	81	87.4 Å²	87.4	42%	0.424	47%	0.473	S	S	.	.	H	α-helix	trans	-67.1	-43.3	-179.9	-163.4	123.8	0	0	0	111.9	L57 S58 G59 W63 L65 L87	L57-L61 WeakPolarHBondContact O-CB 3.32Å; L57-L61 PolarHBondContact O-N 2.74Å; S58-L61 PolarHBondContact O-N 2.94Å; G59-L61 VanDerWaalsContact C-N 3.3Å; G59-L61 PolarHBondContact O-N 3.43Å; L61-W63 VanDerWaalsContact C-N 3.34Å; L61-W63 PolarHBondContact O-N 3.27Å; L61-L65 VanDerWaalsContact O-CB 3.29Å; L61-L65 WeakPolarHBondContact O-CB 3.21Å; L61-L65 PolarHBondContact O-N 3.09Å; L61-L87 HydrophobicContact CD2-CD1 3.49Å; L61-L87 VanDerWaalsContact CD2-CD1 3.49Å
62	V	60.9	Low	59.9	Low	34 Å²	34	94.4 Å²	94.4	21%	0.206	50%	0.503	C	S	.	.	H	α-helix	trans	-60.9	-43.1	173.8	170.7	0	0	0	0	111	S58 G59 L65 I66	S58-V62 WeakPolarHBondContact O-CG2 3.33Å; S58-V62 PolarHBondContact O-N 3.21Å; G59-V62 PolarHBondContact O-N 3.17Å; V62-L65 WeakPolarHBondContact O-CB 3.36Å; V62-L65 PolarHBondContact O-N 3.39Å; V62-I66 HydrophobicContact CG1-CD1 4.01Å; V62-I66 WeakPolarHBondContact O-CD1 3.37Å; V62-I66 PolarHBondContact O-N 3.45Å
63	W	65.1	Low	59.3	Low	198 Å²	198	99 Å²	99	75%	0.75	51%	0.512	S	S	*	.	H	α-helix	trans	-70.1	-40.1	-179.3	-83.3	70.2	0	0	0	113.3	G59 M60 L61 L65 I66 G67	G59-W63 WeakPolarHBondContact O-CB 3.35Å; G59-W63 PolarHBondContact O-N 3.24Å; M60-W63 PolarHBondContact O-N 3.49Å; L61-W63 VanDerWaalsContact C-N 3.34Å; L61-W63 PolarHBondContact O-N 3.27Å; W63-L65 PolarHBondContact O-N 3.48Å; W63-I66 PolarHBondContact O-N 3.14Å; W63-G67 PolarHBondContact O-N 3.17Å
64	I	59.2	Low	58.7	Low	112 Å²	112	101.4 Å²	101.4	57%	0.574	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-33.6	172.6	-70	163.5	0	0	0	110.1	M60 G68	M60-I64 HydrophobicContact CB-CD1 4.49Å; M60-I64 WeakPolarHBondContact O-CB 3.44Å; M60-I64 WeakPolarHBondContact O-CD1 3.14Å; M60-I64 WeakPolarHBondContact O-CG1 3.43Å; M60-I64 PolarHBondContact O-N 3.1Å; I64-G68 VanDerWaalsContact O-CA 3.3Å; I64-G68 WeakPolarHBondContact O-CA 3.03Å; I64-G68 PolarHBondContact O-N 3.17Å
65	L	60.7	Low	58.4	Low	43 Å²	43	103.6 Å²	103.6	23%	0.225	54%	0.54	C	S	.	.	H	α-helix	trans	-71.9	-46.2	177.7	-144.3	66.9	0	0	0	112.7	L61 V62 W63 G68 T69 V80 S84	L61-L65 VanDerWaalsContact O-CB 3.29Å; L61-L65 WeakPolarHBondContact O-CB 3.21Å; L61-L65 PolarHBondContact O-N 3.09Å; V62-L65 WeakPolarHBondContact O-CB 3.36Å; V62-L65 PolarHBondContact O-N 3.39Å; W63-L65 PolarHBondContact O-N 3.48Å; L65-G68 PolarHBondContact O-N 3.23Å; L65-T69 WeakPolarHBondContact O-CG2 3.04Å; L65-T69 PolarHBondContact O-N 2.83Å; L65-V80 HydrophobicContact CD1-CG1 3.29Å; L65-V80 HydrophobicContact CD2-CG1 3.37Å; L65-V80 WeakPolarHBondContact CD2-O 3.41Å; L65-V80 HydrophobicContact CG-CG1 3.13Å; L65-S84 WeakPolarHBondContact CD2-OG 3.12Å
66	I	61.1	Low	57.7	Low	109 Å²	109	102 Å²	102	56%	0.559	54%	0.543	S	S	*	.	H	α-helix	trans	-64.4	-41.8	175.2	-97	72.2	0	0	0	110.8	V62 W63 T69	V62-I66 HydrophobicContact CG1-CD1 4.01Å; V62-I66 WeakPolarHBondContact O-CD1 3.37Å; V62-I66 PolarHBondContact O-N 3.45Å; W63-I66 PolarHBondContact O-N 3.14Å; I66-T69 PolarHBondContact O-OG1 3.37Å
67	G	58.8	Low	57.2	Low	65 Å²	65	100.7 Å²	100.7	67%	0.67	54%	0.536	S	S	*	.	H	α-helix	trans	-78.5	-22.3	179.5	0	0	0	0	0	113.5	W63	W63-G67 PolarHBondContact O-N 3.17Å
68	G	57.1	Low	56.7	Low	58 Å²	58	99.9 Å²	99.9	60%	0.598	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-3.1	178.6	0	0	0	0	0	114.2	I64 L65 D70	I64-G68 VanDerWaalsContact O-CA 3.3Å; I64-G68 WeakPolarHBondContact O-CA 3.03Å; I64-G68 PolarHBondContact O-N 3.17Å; L65-G68 PolarHBondContact O-N 3.23Å; G68-D70 PolarHBondContact O-N 2.89Å
69	T	51.7	Low	56.7	Low	60 Å²	60	104.1 Å²	104.1	37%	0.368	55%	0.551	S	S	.	*			trans	-77.3	74.1	170.5	57.9	0	0	0	0	110.5	L65 I66 L77	L65-T69 WeakPolarHBondContact O-CG2 3.04Å; L65-T69 PolarHBondContact O-N 2.83Å; I66-T69 PolarHBondContact O-OG1 3.37Å; T69-L77 HydrophobicContact CG2-CD2 3.48Å; T69-L77 VanDerWaalsContact CG2-CD2 3.48Å
70	D	51	Low	56.8	Low	135 Å²	135	104.2 Å²	104.2	72%	0.722	55%	0.546	S	S	*	.			trans	-78.4	135	155.7	-128.9	-53.7	0	0	0	108.9	G68 F72	G68-D70 PolarHBondContact O-N 2.89Å; D70-F72 VanDerWaalsContact C-N 3.35Å; D70-F72 PolarHBondContact O-N 3.37Å
71	Y	52.9	Low	57	Low	200 Å²	200	105 Å²	105	78%	0.784	55%	0.549	S	S	*	.	S	Bend	trans	-71.1	69.2	-154.6	-69.9	-97.6	0	0	0	114.8
72	F	43.9	Very low	57	Low	174 Å²	174	104.5 Å²	104.5	76%	0.763	54%	0.544	S	S	*	.			trans	-132.2	111	173.2	-81.9	-82.2	0	0	0	114.2	D70	D70-F72 VanDerWaalsContact C-N 3.35Å; D70-F72 PolarHBondContact O-N 3.37Å
73	R	49.8	Very low	57.2	Low	207 Å²	207	104.6 Å²	104.6	78%	0.781	55%	0.545	S	S	*	.			trans	75.8	104.3	165.9	-69.5	178.1	179.1	-138.6	-2.6	117.2	S75 A76	R73-S75 PolarHBondContact O-N 3.36Å; R73-A76 PolarHBondContact O-N 3.04Å; R73-A76 VanDerWaalsContact O-N 3.11Å
74	L	50.8	Low	57.4	Low	159 Å²	159	95.8 Å²	95.8	83%	0.832	51%	0.513	S	S	*	.	H	α-helix	trans	-45.4	-24.6	177.3	-80.2	74.6	0	0	0	116.2
75	S	54.3	Low	57.7	Low	93 Å²	93	94.6 Å²	94.6	65%	0.65	51%	0.507	S	S	*	.	H	α-helix	trans	-79.5	-31.1	-178.2	-155.8	0	0	0	0	113.9	R73	R73-S75 PolarHBondContact O-N 3.36Å
76	A	52.4	Low	57.9	Low	57 Å²	57	94.3 Å²	94.3	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-80.8	-32.6	177	0	0	0	0	0	111.3	R73 W79 V80	R73-A76 PolarHBondContact O-N 3.04Å; R73-A76 VanDerWaalsContact O-N 3.11Å; A76-W79 WeakPolarHBondContact O-CB 3.32Å; A76-W79 PolarHBondContact O-N 3.48Å; A76-V80 WeakPolarHBondContact O-CG2 3.45Å; A76-V80 PolarHBondContact O-N 2.9Å; A76-V80 VanDerWaalsContact O-N 3.11Å
77	L	56.6	Low	58.2	Low	60 Å²	60	91.2 Å²	91.2	31%	0.314	49%	0.49	S	S	.	.	H	α-helix	trans	-67.9	-37.7	-179.8	-69.5	173	0	0	0	113.1	T69 W79 V80 M81	T69-L77 HydrophobicContact CG2-CD2 3.48Å; T69-L77 VanDerWaalsContact CG2-CD2 3.48Å; L77-W79 VanDerWaalsContact C-N 3.28Å; L77-W79 PolarHBondContact O-N 3.34Å; L77-V80 PolarHBondContact O-N 3.43Å; L77-M81 WeakPolarHBondContact O-CB 3.46Å; L77-M81 PolarHBondContact O-N 3.34Å
78	C	56.6	Low	58.8	Low	89 Å²	89	94.5 Å²	94.5	60%	0.601	48%	0.482	S	S	*	.	H	α-helix	trans	-60.7	-40	175.5	-173.2	0	0	0	0	111.6	F82	C78-F82 WeakPolarHBondContact O-CB 3.49Å; C78-F82 PolarHBondContact O-N 2.94Å; C78-F82 VanDerWaalsContact O-N 3.1Å
79	W	60.4	Low	59.1	Low	113 Å²	113	95.6 Å²	95.6	43%	0.428	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-48.6	174.9	178.6	95.6	0	0	0	111.4	A76 L77 F82 V83 A152	A76-W79 WeakPolarHBondContact O-CB 3.32Å; A76-W79 PolarHBondContact O-N 3.48Å; L77-W79 VanDerWaalsContact C-N 3.28Å; L77-W79 PolarHBondContact O-N 3.34Å; W79-F82 PolarHBondContact O-N 3.48Å; W79-V83 HydrophobicContact CD2-CG2 4.1Å; W79-V83 HydrophobicContact CE3-CG2 4.31Å; W79-V83 HydrophobicContact CH2-CG2 4.08Å; W79-V83 HydrophobicContact CZ2-CG2 3.88Å; W79-V83 HydrophobicContact CZ3-CG2 4.29Å; W79-V83 VanDerWaalsContact O-CG2 3.28Å; W79-V83 WeakPolarHBondContact O-CG2 3.41Å; W79-V83 PolarHBondContact O-N 3.38Å; W79-A152 HydrophobicContact CZ2-CB 3.94Å
80	V	65.6	Low	59.8	Low	32 Å²	32	95.6 Å²	95.6	19%	0.194	47%	0.471	C	S	.	.	H	α-helix	trans	-63.9	-46.2	-177.3	171.2	0	0	0	0	111	L65 A76 L77 F82 V83 S84	L65-V80 HydrophobicContact CD1-CG1 3.29Å; L65-V80 HydrophobicContact CD2-CG1 3.37Å; L65-V80 WeakPolarHBondContact CD2-O 3.41Å; L65-V80 HydrophobicContact CG-CG1 3.13Å; A76-V80 WeakPolarHBondContact O-CG2 3.45Å; A76-V80 PolarHBondContact O-N 2.9Å; A76-V80 VanDerWaalsContact O-N 3.11Å; L77-V80 PolarHBondContact O-N 3.43Å; V80-F82 VanDerWaalsContact C-N 3.33Å; V80-F82 PolarHBondContact O-N 3.34Å; V80-V83 PolarHBondContact O-N 2.84Å; V80-S84 PolarHBondContact O-N 2.91Å
81	M	67.1	Low	60.5	Low	126 Å²	126	90.5 Å²	90.5	62%	0.621	44%	0.444	S	S	*	.	H	α-helix	trans	-64.1	-39.4	-179.7	-162	-177.3	91.6	0	0	111.5	L77 S84 I85	L77-M81 WeakPolarHBondContact O-CB 3.46Å; L77-M81 PolarHBondContact O-N 3.34Å; M81-S84 WeakPolarHBondContact O-CB 3.36Å; M81-S84 PolarHBondContact O-N 3.49Å; M81-I85 HydrophobicContact CE-CD1 4.24Å; M81-I85 HydrophobicContact CG-CD1 4.23Å; M81-I85 WeakPolarHBondContact O-CD1 3.39Å; M81-I85 VanDerWaalsContact O-CG1 3.3Å; M81-I85 WeakPolarHBondContact O-CG1 3.27Å; M81-I85 PolarHBondContact O-N 3.19Å; M81-I85 VanDerWaalsContact O-N 3.11Å
82	F	61.1	Low	61.3	Low	70 Å²	70	84.1 Å²	84.1	31%	0.307	42%	0.423	S	S	.	.	H	α-helix	trans	-65.5	-44.8	176.9	-176.5	-109.4	0	0	0	112.1	C78 W79 V80 S84 I85 L86 V131	C78-F82 WeakPolarHBondContact O-CB 3.49Å; C78-F82 PolarHBondContact O-N 2.94Å; C78-F82 VanDerWaalsContact O-N 3.1Å; W79-F82 PolarHBondContact O-N 3.48Å; V80-F82 VanDerWaalsContact C-N 3.33Å; V80-F82 PolarHBondContact O-N 3.34Å; F82-S84 VanDerWaalsContact C-N 3.3Å; F82-S84 PolarHBondContact O-N 2.94Å; F82-I85 PolarHBondContact O-N 2.82Å; F82-L86 HydrophobicContact CD1-CD1 3.58Å; F82-L86 HydrophobicContact CD1-CG 4.48Å; F82-L86 HydrophobicContact CE1-CD1 3.14Å; F82-L86 HydrophobicContact CE1-CG 4.14Å; F82-L86 HydrophobicContact CE2-CD1 4.18Å; F82-L86 HydrophobicContact CE2-CG 4.35Å; F82-L86 HydrophobicContact CG-CD1 4.26Å; F82-L86 HydrophobicContact CZ-CD1 3.47Å; F82-L86 VanDerWaalsContact CZ-CD1 3.47Å; F82-L86 HydrophobicContact CZ-CD2 4.25Å; F82-L86 HydrophobicContact CZ-CG 4.04Å; F82-L86 WeakPolarHBondContact O-CG 3.23Å; F82-L86 PolarHBondContact O-N 3.22Å; F82-V131 HydrophobicContact CD1-CG1 3.9Å; F82-V131 HydrophobicContact CE1-CB 3.7Å; F82-V131 HydrophobicContact CE1-CG1 3.48Å; F82-V131 VanDerWaalsContact CE1-CG1 3.48Å; F82-V131 HydrophobicContact CE1-CG2 3.9Å; F82-V131 HydrophobicContact CE2-CG2 4.39Å; F82-V131 HydrophobicContact CZ-CB 3.95Å; F82-V131 HydrophobicContact CZ-CG1 3.97Å; F82-V131 HydrophobicContact CZ-CG2 3.59Å
83	V	66.2	Low	62.4	Low	37 Å²	37	78.2 Å²	78.2	22%	0.224	40%	0.403	C	S	.	.	H	α-helix	trans	-62.4	-39.2	175.9	173.1	0	0	0	0	111.1	W79 V80 I85 L86 L87	W79-V83 HydrophobicContact CD2-CG2 4.1Å; W79-V83 HydrophobicContact CE3-CG2 4.31Å; W79-V83 HydrophobicContact CH2-CG2 4.08Å; W79-V83 HydrophobicContact CZ2-CG2 3.88Å; W79-V83 HydrophobicContact CZ3-CG2 4.29Å; W79-V83 VanDerWaalsContact O-CG2 3.28Å; W79-V83 WeakPolarHBondContact O-CG2 3.41Å; W79-V83 PolarHBondContact O-N 3.38Å; V80-V83 PolarHBondContact O-N 2.84Å; V83-I85 PolarHBondContact O-N 3.43Å; V83-L86 PolarHBondContact O-N 2.9Å; V83-L87 HydrophobicContact CG1-CD1 3.73Å; V83-L87 HydrophobicContact CG1-CG 4.37Å; V83-L87 WeakPolarHBondContact O-CB 3.44Å; V83-L87 WeakPolarHBondContact O-CG 3.19Å; V83-L87 PolarHBondContact O-N 2.91Å
84	S	67.4	Low	63.2	Low	12 Å²	12	72.5 Å²	72.5	8%	0.084	39%	0.387	C	S	.	.	H	α-helix	trans	-58.8	-47.9	175.8	-156.8	0	0	0	0	112.6	L65 V80 M81 F82 L87 W88	L65-S84 WeakPolarHBondContact CD2-OG 3.12Å; V80-S84 PolarHBondContact O-N 2.91Å; M81-S84 WeakPolarHBondContact O-CB 3.36Å; M81-S84 PolarHBondContact O-N 3.49Å; F82-S84 VanDerWaalsContact C-N 3.3Å; F82-S84 PolarHBondContact O-N 2.94Å; S84-L87 PolarHBondContact O-N 3.37Å; S84-W88 VanDerWaalsContact O-CB 3.29Å; S84-W88 WeakPolarHBondContact O-CB 3.28Å; S84-W88 PolarHBondContact O-N 3.49Å
85	I	66.9	Low	64.1	Low	87 Å²	87	68 Å²	68	45%	0.446	36%	0.361	S	S	.	.	H	α-helix	trans	-68.6	-41.1	-176.6	-66.2	163.8	0	0	0	109.5	M81 F82 V83 W88 I89	M81-I85 HydrophobicContact CE-CD1 4.24Å; M81-I85 HydrophobicContact CG-CD1 4.23Å; M81-I85 WeakPolarHBondContact O-CD1 3.39Å; M81-I85 VanDerWaalsContact O-CG1 3.3Å; M81-I85 WeakPolarHBondContact O-CG1 3.27Å; M81-I85 PolarHBondContact O-N 3.19Å; M81-I85 VanDerWaalsContact O-N 3.11Å; F82-I85 PolarHBondContact O-N 2.82Å; V83-I85 PolarHBondContact O-N 3.43Å; I85-W88 PolarHBondContact O-N 3.34Å; I85-I89 HydrophobicContact CG2-CG1 4.45Å; I85-I89 VanDerWaalsContact O-CG1 3.28Å; I85-I89 WeakPolarHBondContact O-CG1 3.38Å; I85-I89 PolarHBondContact O-N 2.89Å
86	L	64.6	Low	64.6	Low	38 Å²	38	68 Å²	68	20%	0.199	35%	0.353	C	S	.	.	H	α-helix	trans	-63.5	-42.7	175.7	-72	169.6	0	0	0	113	F82 V83 W88 I89 L90 V128	F82-L86 HydrophobicContact CD1-CD1 3.58Å; F82-L86 HydrophobicContact CD1-CG 4.48Å; F82-L86 HydrophobicContact CE1-CD1 3.14Å; F82-L86 HydrophobicContact CE1-CG 4.14Å; F82-L86 HydrophobicContact CE2-CD1 4.18Å; F82-L86 HydrophobicContact CE2-CG 4.35Å; F82-L86 HydrophobicContact CG-CD1 4.26Å; F82-L86 HydrophobicContact CZ-CD1 3.47Å; F82-L86 VanDerWaalsContact CZ-CD1 3.47Å; F82-L86 HydrophobicContact CZ-CD2 4.25Å; F82-L86 HydrophobicContact CZ-CG 4.04Å; F82-L86 WeakPolarHBondContact O-CG 3.23Å; F82-L86 PolarHBondContact O-N 3.22Å; V83-L86 PolarHBondContact O-N 2.9Å; L86-W88 VanDerWaalsContact C-N 3.33Å; L86-I89 PolarHBondContact O-N 3.45Å; L86-L90 VanDerWaalsContact O-CB 3.32Å; L86-L90 WeakPolarHBondContact O-CB 3.19Å; L86-L90 PolarHBondContact O-N 2.9Å; L86-V128 HydrophobicContact CD1-CB 4.39Å; L86-V128 HydrophobicContact CD1-CG1 4.47Å; L86-V128 HydrophobicContact CD1-CG2 3.43Å; L86-V128 VanDerWaalsContact CD1-CG2 3.43Å; L86-V128 HydrophobicContact CD2-CG2 4.31Å; L86-V128 HydrophobicContact CG-CG2 4.39Å
87	L	66.5	Low	65.2	Low	43 Å²	43	67.3 Å²	67.3	23%	0.225	34%	0.341	C	S	.	.	H	α-helix	trans	-65.7	-38.4	175.8	-77.5	169.1	0	0	0	111.6	L61 V83 S84 L90 T91 L159	L61-L87 HydrophobicContact CD2-CD1 3.49Å; L61-L87 VanDerWaalsContact CD2-CD1 3.49Å; V83-L87 HydrophobicContact CG1-CD1 3.73Å; V83-L87 HydrophobicContact CG1-CG 4.37Å; V83-L87 WeakPolarHBondContact O-CB 3.44Å; V83-L87 WeakPolarHBondContact O-CG 3.19Å; V83-L87 PolarHBondContact O-N 2.91Å; S84-L87 PolarHBondContact O-N 3.37Å; L87-L90 PolarHBondContact O-N 3.27Å; L87-T91 WeakPolarHBondContact O-CB 3.5Å; L87-T91 PolarHBondContact O-N 3.22Å; L87-T91 PolarHBondContact O-OG1 2.94Å; L87-L159 HydrophobicContact CD2-CD2 4.4Å
88	W	71.4	Confident	65.5	Low	135 Å²	135	66.4 Å²	66.4	51%	0.511	33%	0.334	S	S	.	.	H	α-helix	trans	-64.2	-46.5	176	-173.5	76	0	0	0	112	S84 I85 L86 T91 I92	S84-W88 VanDerWaalsContact O-CB 3.29Å; S84-W88 WeakPolarHBondContact O-CB 3.28Å; S84-W88 PolarHBondContact O-N 3.49Å; I85-W88 PolarHBondContact O-N 3.34Å; L86-W88 VanDerWaalsContact C-N 3.33Å; W88-T91 WeakPolarHBondContact O-CB 3.2Å; W88-T91 PolarHBondContact O-N 2.8Å; W88-I92 HydrophobicContact CD2-CD1 3.67Å; W88-I92 VanDerWaalsContact CE2-CD1 3.48Å; W88-I92 HydrophobicContact CE3-CD1 3.7Å; W88-I92 HydrophobicContact CH2-CD1 3.43Å; W88-I92 VanDerWaalsContact CH2-CD1 3.43Å; W88-I92 HydrophobicContact CZ2-CD1 3.39Å; W88-I92 HydrophobicContact CZ3-CD1 3.58Å; W88-I92 WeakPolarHBondContact O-CG1 3.44Å; W88-I92 PolarHBondContact O-N 3.5Å
89	I	63.7	Low	65.8	Low	81 Å²	81	66 Å²	66	42%	0.415	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-43.3	176.4	-63.6	-65.4	0	0	0	111.3	I85 L86 T91 I92 C93	I85-I89 HydrophobicContact CG2-CG1 4.45Å; I85-I89 VanDerWaalsContact O-CG1 3.28Å; I85-I89 WeakPolarHBondContact O-CG1 3.38Å; I85-I89 PolarHBondContact O-N 2.89Å; L86-I89 PolarHBondContact O-N 3.45Å; I89-T91 VanDerWaalsContact C-N 3.29Å; I89-T91 PolarHBondContact O-N 3.43Å; I89-I92 PolarHBondContact O-N 3.38Å; I89-C93 PolarHBondContact O-N 3.24Å; I89-C93 PolarHBondContact O-SG 3.46Å; I89-C93 VanDerWaalsContact O-SG 3.41Å
90	L	66.1	Low	65.6	Low	59 Å²	59	63 Å²	63	31%	0.309	32%	0.319	S	S	.	.	H	α-helix	trans	-58.8	-42.5	175	-176.9	70.5	0	0	0	111.4	L86 L87 C93 L94	L86-L90 VanDerWaalsContact O-CB 3.32Å; L86-L90 WeakPolarHBondContact O-CB 3.19Å; L86-L90 PolarHBondContact O-N 2.9Å; L87-L90 PolarHBondContact O-N 3.27Å; L90-C93 PolarHBondContact O-N 2.8Å; L90-L94 HydrophobicContact CG-CD1 4.06Å; L90-L94 WeakPolarHBondContact O-CB 3.3Å; L90-L94 VanDerWaalsContact O-CG 3.24Å; L90-L94 WeakPolarHBondContact O-CG 3.26Å; L90-L94 PolarHBondContact O-N 2.95Å
91	T	66.8	Low	65.1	Low	28 Å²	28	64 Å²	64	17%	0.172	34%	0.336	C	S	.	.	H	α-helix	trans	-61.4	-46.1	176.6	-55.4	0	0	0	0	110.9	S58 L87 W88 I89 L94 F95	S58-T91 WeakPolarHBondContact CB-OG1 3.36Å; S58-T91 WeakPolarHBondContact OG-CG2 3.17Å; L87-T91 WeakPolarHBondContact O-CB 3.5Å; L87-T91 PolarHBondContact O-N 3.22Å; L87-T91 PolarHBondContact O-OG1 2.94Å; W88-T91 WeakPolarHBondContact O-CB 3.2Å; W88-T91 PolarHBondContact O-N 2.8Å; I89-T91 VanDerWaalsContact C-N 3.29Å; I89-T91 PolarHBondContact O-N 3.43Å; T91-L94 PolarHBondContact O-N 3.43Å; T91-F95 VanDerWaalsContact O-CB 3.32Å; T91-F95 WeakPolarHBondContact O-CB 3.37Å; T91-F95 PolarHBondContact O-N 3.45Å
92	I	69.1	Low	64.4	Low	66 Å²	66	60.3 Å²	60.3	34%	0.338	32%	0.321	S	S	.	.	H	α-helix	trans	-62.9	-45.4	177.8	-69.5	170.8	0	0	0	110.9	W88 I89 L94 F95 I96	W88-I92 HydrophobicContact CD2-CD1 3.67Å; W88-I92 VanDerWaalsContact CE2-CD1 3.48Å; W88-I92 HydrophobicContact CE3-CD1 3.7Å; W88-I92 HydrophobicContact CH2-CD1 3.43Å; W88-I92 VanDerWaalsContact CH2-CD1 3.43Å; W88-I92 HydrophobicContact CZ2-CD1 3.39Å; W88-I92 HydrophobicContact CZ3-CD1 3.58Å; W88-I92 WeakPolarHBondContact O-CG1 3.44Å; W88-I92 PolarHBondContact O-N 3.5Å; I89-I92 PolarHBondContact O-N 3.38Å; I92-L94 PolarHBondContact O-N 2.92Å; I92-F95 WeakPolarHBondContact O-CB 3.29Å; I92-F95 PolarHBondContact O-N 2.85Å; I92-I96 HydrophobicContact CG2-CG1 4.38Å; I92-I96 VanDerWaalsContact O-CG1 3.3Å; I92-I96 WeakPolarHBondContact O-CG1 3.4Å; I92-I96 PolarHBondContact O-N 3.4Å
93	C	67.6	Low	63.7	Low	50 Å²	50	64.7 Å²	64.7	34%	0.338	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-49.9	176.2	-71.2	0	0	0	0	110.9	I89 L90 F95 I96 I97	I89-C93 PolarHBondContact O-N 3.24Å; I89-C93 PolarHBondContact O-SG 3.46Å; I89-C93 VanDerWaalsContact O-SG 3.41Å; L90-C93 PolarHBondContact O-N 2.8Å; C93-F95 VanDerWaalsContact C-N 3.33Å; C93-F95 PolarHBondContact O-N 2.81Å; C93-I96 PolarHBondContact O-N 3.26Å; C93-I97 WeakPolarHBondContact O-CD1 3.38Å; C93-I97 VanDerWaalsContact O-CG1 3.26Å; C93-I97 WeakPolarHBondContact O-CG1 3.41Å; C93-I97 PolarHBondContact O-N 2.99Å
94	L	66.1	Low	62.9	Low	87 Å²	87	65.3 Å²	65.3	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-59	-42.2	177.6	-72	171.5	0	0	0	112.2	L90 T91 I92 I97 Y98	L90-L94 HydrophobicContact CG-CD1 4.06Å; L90-L94 WeakPolarHBondContact O-CB 3.3Å; L90-L94 VanDerWaalsContact O-CG 3.24Å; L90-L94 WeakPolarHBondContact O-CG 3.26Å; L90-L94 PolarHBondContact O-N 2.95Å; T91-L94 PolarHBondContact O-N 3.43Å; I92-L94 PolarHBondContact O-N 2.92Å; L94-I97 PolarHBondContact O-N 3.45Å; L94-Y98 WeakPolarHBondContact O-CB 3.24Å; L94-Y98 PolarHBondContact O-N 3.48Å
95	F	68.6	Low	62	Low	65 Å²	65	75.8 Å²	75.8	29%	0.285	39%	0.386	S	S	.	.	H	α-helix	trans	-59.7	-45.5	175.9	-174.6	-99.5	0	0	0	112	L51 E55 T91 I92 C93 Y98 L99	L51-F95 HydrophobicContact CD2-CD2 3.19Å; L51-F95 HydrophobicContact CD2-CE2 3.53Å; L51-F95 HydrophobicContact CD2-CG 4.2Å; L51-F95 HydrophobicContact CG-CD2 4.23Å; E55-F95 WeakPolarHBondContact OE2-CD2 3.46Å; E55-F95 WeakPolarHBondContact OE2-CE2 3.3Å; T91-F95 VanDerWaalsContact O-CB 3.32Å; T91-F95 WeakPolarHBondContact O-CB 3.37Å; T91-F95 PolarHBondContact O-N 3.45Å; I92-F95 WeakPolarHBondContact O-CB 3.29Å; I92-F95 PolarHBondContact O-N 2.85Å; C93-F95 VanDerWaalsContact C-N 3.33Å; C93-F95 PolarHBondContact O-N 2.81Å; F95-Y98 WeakPolarHBondContact O-CB 3.36Å; F95-Y98 PolarHBondContact O-N 3.45Å; F95-L99 HydrophobicContact CD1-CD1 3.74Å; F95-L99 HydrophobicContact CD1-CG 4.15Å; F95-L99 HydrophobicContact CE1-CD1 3.17Å; F95-L99 HydrophobicContact CE1-CG 3.82Å; F95-L99 HydrophobicContact CE2-CG 4.49Å; F95-L99 HydrophobicContact CZ-CD1 3.67Å; F95-L99 HydrophobicContact CZ-CD2 4.21Å; F95-L99 HydrophobicContact CZ-CG 3.98Å; F95-L99 WeakPolarHBondContact O-CB 3.38Å; F95-L99 WeakPolarHBondContact O-CG 3.14Å; F95-L99 PolarHBondContact O-N 2.89Å
96	I	65.8	Low	61.2	Low	92 Å²	92	78.3 Å²	78.3	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-68.3	-43.6	180	-64.9	-63.8	0	0	0	112.1	I92 C93 Y98 L99 T100	I92-I96 HydrophobicContact CG2-CG1 4.38Å; I92-I96 VanDerWaalsContact O-CG1 3.3Å; I92-I96 WeakPolarHBondContact O-CG1 3.4Å; I92-I96 PolarHBondContact O-N 3.4Å; C93-I96 PolarHBondContact O-N 3.26Å; I96-Y98 PolarHBondContact O-N 2.96Å; I96-L99 PolarHBondContact O-N 3.3Å; I96-T100 VanDerWaalsContact O-CB 3.31Å; I96-T100 WeakPolarHBondContact O-CB 3.23Å; I96-T100 PolarHBondContact O-N 3.21Å; I96-T100 PolarHBondContact O-OG1 2.72Å
97	I	65.6	Low	60.4	Low	44 Å²	44	82 Å²	82	23%	0.226	43%	0.425	C	S	.	.	H	α-helix	trans	-61.3	-39.4	176	-64.3	150.8	0	0	0	110.1	C93 L94 T100 G101 C117	C93-I97 WeakPolarHBondContact O-CD1 3.38Å; C93-I97 VanDerWaalsContact O-CG1 3.26Å; C93-I97 WeakPolarHBondContact O-CG1 3.41Å; C93-I97 PolarHBondContact O-N 2.99Å; L94-I97 PolarHBondContact O-N 3.45Å; I97-T100 PolarHBondContact O-N 3.27Å; I97-G101 PolarHBondContact O-N 2.69Å; I97-C117 HydrophobicContact CD1-CB 3.32Å; I97-C117 WeakPolarHBondContact CD1-SG 3.44Å; I97-C117 HydrophobicContact CG1-CB 3.86Å
98	Y	62.2	Low	59.4	Low	41 Å²	41	88.5 Å²	88.5	16%	0.161	45%	0.454	C	S	.	.	H	α-helix	trans	-68.1	-49.4	178.6	-179.5	-99	0	0	0	113.1	A47 K48 L51 L94 F95 I96 T100 G101 V102	A47-Y98 VanDerWaalsContact C-CE2 3.46Å; A47-Y98 HydrophobicContact CB-CD2 4.33Å; A47-Y98 HydrophobicContact CB-CE2 3.38Å; A47-Y98 WeakPolarHBondContact O-CE2 3.26Å; K48-Y98 WeakPolarHBondContact CA-OH 3.23Å; K48-Y98 HydrophobicContact CG-CE1 4.12Å; K48-Y98 WeakPolarHBondContact CG-OH 2.87Å; K48-Y98 VanDerWaalsContact N-CZ 3.3Å; K48-Y98 PolarHBondContact N-OH 3.47Å; L51-Y98 HydrophobicContact CB-CD1 3.8Å; L51-Y98 HydrophobicContact CB-CD2 4.45Å; L51-Y98 HydrophobicContact CB-CE1 3.9Å; L51-Y98 HydrophobicContact CB-CG 4.1Å; L51-Y98 HydrophobicContact CD1-CD1 3.55Å; L51-Y98 HydrophobicContact CD1-CD2 3.86Å; L51-Y98 HydrophobicContact CD1-CE1 4.44Å; L51-Y98 HydrophobicContact CD1-CG 3.21Å; L51-Y98 HydrophobicContact CD2-CD1 3.2Å; L51-Y98 HydrophobicContact CD2-CE1 3.84Å; L51-Y98 HydrophobicContact CD2-CG 3.88Å; L51-Y98 HydrophobicContact CG-CD1 3.64Å; L51-Y98 HydrophobicContact CG-CE1 4.24Å; L51-Y98 HydrophobicContact CG-CG 3.86Å; L94-Y98 WeakPolarHBondContact O-CB 3.24Å; L94-Y98 PolarHBondContact O-N 3.48Å; F95-Y98 WeakPolarHBondContact O-CB 3.36Å; F95-Y98 PolarHBondContact O-N 3.45Å; I96-Y98 PolarHBondContact O-N 2.96Å; Y98-T100 PolarHBondContact O-N 3.46Å; Y98-G101 PolarHBondContact O-N 3.49Å; Y98-V102 HydrophobicContact CD1-CG2 4.28Å; Y98-V102 HydrophobicContact CE1-CG2 3.64Å; Y98-V102 HydrophobicContact CE2-CG2 3.84Å; Y98-V102 WeakPolarHBondContact O-CG2 3.41Å; Y98-V102 PolarHBondContact O-N 2.92Å; Y98-V102 WeakPolarHBondContact OH-CG2 3.18Å
99	L	62.6	Low	58.5	Low	80 Å²	80	88.1 Å²	88.1	42%	0.419	46%	0.461	S	S	.	.	H	α-helix	trans	-56.6	-42.4	174	-77.8	-173.8	0	0	0	110.9	F95 I96 V102 H103	F95-L99 HydrophobicContact CD1-CD1 3.74Å; F95-L99 HydrophobicContact CD1-CG 4.15Å; F95-L99 HydrophobicContact CE1-CD1 3.17Å; F95-L99 HydrophobicContact CE1-CG 3.82Å; F95-L99 HydrophobicContact CE2-CG 4.49Å; F95-L99 HydrophobicContact CZ-CD1 3.67Å; F95-L99 HydrophobicContact CZ-CD2 4.21Å; F95-L99 HydrophobicContact CZ-CG 3.98Å; F95-L99 WeakPolarHBondContact O-CB 3.38Å; F95-L99 WeakPolarHBondContact O-CG 3.14Å; F95-L99 PolarHBondContact O-N 2.89Å; I96-L99 PolarHBondContact O-N 3.3Å; L99-V102 PolarHBondContact O-N 2.97Å; L99-H103 VanDerWaalsContact O-CB 3.23Å; L99-H103 WeakPolarHBondContact O-CB 3.31Å; L99-H103 PolarHBondContact O-N 2.91Å
100	T	57.1	Low	58.2	Low	49 Å²	49	86.8 Å²	86.8	30%	0.301	46%	0.457	S	S	.	.	H	α-helix	trans	-66.9	-41.6	178.2	-52.8	0	0	0	0	111.3	I96 I97 Y98 V102 H103 S104 T113	I96-T100 VanDerWaalsContact O-CB 3.31Å; I96-T100 WeakPolarHBondContact O-CB 3.23Å; I96-T100 PolarHBondContact O-N 3.21Å; I96-T100 PolarHBondContact O-OG1 2.72Å; I97-T100 PolarHBondContact O-N 3.27Å; Y98-T100 PolarHBondContact O-N 3.46Å; T100-V102 VanDerWaalsContact C-N 3.33Å; T100-V102 PolarHBondContact O-N 3.38Å; T100-H103 PolarHBondContact O-N 3.23Å; T100-S104 WeakPolarHBondContact O-CB 3.03Å; T100-S104 PolarHBondContact O-N 3.34Å; T100-S104 PolarHBondContact O-OG 3.4Å; T100-T113 HydrophobicContact CG2-CG2 4.34Å
101	G	55.4	Low	57.6	Low	53 Å²	53	90.9 Å²	90.9	55%	0.546	47%	0.469	S	S	.	.	H	α-helix	trans	-67.3	-29.6	176.6	0	0	0	0	0	114	I97 Y98	I97-G101 PolarHBondContact O-N 2.69Å; Y98-G101 PolarHBondContact O-N 3.49Å
102	V	51.2	Low	57.1	Low	50 Å²	50	94.7 Å²	94.7	30%	0.303	49%	0.492	S	S	.	.	H	α-helix	trans	-76.5	-39.3	171.4	170.5	0	0	0	0	111.4	Y98 L99 T100	Y98-V102 HydrophobicContact CD1-CG2 4.28Å; Y98-V102 HydrophobicContact CE1-CG2 3.64Å; Y98-V102 HydrophobicContact CE2-CG2 3.84Å; Y98-V102 WeakPolarHBondContact O-CG2 3.41Å; Y98-V102 PolarHBondContact O-N 2.92Å; Y98-V102 WeakPolarHBondContact OH-CG2 3.18Å; L99-V102 PolarHBondContact O-N 2.97Å; T100-V102 VanDerWaalsContact C-N 3.33Å; T100-V102 PolarHBondContact O-N 3.38Å
103	H	46.4	Very low	56.3	Low	162 Å²	162	93.7 Å²	93.7	75%	0.75	49%	0.489	S	S	*	.	H	α-helix	trans	-72.7	-30.2	-178.1	-155.7	69.8	0	0	0	112.2	L99 T100 R105	L99-H103 VanDerWaalsContact O-CB 3.23Å; L99-H103 WeakPolarHBondContact O-CB 3.31Å; L99-H103 PolarHBondContact O-N 2.91Å; T100-H103 PolarHBondContact O-N 3.23Å; H103-R105 PolarHBondContact O-N 2.84Å; H103-R105 VanDerWaalsContact O-N 3.11Å
104	S	49.8	Very low	55.6	Low	50 Å²	50	94.8 Å²	94.8	35%	0.35	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	29.3	177.4	-67.3	0	0	0	0	115.1	T100 I106	T100-S104 WeakPolarHBondContact O-CB 3.03Å; T100-S104 PolarHBondContact O-N 3.34Å; T100-S104 PolarHBondContact O-OG 3.4Å; S104-I106 PolarHBondContact O-N 2.92Å; S104-I106 VanDerWaalsContact O-N 3.17Å
105	R	48.9	Very low	55.4	Low	232 Å²	232	93.7 Å²	93.7	88%	0.875	49%	0.491	S	S	*	.			trans	-76.2	22	159.3	-80.1	-71.9	-170.4	162.5	2.2	112.7	H103	H103-R105 PolarHBondContact O-N 2.84Å; H103-R105 VanDerWaalsContact O-N 3.11Å
106	I	50.3	Low	54.9	Low	140 Å²	140	95.8 Å²	95.8	72%	0.718	51%	0.505	S	S	*	.	S	Bend	trans	-118.9	124.1	162.5	-57.7	175.5	0	0	0	105.7	S104 Q108	S104-I106 PolarHBondContact O-N 2.92Å; S104-I106 VanDerWaalsContact O-N 3.17Å; I106-Q108 PolarHBondContact O-N 2.99Å
107	P	47.9	Very low	54.8	Low	116 Å²	116	92.8 Å²	92.8	75%	0.753	49%	0.492	S	S	*	.	S	Bend	trans	-79	110	-146	31.5	-33.6	0	0	0	111.6
108	Q	44.7	Very low	54.7	Low	179 Å²	179	95.1 Å²	95.1	84%	0.836	50%	0.5	S	S	*	.			trans	-170.2	124.9	142.6	-83.9	-141.5	-66.7	0	0	108.2	I106 P110	I106-Q108 PolarHBondContact O-N 2.99Å; Q108-P110 VanDerWaalsContact O-CD 3.27Å; Q108-P110 WeakPolarHBondContact O-CD 3.45Å
109	I	52.2	Low	54.9	Low	127 Å²	127	98 Å²	98	65%	0.651	52%	0.519	S	S	*	.			trans	-65.9	116.6	-167.9	-52.7	100	0	0	0	111.7	W111	I109-W111 VanDerWaalsContact C-N 3.32Å; I109-W111 HydrophobicContact CG2-CD2 3.95Å; I109-W111 HydrophobicContact CG2-CG 3.83Å; I109-W111 HydrophobicContact CG2-CZ2 4.35Å; I109-W111 PolarHBondContact O-N 3.01Å; I109-W111 VanDerWaalsContact O-N 3.13Å
110	P	57.4	Low	54.8	Low	53 Å²	53	97 Å²	97	34%	0.344	52%	0.518	S	S	.	.			trans	-88.2	75.8	170.2	34.2	-28.4	0	0	0	109.5	Q108 T112 T113	Q108-P110 VanDerWaalsContact O-CD 3.27Å; Q108-P110 WeakPolarHBondContact O-CD 3.45Å; P110-T112 PolarHBondContact O-N 3.41Å; P110-T113 PolarHBondContact O-N 2.91Å
111	W	54.5	Low	55.3	Low	144 Å²	144	95.5 Å²	95.5	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-50	-27.3	167.7	-67.6	96.9	0	0	0	112.4	I109 S115 L174	I109-W111 VanDerWaalsContact C-N 3.32Å; I109-W111 HydrophobicContact CG2-CD2 3.95Å; I109-W111 HydrophobicContact CG2-CG 3.83Å; I109-W111 HydrophobicContact CG2-CZ2 4.35Å; I109-W111 PolarHBondContact O-N 3.01Å; I109-W111 VanDerWaalsContact O-N 3.13Å; W111-S115 WeakPolarHBondContact O-CB 3.39Å; W111-S115 PolarHBondContact O-N 3.37Å; W111-S115 PolarHBondContact O-OG 3.05Å; W111-L174 HydrophobicContact CH2-CD1 3.57Å; W111-L174 HydrophobicContact CH2-CD2 4.02Å; W111-L174 HydrophobicContact CH2-CG 4.27Å; W111-L174 HydrophobicContact CZ3-CD1 3.78Å; W111-L174 HydrophobicContact CZ3-CD2 4Å
112	T	54.8	Low	55.8	Low	108 Å²	108	94 Å²	94	66%	0.663	49%	0.492	S	S	*	.	H	α-helix	trans	-66.7	-41.1	176.4	-44.8	0	0	0	0	112.8	P110 L114 S115 L116	P110-T112 PolarHBondContact O-N 3.41Å; T112-L114 VanDerWaalsContact C-N 3.34Å; T112-S115 PolarHBondContact O-N 3.44Å; T112-L116 WeakPolarHBondContact O-CB 3.32Å; T112-L116 PolarHBondContact O-N 3.28Å
113	T	52.3	Low	56.4	Low	46 Å²	46	94 Å²	94	28%	0.282	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-36.6	-178.8	-56.4	0	0	0	0	111.1	T100 P110 C117	T100-T113 HydrophobicContact CG2-CG2 4.34Å; P110-T113 PolarHBondContact O-N 2.91Å; T113-C117 VanDerWaalsContact O-CB 3.23Å; T113-C117 WeakPolarHBondContact O-CB 3.38Å; T113-C117 PolarHBondContact O-N 3.13Å
114	L	54.2	Low	57.3	Low	72 Å²	72	87.8 Å²	87.8	38%	0.377	47%	0.474	S	S	.	.	H	α-helix	trans	-67.9	-46.3	175.1	-168.3	65.2	0	0	0	111.6	T112 L116 C117 F118 L170	T112-L114 VanDerWaalsContact C-N 3.34Å; L114-L116 PolarHBondContact O-N 3.05Å; L114-C117 WeakPolarHBondContact O-CB 3.36Å; L114-C117 PolarHBondContact O-N 2.87Å; L114-F118 PolarHBondContact O-N 2.68Å; L114-L170 HydrophobicContact CD1-CD1 3.95Å
115	S	61.8	Low	58	Low	65 Å²	65	87.2 Å²	87.2	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-63.6	-40.5	177.1	-59.8	0	0	0	0	112.1	W111 T112 F118 N119	W111-S115 WeakPolarHBondContact O-CB 3.39Å; W111-S115 PolarHBondContact O-N 3.37Å; W111-S115 PolarHBondContact O-OG 3.05Å; T112-S115 PolarHBondContact O-N 3.44Å; S115-F118 PolarHBondContact O-N 3.24Å; S115-N119 WeakPolarHBondContact O-CB 3.49Å; S115-N119 PolarHBondContact O-N 2.86Å; S115-N119 PolarHBondContact O-ND2 3.06Å
116	L	57.1	Low	58.8	Low	109 Å²	109	84.5 Å²	84.5	57%	0.571	46%	0.458	S	S	*	.	H	α-helix	trans	-68.5	-41.7	177.6	-173.6	67.8	0	0	0	111.3	T112 L114 N119 C120	T112-L116 WeakPolarHBondContact O-CB 3.32Å; T112-L116 PolarHBondContact O-N 3.28Å; L114-L116 PolarHBondContact O-N 3.05Å; L116-N119 PolarHBondContact O-N 3.41Å; L116-C120 VanDerWaalsContact O-CB 3.3Å; L116-C120 WeakPolarHBondContact O-CB 3.35Å; L116-C120 PolarHBondContact O-N 3.34Å; L116-C120 PolarHBondContact O-SG 2.9Å; L116-C120 VanDerWaalsContact O-SG 3.41Å
117	C	65	Low	59.4	Low	29 Å²	29	83 Å²	83	20%	0.196	45%	0.451	C	S	.	.	H	α-helix	trans	-55.4	-52.5	170.8	165.5	0	0	0	0	111.4	I97 T113 L114 N119 C120 A121	I97-C117 HydrophobicContact CD1-CB 3.32Å; I97-C117 WeakPolarHBondContact CD1-SG 3.44Å; I97-C117 HydrophobicContact CG1-CB 3.86Å; T113-C117 VanDerWaalsContact O-CB 3.23Å; T113-C117 WeakPolarHBondContact O-CB 3.38Å; T113-C117 PolarHBondContact O-N 3.13Å; L114-C117 WeakPolarHBondContact O-CB 3.36Å; L114-C117 PolarHBondContact O-N 2.87Å; C117-N119 VanDerWaalsContact C-N 3.3Å; C117-N119 PolarHBondContact O-N 3.39Å; C117-C120 PolarHBondContact O-N 2.9Å; C117-A121 VanDerWaalsContact O-CB 3.29Å; C117-A121 WeakPolarHBondContact O-CB 3.43Å; C117-A121 PolarHBondContact O-N 2.96Å
118	F	61.9	Low	60.3	Low	92 Å²	92	78.7 Å²	78.7	40%	0.404	42%	0.422	S	S	.	.	H	α-helix	trans	-61.5	-42	-177.8	-178.7	-99.8	0	0	0	111.2	L114 S115 A121 A122	L114-F118 PolarHBondContact O-N 2.68Å; S115-F118 PolarHBondContact O-N 3.24Å; F118-A121 PolarHBondContact O-N 2.96Å; F118-A122 WeakPolarHBondContact O-CB 3.29Å; F118-A122 PolarHBondContact O-N 2.8Å
119	N	66.4	Low	61.4	Low	103 Å²	103	73 Å²	73	55%	0.551	40%	0.4	S	S	*	.	H	α-helix	trans	-67.3	-39.4	175.5	-82.6	-81.3	0	0	0	112.7	S115 L116 C117 A123	S115-N119 WeakPolarHBondContact O-CB 3.49Å; S115-N119 PolarHBondContact O-N 2.86Å; S115-N119 PolarHBondContact O-ND2 3.06Å; L116-N119 PolarHBondContact O-N 3.41Å; C117-N119 VanDerWaalsContact C-N 3.3Å; C117-N119 PolarHBondContact O-N 3.39Å; N119-A123 WeakPolarHBondContact O-CB 3.37Å; N119-A123 PolarHBondContact O-N 2.82Å
120	C	61.1	Low	62.1	Low	59 Å²	59	69.6 Å²	69.6	40%	0.399	39%	0.39	S	S	.	.	H	α-helix	trans	-66.8	-41.7	174.9	-79.1	0	0	0	0	112	L116 C117 A123 A124	L116-C120 VanDerWaalsContact O-CB 3.3Å; L116-C120 WeakPolarHBondContact O-CB 3.35Å; L116-C120 PolarHBondContact O-N 3.34Å; L116-C120 PolarHBondContact O-SG 2.9Å; L116-C120 VanDerWaalsContact O-SG 3.41Å; C117-C120 PolarHBondContact O-N 2.9Å; C120-A123 PolarHBondContact O-N 3.22Å; C120-A124 WeakPolarHBondContact O-CB 3.28Å; C120-A124 PolarHBondContact O-N 3.36Å
121	A	67.6	Low	62.4	Low	17 Å²	17	69.3 Å²	69.3	14%	0.14	39%	0.388	C	S	.	.	H	α-helix	trans	-65	-46.1	175.4	0	0	0	0	0	110.7	C117 F118 A123 A124 L125	C117-A121 VanDerWaalsContact O-CB 3.29Å; C117-A121 WeakPolarHBondContact O-CB 3.43Å; C117-A121 PolarHBondContact O-N 2.96Å; F118-A121 PolarHBondContact O-N 2.96Å; A121-A123 PolarHBondContact O-N 2.91Å; A121-A124 PolarHBondContact O-N 2.98Å; A121-L125 WeakPolarHBondContact O-CB 3.38Å; A121-L125 VanDerWaalsContact O-CG 3.23Å; A121-L125 WeakPolarHBondContact O-CG 3.28Å; A121-L125 PolarHBondContact O-N 3.29Å
122	A	65.4	Low	62.7	Low	21 Å²	21	64.1 Å²	64.1	17%	0.174	37%	0.372	C	S	.	.	H	α-helix	trans	-59.9	-45.7	174.5	0	0	0	0	0	111.6	F118 A124 L125 Y126	F118-A122 WeakPolarHBondContact O-CB 3.29Å; F118-A122 PolarHBondContact O-N 2.8Å; A122-A124 PolarHBondContact O-N 3.25Å; A122-L125 PolarHBondContact O-N 2.92Å; A122-Y126 WeakPolarHBondContact O-CD2 3.29Å; A122-Y126 PolarHBondContact O-N 3.11Å
123	A	64	Low	63	Low	51 Å²	51	65.9 Å²	65.9	42%	0.421	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-42.3	177.8	0	0	0	0	0	112.3	N119 C120 A121 L125 Y126 L127	N119-A123 WeakPolarHBondContact O-CB 3.37Å; N119-A123 PolarHBondContact O-N 2.82Å; C120-A123 PolarHBondContact O-N 3.22Å; A121-A123 PolarHBondContact O-N 2.91Å; A123-L125 VanDerWaalsContact C-N 3.35Å; A123-Y126 PolarHBondContact O-N 2.94Å; A123-L127 WeakPolarHBondContact O-CB 3.38Å; A123-L127 WeakPolarHBondContact O-CG 3.32Å; A123-L127 PolarHBondContact O-N 3Å
124	A	66.3	Low	63.4	Low	30 Å²	30	66.6 Å²	66.6	25%	0.248	38%	0.383	C	S	.	.	H	α-helix	trans	-61.9	-44.3	174.5	0	0	0	0	0	110.9	C120 A121 A122 L127 V128	C120-A124 WeakPolarHBondContact O-CB 3.28Å; C120-A124 PolarHBondContact O-N 3.36Å; A121-A124 PolarHBondContact O-N 2.98Å; A122-A124 PolarHBondContact O-N 3.25Å; A124-L127 PolarHBondContact O-N 3.34Å; A124-V128 WeakPolarHBondContact O-CG2 3.13Å; A124-V128 PolarHBondContact O-N 3.43Å
125	L	64.3	Low	63.6	Low	39 Å²	39	66 Å²	66	20%	0.204	38%	0.382	C	S	.	.	H	α-helix	trans	-62.3	-45	175.7	-70	171.8	0	0	0	111.9	A121 A122 A123 L127 V128 T129 F156 A160 C163	A121-L125 WeakPolarHBondContact O-CB 3.38Å; A121-L125 VanDerWaalsContact O-CG 3.23Å; A121-L125 WeakPolarHBondContact O-CG 3.28Å; A121-L125 PolarHBondContact O-N 3.29Å; A122-L125 PolarHBondContact O-N 2.92Å; A123-L125 VanDerWaalsContact C-N 3.35Å; L125-L127 VanDerWaalsContact C-N 3.31Å; L125-L127 PolarHBondContact O-N 3.49Å; L125-V128 PolarHBondContact O-N 2.92Å; L125-V128 VanDerWaalsContact O-N 3.12Å; L125-T129 PolarHBondContact O-N 2.92Å; L125-T129 PolarHBondContact O-OG1 3.31Å; L125-T129 VanDerWaalsContact O-OG1 3.06Å; L125-F156 HydrophobicContact CD2-CE2 3.82Å; L125-F156 HydrophobicContact CD2-CZ 4.4Å; L125-F156 VanDerWaalsContact O-CZ 3.22Å; L125-F156 WeakPolarHBondContact O-CZ 3.46Å; L125-A160 HydrophobicContact CD2-CB 4.37Å; L125-C163 HydrophobicContact CD1-CB 3.69Å
126	Y	65.6	Low	63.2	Low	174 Å²	174	65.2 Å²	65.2	68%	0.682	38%	0.376	S	S	*	.	H	α-helix	trans	-62.2	-38.5	176.1	-82.7	-64	0	0	0	112.5	A122 A123 V128 T129 A130	A122-Y126 WeakPolarHBondContact O-CD2 3.29Å; A122-Y126 PolarHBondContact O-N 3.11Å; A123-Y126 PolarHBondContact O-N 2.94Å; Y126-V128 VanDerWaalsContact C-N 3.35Å; Y126-T129 PolarHBondContact O-N 3.44Å; Y126-A130 VanDerWaalsContact O-CB 3.31Å; Y126-A130 WeakPolarHBondContact O-CB 3.34Å; Y126-A130 PolarHBondContact O-N 3.48Å
127	L	63.6	Low	63.1	Low	109 Å²	109	64.8 Å²	64.8	57%	0.571	38%	0.378	S	S	*	.	H	α-helix	trans	-63.1	-41	172.5	-80.4	169.8	0	0	0	111.6	A123 A124 L125 A130 V131	A123-L127 WeakPolarHBondContact O-CB 3.38Å; A123-L127 WeakPolarHBondContact O-CG 3.32Å; A123-L127 PolarHBondContact O-N 3Å; A124-L127 PolarHBondContact O-N 3.34Å; L125-L127 VanDerWaalsContact C-N 3.31Å; L125-L127 PolarHBondContact O-N 3.49Å; L127-A130 PolarHBondContact O-N 2.94Å; L127-V131 WeakPolarHBondContact O-CB 3.47Å; L127-V131 VanDerWaalsContact O-CG2 3.3Å; L127-V131 WeakPolarHBondContact O-CG2 3.23Å; L127-V131 PolarHBondContact O-N 2.93Å
128	V	65.5	Low	62.6	Low	26 Å²	26	65.4 Å²	65.4	16%	0.158	39%	0.39	C	S	.	.	H	α-helix	trans	-65.6	-44.4	175.2	-172.7	0	0	0	0	110.9	L86 A124 L125 Y126 A130 V131 V132 F156	L86-V128 HydrophobicContact CD1-CB 4.39Å; L86-V128 HydrophobicContact CD1-CG1 4.47Å; L86-V128 HydrophobicContact CD1-CG2 3.43Å; L86-V128 VanDerWaalsContact CD1-CG2 3.43Å; L86-V128 HydrophobicContact CD2-CG2 4.31Å; L86-V128 HydrophobicContact CG-CG2 4.39Å; A124-V128 WeakPolarHBondContact O-CG2 3.13Å; A124-V128 PolarHBondContact O-N 3.43Å; L125-V128 PolarHBondContact O-N 2.92Å; L125-V128 VanDerWaalsContact O-N 3.12Å; Y126-V128 VanDerWaalsContact C-N 3.35Å; V128-A130 VanDerWaalsContact C-N 3.33Å; V128-A130 PolarHBondContact O-N 3.45Å; V128-V131 PolarHBondContact O-N 3.42Å; V128-V132 HydrophobicContact CG1-CG2 4.12Å; V128-V132 WeakPolarHBondContact O-CB 3.3Å; V128-V132 WeakPolarHBondContact O-CG2 3.18Å; V128-V132 PolarHBondContact O-N 3.37Å; V128-F156 HydrophobicContact CB-CD2 3.75Å; V128-F156 HydrophobicContact CB-CE2 3.3Å; V128-F156 HydrophobicContact CB-CZ 3.9Å; V128-F156 HydrophobicContact CG1-CD2 3.22Å; V128-F156 HydrophobicContact CG1-CE2 3.37Å; V128-F156 HydrophobicContact CG1-CG 3.96Å; V128-F156 HydrophobicContact CG1-CZ 4.17Å; V128-F156 HydrophobicContact CG2-CE2 4.07Å
129	T	68.2	Low	62.1	Low	60 Å²	60	64 Å²	64	37%	0.368	38%	0.384	S	S	.	.	H	α-helix	trans	-56.2	-48.6	174.7	-51.5	0	0	0	0	110.8	L125 Y126 V131 V132 E133 F156	L125-T129 PolarHBondContact O-N 2.92Å; L125-T129 PolarHBondContact O-OG1 3.31Å; L125-T129 VanDerWaalsContact O-OG1 3.06Å; Y126-T129 PolarHBondContact O-N 3.44Å; T129-V131 PolarHBondContact O-N 3.04Å; T129-V132 PolarHBondContact O-N 3.48Å; T129-E133 WeakPolarHBondContact O-CB 3.36Å; T129-E133 PolarHBondContact O-N 2.95Å; T129-F156 HydrophobicContact CG2-CE1 4.35Å; T129-F156 WeakPolarHBondContact OG1-CE1 3.36Å; T129-F156 WeakPolarHBondContact OG1-CZ 3.47Å
130	A	66.1	Low	61.2	Low	54 Å²	54	63.1 Å²	63.1	45%	0.446	39%	0.392	S	S	.	.	H	α-helix	trans	-63.7	-40.9	-179.1	0	0	0	0	0	111.9	Y126 L127 V128 E133 A134	Y126-A130 VanDerWaalsContact O-CB 3.31Å; Y126-A130 WeakPolarHBondContact O-CB 3.34Å; Y126-A130 PolarHBondContact O-N 3.48Å; L127-A130 PolarHBondContact O-N 2.94Å; V128-A130 VanDerWaalsContact C-N 3.33Å; V128-A130 PolarHBondContact O-N 3.45Å; A130-E133 PolarHBondContact O-N 3.43Å; A130-A134 WeakPolarHBondContact O-CB 3.48Å; A130-A134 PolarHBondContact O-N 3.32Å
131	V	63.9	Low	60.8	Low	48 Å²	48	66.2 Å²	66.2	29%	0.291	41%	0.409	S	S	.	.	H	α-helix	trans	-69.5	-39.3	175.8	172.3	0	0	0	0	111.3	F82 L127 V128 T129 E133 A134 V135	F82-V131 HydrophobicContact CD1-CG1 3.9Å; F82-V131 HydrophobicContact CE1-CB 3.7Å; F82-V131 HydrophobicContact CE1-CG1 3.48Å; F82-V131 VanDerWaalsContact CE1-CG1 3.48Å; F82-V131 HydrophobicContact CE1-CG2 3.9Å; F82-V131 HydrophobicContact CE2-CG2 4.39Å; F82-V131 HydrophobicContact CZ-CB 3.95Å; F82-V131 HydrophobicContact CZ-CG1 3.97Å; F82-V131 HydrophobicContact CZ-CG2 3.59Å; L127-V131 WeakPolarHBondContact O-CB 3.47Å; L127-V131 VanDerWaalsContact O-CG2 3.3Å; L127-V131 WeakPolarHBondContact O-CG2 3.23Å; L127-V131 PolarHBondContact O-N 2.93Å; V128-V131 PolarHBondContact O-N 3.42Å; T129-V131 PolarHBondContact O-N 3.04Å; V131-E133 VanDerWaalsContact C-N 3.32Å; V131-E133 PolarHBondContact O-N 3.39Å; V131-A134 PolarHBondContact O-N 3.41Å; V131-V135 HydrophobicContact CG1-CG2 4.14Å; V131-V135 WeakPolarHBondContact O-CB 3.42Å; V131-V135 WeakPolarHBondContact O-CG2 3.42Å; V131-V135 PolarHBondContact O-N 2.79Å
132	V	60.6	Low	60	Low	35 Å²	35	75.9 Å²	75.9	21%	0.212	44%	0.442	C	S	.	.	H	α-helix	trans	-60.8	-43.6	173.6	169.6	0	0	0	0	110.3	V128 T129 V135 C136	V128-V132 HydrophobicContact CG1-CG2 4.12Å; V128-V132 WeakPolarHBondContact O-CB 3.3Å; V128-V132 WeakPolarHBondContact O-CG2 3.18Å; V128-V132 PolarHBondContact O-N 3.37Å; T129-V132 PolarHBondContact O-N 3.48Å; V132-V135 PolarHBondContact O-N 3.24Å; V132-C136 WeakPolarHBondContact O-CB 3.45Å; V132-C136 PolarHBondContact O-N 3.41Å; V132-C136 PolarHBondContact O-SG 3.42Å
133	E	62.2	Low	59.2	Low	145 Å²	145	77.7 Å²	77.7	68%	0.678	46%	0.462	S	S	*	.	H	α-helix	trans	-66	-42.6	176.5	-171	160.1	83.3	0	0	112	T129 A130 V131 V135 C136 V137	T129-E133 WeakPolarHBondContact O-CB 3.36Å; T129-E133 PolarHBondContact O-N 2.95Å; A130-E133 PolarHBondContact O-N 3.43Å; V131-E133 VanDerWaalsContact C-N 3.32Å; V131-E133 PolarHBondContact O-N 3.39Å; E133-V135 VanDerWaalsContact C-N 3.35Å; E133-V135 PolarHBondContact O-N 3.38Å; E133-C136 PolarHBondContact O-N 2.79Å; E133-V137 WeakPolarHBondContact O-CB 3.47Å; E133-V137 PolarHBondContact O-N 3.49Å
134	A	60.3	Low	58.6	Low	61 Å²	61	86.2 Å²	86.2	50%	0.504	48%	0.484	S	S	.	.	H	α-helix	trans	-64.1	-36.2	175.6	0	0	0	0	0	113.1	A130 V131 V137 G138	A130-A134 WeakPolarHBondContact O-CB 3.48Å; A130-A134 PolarHBondContact O-N 3.32Å; V131-A134 PolarHBondContact O-N 3.41Å; A134-V137 WeakPolarHBondContact O-CG1 3.34Å; A134-G138 PolarHBondContact O-N 3.43Å
135	V	58.1	Low	57.9	Low	59 Å²	59	95 Å²	95	36%	0.358	51%	0.512	S	S	.	.	H	α-helix	trans	-76.7	-40.2	176.5	172.8	0	0	0	0	110.7	V131 V132 E133 G138 Q139	V131-V135 HydrophobicContact CG1-CG2 4.14Å; V131-V135 WeakPolarHBondContact O-CB 3.42Å; V131-V135 WeakPolarHBondContact O-CG2 3.42Å; V131-V135 PolarHBondContact O-N 2.79Å; V132-V135 PolarHBondContact O-N 3.24Å; E133-V135 VanDerWaalsContact C-N 3.35Å; E133-V135 PolarHBondContact O-N 3.38Å; V135-G138 PolarHBondContact O-N 3.04Å; V135-Q139 VanDerWaalsContact CG1-OE1 3.25Å; V135-Q139 PolarHBondContact O-N 2.97Å
136	C	53.6	Low	57.3	Low	49 Å²	49	97 Å²	97	33%	0.331	52%	0.523	S	S	.	.	H	α-helix	trans	-65.6	-40.4	176.1	-77.7	0	0	0	0	112	V132 E133 G138 Q139 A140	V132-C136 WeakPolarHBondContact O-CB 3.45Å; V132-C136 PolarHBondContact O-N 3.41Å; V132-C136 PolarHBondContact O-SG 3.42Å; E133-C136 PolarHBondContact O-N 2.79Å; C136-G138 VanDerWaalsContact C-N 3.32Å; C136-G138 PolarHBondContact O-N 2.81Å; C136-Q139 PolarHBondContact O-N 2.89Å; C136-A140 VanDerWaalsContact O-CB 3.29Å; C136-A140 WeakPolarHBondContact O-CB 3.48Å; C136-A140 PolarHBondContact O-N 3.47Å
137	V	55.8	Low	56.6	Low	99 Å²	99	98 Å²	98	60%	0.6	53%	0.527	S	S	*	.	H	α-helix	trans	-66.9	-36.2	177.3	85.4	0	0	0	0	111.2	E133 A134 T141	E133-V137 WeakPolarHBondContact O-CB 3.47Å; E133-V137 PolarHBondContact O-N 3.49Å; A134-V137 WeakPolarHBondContact O-CG1 3.34Å; V137-T141 PolarHBondContact O-OG1 2.82Å
138	G	53.4	Low	56.1	Low	43 Å²	43	98.5 Å²	98.5	44%	0.443	53%	0.53	S	S	.	.	H	α-helix	trans	-69.3	-28.3	173.6	0	0	0	0	0	114.1	A134 V135 C136 T141	A134-G138 PolarHBondContact O-N 3.43Å; V135-G138 PolarHBondContact O-N 3.04Å; C136-G138 VanDerWaalsContact C-N 3.32Å; C136-G138 PolarHBondContact O-N 2.81Å; G138-T141 PolarHBondContact O-OG1 3.49Å
139	Q	51.3	Low	55.5	Low	61 Å²	61	98.9 Å²	98.9	29%	0.285	53%	0.533	S	S	.	.	H	α-helix	trans	-88.9	-29.9	176	-94.4	139.6	-113.4	0	0	113.9	V135 C136 T141 R142 C149	V135-Q139 VanDerWaalsContact CG1-OE1 3.25Å; V135-Q139 PolarHBondContact O-N 2.97Å; C136-Q139 PolarHBondContact O-N 2.89Å; Q139-T141 PolarHBondContact O-N 3.34Å; Q139-R142 PolarHBondContact O-N 3.32Å; Q139-C149 PolarHBondContact NE2-SG 3.24Å
140	A	49.2	Very low	54.6	Low	86 Å²	86	106.3 Å²	106.3	71%	0.711	56%	0.555	S	S	*	*	H	α-helix	trans	-61.9	-29.8	175.1	0	0	0	0	0	112	C136 R142	C136-A140 VanDerWaalsContact O-CB 3.29Å; C136-A140 WeakPolarHBondContact O-CB 3.48Å; C136-A140 PolarHBondContact O-N 3.47Å; A140-R142 VanDerWaalsContact C-N 3.31Å; A140-R142 PolarHBondContact O-N 2.91Å
141	T	52	Low	54.1	Low	124 Å²	124	105.3 Å²	105.3	76%	0.761	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.8	174.9	12.5	0	0	0	0	114.2	V137 G138 Q139	V137-T141 PolarHBondContact O-OG1 2.82Å; G138-T141 PolarHBondContact O-OG1 3.49Å; Q139-T141 PolarHBondContact O-N 3.34Å
142	R	50.8	Low	53.8	Low	220 Å²	220	103.9 Å²	103.9	83%	0.83	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	3	-167.5	-149.6	167.6	-178.3	143.7	1.2	117	Q139 A140	Q139-R142 PolarHBondContact O-N 3.32Å; A140-R142 VanDerWaalsContact C-N 3.31Å; A140-R142 PolarHBondContact O-N 2.91Å
143	G	48.6	Very low	53.7	Low	59 Å²	59	104.9 Å²	104.9	61%	0.608	55%	0.549	S	S	*	.			trans	71.5	125	159.4	0	0	0	0	0	116.8
144	R	52.2	Low	53.5	Low	230 Å²	230	100.9 Å²	100.9	87%	0.868	54%	0.54	S	S	*	.	S	Bend	trans	72.2	120.9	159.4	-128	101.8	171.5	-159.6	-2.3	117.2
145	Y	50.4	Low	53.4	Low	213 Å²	213	104.7 Å²	104.7	84%	0.835	55%	0.546	S	S	*	.			trans	72.5	81.7	166.6	-84.4	-89.2	0	0	0	117.8
146	N	51.8	Low	53.4	Low	82 Å²	82	103.2 Å²	103.2	44%	0.439	53%	0.534	S	S	.	.			trans	-136	80.5	164.6	-70.2	-49.5	0	0	0	112.2	N148 C149	N146-N148 PolarHBondContact O-N 2.95Å; N146-C149 HydrophobicContact CB-CB 3.99Å; N146-C149 WeakPolarHBondContact CB-SG 3.44Å; N146-C149 PolarHBondContact O-N 2.82Å
147	Y	50.5	Low	53.5	Low	194 Å²	194	103.2 Å²	103.2	76%	0.761	54%	0.538	S	S	*	.	H	α-helix	trans	-60	-30.9	166.1	-174.9	-100.9	0	0	0	111.5	C149 W150 A151	Y147-C149 VanDerWaalsContact C-N 3.34Å; Y147-C149 PolarHBondContact O-N 3.49Å; Y147-W150 PolarHBondContact O-N 2.82Å; Y147-A151 PolarHBondContact O-N 3.4Å
148	N	52.7	Low	53.6	Low	120 Å²	120	104.8 Å²	104.8	64%	0.642	54%	0.537	S	S	*	.	H	α-helix	trans	-68.5	-26.5	179.1	-60.1	-26.3	0	0	0	113.8	N146 W150 A152	N146-N148 PolarHBondContact O-N 2.95Å; N148-W150 VanDerWaalsContact C-N 3.31Å; N148-A152 VanDerWaalsContact O-CB 3.26Å; N148-A152 WeakPolarHBondContact O-CB 3.3Å; N148-A152 PolarHBondContact O-N 3.17Å
149	C	53.3	Low	54	Low	34 Å²	34	106.2 Å²	106.2	23%	0.23	53%	0.534	C	S	.	.	H	α-helix	trans	-66.2	-37.3	175.8	-75.7	0	0	0	0	111.6	Q139 N146 Y147 S153	Q139-C149 PolarHBondContact NE2-SG 3.24Å; N146-C149 HydrophobicContact CB-CB 3.99Å; N146-C149 WeakPolarHBondContact CB-SG 3.44Å; N146-C149 PolarHBondContact O-N 2.82Å; Y147-C149 VanDerWaalsContact C-N 3.34Å; Y147-C149 PolarHBondContact O-N 3.49Å; C149-S153 PolarHBondContact O-N 3.31Å; C149-S153 VanDerWaalsContact O-N 3.12Å
150	W	50.6	Low	54.1	Low	216 Å²	216	104.9 Å²	104.9	82%	0.818	53%	0.534	S	S	*	.	H	α-helix	trans	-75	-41.2	179.2	-136.3	53.8	0	0	0	111.2	Y147 N148 S153 A154	Y147-W150 PolarHBondContact O-N 2.82Å; N148-W150 VanDerWaalsContact C-N 3.31Å; W150-S153 PolarHBondContact O-N 3.3Å; W150-A154 PolarHBondContact O-N 3.32Å
151	A	55.1	Low	54.5	Low	33 Å²	33	105 Å²	105	27%	0.273	53%	0.525	S	S	.	.	H	α-helix	trans	-60	-47.2	172.5	0	0	0	0	0	111.5	Y147 S153 A154 F155	Y147-A151 PolarHBondContact O-N 3.4Å; A151-S153 VanDerWaalsContact C-N 3.31Å; A151-S153 PolarHBondContact O-N 2.9Å; A151-A154 PolarHBondContact O-N 2.88Å; A151-F155 HydrophobicContact CB-CD2 4.42Å; A151-F155 HydrophobicContact CB-CE2 4.32Å; A151-F155 WeakPolarHBondContact O-CD2 3.09Å; A151-F155 PolarHBondContact O-N 3.43Å
152	A	57.2	Low	54.7	Low	18 Å²	18	104 Å²	104	15%	0.149	52%	0.515	C	S	.	.	H	α-helix	trans	-59.8	-39.9	177.7	0	0	0	0	0	112.6	W79 N148 F155 F156	W79-A152 HydrophobicContact CZ2-CB 3.94Å; N148-A152 VanDerWaalsContact O-CB 3.26Å; N148-A152 WeakPolarHBondContact O-CB 3.3Å; N148-A152 PolarHBondContact O-N 3.17Å; A152-F155 PolarHBondContact O-N 3.01Å; A152-F156 WeakPolarHBondContact O-CB 3.32Å; A152-F156 PolarHBondContact O-N 3.35Å
153	S	58.8	Low	55	Low	57 Å²	57	95.2 Å²	95.2	40%	0.399	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-43.1	175.1	179.4	0	0	0	0	112.2	C149 W150 A151 F156 A157	C149-S153 PolarHBondContact O-N 3.31Å; C149-S153 VanDerWaalsContact O-N 3.12Å; W150-S153 PolarHBondContact O-N 3.3Å; A151-S153 VanDerWaalsContact C-N 3.31Å; A151-S153 PolarHBondContact O-N 2.9Å; S153-F156 PolarHBondContact O-N 3.11Å; S153-A157 WeakPolarHBondContact O-CB 3.19Å; S153-A157 PolarHBondContact O-N 2.88Å
154	A	56.9	Low	55	Low	61 Å²	61	101.4 Å²	101.4	50%	0.504	49%	0.493	S	S	.	.	H	α-helix	trans	-66.4	-40.9	177.4	0	0	0	0	0	112.6	W150 A151 F156 A157 F158	W150-A154 PolarHBondContact O-N 3.32Å; A151-A154 PolarHBondContact O-N 2.88Å; A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 3.33Å; A154-A157 PolarHBondContact O-N 3.26Å; A154-F158 WeakPolarHBondContact O-CB 3.26Å; A154-F158 PolarHBondContact O-N 3.4Å
155	F	59	Low	55.2	Low	140 Å²	140	93.2 Å²	93.2	61%	0.614	48%	0.475	S	S	*	.	H	α-helix	trans	-63.4	-39.6	174.6	-79.7	-66.4	0	0	0	111.8	A151 A152 F158 L159	A151-F155 HydrophobicContact CB-CD2 4.42Å; A151-F155 HydrophobicContact CB-CE2 4.32Å; A151-F155 WeakPolarHBondContact O-CD2 3.09Å; A151-F155 PolarHBondContact O-N 3.43Å; A152-F155 PolarHBondContact O-N 3.01Å; F155-F158 WeakPolarHBondContact O-CB 3.37Å; F155-F158 PolarHBondContact O-N 2.91Å; F155-L159 WeakPolarHBondContact O-CD1 3.19Å; F155-L159 PolarHBondContact O-N 3.03Å
156	F	58.4	Low	55.5	Low	28 Å²	28	84.6 Å²	84.6	12%	0.123	45%	0.45	C	S	.	.	H	α-helix	trans	-66.7	-42.3	175.4	177.9	-114.8	0	0	0	112.3	L125 V128 T129 A152 S153 A154 F158 L159 A160	L125-F156 HydrophobicContact CD2-CE2 3.82Å; L125-F156 HydrophobicContact CD2-CZ 4.4Å; L125-F156 VanDerWaalsContact O-CZ 3.22Å; L125-F156 WeakPolarHBondContact O-CZ 3.46Å; V128-F156 HydrophobicContact CB-CD2 3.75Å; V128-F156 HydrophobicContact CB-CE2 3.3Å; V128-F156 HydrophobicContact CB-CZ 3.9Å; V128-F156 HydrophobicContact CG1-CD2 3.22Å; V128-F156 HydrophobicContact CG1-CE2 3.37Å; V128-F156 HydrophobicContact CG1-CG 3.96Å; V128-F156 HydrophobicContact CG1-CZ 4.17Å; V128-F156 HydrophobicContact CG2-CE2 4.07Å; T129-F156 HydrophobicContact CG2-CE1 4.35Å; T129-F156 WeakPolarHBondContact OG1-CE1 3.36Å; T129-F156 WeakPolarHBondContact OG1-CZ 3.47Å; A152-F156 WeakPolarHBondContact O-CB 3.32Å; A152-F156 PolarHBondContact O-N 3.35Å; S153-F156 PolarHBondContact O-N 3.11Å; A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 3.33Å; F156-F158 VanDerWaalsContact C-N 3.28Å; F156-F158 PolarHBondContact O-N 3.1Å; F156-L159 PolarHBondContact O-N 3.37Å; F156-A160 WeakPolarHBondContact O-CB 3.36Å; F156-A160 PolarHBondContact O-N 3.35Å
157	A	56.3	Low	55.5	Low	49 Å²	49	82.5 Å²	82.5	41%	0.405	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-35.3	173.7	0	0	0	0	0	112.1	S153 A154 A160 T161	S153-A157 WeakPolarHBondContact O-CB 3.19Å; S153-A157 PolarHBondContact O-N 2.88Å; A154-A157 PolarHBondContact O-N 3.26Å; A157-A160 PolarHBondContact O-N 2.9Å; A157-T161 WeakPolarHBondContact O-CB 3.22Å; A157-T161 PolarHBondContact O-N 2.92Å; A157-T161 PolarHBondContact O-OG1 3.44Å
158	F	58.1	Low	55.6	Low	133 Å²	133	75.2 Å²	75.2	58%	0.583	43%	0.426	S	S	*	.	H	α-helix	trans	-65.7	-43.6	175.7	-171.8	-100.6	0	0	0	112	A154 F155 F156 T161 L162	A154-F158 WeakPolarHBondContact O-CB 3.26Å; A154-F158 PolarHBondContact O-N 3.4Å; F155-F158 WeakPolarHBondContact O-CB 3.37Å; F155-F158 PolarHBondContact O-N 2.91Å; F156-F158 VanDerWaalsContact C-N 3.28Å; F156-F158 PolarHBondContact O-N 3.1Å; F158-T161 WeakPolarHBondContact O-CB 3.06Å; F158-T161 PolarHBondContact O-N 3.37Å; F158-L162 HydrophobicContact CD1-CD1 3.84Å; F158-L162 HydrophobicContact CE1-CD1 3.36Å; F158-L162 HydrophobicContact CZ-CD1 3.9Å; F158-L162 PolarHBondContact O-N 2.81Å
159	L	61.3	Low	55.7	Low	73 Å²	73	76 Å²	76	38%	0.382	42%	0.421	S	S	.	.	H	α-helix	trans	-64.8	-41.3	174.4	-76.3	154.7	0	0	0	112	L87 F155 F156 T161 L162 C163	L87-L159 HydrophobicContact CD2-CD2 4.4Å; F155-L159 WeakPolarHBondContact O-CD1 3.19Å; F155-L159 PolarHBondContact O-N 3.03Å; F156-L159 PolarHBondContact O-N 3.37Å; L159-T161 VanDerWaalsContact C-N 3.3Å; L159-T161 PolarHBondContact O-N 2.95Å; L159-L162 PolarHBondContact O-N 3.3Å; L159-C163 PolarHBondContact O-N 3.49Å
160	A	53.2	Low	55.9	Low	33 Å²	33	78.4 Å²	78.4	27%	0.273	43%	0.431	S	S	.	.	H	α-helix	trans	-62.2	-38.4	173.2	0	0	0	0	0	111.8	L125 F156 A157 C163 Y164	L125-A160 HydrophobicContact CD2-CB 4.37Å; F156-A160 WeakPolarHBondContact O-CB 3.36Å; F156-A160 PolarHBondContact O-N 3.35Å; A157-A160 PolarHBondContact O-N 2.9Å; A160-C163 WeakPolarHBondContact O-CB 3.11Å; A160-C163 PolarHBondContact O-N 3.29Å; A160-Y164 PolarHBondContact O-N 3.37Å
161	T	57	Low	55.9	Low	87 Å²	87	71.8 Å²	71.8	53%	0.534	42%	0.418	S	S	.	.	H	α-helix	trans	-68.6	-41.2	177.5	-57.8	0	0	0	0	111.8	A157 F158 L159 C163 Y164 A165	A157-T161 WeakPolarHBondContact O-CB 3.22Å; A157-T161 PolarHBondContact O-N 2.92Å; A157-T161 PolarHBondContact O-OG1 3.44Å; F158-T161 WeakPolarHBondContact O-CB 3.06Å; F158-T161 PolarHBondContact O-N 3.37Å; L159-T161 VanDerWaalsContact C-N 3.3Å; L159-T161 PolarHBondContact O-N 2.95Å; T161-C163 VanDerWaalsContact C-N 3.27Å; T161-C163 PolarHBondContact O-N 3.42Å; T161-Y164 PolarHBondContact O-N 3.12Å; T161-A165 VanDerWaalsContact O-CB 3.28Å; T161-A165 WeakPolarHBondContact O-CB 3.06Å; T161-A165 PolarHBondContact O-N 3.06Å
162	L	57.2	Low	55.9	Low	105 Å²	105	76 Å²	76	55%	0.55	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-35.6	174.1	-109.1	144.7	0	0	0	111.9	F158 L159 G166	F158-L162 HydrophobicContact CD1-CD1 3.84Å; F158-L162 HydrophobicContact CE1-CD1 3.36Å; F158-L162 HydrophobicContact CZ-CD1 3.9Å; F158-L162 PolarHBondContact O-N 2.81Å; L159-L162 PolarHBondContact O-N 3.3Å; L162-G166 PolarHBondContact O-N 2.79Å
163	C	56	Low	55.7	Low	34 Å²	34	81.3 Å²	81.3	23%	0.23	44%	0.444	C	S	.	.	H	α-helix	trans	-68.3	-42.9	173.1	-174	0	0	0	0	112.4	L125 L159 A160 T161 G166 S167	L125-C163 HydrophobicContact CD1-CB 3.69Å; L159-C163 PolarHBondContact O-N 3.49Å; A160-C163 WeakPolarHBondContact O-CB 3.11Å; A160-C163 PolarHBondContact O-N 3.29Å; T161-C163 VanDerWaalsContact C-N 3.27Å; T161-C163 PolarHBondContact O-N 3.42Å; C163-G166 PolarHBondContact O-N 2.81Å; C163-S167 PolarHBondContact O-N 2.84Å
164	Y	49.5	Very low	55.4	Low	189 Å²	189	82.1 Å²	82.1	74%	0.741	44%	0.443	S	S	*	.	H	α-helix	trans	-67.2	-39.1	177.8	-153.8	-93.9	0	0	0	111.7	A160 T161 G166 S167 G168	A160-Y164 PolarHBondContact O-N 3.37Å; T161-Y164 PolarHBondContact O-N 3.12Å; Y164-G166 VanDerWaalsContact C-N 3.32Å; Y164-S167 PolarHBondContact O-N 3.35Å; Y164-G168 PolarHBondContact O-N 3.38Å
165	A	55.4	Low	55.1	Low	59 Å²	59	86.3 Å²	86.3	49%	0.488	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-37.4	171.6	0	0	0	0	0	111.7	T161 G168 Y169	T161-A165 VanDerWaalsContact O-CB 3.28Å; T161-A165 WeakPolarHBondContact O-CB 3.06Å; T161-A165 PolarHBondContact O-N 3.06Å; A165-G168 PolarHBondContact O-N 3.42Å; A165-Y169 WeakPolarHBondContact O-CB 3.3Å; A165-Y169 PolarHBondContact O-N 3.25Å
166	G	57.9	Low	54.8	Low	31 Å²	31	83.8 Å²	83.8	32%	0.32	44%	0.435	S	S	.	.	H	α-helix	trans	-59.8	-47.9	171.2	0	0	0	0	0	112.3	L162 C163 Y164 Y169 L170	L162-G166 PolarHBondContact O-N 2.79Å; C163-G166 PolarHBondContact O-N 2.81Å; Y164-G166 VanDerWaalsContact C-N 3.32Å; G166-Y169 PolarHBondContact O-N 3.37Å; G166-L170 WeakPolarHBondContact O-CB 3.44Å; G166-L170 WeakPolarHBondContact O-CD1 3.14Å; G166-L170 WeakPolarHBondContact O-CG 3.34Å; G166-L170 PolarHBondContact O-N 3.24Å
167	S	51.8	Low	54.5	Low	38 Å²	38	86.6 Å²	86.6	27%	0.266	45%	0.454	S	S	.	.	H	α-helix	trans	-60.7	-45.4	175.5	-173.1	0	0	0	0	112.3	C163 Y164 Y169 L170 S171	C163-S167 PolarHBondContact O-N 2.84Å; Y164-S167 PolarHBondContact O-N 3.35Å; S167-Y169 PolarHBondContact O-N 2.8Å; S167-L170 PolarHBondContact O-N 3.47Å; S167-S171 PolarHBondContact O-N 2.84Å
168	G	52.9	Low	54.4	Low	41 Å²	41	88.5 Å²	88.5	42%	0.423	46%	0.461	S	S	.	.	H	α-helix	trans	-64.7	-39.4	176.3	0	0	0	0	0	113.3	Y164 A165 L170 S171 Y172	Y164-G168 PolarHBondContact O-N 3.38Å; A165-G168 PolarHBondContact O-N 3.42Å; G168-L170 VanDerWaalsContact C-N 3.3Å; G168-L170 PolarHBondContact O-N 3.12Å; G168-S171 PolarHBondContact O-N 3.11Å; G168-Y172 VanDerWaalsContact O-CB 3.26Å; G168-Y172 WeakPolarHBondContact O-CB 3.2Å; G168-Y172 PolarHBondContact O-N 2.89Å
169	Y	53.7	Low	54.3	Low	136 Å²	136	88.2 Å²	88.2	53%	0.533	46%	0.462	S	S	.	.	H	α-helix	trans	-64.6	-37.2	175.3	-172	-97.7	0	0	0	111.2	A165 G166 S167 Y172 R173	A165-Y169 WeakPolarHBondContact O-CB 3.3Å; A165-Y169 PolarHBondContact O-N 3.25Å; G166-Y169 PolarHBondContact O-N 3.37Å; S167-Y169 PolarHBondContact O-N 2.8Å; Y169-Y172 PolarHBondContact O-N 3.28Å; Y169-R173 HydrophobicContact CD1-CG 4.05Å; Y169-R173 HydrophobicContact CE1-CG 3.78Å; Y169-R173 WeakPolarHBondContact O-CB 3.31Å; Y169-R173 WeakPolarHBondContact O-CG 3.42Å; Y169-R173 PolarHBondContact O-N 2.91Å
170	L	58.1	Low	53.8	Low	86 Å²	86	92.7 Å²	92.7	45%	0.45	48%	0.48	S	S	.	.	H	α-helix	trans	-71.5	-42.7	176.9	-69.6	164	0	0	0	112.3	L114 G166 S167 G168 Y172 R173 L174	L114-L170 HydrophobicContact CD1-CD1 3.95Å; G166-L170 WeakPolarHBondContact O-CB 3.44Å; G166-L170 WeakPolarHBondContact O-CD1 3.14Å; G166-L170 WeakPolarHBondContact O-CG 3.34Å; G166-L170 PolarHBondContact O-N 3.24Å; S167-L170 PolarHBondContact O-N 3.47Å; G168-L170 VanDerWaalsContact C-N 3.3Å; G168-L170 PolarHBondContact O-N 3.12Å; L170-Y172 VanDerWaalsContact C-N 3.29Å; L170-Y172 PolarHBondContact O-N 3.33Å; L170-R173 PolarHBondContact O-N 2.88Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 PolarHBondContact O-N 3.41Å
171	S	51	Low	53.6	Low	77 Å²	77	99.6 Å²	99.6	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-37.1	171	-82.1	0	0	0	0	112.4	S167 G168 L174 W175	S167-S171 PolarHBondContact O-N 2.84Å; G168-S171 PolarHBondContact O-N 3.11Å; S171-L174 WeakPolarHBondContact O-CB 3.33Å; S171-L174 PolarHBondContact O-N 3.42Å; S171-W175 WeakPolarHBondContact O-CB 3.47Å; S171-W175 PolarHBondContact O-N 3.2Å
172	Y	53.4	Low	52.5	Low	121 Å²	121	106.4 Å²	106.4	48%	0.475	53%	0.532	S	S	.	.	H	α-helix	trans	-67.8	-39	175.2	-178.7	-102.2	0	0	0	112.2	G168 Y169 L170 W175 K176	G168-Y172 VanDerWaalsContact O-CB 3.26Å; G168-Y172 WeakPolarHBondContact O-CB 3.2Å; G168-Y172 PolarHBondContact O-N 2.89Å; Y169-Y172 PolarHBondContact O-N 3.28Å; L170-Y172 VanDerWaalsContact C-N 3.29Å; L170-Y172 PolarHBondContact O-N 3.33Å; Y172-W175 HydrophobicContact CD2-CE3 4.08Å; Y172-W175 HydrophobicContact CD2-CZ3 4.42Å; Y172-W175 HydrophobicContact CE2-CE3 4.16Å; Y172-W175 HydrophobicContact CE2-CZ3 4.15Å; Y172-W175 PolarHBondContact O-N 2.85Å; Y172-K176 PolarHBondContact O-N 3.48Å; Y172-K176 VanDerWaalsContact O-N 3.1Å
173	R	53.7	Low	52.3	Low	130 Å²	130	106.5 Å²	106.5	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-67.5	-37	173.6	-69.3	-70.5	-70.3	-139.6	4.3	111.7	Y169 L170 K176 T177	Y169-R173 HydrophobicContact CD1-CG 4.05Å; Y169-R173 HydrophobicContact CE1-CG 3.78Å; Y169-R173 WeakPolarHBondContact O-CB 3.31Å; Y169-R173 WeakPolarHBondContact O-CG 3.42Å; Y169-R173 PolarHBondContact O-N 2.91Å; L170-R173 PolarHBondContact O-N 2.88Å; R173-K176 PolarHBondContact O-N 2.99Å; R173-T177 WeakPolarHBondContact O-CG2 3.29Å; R173-T177 PolarHBondContact O-N 3.49Å; R173-T177 VanDerWaalsContact O-N 3.09Å; R173-T177 PolarHBondContact O-OG1 3.05Å
174	L	53.2	Low	52.1	Low	73 Å²	73	110.3 Å²	110.3	38%	0.382	55%	0.547	S	S	.	.	H	α-helix	trans	-62.1	-46.2	174.7	-163.4	81.9	0	0	0	111.6	W111 L170 S171 K176 T177 T178	W111-L174 HydrophobicContact CH2-CD1 3.57Å; W111-L174 HydrophobicContact CH2-CD2 4.02Å; W111-L174 HydrophobicContact CH2-CG 4.27Å; W111-L174 HydrophobicContact CZ3-CD1 3.78Å; W111-L174 HydrophobicContact CZ3-CD2 4Å; L170-L174 WeakPolarHBondContact O-CB 3.47Å; L170-L174 PolarHBondContact O-N 3.41Å; S171-L174 WeakPolarHBondContact O-CB 3.33Å; S171-L174 PolarHBondContact O-N 3.42Å; L174-K176 PolarHBondContact O-N 3.38Å; L174-T177 WeakPolarHBondContact CA-OG1 3.37Å; L174-T177 PolarHBondContact O-N 3.44Å; L174-T177 PolarHBondContact O-OG1 3.3Å; L174-T178 PolarHBondContact O-N 3.42Å; L174-T178 VanDerWaalsContact O-N 3.17Å; L174-T178 PolarHBondContact O-OG1 2.87Å
175	W	49	Very low	52.3	Low	150 Å²	150	105.9 Å²	105.9	57%	0.568	54%	0.536	S	S	*	.	H	α-helix	trans	-62.8	-42.6	178	179.2	36	0	0	0	111.8	S171 Y172 T177 T178 E179	S171-W175 WeakPolarHBondContact O-CB 3.47Å; S171-W175 PolarHBondContact O-N 3.2Å; Y172-W175 HydrophobicContact CD2-CE3 4.08Å; Y172-W175 HydrophobicContact CD2-CZ3 4.42Å; Y172-W175 HydrophobicContact CE2-CE3 4.16Å; Y172-W175 HydrophobicContact CE2-CZ3 4.15Å; Y172-W175 PolarHBondContact O-N 2.85Å; W175-T177 VanDerWaalsContact C-N 3.32Å; W175-T177 PolarHBondContact O-N 3.46Å; W175-T178 PolarHBondContact O-N 2.79Å; W175-T178 VanDerWaalsContact O-N 3.17Å; W175-E179 PolarHBondContact O-N 3.24Å
176	K	53.2	Low	52.1	Low	87 Å²	87	108.6 Å²	108.6	38%	0.378	54%	0.539	S	S	.	.	H	α-helix	trans	-63.9	-35.9	176.9	-160.1	-169.9	-62.5	-167.1	0	112.7	Y172 R173 L174 T178 E179 E180	Y172-K176 PolarHBondContact O-N 3.48Å; Y172-K176 VanDerWaalsContact O-N 3.1Å; R173-K176 PolarHBondContact O-N 2.99Å; L174-K176 PolarHBondContact O-N 3.38Å; K176-T178 VanDerWaalsContact C-N 3.32Å; K176-E179 PolarHBondContact O-N 3.37Å; K176-E180 PolarHBondContact O-N 3.29Å
177	T	52.5	Low	51.7	Low	86 Å²	86	113.5 Å²	113.5	53%	0.528	55%	0.553	S	S	.	*	H	α-helix	trans	-70.6	-27.7	176.2	47.6	0	0	0	0	113.2	R173 L174 W175 E180	R173-T177 WeakPolarHBondContact O-CG2 3.29Å; R173-T177 PolarHBondContact O-N 3.49Å; R173-T177 VanDerWaalsContact O-N 3.09Å; R173-T177 PolarHBondContact O-OG1 3.05Å; L174-T177 WeakPolarHBondContact CA-OG1 3.37Å; L174-T177 PolarHBondContact O-N 3.44Å; L174-T177 PolarHBondContact O-OG1 3.3Å; W175-T177 VanDerWaalsContact C-N 3.32Å; W175-T177 PolarHBondContact O-N 3.46Å; T177-E180 PolarHBondContact O-N 2.91Å
178	T	54.5	Low	51.7	Low	90 Å²	90	118.5 Å²	118.5	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-72.5	-30.7	174.1	-53.2	0	0	0	0	112.1	L174 W175 K176 E180 E181	L174-T178 PolarHBondContact O-N 3.42Å; L174-T178 VanDerWaalsContact O-N 3.17Å; L174-T178 PolarHBondContact O-OG1 2.87Å; W175-T178 PolarHBondContact O-N 2.79Å; W175-T178 VanDerWaalsContact O-N 3.17Å; K176-T178 VanDerWaalsContact C-N 3.32Å; T178-E180 VanDerWaalsContact C-N 3.33Å; T178-E181 PolarHBondContact O-N 2.81Å
179	E	56.4	Low	51.6	Low	127 Å²	127	124.1 Å²	124.1	59%	0.593	58%	0.583	S	S	*	*	H	α-helix	trans	-72.3	-23.8	174.4	-68.8	-157	124.7	0	0	113.4	W175 K176 E181	W175-E179 PolarHBondContact O-N 3.24Å; K176-E179 PolarHBondContact O-N 3.37Å; E179-E181 VanDerWaalsContact C-N 3.33Å
180	E	50.4	Low	51.5	Low	166 Å²	166	123.2 Å²	123.2	78%	0.776	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-3	177.4	-65.7	-160.6	175.4	0	0	113.9	K176 T177 T178	K176-E180 PolarHBondContact O-N 3.29Å; T177-E180 PolarHBondContact O-N 2.91Å; T178-E180 VanDerWaalsContact C-N 3.33Å
181	E	48.3	Very low	50.9	Low	178 Å²	178	126.3 Å²	126.3	83%	0.832	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	7.7	175.9	-141.7	-171.1	145.6	0	0	113.2	T178 E179	T178-E181 PolarHBondContact O-N 2.81Å; E179-E181 VanDerWaalsContact C-N 3.33Å
182	H	35.3	Very low	50.9	Low	230 Å²	230	130.7 Å²	130.7	100%	1.065	60%	0.604	S	S	*	*			trans	-122	0	-174.5	-147.8	-60.1	0	0	0	114.8

Retrieved 182 of 182 residues in 442.4 ms (Link to these results)

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