A0A096N7H0_PAPAN Loading...

DCN1-like protein

Contributes to the neddylation of all cullins by transferring NEDD8 from N-terminally acetylated NEDD8-conjugating E2s enzyme to different cullin C-terminal domain-RBX complexes which is necessary for the activation of cullin-RING E3 ubiquitin ligases (CRLs). May play a role in DNA damage response and may participate in cell proliferation and anchorage-independent cell growth.

AlphaFold DB (Q9BTE7), UniProt , Accession A0A096N7H0, Species PAPAN (Papio anubis, Olive baboon), Gene DCUN1D5, Length 237 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	40.9	Very low	47.3	Very low	240 Å²	240	165.3 Å²	165.3	100%	1.182	85%	0.851	S	S	*	*				0	149.9	0	-67.8	-165.6	155.7	0	0	108.5
2	P	53.4	Low	47.1	Very low	121 Å²	121	162.9 Å²	162.9	79%	0.786	85%	0.85	S	S	*	*			cis	-113.3	139.9	-36.2	25.5	-5.7	0	0	0	111.4
3	V	45.3	Very low	46.9	Very low	116 Å²	116	157.5 Å²	157.5	70%	0.703	84%	0.843	S	S	*	*				91.8	111.2	69.6	170.5	0	0	0	0	115.6
4	K	46.5	Very low	46.5	Very low	183 Å²	183	153.1 Å²	153.1	80%	0.796	84%	0.84	S	S	*	*			trans	66.1	135.5	140.5	-64	172.3	-172.3	176	0	121.2
5	K	55.5	Low	46.2	Very low	208 Å²	208	149.2 Å²	149.2	90%	0.904	84%	0.836	S	S	*	*				-176.1	137.4	86.3	-95.3	176.8	-179.7	167.5	0	113.2
6	K	42.2	Very low	46	Very low	199 Å²	199	148.8 Å²	148.8	87%	0.865	84%	0.838	S	S	*	*			trans	-102.8	145	170.3	-169.7	177.8	-172.9	174.2	0	107.7
7	R	52	Low	45.5	Very low	242 Å²	242	144.6 Å²	144.6	91%	0.913	83%	0.826	S	S	*	*			trans	-149.3	133.7	159.5	-135.3	176	-176.8	176.4	-0.3	110.9
8	K	40.9	Very low	45.3	Very low	193 Å²	193	146.7 Å²	146.7	84%	0.839	83%	0.827	S	S	*	*			trans	-128.5	143.2	178.2	-158	-177.3	-170.7	-174	0	105.2
9	S	52.9	Low	45.1	Very low	109 Å²	109	147 Å²	147	76%	0.762	83%	0.827	S	S	*	*			trans	-144.1	131	172	-49.6	0	0	0	0	109.6
10	P	46.5	Very low	44.6	Very low	136 Å²	136	143 Å²	143	88%	0.883	82%	0.82	S	S	*	*			trans	-118	173	174.5	39.6	-27.5	0	0	0	113.7
11	G	44.6	Very low	44.2	Very low	71 Å²	71	139.8 Å²	139.8	73%	0.732	82%	0.818	S	S	*	*			trans	143.7	139.1	170.3	0	0	0	0	0	109.9
12	V	45	Very low	44	Very low	137 Å²	137	136.1 Å²	136.1	83%	0.83	80%	0.803	S	S	*	*			cis	-164.1	123.4	30.9	175.6	0	0	0	0	106.2
13	A	43.8	Very low	43.6	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	81%	0.808	S	S	*	*				44.7	144.3	103.8	0	0	0	0	0	116
14	A	41.9	Very low	43.1	Very low	96 Å²	96	144.3 Å²	144.3	79%	0.793	82%	0.816	S	S	*	*			cis	-175.6	174.7	-5.9	0	0	0	0	0	107.8
15	A	42.2	Very low	42.7	Very low	94 Å²	94	141.6 Å²	141.6	78%	0.777	82%	0.819	S	S	*	*			trans	90.4	149.2	155.3	0	0	0	0	0	121
16	V	42.6	Very low	41.7	Very low	143 Å²	143	141.4 Å²	141.4	87%	0.867	82%	0.818	S	S	*	*			cis	-162.1	153	-36.2	170.3	0	0	0	0	103.8
17	A	37.9	Very low	42	Very low	78 Å²	78	139.8 Å²	139.8	65%	0.645	82%	0.817	S	S	*	*			trans	-69.2	162.6	-176.6	0	0	0	0	0	116.7
18	E	40.6	Very low	41.7	Very low	181 Å²	181	133 Å²	133	85%	0.846	81%	0.806	S	S	*	*				164.5	135.7	111.8	-85.3	-79.1	105.2	0	0	113.2
19	D	41.6	Very low	41.4	Very low	153 Å²	153	128 Å²	128	82%	0.818	80%	0.796	S	S	*	*			trans	59.4	128.1	142.1	-151.6	44.8	0	0	0	126
20	G	36.2	Very low	40.9	Very low	66 Å²	66	133.9 Å²	133.9	68%	0.68	80%	0.803	S	S	*	*				85.9	117	118.7	0	0	0	0	0	121.4
21	G	36.4	Very low	40.4	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	80%	0.802	S	S	*	*			trans	133.4	106.2	143.3	0	0	0	0	0	118.8
22	L	36.4	Very low	40.2	Very low	163 Å²	163	141.2 Å²	141.2	85%	0.853	81%	0.809	S	S	*	*			trans	-41.7	140	174.8	-65.6	81.6	0	0	0	116.7
23	K	44.5	Very low	40.1	Very low	207 Å²	207	140 Å²	140	90%	0.9	81%	0.807	S	S	*	*			trans	-145.8	122.4	135.5	-70.2	-164.6	179.3	170.2	0	112.7
24	K	35.5	Very low	40.2	Very low	202 Å²	202	144.1 Å²	144.1	88%	0.878	81%	0.81	S	S	*	*			trans	-59	133.2	168.5	-82.7	169.8	168.7	168.5	0	111
25	C	37.7	Very low	40.7	Very low	125 Å²	125	144.9 Å²	144.9	85%	0.845	81%	0.807	S	S	*	*			trans	-120.9	117.1	155.8	-90.9	0	0	0	0	109.5
26	K	34.5	Very low	40.6	Very low	205 Å²	205	145.9 Å²	145.9	89%	0.891	81%	0.806	S	S	*	*			trans	-74.4	125.7	166.9	-69.6	174.6	174.6	178.1	0	107.6
27	I	48.9	Very low	40.6	Very low	164 Å²	164	143.5 Å²	143.5	84%	0.841	80%	0.801	S	S	*	*			trans	-123.3	129.8	160.1	-64.7	179.3	0	0	0	108.6
28	S	44.7	Very low	40.8	Very low	99 Å²	99	151 Å²	151	69%	0.692	81%	0.812	S	S	*	*			trans	-61.3	151.6	-175.2	179.5	0	0	0	0	113.6
29	S	35.8	Very low	40.7	Very low	89 Å²	89	150 Å²	150	62%	0.622	81%	0.812	S	S	*	*			trans	-31.5	133.8	168.3	58.4	0	0	0	0	116.4
30	Y	42.7	Very low	41	Very low	233 Å²	233	150.3 Å²	150.3	91%	0.914	81%	0.812	S	S	*	*			trans	-142	112.5	132.1	-91	-79.9	0	0	0	108.6	R32	Y30-R32 PolarHBondContact O-N 3.12Å; Y30-R32 VanDerWaalsContact O-N 3.14Å
31	C	34.4	Very low	41	Very low	127 Å²	127	152.5 Å²	152.5	86%	0.858	82%	0.817	S	S	*	*			trans	-60	110.2	168.3	-64.2	0	0	0	0	108.4
32	R	41.4	Very low	41.5	Very low	233 Å²	233	151.5 Å²	151.5	88%	0.879	81%	0.807	S	S	*	*			trans	-101.1	103.4	162.8	-177.2	172.8	-83.5	-144.2	-2.7	107	Y30 Q34	Y30-R32 PolarHBondContact O-N 3.12Å; Y30-R32 VanDerWaalsContact O-N 3.14Å; R32-Q34 PolarHBondContact O-N 3.09Å; R32-Q34 VanDerWaalsContact O-N 3.12Å
33	S	41.8	Very low	42.5	Very low	112 Å²	112	152.7 Å²	152.7	78%	0.783	81%	0.808	S	S	*	*			trans	-50.6	111.7	171.3	-30.6	0	0	0	0	109
34	Q	47.1	Very low	44.1	Very low	179 Å²	179	149.5 Å²	149.5	84%	0.836	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.5	137.6	163.9	-75.5	-173.5	-17.2	0	0	108	R32	R32-Q34 PolarHBondContact O-N 3.09Å; R32-Q34 VanDerWaalsContact O-N 3.12Å
35	P	51.8	Low	46.8	Very low	112 Å²	112	147.8 Å²	147.8	73%	0.727	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.7	146.4	166.7	30.4	-31.4	0	0	0	107.8	A37	P35-A37 PolarHBondContact O-N 2.68Å
36	P	39.7	Very low	49.5	Very low	115 Å²	115	143.9 Å²	143.9	75%	0.747	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-62.2	127.6	177.6	27.8	-31.2	0	0	0	107.6	R38	P36-R38 PolarHBondContact O-N 3.42Å
37	A	42.2	Very low	52.5	Low	93 Å²	93	136.3 Å²	136.3	77%	0.769	73%	0.733	S	S	*	*			trans	-49.9	114.3	158.8	0	0	0	0	0	106.3	P35 L39	P35-A37 PolarHBondContact O-N 2.68Å; A37-L39 PolarHBondContact O-N 3.34Å
38	R	42.1	Very low	54.8	Low	235 Å²	235	131.8 Å²	131.8	89%	0.887	72%	0.716	S	S	*	*			trans	-58.1	106.3	174.2	-84.7	-177.5	176.1	171.3	-1.3	106.5	P36 I40	P36-R38 PolarHBondContact O-N 3.42Å; R38-I40 PolarHBondContact O-N 2.89Å
39	L	40.4	Very low	57.3	Low	160 Å²	160	135.5 Å²	135.5	84%	0.838	72%	0.72	S	S	*	*			trans	-51.7	110.3	159.3	-78.3	151.4	0	0	0	106.4	A37 S41	A37-L39 PolarHBondContact O-N 3.34Å; L39-S41 PolarHBondContact O-N 3.15Å
40	I	46.2	Very low	60.3	Low	161 Å²	161	134.7 Å²	134.7	83%	0.826	71%	0.705	S	S	*	*			trans	-66	92.4	166.5	-61.8	174.6	0	0	0	105	R38	R38-I40 PolarHBondContact O-N 2.89Å
41	S	36.3	Very low	62.9	Low	111 Å²	111	123.6 Å²	123.6	78%	0.776	66%	0.661	S	S	*	*			trans	-122.8	103.8	-176.2	163.5	0	0	0	0	107.5	L39	L39-S41 PolarHBondContact O-N 3.15Å
42	G	48	Very low	66	Low	57 Å²	57	120 Å²	120	59%	0.588	63%	0.633	S	S	*	*	S	Bend	trans	121	119.5	175.2	0	0	0	0	0	111	E44	G42-E44 PolarHBondContact O-N 2.84Å
43	E	56.8	Low	68.7	Low	187 Å²	187	111.5 Å²	111.5	87%	0.874	61%	0.613	S	S	*	*			trans	-60.8	91.8	163.5	-77.5	-177.8	145.7	0	0	108.1	H45	E43-H45 PolarHBondContact O-N 3.01Å; E43-H45 VanDerWaalsContact O-N 3.1Å; E43-H45 PolarHBondContact O-ND1 3.14Å
44	E	78.3	Confident	71.3	Confident	140 Å²	140	106.4 Å²	106.4	65%	0.654	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-61.5	116.1	171.8	-73.6	-163.8	163.9	0	0	108.3	G42 K50 K120	G42-E44 PolarHBondContact O-N 2.84Å; E44-K50 IonicContact OE2-NZ 2.84Å; E44-K120 WeakPolarHBondContact O-CE 3.42Å; E44-K120 PolarHBondContact O-NZ 2.82Å
45	H	91.1	Very high	73.8	Confident	167 Å²	167	97.9 Å²	97.9	77%	0.773	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-60.6	153.3	175.8	-69.3	53.5	0	0	0	110	E43 S47 K120	E43-H45 PolarHBondContact O-N 3.01Å; E43-H45 VanDerWaalsContact O-N 3.1Å; E43-H45 PolarHBondContact O-ND1 3.14Å; H45-S47 PolarHBondContact O-N 3.37Å; H45-K120 PolarHBondContact O-NZ 3.14Å
46	F	96.1	Very high	76	Confident	42 Å²	42	97.1 Å²	97.1	18%	0.184	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-56	133.2	174.9	171.3	-93.9	0	0	0	111.4	C51 T111 Q114 C115 D116	F46-C51 HydrophobicContact CE2-CB 3.75Å; F46-C51 HydrophobicContact CZ-CB 3.76Å; F46-T111 HydrophobicContact CD1-CG2 4.38Å; F46-T111 HydrophobicContact CE1-CG2 3.81Å; F46-T111 WeakPolarHBondContact CE1-OG1 3.24Å; F46-T111 HydrophobicContact CZ-CG2 4.13Å; F46-T111 WeakPolarHBondContact CZ-OG1 3.06Å; F46-Q114 VanDerWaalsContact CB-OE1 3.25Å; F46-C115 WeakPolarHBondContact CE2-O 3.32Å; F46-D116 WeakPolarHBondContact CA-OD2 3.46Å; F46-D116 HydrophobicContact CD2-CB 3.88Å; F46-D116 HydrophobicContact CE2-CB 3.98Å
47	S	97.4	Very high	78.8	Confident	47 Å²	47	96.6 Å²	96.6	33%	0.329	51%	0.508	S	S	.	.			trans	-118	113.5	173.9	174.2	0	0	0	0	111.1	H45 K49 K50 C51 D116	H45-S47 PolarHBondContact O-N 3.37Å; S47-K49 PolarHBondContact O-N 3.03Å; S47-K50 PolarHBondContact O-N 3.48Å; S47-K50 PolarHBondContact OG-N 3.46Å; S47-C51 WeakPolarHBondContact O-CB 3.45Å; S47-C51 PolarHBondContact O-N 3.25Å; S47-D116 PolarHBondContact N-OD2 2.79Å
48	S	96.9	Very high	81.5	Confident	68 Å²	68	92.7 Å²	92.7	48%	0.476	47%	0.473	S	S	.	.	H	α-helix	trans	-58.4	-36	176.1	178.2	0	0	0	0	112.2	K50 C51 L52	S48-K50 PolarHBondContact O-N 3.43Å; S48-C51 PolarHBondContact O-N 3.23Å; S48-L52 WeakPolarHBondContact O-CB 3.44Å; S48-L52 PolarHBondContact O-N 3.21Å
49	K	97.4	Very high	84.1	Confident	178 Å²	178	82.5 Å²	82.5	77%	0.774	44%	0.439	S	S	*	.	H	α-helix	trans	-64.5	-40.8	175.8	-175.5	178.5	179	-179.7	0	112	S47 A53	S47-K49 PolarHBondContact O-N 3.03Å; K49-A53 WeakPolarHBondContact O-CB 3.48Å; K49-A53 PolarHBondContact O-N 3.14Å
50	K	97.8	Very high	86.7	Confident	72 Å²	72	76.5 Å²	76.5	31%	0.313	42%	0.415	S	S	.	.	H	α-helix	trans	-69.5	-42	177.4	-170	-174.9	166.2	-159	0	110.7	E44 S47 S48 L52 A53 W54 D116 C117	E44-K50 IonicContact OE2-NZ 2.84Å; S47-K50 PolarHBondContact O-N 3.48Å; S47-K50 PolarHBondContact OG-N 3.46Å; S48-K50 PolarHBondContact O-N 3.43Å; K50-L52 VanDerWaalsContact C-N 3.35Å; K50-L52 PolarHBondContact O-N 3.12Å; K50-A53 PolarHBondContact O-N 3.4Å; K50-W54 WeakPolarHBondContact O-CB 3.49Å; K50-W54 PolarHBondContact O-N 2.76Å; K50-D116 HydrophobicContact CB-CB 4.18Å; K50-D116 HydrophobicContact CD-CB 4.22Å; K50-D116 WeakPolarHBondContact CE-OD1 3.22Å; K50-D116 HydrophobicContact CG-CB 4.33Å; K50-D116 WeakPolarHBondContact CG-O 3.26Å; K50-D116 IonicContact NZ-OD1 3.05Å; K50-D116 PolarHBondContact NZ-OD1 3.02Å; K50-C117 PolarHBondContact NZ-SG 2.88Å; K50-C117 VanDerWaalsContact NZ-SG 3.45Å
51	C	98.3	Very high	88.9	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	42%	0.422	C	S	.	.	H	α-helix	trans	-59.6	-42.1	174.8	-173.3	0	0	0	0	112.5	F46 S47 S48 W54 F55 W106 L107 M110 D116	F46-C51 HydrophobicContact CE2-CB 3.75Å; F46-C51 HydrophobicContact CZ-CB 3.76Å; S47-C51 WeakPolarHBondContact O-CB 3.45Å; S47-C51 PolarHBondContact O-N 3.25Å; S48-C51 PolarHBondContact O-N 3.23Å; C51-W54 PolarHBondContact O-N 2.87Å; C51-F55 PolarHBondContact O-N 3.27Å; C51-W106 PolarHBondContact O-NE1 2.79Å; C51-L107 HydrophobicContact CB-CD2 4.43Å; C51-M110 VanDerWaalsContact SG-CB 3.52Å; C51-D116 HydrophobicContact CB-CB 3.98Å
52	L	98	Very high	91.6	Very high	50 Å²	50	75.7 Å²	75.7	26%	0.262	41%	0.412	S	S	.	.	H	α-helix	trans	-68.3	-41.3	175.3	-178.2	58.1	0	0	0	112.4	S48 K50 W54 F55 Y56 K103 L107	S48-L52 WeakPolarHBondContact O-CB 3.44Å; S48-L52 PolarHBondContact O-N 3.21Å; K50-L52 VanDerWaalsContact C-N 3.35Å; K50-L52 PolarHBondContact O-N 3.12Å; L52-W54 VanDerWaalsContact C-N 3.29Å; L52-W54 PolarHBondContact O-N 3Å; L52-F55 HydrophobicContact CD1-CD1 4.44Å; L52-F55 WeakPolarHBondContact O-CB 3.37Å; L52-F55 PolarHBondContact O-N 3.39Å; L52-Y56 HydrophobicContact CD1-CD2 3.9Å; L52-Y56 HydrophobicContact CD1-CE2 3.43Å; L52-Y56 VanDerWaalsContact CD1-CE2 3.43Å; L52-Y56 HydrophobicContact CD2-CE2 4.25Å; L52-Y56 HydrophobicContact CG-CD2 3.99Å; L52-Y56 HydrophobicContact CG-CE2 3.7Å; L52-Y56 VanDerWaalsContact O-CD2 3.22Å; L52-Y56 WeakPolarHBondContact O-CD2 3.35Å; L52-Y56 PolarHBondContact O-N 2.91Å; L52-K103 HydrophobicContact CD1-CD 4.16Å; L52-K103 HydrophobicContact CD1-CG 4.15Å; L52-L107 HydrophobicContact CB-CD2 4.01Å; L52-L107 HydrophobicContact CD1-CD1 4.23Å; L52-L107 HydrophobicContact CD1-CD2 4.3Å
53	A	98.1	Very high	93.8	Very high	55 Å²	55	77.4 Å²	77.4	46%	0.455	41%	0.405	S	S	.	.	H	α-helix	trans	-60.8	-42.8	175.4	0	0	0	0	0	111	K49 K50 F55 Y56 E57	K49-A53 WeakPolarHBondContact O-CB 3.48Å; K49-A53 PolarHBondContact O-N 3.14Å; K50-A53 PolarHBondContact O-N 3.4Å; A53-F55 PolarHBondContact O-N 2.98Å; A53-Y56 PolarHBondContact O-N 2.8Å; A53-E57 PolarHBondContact O-N 3.27Å
54	W	98.3	Very high	95.8	Very high	6 Å²	6	69.9 Å²	69.9	2%	0.023	37%	0.372	C	S	.	.	H	α-helix	trans	-61.5	-40.4	176.5	-175.3	38	0	0	0	112.5	K50 C51 L52 Y56 E57 Y58 F73 W106 M110 T118 L121	K50-W54 WeakPolarHBondContact O-CB 3.49Å; K50-W54 PolarHBondContact O-N 2.76Å; C51-W54 PolarHBondContact O-N 2.87Å; L52-W54 VanDerWaalsContact C-N 3.29Å; L52-W54 PolarHBondContact O-N 3Å; W54-Y56 VanDerWaalsContact C-N 3.35Å; W54-Y56 PolarHBondContact O-N 3.06Å; W54-E57 WeakPolarHBondContact O-CB 3.45Å; W54-E57 PolarHBondContact O-N 3.31Å; W54-E57 VanDerWaalsContact O-N 3.14Å; W54-Y58 AromaticContact CD1-CE2 3.62Å; W54-Y58 HydrophobicContact CG-CE2 4.44Å; W54-Y58 AromaticContact NE1-CE2 3.4Å; W54-Y58 AromaticContact NE1-CZ 3.78Å; W54-Y58 PolarHBondContact NE1-OH 3.46Å; W54-Y58 VanDerWaalsContact O-CD2 3.3Å; W54-Y58 WeakPolarHBondContact O-CD2 3.27Å; W54-Y58 WeakPolarHBondContact O-CE2 3.47Å; W54-F73 HydrophobicContact CH2-CE2 4.12Å; W54-F73 HydrophobicContact CZ2-CD2 4.46Å; W54-F73 AromaticContact CZ2-CE2 3.73Å; W54-F73 HydrophobicContact CZ2-CE2 3.73Å; W54-W106 AromaticContact CD2-CZ2 3.65Å; W54-W106 HydrophobicContact CD2-CZ2 3.65Å; W54-W106 AromaticContact CE2-CZ2 3.97Å; W54-W106 AromaticContact CE3-CZ2 3.53Å; W54-W106 HydrophobicContact CE3-CZ2 3.53Å; W54-W106 HydrophobicContact CG-CZ2 4.25Å; W54-W106 HydrophobicContact CH2-CH2 4.44Å; W54-W106 HydrophobicContact CH2-CZ2 4.07Å; W54-W106 HydrophobicContact CZ2-CH2 4.39Å; W54-W106 HydrophobicContact CZ2-CZ2 4.19Å; W54-W106 AromaticContact CZ3-CZ2 3.75Å; W54-W106 HydrophobicContact CZ3-CZ2 3.75Å; W54-M110 HydrophobicContact CH2-CE 4.1Å; W54-M110 HydrophobicContact CH2-SD 4.33Å; W54-M110 HydrophobicContact CZ3-CE 4.06Å; W54-M110 HydrophobicContact CZ3-CG 4.32Å; W54-M110 HydrophobicContact CZ3-SD 3.93Å; W54-T118 VanDerWaalsContact CZ2-N 3.33Å; W54-T118 PolarHBondContact NE1-OG1 2.93Å; W54-L121 HydrophobicContact CH2-CB 3.89Å; W54-L121 HydrophobicContact CH2-CD2 3.78Å; W54-L121 HydrophobicContact CH2-CG 4.46Å; W54-L121 HydrophobicContact CZ2-CD2 4.4Å
55	F	98.6	Very high	96.7	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-56	-47.2	172.4	172.9	-100	0	0	0	112.6	C51 L52 A53 E57 Y58 A59 E63 V65 K103 W106	C51-F55 PolarHBondContact O-N 3.27Å; L52-F55 HydrophobicContact CD1-CD1 4.44Å; L52-F55 WeakPolarHBondContact O-CB 3.37Å; L52-F55 PolarHBondContact O-N 3.39Å; A53-F55 PolarHBondContact O-N 2.98Å; F55-E57 PolarHBondContact O-N 3.05Å; F55-E57 VanDerWaalsContact O-N 3.14Å; F55-Y58 PolarHBondContact O-N 3.5Å; F55-A59 HydrophobicContact CD1-CB 3.92Å; F55-A59 HydrophobicContact CE1-CB 3.47Å; F55-A59 VanDerWaalsContact CE1-CB 3.47Å; F55-A59 HydrophobicContact CE2-CB 4.49Å; F55-A59 HydrophobicContact CZ-CB 3.79Å; F55-A59 PolarHBondContact O-N 2.91Å; F55-E63 VanDerWaalsContact CZ-O 3.26Å; F55-E63 WeakPolarHBondContact CZ-O 3.23Å; F55-V65 HydrophobicContact CD2-CG2 3.81Å; F55-V65 HydrophobicContact CE2-CG2 3.53Å; F55-V65 HydrophobicContact CZ-CG2 4.22Å; F55-K103 HydrophobicContact CD1-CB 4.4Å; F55-K103 HydrophobicContact CD1-CG 4.4Å; F55-K103 HydrophobicContact CE1-CB 3.73Å; F55-K103 HydrophobicContact CE1-CD 4.42Å; F55-K103 HydrophobicContact CE1-CG 4.13Å; F55-K103 HydrophobicContact CE2-CB 4.35Å; F55-K103 VanDerWaalsContact CZ-CA 3.48Å; F55-K103 HydrophobicContact CZ-CB 3.7Å; F55-W106 HydrophobicContact CB-CD2 4.35Å; F55-W106 HydrophobicContact CB-CG 4.14Å; F55-W106 HydrophobicContact CD2-CB 3.64Å; F55-W106 AromaticContact CD2-CD1 3.98Å; F55-W106 AromaticContact CD2-CD2 3.76Å; F55-W106 HydrophobicContact CD2-CD2 3.76Å; F55-W106 HydrophobicContact CD2-CE3 4.18Å; F55-W106 AromaticContact CD2-CG 3.53Å; F55-W106 HydrophobicContact CD2-CG 3.53Å; F55-W106 HydrophobicContact CE2-CB 4.03Å; F55-W106 HydrophobicContact CE2-CG 4.37Å; F55-W106 HydrophobicContact CG-CG 4.24Å
56	Y	98.1	Very high	97.1	Very high	96 Å²	96	56 Å²	56	38%	0.376	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-5.1	-179.5	-74.2	-64.4	0	0	0	114	L52 A53 W54 A59 E63 K103	L52-Y56 HydrophobicContact CD1-CD2 3.9Å; L52-Y56 HydrophobicContact CD1-CE2 3.43Å; L52-Y56 VanDerWaalsContact CD1-CE2 3.43Å; L52-Y56 HydrophobicContact CD2-CE2 4.25Å; L52-Y56 HydrophobicContact CG-CD2 3.99Å; L52-Y56 HydrophobicContact CG-CE2 3.7Å; L52-Y56 VanDerWaalsContact O-CD2 3.22Å; L52-Y56 WeakPolarHBondContact O-CD2 3.35Å; L52-Y56 PolarHBondContact O-N 2.91Å; A53-Y56 PolarHBondContact O-N 2.8Å; W54-Y56 VanDerWaalsContact C-N 3.35Å; W54-Y56 PolarHBondContact O-N 3.06Å; Y56-A59 HydrophobicContact CD1-CB 4.13Å; Y56-E63 HydrophobicContact CE1-CG 4.27Å; Y56-E63 PolarHBondContact OH-OE1 3.37Å; Y56-K103 PolarHBondContact OH-NZ 3.2Å
57	E	98.1	Very high	97.1	Very high	104 Å²	104	57.3 Å²	57.3	49%	0.486	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.7	168.2	-62.5	178.9	-161.4	0	0	112.5	A53 W54 F55 K72	A53-E57 PolarHBondContact O-N 3.27Å; W54-E57 WeakPolarHBondContact O-CB 3.45Å; W54-E57 PolarHBondContact O-N 3.31Å; W54-E57 VanDerWaalsContact O-N 3.14Å; F55-E57 PolarHBondContact O-N 3.05Å; F55-E57 VanDerWaalsContact O-N 3.14Å; E57-K72 PolarHBondContact O-NZ 3.4Å
58	Y	98.3	Very high	97	Very high	11 Å²	11	63.3 Å²	63.3	4%	0.043	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-22.2	-177	-49.1	-71.7	0	0	0	113.5	W54 F55 G69 K72 F73 D76 W106	W54-Y58 AromaticContact CD1-CE2 3.62Å; W54-Y58 HydrophobicContact CG-CE2 4.44Å; W54-Y58 AromaticContact NE1-CE2 3.4Å; W54-Y58 AromaticContact NE1-CZ 3.78Å; W54-Y58 PolarHBondContact NE1-OH 3.46Å; W54-Y58 VanDerWaalsContact O-CD2 3.3Å; W54-Y58 WeakPolarHBondContact O-CD2 3.27Å; W54-Y58 WeakPolarHBondContact O-CE2 3.47Å; F55-Y58 PolarHBondContact O-N 3.5Å; Y58-G69 WeakPolarHBondContact O-CA 3.24Å; Y58-K72 HydrophobicContact CD1-CB 4.21Å; Y58-K72 HydrophobicContact CD1-CD 3.9Å; Y58-K72 HydrophobicContact CD1-CG 4.03Å; Y58-K72 HydrophobicContact CE1-CD 4.09Å; Y58-K72 HydrophobicContact CE1-CG 3.99Å; Y58-F73 HydrophobicContact CD1-CB 3.8Å; Y58-F73 HydrophobicContact CD2-CB 4.4Å; Y58-F73 HydrophobicContact CD2-CD2 4.23Å; Y58-F73 HydrophobicContact CE1-CB 3.94Å; Y58-F73 HydrophobicContact CE1-CD2 4.41Å; Y58-F73 HydrophobicContact CE2-CB 4.5Å; Y58-F73 AromaticContact CE2-CD2 3.8Å; Y58-F73 HydrophobicContact CE2-CD2 3.8Å; Y58-F73 HydrophobicContact CG-CB 4.06Å; Y58-F73 AromaticContact CZ-CD2 3.93Å; Y58-D76 WeakPolarHBondContact CE1-OD2 3.44Å; Y58-D76 PolarHBondContact OH-OD2 3.46Å; Y58-W106 AromaticContact CD2-CH2 3.99Å; Y58-W106 HydrophobicContact CD2-CH2 3.99Å; Y58-W106 HydrophobicContact CD2-CZ2 4.47Å; Y58-W106 HydrophobicContact CE2-CH2 4.13Å
59	A	97.9	Very high	97.1	Very high	21 Å²	21	60.6 Å²	60.6	17%	0.174	33%	0.33	C	S	.	.			trans	-67.7	138	-177.1	0	0	0	0	0	112.3	F55 Y56 V64 V65	F55-A59 HydrophobicContact CD1-CB 3.92Å; F55-A59 HydrophobicContact CE1-CB 3.47Å; F55-A59 VanDerWaalsContact CE1-CB 3.47Å; F55-A59 HydrophobicContact CE2-CB 4.49Å; F55-A59 HydrophobicContact CZ-CB 3.79Å; F55-A59 PolarHBondContact O-N 2.91Å; Y56-A59 HydrophobicContact CD1-CB 4.13Å; A59-V64 WeakPolarHBondContact CA-O 3.44Å; A59-V65 HydrophobicContact CB-CG2 4.36Å
60	G	94.6	Very high	97.1	Very high	33 Å²	33	52.9 Å²	52.9	34%	0.34	30%	0.297	S	S	.	.			trans	-79.2	-175.3	173.6	0	0	0	0	0	113.5	D62 E63 V64	G60-D62 PolarHBondContact O-N 3.02Å; G60-D62 VanDerWaalsContact O-N 3.12Å; G60-E63 PolarHBondContact O-N 3.25Å; G60-E63 VanDerWaalsContact O-N 3.09Å; G60-V64 PolarHBondContact N-O 3.07Å
61	P	92.2	Very high	97.1	Very high	149 Å²	149	55.6 Å²	55.6	97%	0.968	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.1	179.8	-24	34.4	0	0	0	115.1	E63	P61-E63 VanDerWaalsContact C-N 3.33Å
62	D	93.3	Very high	97.1	Very high	107 Å²	107	60 Å²	60	57%	0.572	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	7.1	179.2	59.4	-14.5	0	0	0	113.6	G60 V64	G60-D62 PolarHBondContact O-N 3.02Å; G60-D62 VanDerWaalsContact O-N 3.12Å; D62-V64 VanDerWaalsContact C-N 3.25Å; D62-V64 PolarHBondContact O-N 3.44Å; D62-V64 PolarHBondContact OD1-N 2.89Å
63	E	95.3	Very high	97.1	Very high	93 Å²	93	57.6 Å²	57.6	44%	0.435	32%	0.317	S	S	.	.	S	Bend	trans	58.5	33.2	-173	-53	-155.3	136.7	0	0	113.6	F55 Y56 G60 P61 K103	F55-E63 VanDerWaalsContact CZ-O 3.26Å; F55-E63 WeakPolarHBondContact CZ-O 3.23Å; Y56-E63 HydrophobicContact CE1-CG 4.27Å; Y56-E63 PolarHBondContact OH-OE1 3.37Å; G60-E63 PolarHBondContact O-N 3.25Å; G60-E63 VanDerWaalsContact O-N 3.09Å; P61-E63 VanDerWaalsContact C-N 3.33Å; E63-K103 IonicContact OE2-NZ 2.87Å
64	V	97.6	Very high	97.1	Very high	29 Å²	29	55 Å²	55	18%	0.176	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.3	174.3	-179.4	0	0	0	0	109.6	A59 G60 D62 G66 F100 F101	A59-V64 WeakPolarHBondContact CA-O 3.44Å; G60-V64 PolarHBondContact N-O 3.07Å; D62-V64 VanDerWaalsContact C-N 3.25Å; D62-V64 PolarHBondContact O-N 3.44Å; D62-V64 PolarHBondContact OD1-N 2.89Å; V64-G66 PolarHBondContact O-N 3.34Å; V64-G66 VanDerWaalsContact O-N 3.15Å; V64-F100 HydrophobicContact CG1-CB 4.18Å; V64-F100 HydrophobicContact CG1-CD1 3.94Å; V64-F101 WeakPolarHBondContact CG1-O 3.41Å
65	V	98.5	Very high	97.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	95.1	166.7	-179	0	0	0	0	107.4	F55 A59 M70 F100 F101	F55-V65 HydrophobicContact CD2-CG2 3.81Å; F55-V65 HydrophobicContact CE2-CG2 3.53Å; F55-V65 HydrophobicContact CZ-CG2 4.22Å; A59-V65 HydrophobicContact CB-CG2 4.36Å; V65-M70 HydrophobicContact CG1-CE 4.36Å; V65-F100 CarbonylContact O-C 3.42Å; V65-F100 VanDerWaalsContact O-CA 3.23Å; V65-F100 WeakPolarHBondContact O-CA 3.42Å; V65-F101 HydrophobicContact CB-CB 4.25Å; V65-F101 PolarHBondContact N-O 2.91Å; V65-F101 PolarHBondContact O-N 3.07Å
66	G	97.5	Very high	97.1	Very high	16 Å²	16	65 Å²	65	17%	0.165	35%	0.345	C	S	.	.			trans	-82.5	-172	174.2	0	0	0	0	0	113.3	V64 E68 G69 M70 G99	V64-G66 PolarHBondContact O-N 3.34Å; V64-G66 VanDerWaalsContact O-N 3.15Å; G66-E68 PolarHBondContact O-N 2.92Å; G66-G69 CarbonylContact O-C 3.33Å; G66-G69 PolarHBondContact O-N 3.22Å; G66-M70 WeakPolarHBondContact O-CB 3.43Å; G66-M70 PolarHBondContact O-N 3.31Å; G66-G99 CarbonylContact C-O 3.56Å
67	P	96.5	Very high	97.1	Very high	69 Å²	69	60.5 Å²	60.5	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-53	-45.5	-174.7	-30.5	36.2	0	0	0	114.9	G69 M70 E71 F100	P67-G69 PolarHBondContact O-N 3.44Å; P67-M70 WeakPolarHBondContact O-CB 3.33Å; P67-M70 PolarHBondContact O-N 3.1Å; P67-E71 WeakPolarHBondContact O-CG 3.3Å; P67-E71 PolarHBondContact O-N 3.26Å; P67-F100 HydrophobicContact CG-CE1 4.45Å; P67-F100 HydrophobicContact CG-CZ 4.07Å
68	E	96.6	Very high	97.1	Very high	172 Å²	172	58.4 Å²	58.4	80%	0.804	33%	0.334	S	S	*	.	H	α-helix	trans	-63.3	-41.6	178	-62.7	-179.5	178.6	0	0	112.1	G66 M70 K72	G66-E68 PolarHBondContact O-N 2.92Å; E68-M70 VanDerWaalsContact C-N 3.35Å; E68-K72 PolarHBondContact O-N 2.86Å
69	G	98	Very high	97	Very high	12 Å²	12	58.8 Å²	58.8	12%	0.124	34%	0.337	C	S	.	.	H	α-helix	trans	-68.3	-35.3	175.4	0	0	0	0	0	112.3	Y58 G66 P67 K72 F73	Y58-G69 WeakPolarHBondContact O-CA 3.24Å; G66-G69 CarbonylContact O-C 3.33Å; G66-G69 PolarHBondContact O-N 3.22Å; P67-G69 PolarHBondContact O-N 3.44Å; G69-K72 PolarHBondContact O-N 2.85Å; G69-F73 VanDerWaalsContact O-CB 3.3Å; G69-F73 WeakPolarHBondContact O-CB 3.3Å; G69-F73 PolarHBondContact O-N 3.33Å
70	M	98.1	Very high	97	Very high	16 Å²	16	64.6 Å²	64.6	8%	0.079	36%	0.361	C	S	.	.	H	α-helix	trans	-66.4	-42.2	176.5	-172.9	65.6	62.3	0	0	111.5	V65 G66 P67 E68 F73 C74 M86 F101	V65-M70 HydrophobicContact CG1-CE 4.36Å; G66-M70 WeakPolarHBondContact O-CB 3.43Å; G66-M70 PolarHBondContact O-N 3.31Å; P67-M70 WeakPolarHBondContact O-CB 3.33Å; P67-M70 PolarHBondContact O-N 3.1Å; E68-M70 VanDerWaalsContact C-N 3.35Å; M70-F73 PolarHBondContact O-N 2.95Å; M70-F73 HydrophobicContact SD-CD1 3.98Å; M70-C74 WeakPolarHBondContact O-CB 3.39Å; M70-C74 PolarHBondContact O-N 3.48Å; M70-C74 PolarHBondContact O-SG 2.68Å; M70-M86 HydrophobicContact SD-CE 3.42Å; M70-M86 WeakPolarHBondContact SD-CE 3.42Å; M70-F101 HydrophobicContact CE-CD1 4.37Å; M70-F101 HydrophobicContact CE-CD2 3.42Å; M70-F101 VanDerWaalsContact CE-CD2 3.42Å; M70-F101 HydrophobicContact CE-CE1 4.34Å; M70-F101 HydrophobicContact CE-CE2 3.42Å; M70-F101 VanDerWaalsContact CE-CE2 3.42Å; M70-F101 HydrophobicContact CE-CG 3.91Å; M70-F101 HydrophobicContact CE-CZ 3.9Å; M70-F101 HydrophobicContact SD-CD2 4.3Å; M70-F101 HydrophobicContact SD-CE2 3.85Å; M70-F101 HydrophobicContact SD-CZ 4.42Å
71	E	97.7	Very high	97	Very high	129 Å²	129	66.7 Å²	66.7	60%	0.603	37%	0.368	S	S	*	.	H	α-helix	trans	-58.9	-49.7	174.4	-75.3	178.7	-174.8	0	0	111.2	P67 F73 C74 E75	P67-E71 WeakPolarHBondContact O-CG 3.3Å; P67-E71 PolarHBondContact O-N 3.26Å; E71-F73 VanDerWaalsContact C-N 3.34Å; E71-F73 PolarHBondContact O-N 3.48Å; E71-C74 WeakPolarHBondContact O-CB 3.47Å; E71-C74 PolarHBondContact O-N 3.4Å; E71-E75 PolarHBondContact O-N 2.92Å
72	K	98.2	Very high	97.1	Very high	91 Å²	91	66 Å²	66	40%	0.396	35%	0.352	S	S	.	.	H	α-helix	trans	-59.7	-44.1	175.4	-176.1	-170.8	167	-166.2	0	111.9	E57 Y58 E68 G69 C74 E75 D76	E57-K72 PolarHBondContact O-NZ 3.4Å; Y58-K72 HydrophobicContact CD1-CB 4.21Å; Y58-K72 HydrophobicContact CD1-CD 3.9Å; Y58-K72 HydrophobicContact CD1-CG 4.03Å; Y58-K72 HydrophobicContact CE1-CD 4.09Å; Y58-K72 HydrophobicContact CE1-CG 3.99Å; E68-K72 PolarHBondContact O-N 2.86Å; G69-K72 PolarHBondContact O-N 2.85Å; K72-C74 VanDerWaalsContact C-N 3.35Å; K72-C74 PolarHBondContact O-N 2.95Å; K72-E75 PolarHBondContact O-N 3.01Å; K72-D76 PolarHBondContact O-N 2.84Å
73	F	98.4	Very high	97.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-43.6	177.1	171.6	-116.2	0	0	0	111.9	W54 Y58 G69 M70 E71 D76 I77 M86 L89 F101 W106 M110 L121	W54-F73 HydrophobicContact CH2-CE2 4.12Å; W54-F73 HydrophobicContact CZ2-CD2 4.46Å; W54-F73 AromaticContact CZ2-CE2 3.73Å; W54-F73 HydrophobicContact CZ2-CE2 3.73Å; Y58-F73 HydrophobicContact CD1-CB 3.8Å; Y58-F73 HydrophobicContact CD2-CB 4.4Å; Y58-F73 HydrophobicContact CD2-CD2 4.23Å; Y58-F73 HydrophobicContact CE1-CB 3.94Å; Y58-F73 HydrophobicContact CE1-CD2 4.41Å; Y58-F73 HydrophobicContact CE2-CB 4.5Å; Y58-F73 AromaticContact CE2-CD2 3.8Å; Y58-F73 HydrophobicContact CE2-CD2 3.8Å; Y58-F73 HydrophobicContact CG-CB 4.06Å; Y58-F73 AromaticContact CZ-CD2 3.93Å; G69-F73 VanDerWaalsContact O-CB 3.3Å; G69-F73 WeakPolarHBondContact O-CB 3.3Å; G69-F73 PolarHBondContact O-N 3.33Å; M70-F73 PolarHBondContact O-N 2.95Å; M70-F73 HydrophobicContact SD-CD1 3.98Å; E71-F73 VanDerWaalsContact C-N 3.34Å; E71-F73 PolarHBondContact O-N 3.48Å; F73-D76 PolarHBondContact O-N 2.82Å; F73-I77 HydrophobicContact CD1-CD1 4.44Å; F73-I77 HydrophobicContact CD2-CG2 3.97Å; F73-I77 HydrophobicContact CE1-CD1 3.93Å; F73-I77 HydrophobicContact CE2-CD1 4.46Å; F73-I77 HydrophobicContact CE2-CG2 3.55Å; F73-I77 HydrophobicContact CZ-CD1 3.96Å; F73-I77 HydrophobicContact CZ-CG2 4.03Å; F73-I77 WeakPolarHBondContact O-CG1 3.49Å; F73-I77 WeakPolarHBondContact O-CG2 3.41Å; F73-I77 PolarHBondContact O-N 3.24Å; F73-M86 HydrophobicContact CD1-CE 3.98Å; F73-M86 HydrophobicContact CE1-CE 3.86Å; F73-M86 HydrophobicContact CE1-SD 4.27Å; F73-L89 HydrophobicContact CE1-CD2 3.76Å; F73-L89 HydrophobicContact CZ-CD2 3.8Å; F73-F101 HydrophobicContact CE1-CE2 4.19Å; F73-W106 HydrophobicContact CD1-CZ3 4.5Å; F73-W106 AromaticContact CD2-CH2 3.68Å; F73-W106 HydrophobicContact CD2-CH2 3.68Å; F73-W106 HydrophobicContact CD2-CZ3 4.2Å; F73-W106 HydrophobicContact CE1-CZ3 4.28Å; F73-W106 AromaticContact CE2-CH2 3.42Å; F73-W106 HydrophobicContact CE2-CH2 3.42Å; F73-W106 VanDerWaalsContact CE2-CH2 3.42Å; F73-W106 HydrophobicContact CE2-CZ2 4.41Å; F73-W106 AromaticContact CE2-CZ3 3.97Å; F73-W106 HydrophobicContact CE2-CZ3 3.97Å; F73-W106 HydrophobicContact CG-CH2 4.34Å; F73-W106 HydrophobicContact CG-CZ3 4.44Å; F73-W106 AromaticContact CZ-CH2 3.89Å; F73-W106 HydrophobicContact CZ-CH2 3.89Å; F73-W106 AromaticContact CZ-CZ3 4Å; F73-W106 HydrophobicContact CZ-CZ3 4Å; F73-M110 HydrophobicContact CZ-CE 4.11Å; F73-L121 HydrophobicContact CE2-CD2 3.95Å; F73-L121 HydrophobicContact CZ-CD2 3.54Å
74	C	98.3	Very high	97.3	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.007	33%	0.325	C	S	.	.	H	α-helix	trans	-61.6	-44.8	176.2	-68.7	0	0	0	0	111.5	M70 E71 K72 I77 G78 V79 P81 M86	M70-C74 WeakPolarHBondContact O-CB 3.39Å; M70-C74 PolarHBondContact O-N 3.48Å; M70-C74 PolarHBondContact O-SG 2.68Å; E71-C74 WeakPolarHBondContact O-CB 3.47Å; E71-C74 PolarHBondContact O-N 3.4Å; K72-C74 VanDerWaalsContact C-N 3.35Å; K72-C74 PolarHBondContact O-N 2.95Å; C74-I77 WeakPolarHBondContact O-CG1 3.45Å; C74-I77 PolarHBondContact O-N 2.99Å; C74-G78 PolarHBondContact O-N 3.45Å; C74-V79 CarbonylContact C-O 3.58Å; C74-V79 VanDerWaalsContact C-O 3.24Å; C74-V79 HydrophobicContact CB-CG2 4.25Å; C74-V79 WeakPolarHBondContact CB-O 3.5Å; C74-V79 PolarHBondContact O-N 2.92Å; C74-P81 HydrophobicContact CB-CG 4.33Å; C74-M86 VanDerWaalsContact SG-CE 3.54Å
75	E	98.2	Very high	97.3	Very high	151 Å²	151	59 Å²	59	71%	0.706	32%	0.316	S	S	*	.	H	α-helix	trans	-57.8	-50.7	175.4	-174.9	179.6	-174.8	0	0	111.4	E71 K72 I77 G78	E71-E75 PolarHBondContact O-N 2.92Å; K72-E75 PolarHBondContact O-N 3.01Å; E75-I77 VanDerWaalsContact C-N 3.34Å; E75-I77 PolarHBondContact O-N 2.81Å; E75-G78 PolarHBondContact O-N 2.93Å
76	D	98.2	Very high	97.3	Very high	65 Å²	65	59.7 Å²	59.7	35%	0.348	32%	0.32	S	S	.	.	H	α-helix	trans	-61.3	-39.9	-178.5	-78.4	-11.9	0	0	0	112.6	Y58 K72 F73 G78 T118	Y58-D76 WeakPolarHBondContact CE1-OD2 3.44Å; Y58-D76 PolarHBondContact OH-OD2 3.46Å; K72-D76 PolarHBondContact O-N 2.84Å; F73-D76 PolarHBondContact O-N 2.82Å; D76-G78 VanDerWaalsContact C-N 3.27Å; D76-T118 VanDerWaalsContact O-CG2 3.23Å; D76-T118 WeakPolarHBondContact O-CG2 3.49Å
77	I	97.8	Very high	97.3	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-82.2	-5.9	177.7	74.7	178.8	0	0	0	112.7	F73 C74 E75 V79 M86 T118 L121 Q122 F125	F73-I77 HydrophobicContact CD1-CD1 4.44Å; F73-I77 HydrophobicContact CD2-CG2 3.97Å; F73-I77 HydrophobicContact CE1-CD1 3.93Å; F73-I77 HydrophobicContact CE2-CD1 4.46Å; F73-I77 HydrophobicContact CE2-CG2 3.55Å; F73-I77 HydrophobicContact CZ-CD1 3.96Å; F73-I77 HydrophobicContact CZ-CG2 4.03Å; F73-I77 WeakPolarHBondContact O-CG1 3.49Å; F73-I77 WeakPolarHBondContact O-CG2 3.41Å; F73-I77 PolarHBondContact O-N 3.24Å; C74-I77 WeakPolarHBondContact O-CG1 3.45Å; C74-I77 PolarHBondContact O-N 2.99Å; E75-I77 VanDerWaalsContact C-N 3.34Å; E75-I77 PolarHBondContact O-N 2.81Å; I77-V79 HydrophobicContact CD1-CG2 3.7Å; I77-V79 HydrophobicContact CG1-CG1 4.47Å; I77-V79 HydrophobicContact CG1-CG2 3.7Å; I77-M86 HydrophobicContact CD1-SD 3.7Å; I77-T118 HydrophobicContact CG2-CG2 4.08Å; I77-L121 HydrophobicContact CD1-CD2 4.45Å; I77-L121 HydrophobicContact CG2-CD2 4.03Å; I77-Q122 VanDerWaalsContact C-NE2 3.29Å; I77-Q122 HydrophobicContact CB-CG 4.49Å; I77-Q122 PolarHBondContact O-NE2 3.2Å; I77-F125 HydrophobicContact CB-CZ 4.02Å; I77-F125 HydrophobicContact CD1-CE1 4.48Å; I77-F125 HydrophobicContact CD1-CZ 4.17Å; I77-F125 HydrophobicContact CG1-CZ 4.12Å; I77-F125 WeakPolarHBondContact O-CZ 3.15Å
78	G	97.6	Very high	97.3	Very high	60 Å²	60	56 Å²	56	62%	0.619	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	36.6	174.2	0	0	0	0	0	114.6	C74 E75 D76	C74-G78 PolarHBondContact O-N 3.45Å; E75-G78 PolarHBondContact O-N 2.93Å; D76-G78 VanDerWaalsContact C-N 3.27Å
79	V	97.5	Very high	97.4	Very high	19 Å²	19	47.8 Å²	47.8	12%	0.115	25%	0.254	C	S	.	.			trans	-132.4	159.5	175.2	-54.2	0	0	0	0	111.2	C74 I77 N83 M86 F125	C74-V79 CarbonylContact C-O 3.58Å; C74-V79 VanDerWaalsContact C-O 3.24Å; C74-V79 HydrophobicContact CB-CG2 4.25Å; C74-V79 WeakPolarHBondContact CB-O 3.5Å; C74-V79 PolarHBondContact O-N 2.92Å; I77-V79 HydrophobicContact CD1-CG2 3.7Å; I77-V79 HydrophobicContact CG1-CG1 4.47Å; I77-V79 HydrophobicContact CG1-CG2 3.7Å; V79-N83 HydrophobicContact CB-CB 4.01Å; V79-N83 HydrophobicContact CG2-CB 4.39Å; V79-M86 HydrophobicContact CG2-CG 3.83Å; V79-M86 HydrophobicContact CG2-SD 3.84Å; V79-F125 HydrophobicContact CG1-CE2 3.82Å; V79-F125 HydrophobicContact CG1-CZ 3.96Å
80	E	96.5	Very high	97.4	Very high	144 Å²	144	47.2 Å²	47.2	67%	0.673	25%	0.248	S	C	*	.			trans	-81	154.6	167.5	-67	172.5	-179.4	0	0	110.3	E82 N83	E80-E82 PolarHBondContact O-N 3.41Å; E80-N83 WeakPolarHBondContact O-CB 3.26Å; E80-N83 PolarHBondContact O-N 3.5Å; E80-N83 VanDerWaalsContact O-N 3.11Å
81	P	94.9	Very high	97.5	Very high	76 Å²	76	48.9 Å²	48.9	49%	0.494	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-37.8	175.2	-27.3	35.7	0	0	0	113.2	C74 N83	C74-P81 HydrophobicContact CB-CG 4.33Å; P81-N83 PolarHBondContact O-N 3.24Å
82	E	94.5	Very high	97.4	Very high	136 Å²	136	45.1 Å²	45.1	64%	0.636	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	42.7	174.7	-60.8	-173.5	-176.5	0	0	112.3	E80 L168	E80-E82 PolarHBondContact O-N 3.41Å; E82-L168 WeakPolarHBondContact O-CD2 3.34Å
83	N	96.2	Very high	97.4	Very high	48 Å²	48	40.9 Å²	40.9	26%	0.257	22%	0.217	S	C	.	.			trans	-103.9	138.5	173.9	-163.6	-65.4	0	0	0	110.8	V79 E80 P81 I85 M86	V79-N83 HydrophobicContact CB-CB 4.01Å; V79-N83 HydrophobicContact CG2-CB 4.39Å; E80-N83 WeakPolarHBondContact O-CB 3.26Å; E80-N83 PolarHBondContact O-N 3.5Å; E80-N83 VanDerWaalsContact O-N 3.11Å; P81-N83 PolarHBondContact O-N 3.24Å; N83-I85 PolarHBondContact O-N 3.47Å; N83-I85 VanDerWaalsContact O-N 3.09Å; N83-I85 WeakPolarHBondContact OD1-CB 3.11Å; N83-I85 WeakPolarHBondContact OD1-CG1 3.35Å; N83-I85 PolarHBondContact OD1-N 2.85Å; N83-M86 HydrophobicContact CB-CG 4.48Å; N83-M86 WeakPolarHBondContact O-CB 3.37Å; N83-M86 PolarHBondContact O-N 3.45Å
84	I	96.6	Very high	97.4	Very high	33 Å²	33	46.4 Å²	46.4	17%	0.169	24%	0.243	C	C	.	.	H	α-helix	trans	-56.3	-29.6	177	-169.7	60.6	0	0	0	112.9	M86 L87 V88 L132 L168 L169	I84-M86 VanDerWaalsContact C-N 3.28Å; I84-M86 PolarHBondContact O-N 2.87Å; I84-L87 HydrophobicContact CD1-CB 4.42Å; I84-L87 HydrophobicContact CD1-CD2 4.01Å; I84-L87 PolarHBondContact O-N 2.63Å; I84-V88 WeakPolarHBondContact O-CG2 3.17Å; I84-V88 PolarHBondContact O-N 3.09Å; I84-V88 VanDerWaalsContact O-N 3.09Å; I84-L132 HydrophobicContact CD1-CD1 4.33Å; I84-L132 HydrophobicContact CG1-CD1 3.52Å; I84-L168 HydrophobicContact CD1-CB 4.07Å; I84-L169 HydrophobicContact CD1-CD2 4.07Å; I84-L169 HydrophobicContact CD1-CG 4.44Å
85	I	97.1	Very high	97.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.5	-40.6	173.9	-67.1	-62.8	0	0	0	111.4	N83 L87 V88 L89 F125 L128 R129	N83-I85 PolarHBondContact O-N 3.47Å; N83-I85 VanDerWaalsContact O-N 3.09Å; N83-I85 WeakPolarHBondContact OD1-CB 3.11Å; N83-I85 WeakPolarHBondContact OD1-CG1 3.35Å; N83-I85 PolarHBondContact OD1-N 2.85Å; I85-L87 VanDerWaalsContact C-N 3.33Å; I85-L87 PolarHBondContact O-N 2.84Å; I85-V88 PolarHBondContact O-N 3.2Å; I85-L89 VanDerWaalsContact O-CB 3.27Å; I85-L89 WeakPolarHBondContact O-CB 3.18Å; I85-L89 PolarHBondContact O-N 2.84Å; I85-F125 HydrophobicContact CD1-CB 4.44Å; I85-F125 HydrophobicContact CG2-CD1 3.95Å; I85-F125 HydrophobicContact CG2-CE1 3.86Å; I85-F125 HydrophobicContact CG2-CG 4.49Å; I85-F125 HydrophobicContact CG2-CZ 4.35Å; I85-L128 HydrophobicContact CD1-CB 4.24Å; I85-L128 HydrophobicContact CG2-CD1 4.16Å; I85-R129 HydrophobicContact CD1-CG 3.39Å
86	M	98	Very high	97.4	Very high	15 Å²	15	45.4 Å²	45.4	7%	0.074	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-38.9	-179.9	-69.3	-55.8	-61.9	0	0	111.5	M70 F73 C74 I77 V79 N83 I84 L89 A90 F101	M70-M86 HydrophobicContact SD-CE 3.42Å; M70-M86 WeakPolarHBondContact SD-CE 3.42Å; F73-M86 HydrophobicContact CD1-CE 3.98Å; F73-M86 HydrophobicContact CE1-CE 3.86Å; F73-M86 HydrophobicContact CE1-SD 4.27Å; C74-M86 VanDerWaalsContact SG-CE 3.54Å; I77-M86 HydrophobicContact CD1-SD 3.7Å; V79-M86 HydrophobicContact CG2-CG 3.83Å; V79-M86 HydrophobicContact CG2-SD 3.84Å; N83-M86 HydrophobicContact CB-CG 4.48Å; N83-M86 WeakPolarHBondContact O-CB 3.37Å; N83-M86 PolarHBondContact O-N 3.45Å; I84-M86 VanDerWaalsContact C-N 3.28Å; I84-M86 PolarHBondContact O-N 2.87Å; M86-L89 PolarHBondContact O-N 2.6Å; M86-L89 HydrophobicContact SD-CD2 4.4Å; M86-A90 WeakPolarHBondContact O-CB 3.46Å; M86-A90 PolarHBondContact O-N 3.03Å; M86-F101 HydrophobicContact CE-CE2 4.49Å
87	L	98	Very high	97.3	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-44.6	174.7	179.8	60.6	0	0	0	112.2	I84 I85 L89 A90 W91 I141 Y144 A145 F148 M165 L169	I84-L87 HydrophobicContact CD1-CB 4.42Å; I84-L87 HydrophobicContact CD1-CD2 4.01Å; I84-L87 PolarHBondContact O-N 2.63Å; I85-L87 VanDerWaalsContact C-N 3.33Å; I85-L87 PolarHBondContact O-N 2.84Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L87-A90 PolarHBondContact O-N 2.89Å; L87-W91 PolarHBondContact O-N 3.43Å; L87-I141 HydrophobicContact CD2-CG2 4.44Å; L87-I141 HydrophobicContact CG-CG2 4.38Å; L87-Y144 HydrophobicContact CD1-CD1 4.33Å; L87-Y144 HydrophobicContact CD1-CE1 4.17Å; L87-A145 HydrophobicContact CD1-CB 3.87Å; L87-A145 HydrophobicContact CD2-CB 3.99Å; L87-F148 HydrophobicContact CD1-CD1 3.94Å; L87-F148 HydrophobicContact CD1-CE1 4.23Å; L87-M165 HydrophobicContact CD1-SD 4.47Å; L87-M165 HydrophobicContact CD2-SD 4.5Å; L87-L169 HydrophobicContact CD2-CD1 4.05Å; L87-L169 HydrophobicContact CD2-CD2 3.73Å; L87-L169 HydrophobicContact CD2-CG 3.86Å
88	V	97.9	Very high	97.2	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.7	-36.7	177.9	-177.9	0	0	0	0	111.3	I84 I85 W91 K92 L128 Q131 L132 I141	I84-V88 WeakPolarHBondContact O-CG2 3.17Å; I84-V88 PolarHBondContact O-N 3.09Å; I84-V88 VanDerWaalsContact O-N 3.09Å; I85-V88 PolarHBondContact O-N 3.2Å; V88-W91 HydrophobicContact CG1-CE3 4.36Å; V88-W91 PolarHBondContact O-N 3.06Å; V88-K92 WeakPolarHBondContact O-CG 3.38Å; V88-K92 PolarHBondContact O-N 3.21Å; V88-L128 HydrophobicContact CG1-CB 4.07Å; V88-L128 HydrophobicContact CG1-CD2 4.18Å; V88-L128 WeakPolarHBondContact CG1-O 3.39Å; V88-Q131 HydrophobicContact CG1-CB 4.26Å; V88-Q131 HydrophobicContact CG1-CG 4.35Å; V88-L132 HydrophobicContact CG2-CD1 3.88Å; V88-L132 HydrophobicContact CG2-CD2 3.76Å; V88-L132 HydrophobicContact CG2-CG 3.83Å; V88-I141 HydrophobicContact CG1-CD1 4.41Å; V88-I141 HydrophobicContact CG2-CD1 4.36Å
89	L	98.3	Very high	97.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-49.3	175	-179.3	61.5	0	0	0	110.7	F73 I85 M86 L87 W91 K92 L93 M110 L113 L121 L128	F73-L89 HydrophobicContact CE1-CD2 3.76Å; F73-L89 HydrophobicContact CZ-CD2 3.8Å; I85-L89 VanDerWaalsContact O-CB 3.27Å; I85-L89 WeakPolarHBondContact O-CB 3.18Å; I85-L89 PolarHBondContact O-N 2.84Å; M86-L89 PolarHBondContact O-N 2.6Å; M86-L89 HydrophobicContact SD-CD2 4.4Å; L87-L89 VanDerWaalsContact C-N 3.33Å; L89-W91 VanDerWaalsContact C-N 3.27Å; L89-W91 PolarHBondContact O-N 3.21Å; L89-K92 CarbonylContact O-C 3.53Å; L89-K92 WeakPolarHBondContact O-CA 3.09Å; L89-K92 WeakPolarHBondContact O-CB 3.12Å; L89-K92 PolarHBondContact O-N 3.31Å; L89-L93 HydrophobicContact CD1-CD1 3.57Å; L89-L93 HydrophobicContact CG-CD1 4.07Å; L89-L93 WeakPolarHBondContact O-CD1 3.12Å; L89-L93 PolarHBondContact O-N 3.45Å; L89-M110 HydrophobicContact CD1-CE 4.25Å; L89-M110 HydrophobicContact CD2-CE 4.4Å; L89-L113 HydrophobicContact CD1-CD1 3.77Å; L89-L121 HydrophobicContact CD1-CD1 3.88Å; L89-L121 HydrophobicContact CD2-CD2 3.99Å; L89-L128 HydrophobicContact CB-CD1 4.46Å; L89-L128 HydrophobicContact CD1-CD1 4.4Å
90	A	98.5	Very high	97.1	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-56	-43.4	175.7	0	0	0	0	0	111.4	M86 L87 K92 L93 E94 A95 F101 Y144 F148	M86-A90 WeakPolarHBondContact O-CB 3.46Å; M86-A90 PolarHBondContact O-N 3.03Å; L87-A90 PolarHBondContact O-N 2.89Å; A90-K92 PolarHBondContact O-N 3.39Å; A90-L93 CarbonylContact O-C 3.59Å; A90-L93 PolarHBondContact O-N 2.91Å; A90-E94 PolarHBondContact O-N 3.08Å; A90-A95 HydrophobicContact CB-CB 4.23Å; A90-A95 PolarHBondContact O-N 2.94Å; A90-F101 HydrophobicContact CB-CE1 3.92Å; A90-F101 HydrophobicContact CB-CZ 4.17Å; A90-Y144 HydrophobicContact CB-CE1 4.33Å; A90-Y144 WeakPolarHBondContact CB-OH 3.48Å; A90-Y144 PolarHBondContact O-OH 3Å; A90-Y144 VanDerWaalsContact O-OH 3.13Å; A90-F148 HydrophobicContact CB-CE1 3.97Å; A90-F148 HydrophobicContact CB-CE2 3.77Å; A90-F148 HydrophobicContact CB-CZ 3.43Å; A90-F148 VanDerWaalsContact CB-CZ 3.43Å
91	W	98.2	Very high	97.2	Very high	50 Å²	50	41.7 Å²	41.7	19%	0.189	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-40	173.7	174.6	70.8	0	0	0	113.1	L87 V88 L89 L93 E94 Q131 I141 Y144	L87-W91 PolarHBondContact O-N 3.43Å; V88-W91 HydrophobicContact CG1-CE3 4.36Å; V88-W91 PolarHBondContact O-N 3.06Å; L89-W91 VanDerWaalsContact C-N 3.27Å; L89-W91 PolarHBondContact O-N 3.21Å; W91-L93 VanDerWaalsContact C-N 3.33Å; W91-E94 PolarHBondContact O-N 3.27Å; W91-E94 VanDerWaalsContact O-N 3.17Å; W91-Q131 HydrophobicContact CZ3-CB 4.4Å; W91-Q131 HydrophobicContact CZ3-CG 4.37Å; W91-I141 HydrophobicContact CB-CG1 4.42Å; W91-I141 HydrophobicContact CD2-CD1 4.27Å; W91-I141 HydrophobicContact CD2-CG1 3.5Å; W91-I141 VanDerWaalsContact CD2-CG1 3.5Å; W91-I141 HydrophobicContact CE3-CD1 3.91Å; W91-I141 HydrophobicContact CE3-CG1 3.66Å; W91-I141 HydrophobicContact CG-CG1 3.82Å; W91-I141 HydrophobicContact CH2-CG1 4.45Å; W91-I141 HydrophobicContact CZ2-CG1 4.35Å; W91-I141 HydrophobicContact CZ3-CD1 4.04Å; W91-I141 HydrophobicContact CZ3-CG1 4.12Å; W91-Y144 HydrophobicContact CB-CD1 3.75Å; W91-Y144 HydrophobicContact CB-CE1 3.77Å; W91-Y144 HydrophobicContact CB-CG 4.27Å; W91-Y144 AromaticContact CD1-CD1 3.97Å; W91-Y144 AromaticContact CD1-CD2 3.99Å; W91-Y144 AromaticContact CD1-CG 3.63Å; W91-Y144 HydrophobicContact CG-CD1 4.26Å; W91-Y144 HydrophobicContact CG-CG 4.35Å
92	K	97.5	Very high	97.4	Very high	51 Å²	51	40.1 Å²	40.1	22%	0.222	20%	0.199	C	C	.	.	H	α-helix	trans	-69	-29.3	175.3	-75.9	-62.3	-170.1	-166.5	0	113.5	V88 L89 A90 E94 L113 L128	V88-K92 WeakPolarHBondContact O-CG 3.38Å; V88-K92 PolarHBondContact O-N 3.21Å; L89-K92 CarbonylContact O-C 3.53Å; L89-K92 WeakPolarHBondContact O-CA 3.09Å; L89-K92 WeakPolarHBondContact O-CB 3.12Å; L89-K92 PolarHBondContact O-N 3.31Å; A90-K92 PolarHBondContact O-N 3.39Å; K92-E94 VanDerWaalsContact C-N 3.26Å; K92-L113 HydrophobicContact CB-CD1 4.19Å; K92-L113 HydrophobicContact CG-CD2 4.32Å; K92-L128 HydrophobicContact CG-CD2 3.89Å
93	L	98.2	Very high	97.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-80.4	-10.7	173.2	-88.9	62.7	0	0	0	112.2	L89 A90 W91 A95 F101 W106 M110 L113	L89-L93 HydrophobicContact CD1-CD1 3.57Å; L89-L93 HydrophobicContact CG-CD1 4.07Å; L89-L93 WeakPolarHBondContact O-CD1 3.12Å; L89-L93 PolarHBondContact O-N 3.45Å; A90-L93 CarbonylContact O-C 3.59Å; A90-L93 PolarHBondContact O-N 2.91Å; W91-L93 VanDerWaalsContact C-N 3.33Å; L93-A95 PolarHBondContact O-N 3Å; L93-F101 HydrophobicContact CD2-CD1 3.94Å; L93-F101 HydrophobicContact CD2-CD2 4.05Å; L93-F101 HydrophobicContact CD2-CE1 4.02Å; L93-F101 HydrophobicContact CD2-CE2 4.09Å; L93-F101 HydrophobicContact CD2-CG 3.99Å; L93-F101 HydrophobicContact CD2-CZ 4.09Å; L93-W106 HydrophobicContact CD2-CE3 4.41Å; L93-M110 HydrophobicContact CD1-CE 4.38Å; L93-M110 HydrophobicContact CD1-SD 4.46Å; L93-M110 HydrophobicContact CD2-CE 4.36Å; L93-L113 HydrophobicContact CD1-CD1 4.41Å
94	E	97.9	Very high	97.6	Very high	117 Å²	117	39.8 Å²	39.8	55%	0.547	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	41.2	-170	-61.1	173.2	-142.6	0	0	111.7	A90 W91 K92 K108	A90-E94 PolarHBondContact O-N 3.08Å; W91-E94 PolarHBondContact O-N 3.27Å; W91-E94 VanDerWaalsContact O-N 3.17Å; K92-E94 VanDerWaalsContact C-N 3.26Å; E94-K108 WeakPolarHBondContact OE1-CE 3.44Å; E94-K108 IonicContact OE1-NZ 3.78Å; E94-K108 PolarHBondContact OE1-NZ 2.87Å; E94-K108 IonicContact OE2-NZ 2.85Å; E94-K108 PolarHBondContact OE2-NZ 3.11Å
95	A	98.2	Very high	97.7	Very high	2 Å²	2	39.1 Å²	39.1	2%	0.017	19%	0.191	C	C	.	.			trans	-65.9	134.6	-175.7	0	0	0	0	0	112.2	A90 L93 F101 E105 Y144 F148	A90-A95 HydrophobicContact CB-CB 4.23Å; A90-A95 PolarHBondContact O-N 2.94Å; L93-A95 PolarHBondContact O-N 3Å; A95-F101 HydrophobicContact CB-CD1 3.65Å; A95-F101 HydrophobicContact CB-CE1 3.59Å; A95-E105 WeakPolarHBondContact CA-OE1 3.4Å; A95-Y144 PolarHBondContact N-OH 3.26Å; A95-Y144 WeakPolarHBondContact O-CE2 2.94Å; A95-Y144 PolarHBondContact O-OH 3.09Å; A95-F148 HydrophobicContact CB-CD2 4.4Å; A95-F148 HydrophobicContact CB-CE2 3.88Å; A95-F148 WeakPolarHBondContact O-CD2 3.29Å
96	E	97	Very high	97.8	Very high	128 Å²	128	39.1 Å²	39.1	60%	0.598	19%	0.191	S	C	*	.	S	Bend	trans	-76.5	-29.3	-176.4	-72.3	-169.7	177	0	0	113.9	E105 K152	E96-E105 PolarHBondContact N-OE1 2.83Å; E96-K152 IonicContact OE2-NZ 3.54Å; E96-K152 PolarHBondContact OE2-NZ 3.15Å
97	S	96.2	Very high	97.8	Very high	27 Å²	27	40.2 Å²	40.2	19%	0.189	20%	0.197	C	C	.	.	S	Bend	trans	-147	134.3	-168	-61.6	0	0	0	0	112.7	G99 F100 F148 K152	S97-G99 PolarHBondContact O-N 3.01Å; S97-F100 PolarHBondContact O-N 3.43Å; S97-F148 VanDerWaalsContact C-CE2 3.4Å; S97-F148 WeakPolarHBondContact O-CE2 3.09Å; S97-K152 VanDerWaalsContact OG-CE 3.26Å; S97-K152 WeakPolarHBondContact OG-CE 3.49Å
98	M	96.3	Very high	97.8	Very high	73 Å²	73	45.3 Å²	45.3	36%	0.36	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	133.8	-179	-177.2	174.6	66.3	0	0	112.8	F100 F148 A149 T161 M165	M98-F100 VanDerWaalsContact C-N 3.31Å; M98-F100 VanDerWaalsContact O-CD2 3.27Å; M98-F100 WeakPolarHBondContact O-CD2 3.35Å; M98-F148 VanDerWaalsContact CA-CE2 3.49Å; M98-F148 VanDerWaalsContact CA-CZ 3.42Å; M98-F148 HydrophobicContact CB-CD1 4.06Å; M98-F148 HydrophobicContact CB-CD2 4.49Å; M98-F148 HydrophobicContact CB-CE1 3.79Å; M98-F148 HydrophobicContact CB-CE2 4.25Å; M98-F148 HydrophobicContact CB-CG 4.42Å; M98-F148 HydrophobicContact CB-CZ 3.92Å; M98-F148 WeakPolarHBondContact CB-O 3.47Å; M98-F148 HydrophobicContact CG-CD1 4.45Å; M98-F148 HydrophobicContact CG-CE1 3.87Å; M98-F148 HydrophobicContact CG-CZ 4.2Å; M98-F148 PolarHBondContact N-O 3.1Å; M98-A149 HydrophobicContact CE-CB 4.18Å; M98-A149 HydrophobicContact SD-CB 4Å; M98-T161 HydrophobicContact CE-CG2 3.97Å; M98-M165 HydrophobicContact SD-CE 3.41Å; M98-M165 WeakPolarHBondContact SD-CE 3.41Å
99	G	96.2	Very high	97.8	Very high	20 Å²	20	45.4 Å²	45.4	21%	0.206	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	0.1	-178.4	0	0	0	0	0	114.6	G66 S97	G66-G99 CarbonylContact C-O 3.56Å; S97-G99 PolarHBondContact O-N 3.01Å
100	F	97.6	Very high	97.8	Very high	89 Å²	89	45.4 Å²	45.4	39%	0.39	22%	0.22	S	C	.	.			trans	-128.8	139.4	-178.9	-60.3	-90.7	0	0	0	112.1	V64 V65 P67 S97 M98	V64-F100 HydrophobicContact CG1-CB 4.18Å; V64-F100 HydrophobicContact CG1-CD1 3.94Å; V65-F100 CarbonylContact O-C 3.42Å; V65-F100 VanDerWaalsContact O-CA 3.23Å; V65-F100 WeakPolarHBondContact O-CA 3.42Å; P67-F100 HydrophobicContact CG-CE1 4.45Å; P67-F100 HydrophobicContact CG-CZ 4.07Å; S97-F100 PolarHBondContact O-N 3.43Å; M98-F100 VanDerWaalsContact C-N 3.31Å; M98-F100 VanDerWaalsContact O-CD2 3.27Å; M98-F100 WeakPolarHBondContact O-CD2 3.35Å
101	F	98.3	Very high	97.8	Very high	3 Å²	3	47.8 Å²	47.8	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.3	161.1	-64.1	-39.8	0	0	0	110.5	V64 V65 M70 F73 M86 A90 L93 A95 W106	V64-F101 WeakPolarHBondContact CG1-O 3.41Å; V65-F101 HydrophobicContact CB-CB 4.25Å; V65-F101 PolarHBondContact N-O 2.91Å; V65-F101 PolarHBondContact O-N 3.07Å; M70-F101 HydrophobicContact CE-CD1 4.37Å; M70-F101 HydrophobicContact CE-CD2 3.42Å; M70-F101 VanDerWaalsContact CE-CD2 3.42Å; M70-F101 HydrophobicContact CE-CE1 4.34Å; M70-F101 HydrophobicContact CE-CE2 3.42Å; M70-F101 VanDerWaalsContact CE-CE2 3.42Å; M70-F101 HydrophobicContact CE-CG 3.91Å; M70-F101 HydrophobicContact CE-CZ 3.9Å; M70-F101 HydrophobicContact SD-CD2 4.3Å; M70-F101 HydrophobicContact SD-CE2 3.85Å; M70-F101 HydrophobicContact SD-CZ 4.42Å; F73-F101 HydrophobicContact CE1-CE2 4.19Å; M86-F101 HydrophobicContact CE-CE2 4.49Å; A90-F101 HydrophobicContact CB-CE1 3.92Å; A90-F101 HydrophobicContact CB-CZ 4.17Å; L93-F101 HydrophobicContact CD2-CD1 3.94Å; L93-F101 HydrophobicContact CD2-CD2 4.05Å; L93-F101 HydrophobicContact CD2-CE1 4.02Å; L93-F101 HydrophobicContact CD2-CE2 4.09Å; L93-F101 HydrophobicContact CD2-CG 3.99Å; L93-F101 HydrophobicContact CD2-CZ 4.09Å; A95-F101 HydrophobicContact CB-CD1 3.65Å; A95-F101 HydrophobicContact CB-CE1 3.59Å; F101-W106 HydrophobicContact CB-CE3 4.35Å; F101-W106 AromaticContact CD2-CE3 3.89Å; F101-W106 HydrophobicContact CD2-CE3 3.89Å; F101-W106 HydrophobicContact CD2-CZ3 4Å; F101-W106 HydrophobicContact CG-CE3 4.48Å
102	T	98.2	Very high	97.7	Very high	43 Å²	43	50 Å²	50	26%	0.264	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	160.3	168.3	64.5	0	0	0	0	110.6	E104 E105 W106	T102-E104 VanDerWaalsContact C-N 3.27Å; T102-E104 PolarHBondContact O-N 2.68Å; T102-E105 WeakPolarHBondContact CB-OE2 3.48Å; T102-E105 WeakPolarHBondContact CG2-OE2 3.42Å; T102-E105 PolarHBondContact N-OE2 3.37Å; T102-E105 PolarHBondContact O-N 2.65Å; T102-E105 WeakPolarHBondContact OG1-CB 3.3Å; T102-E105 WeakPolarHBondContact OG1-CG 3.43Å; T102-E105 PolarHBondContact OG1-N 3.38Å; T102-E105 PolarHBondContact OG1-OE2 3.04Å; T102-W106 WeakPolarHBondContact O-CB 3.33Å; T102-W106 PolarHBondContact O-N 2.89Å
103	K	98.2	Very high	97.7	Very high	45 Å²	45	48 Å²	48	20%	0.196	25%	0.249	C	C	.	.	H	α-helix	trans	-58.7	-40.5	174.7	178.6	171.6	164.1	178.4	0	112	L52 F55 Y56 E63 L107	L52-K103 HydrophobicContact CD1-CD 4.16Å; L52-K103 HydrophobicContact CD1-CG 4.15Å; F55-K103 HydrophobicContact CD1-CB 4.4Å; F55-K103 HydrophobicContact CD1-CG 4.4Å; F55-K103 HydrophobicContact CE1-CB 3.73Å; F55-K103 HydrophobicContact CE1-CD 4.42Å; F55-K103 HydrophobicContact CE1-CG 4.13Å; F55-K103 HydrophobicContact CE2-CB 4.35Å; F55-K103 VanDerWaalsContact CZ-CA 3.48Å; F55-K103 HydrophobicContact CZ-CB 3.7Å; Y56-K103 PolarHBondContact OH-NZ 3.2Å; E63-K103 IonicContact OE2-NZ 2.87Å; K103-L107 HydrophobicContact CG-CD1 4Å; K103-L107 HydrophobicContact CG-CG 4.46Å; K103-L107 WeakPolarHBondContact O-CB 3.31Å; K103-L107 VanDerWaalsContact O-CG 3.24Å; K103-L107 WeakPolarHBondContact O-CG 3.11Å; K103-L107 PolarHBondContact O-N 2.87Å
104	E	98	Very high	97.7	Very high	131 Å²	131	52.9 Å²	52.9	61%	0.612	27%	0.272	S	S	*	.	H	α-helix	trans	-65.8	-48.6	-179.9	-68.4	68.6	-152.4	0	0	111.6	T102 K108	T102-E104 VanDerWaalsContact C-N 3.27Å; T102-E104 PolarHBondContact O-N 2.68Å; E104-K108 WeakPolarHBondContact O-CB 3.35Å; E104-K108 PolarHBondContact O-N 2.76Å
105	E	98.5	Very high	97.7	Very high	20 Å²	20	47.3 Å²	47.3	9%	0.093	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-48.6	176	-71.4	159.9	160.5	0	0	110.7	A95 E96 T102 K108 G109	A95-E105 WeakPolarHBondContact CA-OE1 3.4Å; E96-E105 PolarHBondContact N-OE1 2.83Å; T102-E105 WeakPolarHBondContact CB-OE2 3.48Å; T102-E105 WeakPolarHBondContact CG2-OE2 3.42Å; T102-E105 PolarHBondContact N-OE2 3.37Å; T102-E105 PolarHBondContact O-N 2.65Å; T102-E105 WeakPolarHBondContact OG1-CB 3.3Å; T102-E105 WeakPolarHBondContact OG1-CG 3.43Å; T102-E105 PolarHBondContact OG1-N 3.38Å; T102-E105 PolarHBondContact OG1-OE2 3.04Å; E105-K108 PolarHBondContact O-N 2.89Å; E105-G109 PolarHBondContact O-N 2.87Å
106	W	98.6	Very high	97.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-54.8	178.9	-176.5	-81.2	0	0	0	111.7	C51 W54 F55 Y58 F73 L93 F101 T102 K108 G109 M110	C51-W106 PolarHBondContact O-NE1 2.79Å; W54-W106 AromaticContact CD2-CZ2 3.65Å; W54-W106 HydrophobicContact CD2-CZ2 3.65Å; W54-W106 AromaticContact CE2-CZ2 3.97Å; W54-W106 AromaticContact CE3-CZ2 3.53Å; W54-W106 HydrophobicContact CE3-CZ2 3.53Å; W54-W106 HydrophobicContact CG-CZ2 4.25Å; W54-W106 HydrophobicContact CH2-CH2 4.44Å; W54-W106 HydrophobicContact CH2-CZ2 4.07Å; W54-W106 HydrophobicContact CZ2-CH2 4.39Å; W54-W106 HydrophobicContact CZ2-CZ2 4.19Å; W54-W106 AromaticContact CZ3-CZ2 3.75Å; W54-W106 HydrophobicContact CZ3-CZ2 3.75Å; F55-W106 HydrophobicContact CB-CD2 4.35Å; F55-W106 HydrophobicContact CB-CG 4.14Å; F55-W106 HydrophobicContact CD2-CB 3.64Å; F55-W106 AromaticContact CD2-CD1 3.98Å; F55-W106 AromaticContact CD2-CD2 3.76Å; F55-W106 HydrophobicContact CD2-CD2 3.76Å; F55-W106 HydrophobicContact CD2-CE3 4.18Å; F55-W106 AromaticContact CD2-CG 3.53Å; F55-W106 HydrophobicContact CD2-CG 3.53Å; F55-W106 HydrophobicContact CE2-CB 4.03Å; F55-W106 HydrophobicContact CE2-CG 4.37Å; F55-W106 HydrophobicContact CG-CG 4.24Å; Y58-W106 AromaticContact CD2-CH2 3.99Å; Y58-W106 HydrophobicContact CD2-CH2 3.99Å; Y58-W106 HydrophobicContact CD2-CZ2 4.47Å; Y58-W106 HydrophobicContact CE2-CH2 4.13Å; F73-W106 HydrophobicContact CD1-CZ3 4.5Å; F73-W106 AromaticContact CD2-CH2 3.68Å; F73-W106 HydrophobicContact CD2-CH2 3.68Å; F73-W106 HydrophobicContact CD2-CZ3 4.2Å; F73-W106 HydrophobicContact CE1-CZ3 4.28Å; F73-W106 AromaticContact CE2-CH2 3.42Å; F73-W106 HydrophobicContact CE2-CH2 3.42Å; F73-W106 VanDerWaalsContact CE2-CH2 3.42Å; F73-W106 HydrophobicContact CE2-CZ2 4.41Å; F73-W106 AromaticContact CE2-CZ3 3.97Å; F73-W106 HydrophobicContact CE2-CZ3 3.97Å; F73-W106 HydrophobicContact CG-CH2 4.34Å; F73-W106 HydrophobicContact CG-CZ3 4.44Å; F73-W106 AromaticContact CZ-CH2 3.89Å; F73-W106 HydrophobicContact CZ-CH2 3.89Å; F73-W106 AromaticContact CZ-CZ3 4Å; F73-W106 HydrophobicContact CZ-CZ3 4Å; L93-W106 HydrophobicContact CD2-CE3 4.41Å; F101-W106 HydrophobicContact CB-CE3 4.35Å; F101-W106 AromaticContact CD2-CE3 3.89Å; F101-W106 HydrophobicContact CD2-CE3 3.89Å; F101-W106 HydrophobicContact CD2-CZ3 4Å; F101-W106 HydrophobicContact CG-CE3 4.48Å; T102-W106 WeakPolarHBondContact O-CB 3.33Å; T102-W106 PolarHBondContact O-N 2.89Å; W106-K108 VanDerWaalsContact C-N 3.34Å; W106-K108 PolarHBondContact O-N 3.01Å; W106-G109 PolarHBondContact O-N 2.92Å; W106-M110 HydrophobicContact CD2-CE 4.07Å; W106-M110 HydrophobicContact CD2-CG 4.08Å; W106-M110 HydrophobicContact CE3-CE 4Å; W106-M110 HydrophobicContact CG-CG 4.09Å; W106-M110 HydrophobicContact CH2-CE 3.95Å; W106-M110 HydrophobicContact CZ2-CE 4Å; W106-M110 HydrophobicContact CZ3-CE 3.94Å; W106-M110 WeakPolarHBondContact O-CB 3.44Å; W106-M110 WeakPolarHBondContact O-CG 3.23Å; W106-M110 PolarHBondContact O-N 3.42Å
107	L	98.1	Very high	97.7	Very high	38 Å²	38	42.3 Å²	42.3	20%	0.199	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-43.2	-178	-71.6	177.3	0	0	0	111.4	C51 L52 K103 T111	C51-L107 HydrophobicContact CB-CD2 4.43Å; L52-L107 HydrophobicContact CB-CD2 4.01Å; L52-L107 HydrophobicContact CD1-CD1 4.23Å; L52-L107 HydrophobicContact CD1-CD2 4.3Å; K103-L107 HydrophobicContact CG-CD1 4Å; K103-L107 HydrophobicContact CG-CG 4.46Å; K103-L107 WeakPolarHBondContact O-CB 3.31Å; K103-L107 VanDerWaalsContact O-CG 3.24Å; K103-L107 WeakPolarHBondContact O-CG 3.11Å; K103-L107 PolarHBondContact O-N 2.87Å; L107-T111 WeakPolarHBondContact O-CB 3.46Å; L107-T111 PolarHBondContact O-N 3.01Å; L107-T111 PolarHBondContact O-OG1 3.17Å
108	K	98	Very high	97.8	Very high	113 Å²	113	42.4 Å²	42.4	49%	0.491	22%	0.224	S	C	.	.	H	α-helix	trans	-62.1	-54.7	178	178.9	-175.4	167.5	-171.4	0	111.1	E94 E104 E105 W106 S112	E94-K108 WeakPolarHBondContact OE1-CE 3.44Å; E94-K108 IonicContact OE1-NZ 3.78Å; E94-K108 PolarHBondContact OE1-NZ 2.87Å; E94-K108 IonicContact OE2-NZ 2.85Å; E94-K108 PolarHBondContact OE2-NZ 3.11Å; E104-K108 WeakPolarHBondContact O-CB 3.35Å; E104-K108 PolarHBondContact O-N 2.76Å; E105-K108 PolarHBondContact O-N 2.89Å; W106-K108 VanDerWaalsContact C-N 3.34Å; W106-K108 PolarHBondContact O-N 3.01Å; K108-S112 PolarHBondContact O-N 2.91Å
109	G	98.1	Very high	97.9	Very high	2 Å²	2	45 Å²	45	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-66.3	-47.3	-175.7	0	0	0	0	0	112.8	E105 W106 T111 S112 L113	E105-G109 PolarHBondContact O-N 2.87Å; W106-G109 PolarHBondContact O-N 2.92Å; G109-T111 VanDerWaalsContact C-N 3.34Å; G109-T111 PolarHBondContact O-N 3.48Å; G109-S112 WeakPolarHBondContact O-CB 3.21Å; G109-S112 PolarHBondContact O-N 3.13Å; G109-S112 VanDerWaalsContact O-N 3.14Å; G109-L113 WeakPolarHBondContact O-CG 3.37Å; G109-L113 PolarHBondContact O-N 3.46Å
110	M	98.2	Very high	98	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.5	-34.5	179.8	-65.2	-60	-175	0	0	112.2	C51 W54 F73 L89 L93 W106 L113 Q114 C115 L121	C51-M110 VanDerWaalsContact SG-CB 3.52Å; W54-M110 HydrophobicContact CH2-CE 4.1Å; W54-M110 HydrophobicContact CH2-SD 4.33Å; W54-M110 HydrophobicContact CZ3-CE 4.06Å; W54-M110 HydrophobicContact CZ3-CG 4.32Å; W54-M110 HydrophobicContact CZ3-SD 3.93Å; F73-M110 HydrophobicContact CZ-CE 4.11Å; L89-M110 HydrophobicContact CD1-CE 4.25Å; L89-M110 HydrophobicContact CD2-CE 4.4Å; L93-M110 HydrophobicContact CD1-CE 4.38Å; L93-M110 HydrophobicContact CD1-SD 4.46Å; L93-M110 HydrophobicContact CD2-CE 4.36Å; W106-M110 HydrophobicContact CD2-CE 4.07Å; W106-M110 HydrophobicContact CD2-CG 4.08Å; W106-M110 HydrophobicContact CE3-CE 4Å; W106-M110 HydrophobicContact CG-CG 4.09Å; W106-M110 HydrophobicContact CH2-CE 3.95Å; W106-M110 HydrophobicContact CZ2-CE 4Å; W106-M110 HydrophobicContact CZ3-CE 3.94Å; W106-M110 WeakPolarHBondContact O-CB 3.44Å; W106-M110 WeakPolarHBondContact O-CG 3.23Å; W106-M110 PolarHBondContact O-N 3.42Å; M110-L113 CarbonylContact O-C 3.58Å; M110-L113 PolarHBondContact O-N 3.42Å; M110-Q114 PolarHBondContact O-N 3.14Å; M110-C115 WeakPolarHBondContact CB-O 3.2Å; M110-C115 PolarHBondContact O-N 3.45Å; M110-C115 HydrophobicContact SD-CB 4.22Å; M110-L121 HydrophobicContact CE-CD2 4.04Å; M110-L121 HydrophobicContact SD-CD1 4.43Å
111	T	97.7	Very high	98	Very high	50 Å²	50	41.8 Å²	41.8	31%	0.307	22%	0.216	S	C	.	.	H	α-helix	trans	-62.9	-46.1	169.5	-60	0	0	0	0	110.8	F46 L107 G109 L113 Q114	F46-T111 HydrophobicContact CD1-CG2 4.38Å; F46-T111 HydrophobicContact CE1-CG2 3.81Å; F46-T111 WeakPolarHBondContact CE1-OG1 3.24Å; F46-T111 HydrophobicContact CZ-CG2 4.13Å; F46-T111 WeakPolarHBondContact CZ-OG1 3.06Å; L107-T111 WeakPolarHBondContact O-CB 3.46Å; L107-T111 PolarHBondContact O-N 3.01Å; L107-T111 PolarHBondContact O-OG1 3.17Å; G109-T111 VanDerWaalsContact C-N 3.34Å; G109-T111 PolarHBondContact O-N 3.48Å; T111-L113 PolarHBondContact O-N 3.01Å; T111-Q114 PolarHBondContact O-N 2.99Å; T111-Q114 PolarHBondContact O-NE2 3.17Å
112	S	97	Very high	98	Very high	96 Å²	96	45.2 Å²	45.2	67%	0.671	23%	0.231	S	C	*	.	H	α-helix	trans	-61.5	-33.4	176.9	-174.6	0	0	0	0	112.5	K108 G109 Q114	K108-S112 PolarHBondContact O-N 2.91Å; G109-S112 WeakPolarHBondContact O-CB 3.21Å; G109-S112 PolarHBondContact O-N 3.13Å; G109-S112 VanDerWaalsContact O-N 3.14Å; S112-Q114 VanDerWaalsContact C-N 3.32Å
113	L	97.4	Very high	97.9	Very high	9 Å²	9	49.6 Å²	49.6	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-83.5	-6.7	176.3	-68	172.9	0	0	0	113.3	L89 K92 L93 G109 M110 T111 C115 K124 F127 L128	L89-L113 HydrophobicContact CD1-CD1 3.77Å; K92-L113 HydrophobicContact CB-CD1 4.19Å; K92-L113 HydrophobicContact CG-CD2 4.32Å; L93-L113 HydrophobicContact CD1-CD1 4.41Å; G109-L113 WeakPolarHBondContact O-CG 3.37Å; G109-L113 PolarHBondContact O-N 3.46Å; M110-L113 CarbonylContact O-C 3.58Å; M110-L113 PolarHBondContact O-N 3.42Å; T111-L113 PolarHBondContact O-N 3.01Å; L113-C115 VanDerWaalsContact C-N 3.26Å; L113-C115 HydrophobicContact CB-CB 4.41Å; L113-C115 PolarHBondContact O-N 2.99Å; L113-C115 PolarHBondContact O-SG 2.89Å; L113-C115 VanDerWaalsContact O-SG 3.37Å; L113-K124 VanDerWaalsContact O-CE 3.27Å; L113-K124 WeakPolarHBondContact O-CE 3.31Å; L113-F127 HydrophobicContact CD2-CD1 4.33Å; L113-F127 HydrophobicContact CD2-CE1 3.84Å; L113-L128 HydrophobicContact CD1-CD2 4.47Å; L113-L128 HydrophobicContact CD2-CD2 4.17Å
114	Q	97.7	Very high	97.9	Very high	105 Å²	105	51.1 Å²	51.1	49%	0.491	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	39.3	-173.2	-61.2	-70.4	-62.3	0	0	112.7	F46 M110 T111 S112	F46-Q114 VanDerWaalsContact CB-OE1 3.25Å; M110-Q114 PolarHBondContact O-N 3.14Å; T111-Q114 PolarHBondContact O-N 2.99Å; T111-Q114 PolarHBondContact O-NE2 3.17Å; S112-Q114 VanDerWaalsContact C-N 3.32Å
115	C	98.2	Very high	97.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.			trans	-113	122.6	-178.9	-65.1	0	0	0	0	110.6	F46 M110 L113 K120 L121	F46-C115 WeakPolarHBondContact CE2-O 3.32Å; M110-C115 WeakPolarHBondContact CB-O 3.2Å; M110-C115 PolarHBondContact O-N 3.45Å; M110-C115 HydrophobicContact SD-CB 4.22Å; L113-C115 VanDerWaalsContact C-N 3.26Å; L113-C115 HydrophobicContact CB-CB 4.41Å; L113-C115 PolarHBondContact O-N 2.99Å; L113-C115 PolarHBondContact O-SG 2.89Å; L113-C115 VanDerWaalsContact O-SG 3.37Å; C115-K120 HydrophobicContact CB-CB 4.25Å; C115-L121 HydrophobicContact CB-CB 4.3Å
116	D	98.1	Very high	97.8	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.26	C	S	.	.			trans	-126.1	10.7	178.1	60.1	25.7	0	0	0	113.2	F46 S47 K50 C51 K120	F46-D116 WeakPolarHBondContact CA-OD2 3.46Å; F46-D116 HydrophobicContact CD2-CB 3.88Å; F46-D116 HydrophobicContact CE2-CB 3.98Å; S47-D116 PolarHBondContact N-OD2 2.79Å; K50-D116 HydrophobicContact CB-CB 4.18Å; K50-D116 HydrophobicContact CD-CB 4.22Å; K50-D116 WeakPolarHBondContact CE-OD1 3.22Å; K50-D116 HydrophobicContact CG-CB 4.33Å; K50-D116 WeakPolarHBondContact CG-O 3.26Å; K50-D116 IonicContact NZ-OD1 3.05Å; K50-D116 PolarHBondContact NZ-OD1 3.02Å; C51-D116 HydrophobicContact CB-CB 3.98Å; D116-K120 VanDerWaalsContact CG-NZ 3.31Å; D116-K120 VanDerWaalsContact OD1-CD 3.31Å; D116-K120 WeakPolarHBondContact OD1-CD 3.35Å; D116-K120 VanDerWaalsContact OD1-CE 3.3Å; D116-K120 WeakPolarHBondContact OD1-CE 3.25Å; D116-K120 IonicContact OD1-NZ 2.77Å; D116-K120 PolarHBondContact OD1-NZ 3.31Å; D116-K120 VanDerWaalsContact OD1-NZ 3.08Å; D116-K120 IonicContact OD2-NZ 2.77Å; D116-K120 PolarHBondContact OD2-NZ 2.96Å
117	C	98	Very high	97.8	Very high	23 Å²	23	54.4 Å²	54.4	16%	0.155	28%	0.278	C	S	.	.	S	Bend	trans	-163.4	167	172.9	59.7	0	0	0	0	110.8	K50 E119 K120 L121	K50-C117 PolarHBondContact NZ-SG 2.88Å; K50-C117 VanDerWaalsContact NZ-SG 3.45Å; C117-E119 VanDerWaalsContact C-N 3.34Å; C117-E119 PolarHBondContact O-N 2.97Å; C117-K120 PolarHBondContact O-N 3.46Å; C117-L121 PolarHBondContact O-N 3.33Å
118	T	98.1	Very high	97.8	Very high	30 Å²	30	52.6 Å²	52.6	18%	0.184	27%	0.268	C	S	.	.	H	α-helix	trans	-47.4	-50.1	176.4	-56.1	0	0	0	0	113.1	W54 D76 I77 K120 L121 Q122	W54-T118 VanDerWaalsContact CZ2-N 3.33Å; W54-T118 PolarHBondContact NE1-OG1 2.93Å; D76-T118 VanDerWaalsContact O-CG2 3.23Å; D76-T118 WeakPolarHBondContact O-CG2 3.49Å; I77-T118 HydrophobicContact CG2-CG2 4.08Å; T118-K120 PolarHBondContact O-N 3.43Å; T118-L121 PolarHBondContact O-N 2.89Å; T118-L121 VanDerWaalsContact O-N 3.17Å; T118-Q122 HydrophobicContact CG2-CG 4.41Å; T118-Q122 WeakPolarHBondContact O-CG 3.09Å; T118-Q122 PolarHBondContact O-N 3.32Å
119	E	97.5	Very high	97.7	Very high	127 Å²	127	52.4 Å²	52.4	59%	0.593	26%	0.264	S	S	*	.	H	α-helix	trans	-60	-43.6	-177.3	-62.7	177.5	178.8	0	0	112.6	C117 L121 Q122 N123	C117-E119 VanDerWaalsContact C-N 3.34Å; C117-E119 PolarHBondContact O-N 2.97Å; E119-L121 VanDerWaalsContact C-N 3.33Å; E119-L121 PolarHBondContact O-N 3.42Å; E119-Q122 PolarHBondContact O-N 3.19Å; E119-N123 VanDerWaalsContact O-CG 3.25Å; E119-N123 PolarHBondContact O-N 2.92Å; E119-N123 PolarHBondContact O-ND2 3.4Å; E119-N123 VanDerWaalsContact O-ND2 3.12Å
120	K	97.9	Very high	97.6	Very high	42 Å²	42	54.6 Å²	54.6	18%	0.183	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-39	178.4	-73	-173.4	-175.9	176	0	111.2	E44 H45 C115 D116 C117 T118 N123 K124	E44-K120 WeakPolarHBondContact O-CE 3.42Å; E44-K120 PolarHBondContact O-NZ 2.82Å; H45-K120 PolarHBondContact O-NZ 3.14Å; C115-K120 HydrophobicContact CB-CB 4.25Å; D116-K120 VanDerWaalsContact CG-NZ 3.31Å; D116-K120 VanDerWaalsContact OD1-CD 3.31Å; D116-K120 WeakPolarHBondContact OD1-CD 3.35Å; D116-K120 VanDerWaalsContact OD1-CE 3.3Å; D116-K120 WeakPolarHBondContact OD1-CE 3.25Å; D116-K120 IonicContact OD1-NZ 2.77Å; D116-K120 PolarHBondContact OD1-NZ 3.31Å; D116-K120 VanDerWaalsContact OD1-NZ 3.08Å; D116-K120 IonicContact OD2-NZ 2.77Å; D116-K120 PolarHBondContact OD2-NZ 2.96Å; C117-K120 PolarHBondContact O-N 3.46Å; T118-K120 PolarHBondContact O-N 3.43Å; K120-N123 PolarHBondContact O-N 3Å; K120-K124 WeakPolarHBondContact O-CG 3.46Å; K120-K124 PolarHBondContact O-N 3.44Å
121	L	98.2	Very high	97.5	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.6	-43.2	177.5	179.9	62.4	0	0	0	112.1	W54 F73 I77 L89 M110 C115 C117 T118 E119 N123 K124 F125 L128	W54-L121 HydrophobicContact CH2-CB 3.89Å; W54-L121 HydrophobicContact CH2-CD2 3.78Å; W54-L121 HydrophobicContact CH2-CG 4.46Å; W54-L121 HydrophobicContact CZ2-CD2 4.4Å; F73-L121 HydrophobicContact CE2-CD2 3.95Å; F73-L121 HydrophobicContact CZ-CD2 3.54Å; I77-L121 HydrophobicContact CD1-CD2 4.45Å; I77-L121 HydrophobicContact CG2-CD2 4.03Å; L89-L121 HydrophobicContact CD1-CD1 3.88Å; L89-L121 HydrophobicContact CD2-CD2 3.99Å; M110-L121 HydrophobicContact CE-CD2 4.04Å; M110-L121 HydrophobicContact SD-CD1 4.43Å; C115-L121 HydrophobicContact CB-CB 4.3Å; C117-L121 PolarHBondContact O-N 3.33Å; T118-L121 PolarHBondContact O-N 2.89Å; T118-L121 VanDerWaalsContact O-N 3.17Å; E119-L121 VanDerWaalsContact C-N 3.33Å; E119-L121 PolarHBondContact O-N 3.42Å; L121-N123 VanDerWaalsContact C-N 3.28Å; L121-N123 PolarHBondContact O-N 2.95Å; L121-K124 WeakPolarHBondContact O-CA 3.39Å; L121-K124 WeakPolarHBondContact O-CB 3.44Å; L121-K124 PolarHBondContact O-N 3.32Å; L121-F125 HydrophobicContact CG-CE1 4.18Å; L121-F125 VanDerWaalsContact O-CD1 3.29Å; L121-F125 WeakPolarHBondContact O-CD1 3.32Å; L121-F125 PolarHBondContact O-N 3.1Å; L121-L128 HydrophobicContact CD1-CD1 4.37Å
122	Q	98.1	Very high	97.4	Very high	74 Å²	74	55.3 Å²	55.3	35%	0.346	28%	0.28	S	S	.	.	H	α-helix	trans	-57.9	-41.7	174.7	-75.2	176.3	-32.3	0	0	111.5	I77 T118 E119 K124 F125	I77-Q122 VanDerWaalsContact C-NE2 3.29Å; I77-Q122 HydrophobicContact CB-CG 4.49Å; I77-Q122 PolarHBondContact O-NE2 3.2Å; T118-Q122 HydrophobicContact CG2-CG 4.41Å; T118-Q122 WeakPolarHBondContact O-CG 3.09Å; T118-Q122 PolarHBondContact O-N 3.32Å; E119-Q122 PolarHBondContact O-N 3.19Å; Q122-K124 PolarHBondContact O-N 2.77Å; Q122-K124 VanDerWaalsContact O-N 3.14Å; Q122-F125 HydrophobicContact CG-CE2 4.12Å; Q122-F125 HydrophobicContact CG-CZ 4Å; Q122-F125 WeakPolarHBondContact O-CB 3.45Å; Q122-F125 WeakPolarHBondContact O-CG 3.27Å; Q122-F125 PolarHBondContact O-N 3Å
123	N	97.5	Very high	97.2	Very high	135 Å²	135	57.3 Å²	57.3	72%	0.722	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.5	174.1	-70.9	-30.7	0	0	0	113.7	E119 K120 L121	E119-N123 VanDerWaalsContact O-CG 3.25Å; E119-N123 PolarHBondContact O-N 2.92Å; E119-N123 PolarHBondContact O-ND2 3.4Å; E119-N123 VanDerWaalsContact O-ND2 3.12Å; K120-N123 PolarHBondContact O-N 3Å; L121-N123 VanDerWaalsContact C-N 3.28Å; L121-N123 PolarHBondContact O-N 2.95Å
124	K	97.6	Very high	97	Very high	77 Å²	77	60.6 Å²	60.6	34%	0.335	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.3	173.7	-67.9	-65.3	-175.2	177	0	113.8	L113 K120 L121 Q122 D126 F127 L128	L113-K124 VanDerWaalsContact O-CE 3.27Å; L113-K124 WeakPolarHBondContact O-CE 3.31Å; K120-K124 WeakPolarHBondContact O-CG 3.46Å; K120-K124 PolarHBondContact O-N 3.44Å; L121-K124 WeakPolarHBondContact O-CA 3.39Å; L121-K124 WeakPolarHBondContact O-CB 3.44Å; L121-K124 PolarHBondContact O-N 3.32Å; Q122-K124 PolarHBondContact O-N 2.77Å; Q122-K124 VanDerWaalsContact O-N 3.14Å; K124-D126 VanDerWaalsContact C-N 3.32Å; K124-D126 PolarHBondContact O-N 3.3Å; K124-F127 HydrophobicContact CD-CB 4.43Å; K124-F127 HydrophobicContact CD-CD1 4.41Å; K124-F127 CarbonylContact O-C 3.24Å; K124-F127 WeakPolarHBondContact O-CA 3.41Å; K124-F127 WeakPolarHBondContact O-CB 3.35Å; K124-F127 PolarHBondContact O-N 3.31Å; K124-L128 WeakPolarHBondContact O-CG 3.13Å; K124-L128 PolarHBondContact O-N 2.93Å
125	F	97.9	Very high	96.9	Very high	22 Å²	22	62.6 Å²	62.6	10%	0.096	31%	0.314	C	S	.	.	H	α-helix	trans	-57.1	-42.4	-176.6	-75.9	1.1	0	0	0	113.2	I77 V79 I85 L121 Q122 F127 L128 R129	I77-F125 HydrophobicContact CB-CZ 4.02Å; I77-F125 HydrophobicContact CD1-CE1 4.48Å; I77-F125 HydrophobicContact CD1-CZ 4.17Å; I77-F125 HydrophobicContact CG1-CZ 4.12Å; I77-F125 WeakPolarHBondContact O-CZ 3.15Å; V79-F125 HydrophobicContact CG1-CE2 3.82Å; V79-F125 HydrophobicContact CG1-CZ 3.96Å; I85-F125 HydrophobicContact CD1-CB 4.44Å; I85-F125 HydrophobicContact CG2-CD1 3.95Å; I85-F125 HydrophobicContact CG2-CE1 3.86Å; I85-F125 HydrophobicContact CG2-CG 4.49Å; I85-F125 HydrophobicContact CG2-CZ 4.35Å; L121-F125 HydrophobicContact CG-CE1 4.18Å; L121-F125 VanDerWaalsContact O-CD1 3.29Å; L121-F125 WeakPolarHBondContact O-CD1 3.32Å; L121-F125 PolarHBondContact O-N 3.1Å; Q122-F125 HydrophobicContact CG-CE2 4.12Å; Q122-F125 HydrophobicContact CG-CZ 4Å; Q122-F125 WeakPolarHBondContact O-CB 3.45Å; Q122-F125 WeakPolarHBondContact O-CG 3.27Å; Q122-F125 PolarHBondContact O-N 3Å; F125-F127 VanDerWaalsContact C-N 3.32Å; F125-F127 PolarHBondContact O-N 2.96Å; F125-L128 HydrophobicContact CD1-CD1 4.38Å; F125-L128 PolarHBondContact O-N 3.39Å; F125-R129 WeakPolarHBondContact O-CG 3.34Å; F125-R129 PolarHBondContact O-N 3.32Å
126	D	97.3	Very high	96.8	Very high	113 Å²	113	66.1 Å²	66.1	60%	0.604	34%	0.338	S	S	*	.	H	α-helix	trans	-67.7	-34.5	177.7	-68.4	-25.5	0	0	0	112.4	K124 R129 S130	K124-D126 VanDerWaalsContact C-N 3.32Å; K124-D126 PolarHBondContact O-N 3.3Å; D126-R129 PolarHBondContact O-N 3.49Å; D126-R129 IonicContact OD1-NH1 3.83Å; D126-R129 PolarHBondContact OD1-NH1 3.47Å; D126-S130 WeakPolarHBondContact O-CB 3.43Å; D126-S130 PolarHBondContact O-N 3.27Å
127	F	97.3	Very high	96.6	Very high	86 Å²	86	67.2 Å²	67.2	38%	0.377	35%	0.346	S	S	.	.	H	α-helix	trans	-64.6	-41.7	171.1	167.9	-99.9	0	0	0	111.9	L113 K124 F125 S130 Q131	L113-F127 HydrophobicContact CD2-CD1 4.33Å; L113-F127 HydrophobicContact CD2-CE1 3.84Å; K124-F127 HydrophobicContact CD-CB 4.43Å; K124-F127 HydrophobicContact CD-CD1 4.41Å; K124-F127 CarbonylContact O-C 3.24Å; K124-F127 WeakPolarHBondContact O-CA 3.41Å; K124-F127 WeakPolarHBondContact O-CB 3.35Å; K124-F127 PolarHBondContact O-N 3.31Å; F125-F127 VanDerWaalsContact C-N 3.32Å; F125-F127 PolarHBondContact O-N 2.96Å; F127-S130 PolarHBondContact O-N 3.47Å; F127-S130 PolarHBondContact O-OG 3.4Å; F127-Q131 WeakPolarHBondContact O-CG 3.33Å; F127-Q131 PolarHBondContact O-N 3.09Å
128	L	97.4	Very high	96.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-46.1	175.8	-64.5	175.7	0	0	0	110.6	I85 V88 L89 K92 L113 L121 K124 F125 S130 Q131	I85-L128 HydrophobicContact CD1-CB 4.24Å; I85-L128 HydrophobicContact CG2-CD1 4.16Å; V88-L128 HydrophobicContact CG1-CB 4.07Å; V88-L128 HydrophobicContact CG1-CD2 4.18Å; V88-L128 WeakPolarHBondContact CG1-O 3.39Å; L89-L128 HydrophobicContact CB-CD1 4.46Å; L89-L128 HydrophobicContact CD1-CD1 4.4Å; K92-L128 HydrophobicContact CG-CD2 3.89Å; L113-L128 HydrophobicContact CD1-CD2 4.47Å; L113-L128 HydrophobicContact CD2-CD2 4.17Å; L121-L128 HydrophobicContact CD1-CD1 4.37Å; K124-L128 WeakPolarHBondContact O-CG 3.13Å; K124-L128 PolarHBondContact O-N 2.93Å; F125-L128 HydrophobicContact CD1-CD1 4.38Å; F125-L128 PolarHBondContact O-N 3.39Å; L128-S130 VanDerWaalsContact C-N 3.28Å; L128-S130 PolarHBondContact O-N 2.9Å; L128-Q131 WeakPolarHBondContact O-CB 3.5Å; L128-Q131 WeakPolarHBondContact O-CG 3.36Å; L128-Q131 PolarHBondContact O-N 3.45Å
129	R	96.1	Very high	96.6	Very high	108 Å²	108	69.2 Å²	69.2	41%	0.408	35%	0.349	S	S	.	.	H	α-helix	trans	-58.9	-39.8	175.4	-67.9	178.6	-170.5	121.3	2.3	112.2	I85 F125 D126 Q131 L132	I85-R129 HydrophobicContact CD1-CG 3.39Å; F125-R129 WeakPolarHBondContact O-CG 3.34Å; F125-R129 PolarHBondContact O-N 3.32Å; D126-R129 PolarHBondContact O-N 3.49Å; D126-R129 IonicContact OD1-NH1 3.83Å; D126-R129 PolarHBondContact OD1-NH1 3.47Å; R129-Q131 PolarHBondContact O-N 2.9Å; R129-L132 WeakPolarHBondContact O-CB 3.29Å; R129-L132 PolarHBondContact O-N 3.37Å
130	S	96.4	Very high	96.6	Very high	49 Å²	49	66.7 Å²	66.7	34%	0.343	34%	0.34	S	S	.	.	H	α-helix	trans	-64.2	-23.3	-177.9	79.1	0	0	0	0	113.1	D126 F127 L128 L132 N133	D126-S130 WeakPolarHBondContact O-CB 3.43Å; D126-S130 PolarHBondContact O-N 3.27Å; F127-S130 PolarHBondContact O-N 3.47Å; F127-S130 PolarHBondContact O-OG 3.4Å; L128-S130 VanDerWaalsContact C-N 3.28Å; L128-S130 PolarHBondContact O-N 2.9Å; S130-L132 PolarHBondContact O-N 3.48Å; S130-N133 WeakPolarHBondContact O-CB 3.37Å; S130-N133 PolarHBondContact O-N 3.17Å; S130-N133 VanDerWaalsContact O-N 3.12Å
131	Q	95.7	Very high	96.6	Very high	30 Å²	30	64.7 Å²	64.7	14%	0.14	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-26	173.3	-54.5	-59.6	-85.1	0	0	112.6	V88 W91 F127 L128 R129 N133 S137 I141	V88-Q131 HydrophobicContact CG1-CB 4.26Å; V88-Q131 HydrophobicContact CG1-CG 4.35Å; W91-Q131 HydrophobicContact CZ3-CB 4.4Å; W91-Q131 HydrophobicContact CZ3-CG 4.37Å; F127-Q131 WeakPolarHBondContact O-CG 3.33Å; F127-Q131 PolarHBondContact O-N 3.09Å; L128-Q131 WeakPolarHBondContact O-CB 3.5Å; L128-Q131 WeakPolarHBondContact O-CG 3.36Å; L128-Q131 PolarHBondContact O-N 3.45Å; R129-Q131 PolarHBondContact O-N 2.9Å; Q131-N133 VanDerWaalsContact C-N 3.31Å; Q131-S137 WeakPolarHBondContact O-CB 3.28Å; Q131-I141 HydrophobicContact CB-CD1 4.13Å
132	L	95.4	Very high	96.6	Very high	34 Å²	34	64.7 Å²	64.7	18%	0.178	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-13.6	179.2	-61.7	165.2	0	0	0	113.1	I84 V88 R129 S130 F138 I141	I84-L132 HydrophobicContact CD1-CD1 4.33Å; I84-L132 HydrophobicContact CG1-CD1 3.52Å; V88-L132 HydrophobicContact CG2-CD1 3.88Å; V88-L132 HydrophobicContact CG2-CD2 3.76Å; V88-L132 HydrophobicContact CG2-CG 3.83Å; R129-L132 WeakPolarHBondContact O-CB 3.29Å; R129-L132 PolarHBondContact O-N 3.37Å; S130-L132 PolarHBondContact O-N 3.48Å; L132-F138 HydrophobicContact CB-CD2 4.24Å; L132-F138 HydrophobicContact CD2-CD2 3.96Å; L132-F138 HydrophobicContact CD2-CE2 4.31Å; L132-F138 WeakPolarHBondContact O-CD2 3.44Å; L132-I141 HydrophobicContact CD2-CD1 3.87Å; L132-I141 HydrophobicContact CD2-CG2 4.18Å
133	N	94.1	Very high	96.6	Very high	138 Å²	138	65.7 Å²	65.7	74%	0.738	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-22.6	179.6	-62.9	-26.7	0	0	0	112.2	S130 Q131	S130-N133 WeakPolarHBondContact O-CB 3.37Å; S130-N133 PolarHBondContact O-N 3.17Å; S130-N133 VanDerWaalsContact O-N 3.12Å; Q131-N133 VanDerWaalsContact C-N 3.31Å
134	D	93.6	Very high	96.6	Very high	78 Å²	78	61.1 Å²	61.1	42%	0.417	31%	0.305	S	S	.	.	S	Bend	trans	-81.6	128.7	174.2	171.6	55.6	0	0	0	110.6	S136 S137 F138	D134-S136 VanDerWaalsContact C-N 3.33Å; D134-S136 PolarHBondContact O-N 3.36Å; D134-S136 WeakPolarHBondContact OD2-CB 3.41Å; D134-S136 PolarHBondContact OD2-N 3.46Å; D134-S137 PolarHBondContact O-N 2.81Å; D134-S137 WeakPolarHBondContact OD2-CB 3.49Å; D134-S137 PolarHBondContact OD2-N 3.05Å; D134-S137 PolarHBondContact OD2-OG 3.12Å; D134-F138 VanDerWaalsContact O-CB 3.26Å; D134-F138 WeakPolarHBondContact O-CB 3.48Å; D134-F138 PolarHBondContact O-N 2.86Å
135	I	94.2	Very high	96.7	Very high	148 Å²	148	57.4 Å²	57.4	76%	0.759	29%	0.289	S	S	*	.	H	α-helix	trans	-62.8	-40.9	-174.2	-62.1	172.3	0	0	0	111.2	K139	I135-K139 WeakPolarHBondContact O-CB 3.07Å; I135-K139 PolarHBondContact O-N 3.08Å
136	S	95.7	Very high	96.7	Very high	74 Å²	74	56.4 Å²	56.4	52%	0.517	28%	0.284	S	S	.	.	H	α-helix	trans	-68.3	-48.3	-179.1	-172.7	0	0	0	0	111	D134 K139 N140	D134-S136 VanDerWaalsContact C-N 3.33Å; D134-S136 PolarHBondContact O-N 3.36Å; D134-S136 WeakPolarHBondContact OD2-CB 3.41Å; D134-S136 PolarHBondContact OD2-N 3.46Å; S136-K139 PolarHBondContact O-N 2.82Å; S136-N140 VanDerWaalsContact O-CG 3.32Å; S136-N140 PolarHBondContact O-N 2.85Å; S136-N140 PolarHBondContact O-ND2 2.96Å
137	S	95.7	Very high	96.7	Very high	23 Å²	23	53.7 Å²	53.7	16%	0.161	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-45.3	177.4	-59.3	0	0	0	0	111.5	Q131 D134 K139 N140 I141	Q131-S137 WeakPolarHBondContact O-CB 3.28Å; D134-S137 PolarHBondContact O-N 2.81Å; D134-S137 WeakPolarHBondContact OD2-CB 3.49Å; D134-S137 PolarHBondContact OD2-N 3.05Å; D134-S137 PolarHBondContact OD2-OG 3.12Å; S137-K139 VanDerWaalsContact C-N 3.34Å; S137-K139 PolarHBondContact O-N 3.45Å; S137-N140 PolarHBondContact O-N 3.05Å; S137-N140 VanDerWaalsContact O-N 3.15Å; S137-I141 VanDerWaalsContact O-CG1 3.29Å; S137-I141 WeakPolarHBondContact O-CG1 3.36Å; S137-I141 PolarHBondContact O-N 3.42Å
138	F	97.3	Very high	96.7	Very high	16 Å²	16	50.3 Å²	50.3	7%	0.07	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-45.9	175.2	-175.4	-86.7	0	0	0	111.5	L132 D134 N140 I141 Y142 L169 L170 L201	L132-F138 HydrophobicContact CB-CD2 4.24Å; L132-F138 HydrophobicContact CD2-CD2 3.96Å; L132-F138 HydrophobicContact CD2-CE2 4.31Å; L132-F138 WeakPolarHBondContact O-CD2 3.44Å; D134-F138 VanDerWaalsContact O-CB 3.26Å; D134-F138 WeakPolarHBondContact O-CB 3.48Å; D134-F138 PolarHBondContact O-N 2.86Å; F138-N140 VanDerWaalsContact C-N 3.29Å; F138-N140 PolarHBondContact O-N 2.77Å; F138-I141 PolarHBondContact O-N 2.85Å; F138-Y142 HydrophobicContact CE1-CD2 4.25Å; F138-Y142 VanDerWaalsContact O-CB 3.25Å; F138-Y142 WeakPolarHBondContact O-CB 3.4Å; F138-Y142 PolarHBondContact O-N 3.09Å; F138-L169 HydrophobicContact CE2-CD2 4.37Å; F138-L169 HydrophobicContact CZ-CB 4.41Å; F138-L169 HydrophobicContact CZ-CD2 4.41Å; F138-L169 WeakPolarHBondContact CZ-O 3.34Å; F138-L170 HydrophobicContact CE1-CD2 4.23Å; F138-L170 HydrophobicContact CZ-CD2 3.95Å; F138-L201 HydrophobicContact CD1-CD1 4.27Å; F138-L201 HydrophobicContact CE1-CD1 3.68Å
139	K	97.2	Very high	96.7	Very high	80 Å²	80	50.8 Å²	50.8	35%	0.348	26%	0.258	S	S	.	.	H	α-helix	trans	-60.3	-39.4	176.9	-174	169.1	-175.2	161.5	0	111.7	I135 S136 S137 R143 L201	I135-K139 WeakPolarHBondContact O-CB 3.07Å; I135-K139 PolarHBondContact O-N 3.08Å; S136-K139 PolarHBondContact O-N 2.82Å; S137-K139 VanDerWaalsContact C-N 3.34Å; S137-K139 PolarHBondContact O-N 3.45Å; K139-R143 VanDerWaalsContact CE-NH2 3.35Å; K139-R143 WeakPolarHBondContact O-CB 3.33Å; K139-R143 VanDerWaalsContact O-CG 3.23Å; K139-R143 WeakPolarHBondContact O-CG 3.49Å; K139-R143 PolarHBondContact O-N 3.43Å; K139-L201 HydrophobicContact CB-CD2 4.48Å; K139-L201 HydrophobicContact CG-CD2 4.18Å
140	N	97.7	Very high	96.7	Very high	74 Å²	74	48.6 Å²	48.6	40%	0.396	25%	0.25	S	S	.	.	H	α-helix	trans	-68	-45.2	176.7	-68.2	-27.5	0	0	0	112.1	S136 S137 F138 R143 Y144	S136-N140 VanDerWaalsContact O-CG 3.32Å; S136-N140 PolarHBondContact O-N 2.85Å; S136-N140 PolarHBondContact O-ND2 2.96Å; S137-N140 PolarHBondContact O-N 3.05Å; S137-N140 VanDerWaalsContact O-N 3.15Å; F138-N140 VanDerWaalsContact C-N 3.29Å; F138-N140 PolarHBondContact O-N 2.77Å; N140-R143 PolarHBondContact O-N 2.93Å; N140-Y144 VanDerWaalsContact O-CB 3.3Å; N140-Y144 WeakPolarHBondContact O-CB 3.37Å; N140-Y144 PolarHBondContact O-N 2.89Å
141	I	98.2	Very high	96.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-44.9	176.3	-67.4	161.1	0	0	0	110.5	L87 V88 W91 Q131 L132 S137 F138 R143 Y144 A145 L169	L87-I141 HydrophobicContact CD2-CG2 4.44Å; L87-I141 HydrophobicContact CG-CG2 4.38Å; V88-I141 HydrophobicContact CG1-CD1 4.41Å; V88-I141 HydrophobicContact CG2-CD1 4.36Å; W91-I141 HydrophobicContact CB-CG1 4.42Å; W91-I141 HydrophobicContact CD2-CD1 4.27Å; W91-I141 HydrophobicContact CD2-CG1 3.5Å; W91-I141 VanDerWaalsContact CD2-CG1 3.5Å; W91-I141 HydrophobicContact CE3-CD1 3.91Å; W91-I141 HydrophobicContact CE3-CG1 3.66Å; W91-I141 HydrophobicContact CG-CG1 3.82Å; W91-I141 HydrophobicContact CH2-CG1 4.45Å; W91-I141 HydrophobicContact CZ2-CG1 4.35Å; W91-I141 HydrophobicContact CZ3-CD1 4.04Å; W91-I141 HydrophobicContact CZ3-CG1 4.12Å; Q131-I141 HydrophobicContact CB-CD1 4.13Å; L132-I141 HydrophobicContact CD2-CD1 3.87Å; L132-I141 HydrophobicContact CD2-CG2 4.18Å; S137-I141 VanDerWaalsContact O-CG1 3.29Å; S137-I141 WeakPolarHBondContact O-CG1 3.36Å; S137-I141 PolarHBondContact O-N 3.42Å; F138-I141 PolarHBondContact O-N 2.85Å; I141-R143 VanDerWaalsContact C-N 3.34Å; I141-R143 PolarHBondContact O-N 3.31Å; I141-Y144 PolarHBondContact O-N 2.96Å; I141-A145 PolarHBondContact O-N 3.3Å; I141-L169 HydrophobicContact CG2-CD2 4.22Å
142	Y	98.4	Very high	96.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-44.1	177.5	-176.1	-84.6	0	0	0	111.9	F138 L166 L169 L170 W197 L201	F138-Y142 HydrophobicContact CE1-CD2 4.25Å; F138-Y142 VanDerWaalsContact O-CB 3.25Å; F138-Y142 WeakPolarHBondContact O-CB 3.4Å; F138-Y142 PolarHBondContact O-N 3.09Å; Y142-L166 HydrophobicContact CE2-CD2 3.96Å; Y142-L166 WeakPolarHBondContact OH-CD2 3.33Å; Y142-L169 HydrophobicContact CD2-CB 4.17Å; Y142-L169 HydrophobicContact CD2-CD1 3.76Å; Y142-L169 HydrophobicContact CD2-CG 4.39Å; Y142-L169 HydrophobicContact CE2-CB 4.46Å; Y142-L169 HydrophobicContact CE2-CD1 4.19Å; Y142-L169 HydrophobicContact CG-CD1 4.47Å; Y142-L170 HydrophobicContact CE2-CD1 3.96Å; Y142-L170 HydrophobicContact CE2-CD2 4.41Å; Y142-L170 HydrophobicContact CE2-CG 4.14Å; Y142-W197 AromaticContact CD1-CD1 3.93Å; Y142-W197 AromaticContact CD1-NE1 3.4Å; Y142-W197 AromaticContact CE1-CD1 3.36Å; Y142-W197 HydrophobicContact CE1-CD2 4.2Å; Y142-W197 AromaticContact CE1-CE2 3.65Å; Y142-W197 AromaticContact CE1-CG 3.99Å; Y142-W197 HydrophobicContact CE1-CG 3.99Å; Y142-W197 HydrophobicContact CE1-CZ2 4.34Å; Y142-W197 AromaticContact CE1-NE1 3.08Å; Y142-W197 VanDerWaalsContact CE1-O 3.27Å; Y142-W197 WeakPolarHBondContact CE1-O 3.48Å; Y142-W197 HydrophobicContact CE2-CZ2 4.08Å; Y142-W197 AromaticContact CZ-CE2 3.63Å; Y142-W197 AromaticContact CZ-CZ2 3.98Å; Y142-W197 AromaticContact CZ-NE1 3.59Å; Y142-W197 PolarHBondContact O-NE1 3.42Å; Y142-W197 PolarHBondContact OH-O 3.04Å; Y142-L201 HydrophobicContact CD1-CB 3.82Å; Y142-L201 HydrophobicContact CD1-CD2 3.66Å; Y142-L201 HydrophobicContact CD1-CG 4.28Å; Y142-L201 HydrophobicContact CD2-CB 4.39Å; Y142-L201 HydrophobicContact CD2-CD1 4.32Å; Y142-L201 HydrophobicContact CD2-CD2 4.39Å; Y142-L201 HydrophobicContact CE1-CB 3.48Å; Y142-L201 VanDerWaalsContact CE1-CB 3.48Å; Y142-L201 HydrophobicContact CE1-CD2 4.24Å; Y142-L201 HydrophobicContact CE1-CG 4.42Å; Y142-L201 HydrophobicContact CE2-CB 4.11Å; Y142-L201 HydrophobicContact CG-CB 4.27Å; Y142-L201 HydrophobicContact CG-CD1 4.49Å; Y142-L201 HydrophobicContact CG-CD2 3.76Å; Y142-L201 HydrophobicContact CG-CG 4.4Å
143	R	97.8	Very high	96	Very high	95 Å²	95	63.3 Å²	63.3	36%	0.358	32%	0.319	S	S	.	.	H	α-helix	trans	-68.1	-41.1	177.7	-73.5	179.8	167.6	-179.4	-6	112.3	K139 N140 I141 A145 F146 Y198	K139-R143 VanDerWaalsContact CE-NH2 3.35Å; K139-R143 WeakPolarHBondContact O-CB 3.33Å; K139-R143 VanDerWaalsContact O-CG 3.23Å; K139-R143 WeakPolarHBondContact O-CG 3.49Å; K139-R143 PolarHBondContact O-N 3.43Å; N140-R143 PolarHBondContact O-N 2.93Å; I141-R143 VanDerWaalsContact C-N 3.34Å; I141-R143 PolarHBondContact O-N 3.31Å; R143-A145 VanDerWaalsContact C-N 3.33Å; R143-F146 PolarHBondContact O-N 3.37Å; R143-Y198 HydrophobicContact CB-CE1 3.96Å; R143-Y198 HydrophobicContact CG-CD1 4.11Å; R143-Y198 HydrophobicContact CG-CE1 3.57Å; R143-Y198 HydrophobicContact CG-CE2 4.24Å
144	Y	98.3	Very high	96	Very high	38 Å²	38	61.5 Å²	61.5	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-43.8	175.7	163.7	-92.5	0	0	0	111.6	L87 A90 W91 A95 N140 I141 F146 D147 F148	L87-Y144 HydrophobicContact CD1-CD1 4.33Å; L87-Y144 HydrophobicContact CD1-CE1 4.17Å; A90-Y144 HydrophobicContact CB-CE1 4.33Å; A90-Y144 WeakPolarHBondContact CB-OH 3.48Å; A90-Y144 PolarHBondContact O-OH 3Å; A90-Y144 VanDerWaalsContact O-OH 3.13Å; W91-Y144 HydrophobicContact CB-CD1 3.75Å; W91-Y144 HydrophobicContact CB-CE1 3.77Å; W91-Y144 HydrophobicContact CB-CG 4.27Å; W91-Y144 AromaticContact CD1-CD1 3.97Å; W91-Y144 AromaticContact CD1-CD2 3.99Å; W91-Y144 AromaticContact CD1-CG 3.63Å; W91-Y144 HydrophobicContact CG-CD1 4.26Å; W91-Y144 HydrophobicContact CG-CG 4.35Å; A95-Y144 PolarHBondContact N-OH 3.26Å; A95-Y144 WeakPolarHBondContact O-CE2 2.94Å; A95-Y144 PolarHBondContact O-OH 3.09Å; N140-Y144 VanDerWaalsContact O-CB 3.3Å; N140-Y144 WeakPolarHBondContact O-CB 3.37Å; N140-Y144 PolarHBondContact O-N 2.89Å; I141-Y144 PolarHBondContact O-N 2.96Å; Y144-F146 PolarHBondContact O-N 2.84Å; Y144-F146 VanDerWaalsContact O-N 3.09Å; Y144-D147 PolarHBondContact O-N 2.88Å; Y144-F148 HydrophobicContact CD1-CB 4.17Å; Y144-F148 HydrophobicContact CE1-CB 3.7Å; Y144-F148 HydrophobicContact CE1-CD1 4.08Å; Y144-F148 HydrophobicContact CE1-CD2 4.16Å; Y144-F148 AromaticContact CE1-CG 3.73Å; Y144-F148 HydrophobicContact CE1-CG 3.73Å; Y144-F148 HydrophobicContact CE2-CB 4.21Å; Y144-F148 AromaticContact CZ-CD2 3.73Å; Y144-F148 AromaticContact CZ-CG 3.73Å; Y144-F148 WeakPolarHBondContact O-CB 3.3Å; Y144-F148 PolarHBondContact O-N 3.33Å; Y144-F148 WeakPolarHBondContact OH-CD2 3.31Å; Y144-F148 WeakPolarHBondContact OH-CE2 3.18Å
145	A	98.4	Very high	96.1	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-54	-34.6	-177.9	0	0	0	0	0	113.2	L87 I141 R143 A149 L169 W197	L87-A145 HydrophobicContact CD1-CB 3.87Å; L87-A145 HydrophobicContact CD2-CB 3.99Å; I141-A145 PolarHBondContact O-N 3.3Å; R143-A145 VanDerWaalsContact C-N 3.33Å; A145-A149 VanDerWaalsContact O-CB 3.25Å; A145-A149 WeakPolarHBondContact O-CB 3.48Å; A145-A149 PolarHBondContact O-N 3.32Å; A145-L169 HydrophobicContact CB-CD1 3.86Å; A145-W197 HydrophobicContact CB-CZ2 4.18Å
146	F	98.2	Very high	96.3	Very high	1 Å²	1	62.3 Å²	62.3	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-65.2	-48.1	176.1	179	-89.2	0	0	0	113	R143 Y144 F148 R150 L157 M192 K194 W197	R143-F146 PolarHBondContact O-N 3.37Å; Y144-F146 PolarHBondContact O-N 2.84Å; Y144-F146 VanDerWaalsContact O-N 3.09Å; F146-F148 VanDerWaalsContact C-N 3.34Å; F146-R150 WeakPolarHBondContact O-CB 3.49Å; F146-R150 PolarHBondContact O-N 3.38Å; F146-L157 HydrophobicContact CD2-CD1 3.65Å; F146-L157 HydrophobicContact CD2-CG 3.87Å; F146-L157 HydrophobicContact CE2-CD1 4.12Å; F146-L157 HydrophobicContact CE2-CG 3.9Å; F146-L157 HydrophobicContact CG-CD1 4.42Å; F146-M192 WeakPolarHBondContact CE2-O 3.49Å; F146-K194 HydrophobicContact CD1-CB 4.23Å; F146-K194 HydrophobicContact CD1-CD 4.24Å; F146-K194 HydrophobicContact CD1-CG 4.01Å; F146-K194 HydrophobicContact CE1-CB 3.62Å; F146-K194 HydrophobicContact CE1-CD 4.07Å; F146-K194 HydrophobicContact CE1-CG 3.87Å; F146-K194 HydrophobicContact CE2-CB 4.32Å; F146-K194 VanDerWaalsContact CZ-CA 3.48Å; F146-K194 HydrophobicContact CZ-CB 3.68Å; F146-K194 HydrophobicContact CZ-CG 4.36Å; F146-K194 VanDerWaalsContact CZ-N 3.31Å; F146-W197 HydrophobicContact CB-CD2 4.24Å; F146-W197 HydrophobicContact CB-CG 3.99Å; F146-W197 HydrophobicContact CD2-CB 3.67Å; F146-W197 HydrophobicContact CD2-CD2 4.01Å; F146-W197 HydrophobicContact CD2-CE3 4.38Å; F146-W197 AromaticContact CD2-CG 3.65Å; F146-W197 HydrophobicContact CD2-CG 3.65Å; F146-W197 HydrophobicContact CE2-CB 4.17Å; F146-W197 HydrophobicContact CG-CB 4.45Å; F146-W197 HydrophobicContact CG-CG 4.17Å
147	D	96.9	Very high	96.4	Very high	55 Å²	55	58.9 Å²	58.9	29%	0.294	27%	0.273	S	S	.	.	H	α-helix	trans	-73.2	-33	-178.3	-69.1	-49.4	0	0	0	110.6	Y144 R150 K194	Y144-D147 PolarHBondContact O-N 2.88Å; D147-R150 IonicContact OD1-CZ 2.89Å; D147-R150 IonicContact OD1-NE 3.08Å; D147-R150 IonicContact OD1-NH2 2.91Å; D147-R150 PolarHBondContact OD1-NH2 2.94Å; D147-K194 VanDerWaalsContact CG-NZ 3.35Å; D147-K194 IonicContact OD1-NZ 3.67Å; D147-K194 PolarHBondContact OD1-NZ 3.48Å; D147-K194 IonicContact OD2-NZ 2.76Å; D147-K194 PolarHBondContact OD2-NZ 2.85Å
148	F	97.5	Very high	96.4	Very high	16 Å²	16	61 Å²	61	7%	0.07	28%	0.283	C	S	.	.	H	α-helix	trans	-67.9	-42.2	177.2	174.7	-115.4	0	0	0	113.9	L87 A90 A95 S97 M98 Y144 F146	L87-F148 HydrophobicContact CD1-CD1 3.94Å; L87-F148 HydrophobicContact CD1-CE1 4.23Å; A90-F148 HydrophobicContact CB-CE1 3.97Å; A90-F148 HydrophobicContact CB-CE2 3.77Å; A90-F148 HydrophobicContact CB-CZ 3.43Å; A90-F148 VanDerWaalsContact CB-CZ 3.43Å; A95-F148 HydrophobicContact CB-CD2 4.4Å; A95-F148 HydrophobicContact CB-CE2 3.88Å; A95-F148 WeakPolarHBondContact O-CD2 3.29Å; S97-F148 VanDerWaalsContact C-CE2 3.4Å; S97-F148 WeakPolarHBondContact O-CE2 3.09Å; M98-F148 VanDerWaalsContact CA-CE2 3.49Å; M98-F148 VanDerWaalsContact CA-CZ 3.42Å; M98-F148 HydrophobicContact CB-CD1 4.06Å; M98-F148 HydrophobicContact CB-CD2 4.49Å; M98-F148 HydrophobicContact CB-CE1 3.79Å; M98-F148 HydrophobicContact CB-CE2 4.25Å; M98-F148 HydrophobicContact CB-CG 4.42Å; M98-F148 HydrophobicContact CB-CZ 3.92Å; M98-F148 WeakPolarHBondContact CB-O 3.47Å; M98-F148 HydrophobicContact CG-CD1 4.45Å; M98-F148 HydrophobicContact CG-CE1 3.87Å; M98-F148 HydrophobicContact CG-CZ 4.2Å; M98-F148 PolarHBondContact N-O 3.1Å; Y144-F148 HydrophobicContact CD1-CB 4.17Å; Y144-F148 HydrophobicContact CE1-CB 3.7Å; Y144-F148 HydrophobicContact CE1-CD1 4.08Å; Y144-F148 HydrophobicContact CE1-CD2 4.16Å; Y144-F148 AromaticContact CE1-CG 3.73Å; Y144-F148 HydrophobicContact CE1-CG 3.73Å; Y144-F148 HydrophobicContact CE2-CB 4.21Å; Y144-F148 AromaticContact CZ-CD2 3.73Å; Y144-F148 AromaticContact CZ-CG 3.73Å; Y144-F148 WeakPolarHBondContact O-CB 3.3Å; Y144-F148 PolarHBondContact O-N 3.33Å; Y144-F148 WeakPolarHBondContact OH-CD2 3.31Å; Y144-F148 WeakPolarHBondContact OH-CE2 3.18Å; F146-F148 VanDerWaalsContact C-N 3.34Å
149	A	97.6	Very high	96.4	Very high	9 Å²	9	61 Å²	61	7%	0.074	28%	0.283	C	S	.	.	H	α-helix	trans	-86.3	-6.4	-176.2	0	0	0	0	0	113.9	M98 A145 L157 T161 M165	M98-A149 HydrophobicContact CE-CB 4.18Å; M98-A149 HydrophobicContact SD-CB 4Å; A145-A149 VanDerWaalsContact O-CB 3.25Å; A145-A149 WeakPolarHBondContact O-CB 3.48Å; A145-A149 PolarHBondContact O-N 3.32Å; A149-L157 HydrophobicContact CB-CD2 3.74Å; A149-L157 WeakPolarHBondContact O-CD2 3.41Å; A149-T161 HydrophobicContact CB-CG2 3.9Å; A149-M165 HydrophobicContact CB-CG 4.03Å; A149-M165 HydrophobicContact CB-SD 4.36Å
150	R	95.7	Very high	96.4	Very high	63 Å²	63	61.7 Å²	61.7	24%	0.238	29%	0.291	C	S	.	.	S	Bend	trans	-93	137.7	-176.6	170.3	173.7	68	118.4	-6.5	110.9	F146 D147 Q154 L157	F146-R150 WeakPolarHBondContact O-CB 3.49Å; F146-R150 PolarHBondContact O-N 3.38Å; D147-R150 IonicContact OD1-CZ 2.89Å; D147-R150 IonicContact OD1-NE 3.08Å; D147-R150 IonicContact OD1-NH2 2.91Å; D147-R150 PolarHBondContact OD1-NH2 2.94Å; R150-Q154 WeakPolarHBondContact CD-O 3.46Å; R150-Q154 HydrophobicContact CG-CB 4.25Å; R150-Q154 PolarHBondContact NH1-O 3.46Å; R150-L157 HydrophobicContact CB-CD2 3.65Å; R150-L157 HydrophobicContact CB-CG 4.48Å
151	D	93.4	Very high	96.4	Very high	119 Å²	119	59.7 Å²	59.7	64%	0.636	28%	0.282	S	S	*	.			trans	-60.5	139.2	169.6	-67.4	-30	0	0	0	111.5	D153 Q154	D151-D153 PolarHBondContact O-N 3.15Å; D151-Q154 HydrophobicContact CB-CB 4.26Å; D151-Q154 HydrophobicContact CB-CG 3.87Å; D151-Q154 PolarHBondContact O-N 2.91Å
152	K	89.5	Confident	96.4	Very high	145 Å²	145	59.7 Å²	59.7	63%	0.63	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.3	-174	-67.2	-170.7	172.8	-167.4	0	113.8	E96 S97	E96-K152 IonicContact OE2-NZ 3.54Å; E96-K152 PolarHBondContact OE2-NZ 3.15Å; S97-K152 VanDerWaalsContact OG-CE 3.26Å; S97-K152 WeakPolarHBondContact OG-CE 3.49Å
153	D	91.7	Very high	96.4	Very high	157 Å²	157	60.5 Å²	60.5	84%	0.84	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-7.4	-178.2	-62.1	-39.9	0	0	0	114.3	D151	D151-D153 PolarHBondContact O-N 3.15Å
154	Q	94.2	Very high	96.3	Very high	101 Å²	101	57.8 Å²	57.8	47%	0.472	28%	0.281	S	S	.	.			trans	-98.2	154.5	-176.9	-63.1	-58.1	-31.7	0	0	111.5	R150 D151	R150-Q154 WeakPolarHBondContact CD-O 3.46Å; R150-Q154 HydrophobicContact CG-CB 4.25Å; R150-Q154 PolarHBondContact NH1-O 3.46Å; D151-Q154 HydrophobicContact CB-CB 4.26Å; D151-Q154 HydrophobicContact CB-CG 3.87Å; D151-Q154 PolarHBondContact O-N 2.91Å
155	R	95.5	Very high	96.3	Very high	218 Å²	218	57 Å²	57	82%	0.823	28%	0.279	S	S	*	.	S	Bend	trans	-104.1	2.5	174.4	-65.4	-175.9	-177.5	-175.6	1.1	113.4
156	S	97.3	Very high	96.3	Very high	24 Å²	24	57 Å²	57	17%	0.168	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	155.6	-174.9	52.6	0	0	0	0	110.2	M192	S156-M192 CarbonylContact C-O 3.54Å; S156-M192 WeakPolarHBondContact CA-O 3.27Å; S156-M192 VanDerWaalsContact CB-O 3.31Å; S156-M192 WeakPolarHBondContact CB-O 3.26Å
157	L	97.3	Very high	96.3	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	146.1	166.4	-66.3	173	0	0	0	109.3	F146 A149 R150 T161 A162 V191 M192 W197	F146-L157 HydrophobicContact CD2-CD1 3.65Å; F146-L157 HydrophobicContact CD2-CG 3.87Å; F146-L157 HydrophobicContact CE2-CD1 4.12Å; F146-L157 HydrophobicContact CE2-CG 3.9Å; F146-L157 HydrophobicContact CG-CD1 4.42Å; A149-L157 HydrophobicContact CB-CD2 3.74Å; A149-L157 WeakPolarHBondContact O-CD2 3.41Å; R150-L157 HydrophobicContact CB-CD2 3.65Å; R150-L157 HydrophobicContact CB-CG 4.48Å; L157-T161 HydrophobicContact CD2-CG2 4.38Å; L157-A162 HydrophobicContact CB-CB 4.03Å; L157-A162 HydrophobicContact CD1-CB 4.22Å; L157-V191 CarbonylContact O-C 3.6Å; L157-V191 WeakPolarHBondContact O-CA 3.39Å; L157-V191 VanDerWaalsContact O-CB 3.24Å; L157-V191 WeakPolarHBondContact O-CB 3.48Å; L157-M192 PolarHBondContact N-O 3.44Å; L157-M192 PolarHBondContact O-N 3.39Å; L157-W197 HydrophobicContact CD1-CE3 3.89Å; L157-W197 HydrophobicContact CD1-CZ3 3.89Å
158	D	97.2	Very high	96.2	Very high	69 Å²	69	58.3 Å²	58.3	37%	0.369	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	154.2	162.4	71.6	90.5	0	0	0	110	D160 T161 A162	D158-D160 VanDerWaalsContact C-N 3.28Å; D158-D160 PolarHBondContact O-N 2.89Å; D158-D160 PolarHBondContact OD1-N 3.12Å; D158-D160 VanDerWaalsContact OD1-N 3.09Å; D158-T161 VanDerWaalsContact CG-OG1 3.26Å; D158-T161 PolarHBondContact OD1-N 3.12Å; D158-T161 PolarHBondContact OD1-OG1 3.31Å; D158-T161 WeakPolarHBondContact OD2-CB 3.23Å; D158-T161 PolarHBondContact OD2-OG1 3.32Å; D158-A162 WeakPolarHBondContact O-CB 3.44Å; D158-A162 PolarHBondContact O-N 3.14Å
159	I	97.5	Very high	96.2	Very high	14 Å²	14	57.8 Å²	57.8	7%	0.072	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-28.5	-171.9	-165.3	59.7	0	0	0	113.1	K163 L184 R190 M192	I159-K163 WeakPolarHBondContact O-CB 3.44Å; I159-K163 WeakPolarHBondContact O-CE 3.45Å; I159-K163 VanDerWaalsContact O-CG 3.28Å; I159-K163 WeakPolarHBondContact O-CG 3.41Å; I159-K163 PolarHBondContact O-N 3.48Å; I159-L184 HydrophobicContact CD1-CB 4.44Å; I159-L184 HydrophobicContact CD1-CD1 4.29Å; I159-L184 HydrophobicContact CD1-CD2 4.23Å; I159-R190 PolarHBondContact N-O 3.2Å; I159-M192 HydrophobicContact CD1-CE 4.48Å
160	D	97.1	Very high	96.2	Very high	95 Å²	95	57.4 Å²	57.4	51%	0.508	29%	0.285	S	S	.	.	H	α-helix	trans	-74.9	-46	-178.7	-68.5	-44	0	0	0	110.5	D158 A162 K163 S164	D158-D160 VanDerWaalsContact C-N 3.28Å; D158-D160 PolarHBondContact O-N 2.89Å; D158-D160 PolarHBondContact OD1-N 3.12Å; D158-D160 VanDerWaalsContact OD1-N 3.09Å; D160-A162 VanDerWaalsContact C-N 3.35Å; D160-A162 PolarHBondContact O-N 3.26Å; D160-K163 WeakPolarHBondContact O-CB 3.45Å; D160-K163 PolarHBondContact O-N 2.96Å; D160-K163 WeakPolarHBondContact OD1-CE 3.44Å; D160-K163 IonicContact OD1-NZ 2.63Å; D160-K163 PolarHBondContact OD1-NZ 3.03Å; D160-S164 PolarHBondContact O-N 2.86Å; D160-S164 PolarHBondContact O-OG 3.2Å
161	T	96.7	Very high	96.3	Very high	33 Å²	33	56 Å²	56	20%	0.202	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-43.5	171.4	-58.8	0	0	0	0	111.7	M98 A149 L157 D158 K163 S164 M165	M98-T161 HydrophobicContact CE-CG2 3.97Å; A149-T161 HydrophobicContact CB-CG2 3.9Å; L157-T161 HydrophobicContact CD2-CG2 4.38Å; D158-T161 VanDerWaalsContact CG-OG1 3.26Å; D158-T161 PolarHBondContact OD1-N 3.12Å; D158-T161 PolarHBondContact OD1-OG1 3.31Å; D158-T161 WeakPolarHBondContact OD2-CB 3.23Å; D158-T161 PolarHBondContact OD2-OG1 3.32Å; T161-K163 PolarHBondContact O-N 3.27Å; T161-S164 PolarHBondContact O-N 3.39Å; T161-M165 HydrophobicContact CG2-CG 4.43Å; T161-M165 WeakPolarHBondContact O-CB 3.45Å; T161-M165 WeakPolarHBondContact O-CG 3.47Å; T161-M165 PolarHBondContact O-N 3.15Å
162	A	98.1	Very high	96.2	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-46.2	177.4	0	0	0	0	0	111.6	L157 D158 D160 S164 M165 L166 M192 W197	L157-A162 HydrophobicContact CB-CB 4.03Å; L157-A162 HydrophobicContact CD1-CB 4.22Å; D158-A162 WeakPolarHBondContact O-CB 3.44Å; D158-A162 PolarHBondContact O-N 3.14Å; D160-A162 VanDerWaalsContact C-N 3.35Å; D160-A162 PolarHBondContact O-N 3.26Å; A162-S164 PolarHBondContact O-N 3.06Å; A162-M165 PolarHBondContact O-N 3.41Å; A162-L166 WeakPolarHBondContact O-CB 3.49Å; A162-L166 VanDerWaalsContact O-CG 3.23Å; A162-L166 WeakPolarHBondContact O-CG 3.33Å; A162-L166 PolarHBondContact O-N 3.11Å; A162-M192 HydrophobicContact CB-CB 3.99Å; A162-M192 HydrophobicContact CB-CE 4.47Å; A162-M192 HydrophobicContact CB-SD 4.4Å; A162-W197 HydrophobicContact CB-CZ3 4.26Å
163	K	97.9	Very high	96.4	Very high	17 Å²	17	58.6 Å²	58.6	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-58	-47.6	175.7	-85.1	-174.8	-56	173	0	111.8	I159 D160 T161 L166 A167 Y181 L184 E185	I159-K163 WeakPolarHBondContact O-CB 3.44Å; I159-K163 WeakPolarHBondContact O-CE 3.45Å; I159-K163 VanDerWaalsContact O-CG 3.28Å; I159-K163 WeakPolarHBondContact O-CG 3.41Å; I159-K163 PolarHBondContact O-N 3.48Å; D160-K163 WeakPolarHBondContact O-CB 3.45Å; D160-K163 PolarHBondContact O-N 2.96Å; D160-K163 WeakPolarHBondContact OD1-CE 3.44Å; D160-K163 IonicContact OD1-NZ 2.63Å; D160-K163 PolarHBondContact OD1-NZ 3.03Å; T161-K163 PolarHBondContact O-N 3.27Å; K163-L166 PolarHBondContact O-N 2.85Å; K163-A167 WeakPolarHBondContact O-CB 3.49Å; K163-A167 PolarHBondContact O-N 3.45Å; K163-Y181 HydrophobicContact CB-CD2 4.2Å; K163-Y181 HydrophobicContact CB-CE2 3.58Å; K163-Y181 HydrophobicContact CD-CD2 4.5Å; K163-Y181 HydrophobicContact CD-CE1 4.19Å; K163-Y181 HydrophobicContact CD-CE2 4.15Å; K163-Y181 HydrophobicContact CG-CD2 4.25Å; K163-Y181 HydrophobicContact CG-CE2 4.01Å; K163-L184 HydrophobicContact CD-CB 4.1Å; K163-L184 HydrophobicContact CG-CB 4.1Å; K163-L184 HydrophobicContact CG-CD1 3.9Å; K163-E185 HydrophobicContact CD-CG 4.11Å
164	S	96.9	Very high	96.7	Very high	38 Å²	38	51.7 Å²	51.7	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-61.6	-47	178.5	-64.9	0	0	0	0	111.6	D160 T161 A162 L166 A167 L168	D160-S164 PolarHBondContact O-N 2.86Å; D160-S164 PolarHBondContact O-OG 3.2Å; T161-S164 PolarHBondContact O-N 3.39Å; A162-S164 PolarHBondContact O-N 3.06Å; S164-L166 PolarHBondContact O-N 3.03Å; S164-A167 WeakPolarHBondContact O-CB 3.44Å; S164-A167 PolarHBondContact O-N 2.89Å; S164-A167 VanDerWaalsContact O-N 3.15Å; S164-L168 WeakPolarHBondContact O-CG 3.36Å; S164-L168 PolarHBondContact O-N 3.34Å; S164-L168 VanDerWaalsContact O-N 3.12Å
165	M	97.7	Very high	96.8	Very high	20 Å²	20	51.8 Å²	51.8	10%	0.099	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-41.7	177.4	-72.3	-70.3	139.3	0	0	112.6	L87 M98 A149 T161 A162 A167 L168 L169 W197	L87-M165 HydrophobicContact CD1-SD 4.47Å; L87-M165 HydrophobicContact CD2-SD 4.5Å; M98-M165 HydrophobicContact SD-CE 3.41Å; M98-M165 WeakPolarHBondContact SD-CE 3.41Å; A149-M165 HydrophobicContact CB-CG 4.03Å; A149-M165 HydrophobicContact CB-SD 4.36Å; T161-M165 HydrophobicContact CG2-CG 4.43Å; T161-M165 WeakPolarHBondContact O-CB 3.45Å; T161-M165 WeakPolarHBondContact O-CG 3.47Å; T161-M165 PolarHBondContact O-N 3.15Å; A162-M165 PolarHBondContact O-N 3.41Å; M165-A167 VanDerWaalsContact C-N 3.31Å; M165-A167 PolarHBondContact O-N 3.45Å; M165-L168 HydrophobicContact CE-CD1 4.35Å; M165-L168 PolarHBondContact O-N 2.93Å; M165-L169 WeakPolarHBondContact O-CG 3.48Å; M165-L169 PolarHBondContact O-N 2.86Å; M165-L169 VanDerWaalsContact O-N 3.12Å; M165-W197 HydrophobicContact CB-CH2 3.52Å; M165-W197 HydrophobicContact CB-CZ2 4.42Å; M165-W197 HydrophobicContact CB-CZ3 4.2Å
166	L	98.2	Very high	96.9	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-35.1	175.1	-67.1	171.6	0	0	0	111.8	Y142 A162 K163 S164 L168 L169 L170 G171 F177 F180 L184 M192 W197 V200	Y142-L166 HydrophobicContact CE2-CD2 3.96Å; Y142-L166 WeakPolarHBondContact OH-CD2 3.33Å; A162-L166 WeakPolarHBondContact O-CB 3.49Å; A162-L166 VanDerWaalsContact O-CG 3.23Å; A162-L166 WeakPolarHBondContact O-CG 3.33Å; A162-L166 PolarHBondContact O-N 3.11Å; K163-L166 PolarHBondContact O-N 2.85Å; S164-L166 PolarHBondContact O-N 3.03Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 3.42Å; L166-L169 PolarHBondContact O-N 2.96Å; L166-L170 HydrophobicContact CD2-CD1 4.07Å; L166-L170 WeakPolarHBondContact O-CA 3.31Å; L166-L170 WeakPolarHBondContact O-CB 3.45Å; L166-L170 PolarHBondContact O-N 3.15Å; L166-G171 PolarHBondContact O-N 3.38Å; L166-F177 HydrophobicContact CB-CE2 3.66Å; L166-F177 HydrophobicContact CB-CZ 4.26Å; L166-F177 WeakPolarHBondContact O-CE2 3.23Å; L166-F180 HydrophobicContact CD1-CE1 4.06Å; L166-L184 HydrophobicContact CD1-CD1 4.28Å; L166-M192 HydrophobicContact CD1-CE 3.9Å; L166-M192 HydrophobicContact CD1-SD 4.23Å; L166-W197 HydrophobicContact CD1-CZ3 4.25Å; L166-W197 HydrophobicContact CD2-CD2 4.48Å; L166-W197 HydrophobicContact CD2-CE3 4.02Å; L166-W197 HydrophobicContact CD2-CH2 3.59Å; L166-W197 HydrophobicContact CD2-CZ2 4.14Å; L166-W197 HydrophobicContact CD2-CZ3 3.57Å; L166-W197 HydrophobicContact CG-CE3 4.25Å; L166-W197 HydrophobicContact CG-CH2 3.75Å; L166-W197 HydrophobicContact CG-CZ3 3.5Å; L166-W197 VanDerWaalsContact CG-CZ3 3.5Å; L166-V200 HydrophobicContact CD1-CG1 4.43Å; L166-V200 HydrophobicContact CD2-CG1 3.94Å
167	A	97.6	Very high	96.9	Very high	37 Å²	37	41.5 Å²	41.5	31%	0.306	23%	0.226	S	C	.	.	H	α-helix	trans	-62.3	-40.7	175.7	0	0	0	0	0	112.1	K163 S164 M165 G171 F177 Y181	K163-A167 WeakPolarHBondContact O-CB 3.49Å; K163-A167 PolarHBondContact O-N 3.45Å; S164-A167 WeakPolarHBondContact O-CB 3.44Å; S164-A167 PolarHBondContact O-N 2.89Å; S164-A167 VanDerWaalsContact O-N 3.15Å; M165-A167 VanDerWaalsContact C-N 3.31Å; M165-A167 PolarHBondContact O-N 3.45Å; A167-G171 WeakPolarHBondContact O-CA 3.38Å; A167-G171 PolarHBondContact O-N 3.3Å; A167-G171 VanDerWaalsContact O-N 3.11Å; A167-F177 HydrophobicContact CB-CE1 3.84Å; A167-F177 HydrophobicContact CB-CZ 3.62Å; A167-F177 VanDerWaalsContact N-CZ 3.29Å; A167-Y181 HydrophobicContact CB-CE2 4.42Å
168	L	96.5	Very high	96.9	Very high	46 Å²	46	45.4 Å²	45.4	24%	0.241	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-43.9	175	-61.5	179.2	0	0	0	112.2	E82 I84 S164 M165 L166	E82-L168 WeakPolarHBondContact O-CD2 3.34Å; I84-L168 HydrophobicContact CD1-CB 4.07Å; S164-L168 WeakPolarHBondContact O-CG 3.36Å; S164-L168 PolarHBondContact O-N 3.34Å; S164-L168 VanDerWaalsContact O-N 3.12Å; M165-L168 HydrophobicContact CE-CD1 4.35Å; M165-L168 PolarHBondContact O-N 2.93Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 3.42Å
169	L	97.7	Very high	96.9	Very high	6 Å²	6	43.3 Å²	43.3	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-83.7	-42.6	-171.3	-73.5	161.9	0	0	0	113.8	I84 L87 F138 I141 Y142 A145 M165 L166 W197	I84-L169 HydrophobicContact CD1-CD2 4.07Å; I84-L169 HydrophobicContact CD1-CG 4.44Å; L87-L169 HydrophobicContact CD2-CD1 4.05Å; L87-L169 HydrophobicContact CD2-CD2 3.73Å; L87-L169 HydrophobicContact CD2-CG 3.86Å; F138-L169 HydrophobicContact CE2-CD2 4.37Å; F138-L169 HydrophobicContact CZ-CB 4.41Å; F138-L169 HydrophobicContact CZ-CD2 4.41Å; F138-L169 WeakPolarHBondContact CZ-O 3.34Å; I141-L169 HydrophobicContact CG2-CD2 4.22Å; Y142-L169 HydrophobicContact CD2-CB 4.17Å; Y142-L169 HydrophobicContact CD2-CD1 3.76Å; Y142-L169 HydrophobicContact CD2-CG 4.39Å; Y142-L169 HydrophobicContact CE2-CB 4.46Å; Y142-L169 HydrophobicContact CE2-CD1 4.19Å; Y142-L169 HydrophobicContact CG-CD1 4.47Å; A145-L169 HydrophobicContact CB-CD1 3.86Å; M165-L169 WeakPolarHBondContact O-CG 3.48Å; M165-L169 PolarHBondContact O-N 2.86Å; M165-L169 VanDerWaalsContact O-N 3.12Å; L166-L169 PolarHBondContact O-N 2.96Å; L169-W197 HydrophobicContact CD1-CH2 4.27Å; L169-W197 HydrophobicContact CD1-CZ2 3.78Å
170	L	97.5	Very high	96.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-114.9	-13.3	-169.7	-60.6	-178.7	0	0	0	113.3	F138 Y142 L166 R172 T173 W174 F177 V200 L201	F138-L170 HydrophobicContact CE1-CD2 4.23Å; F138-L170 HydrophobicContact CZ-CD2 3.95Å; Y142-L170 HydrophobicContact CE2-CD1 3.96Å; Y142-L170 HydrophobicContact CE2-CD2 4.41Å; Y142-L170 HydrophobicContact CE2-CG 4.14Å; L166-L170 HydrophobicContact CD2-CD1 4.07Å; L166-L170 WeakPolarHBondContact O-CA 3.31Å; L166-L170 WeakPolarHBondContact O-CB 3.45Å; L166-L170 PolarHBondContact O-N 3.15Å; L170-R172 PolarHBondContact O-N 3.25Å; L170-T173 PolarHBondContact O-N 3.01Å; L170-W174 HydrophobicContact CB-CB 4.13Å; L170-W174 HydrophobicContact CB-CE3 4.31Å; L170-W174 HydrophobicContact CD1-CE3 4.03Å; L170-W174 PolarHBondContact O-N 3.49Å; L170-F177 HydrophobicContact CB-CD2 4Å; L170-V200 HydrophobicContact CD1-CG1 3.92Å; L170-L201 HydrophobicContact CD2-CD1 4.25Å
171	G	96.3	Very high	96.9	Very high	35 Å²	35	41.3 Å²	41.3	36%	0.361	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.8	-171.9	0	0	0	0	0	115.8	L166 A167	L166-G171 PolarHBondContact O-N 3.38Å; A167-G171 WeakPolarHBondContact O-CA 3.38Å; A167-G171 PolarHBondContact O-N 3.3Å; A167-G171 VanDerWaalsContact O-N 3.11Å
172	R	92.7	Very high	97	Very high	245 Å²	245	42.8 Å²	42.8	93%	0.925	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-18.9	176.3	-61.2	-175.2	-177.6	-173.4	0.9	114.1	L170	L170-R172 PolarHBondContact O-N 3.25Å
173	T	93.6	Very high	97	Very high	73 Å²	73	43.2 Å²	43.2	45%	0.448	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-24.8	-166.1	57.4	0	0	0	0	113.5	L170	L170-T173 PolarHBondContact O-N 3.01Å
174	W	97	Very high	97	Very high	11 Å²	11	42.6 Å²	42.6	4%	0.042	23%	0.232	C	C	.	.			trans	-103.5	112.9	-179.1	179.6	37.1	0	0	0	110.8	L170 L176 F177 F180 V200 F203	L170-W174 HydrophobicContact CB-CB 4.13Å; L170-W174 HydrophobicContact CB-CE3 4.31Å; L170-W174 HydrophobicContact CD1-CE3 4.03Å; L170-W174 PolarHBondContact O-N 3.49Å; W174-L176 HydrophobicContact CD2-CB 4.42Å; W174-L176 HydrophobicContact CZ2-CB 3.86Å; W174-L176 PolarHBondContact O-N 2.85Å; W174-L176 VanDerWaalsContact O-N 3.14Å; W174-F177 HydrophobicContact CB-CB 4.21Å; W174-F177 HydrophobicContact CD2-CB 4.26Å; W174-F177 HydrophobicContact CE3-CB 3.81Å; W174-F177 AromaticContact CE3-CD2 3.81Å; W174-F177 HydrophobicContact CE3-CD2 3.81Å; W174-F177 HydrophobicContact CE3-CG 4.34Å; W174-F177 HydrophobicContact CG-CB 4.48Å; W174-F177 HydrophobicContact CZ3-CD2 4.13Å; W174-F177 VanDerWaalsContact O-CB 3.23Å; W174-F177 WeakPolarHBondContact O-CB 3.27Å; W174-F177 PolarHBondContact O-N 3.41Å; W174-F180 HydrophobicContact CH2-CB 3.47Å; W174-F180 VanDerWaalsContact CH2-CB 3.47Å; W174-F180 AromaticContact CH2-CD1 3.66Å; W174-F180 HydrophobicContact CH2-CD1 3.66Å; W174-F180 AromaticContact CH2-CD2 3.8Å; W174-F180 HydrophobicContact CH2-CD2 3.8Å; W174-F180 HydrophobicContact CH2-CE1 4.27Å; W174-F180 HydrophobicContact CH2-CE2 4.43Å; W174-F180 AromaticContact CH2-CG 3.35Å; W174-F180 HydrophobicContact CH2-CG 3.35Å; W174-F180 HydrophobicContact CZ2-CB 4.36Å; W174-F180 HydrophobicContact CZ3-CB 3.67Å; W174-F180 AromaticContact CZ3-CD1 3.44Å; W174-F180 HydrophobicContact CZ3-CD1 3.44Å; W174-F180 VanDerWaalsContact CZ3-CD1 3.44Å; W174-F180 HydrophobicContact CZ3-CD2 4.44Å; W174-F180 HydrophobicContact CZ3-CE1 4.14Å; W174-F180 AromaticContact CZ3-CG 3.6Å; W174-F180 HydrophobicContact CZ3-CG 3.6Å; W174-V200 HydrophobicContact CZ3-CG1 4.21Å; W174-F203 HydrophobicContact CH2-CD1 4.47Å; W174-F203 AromaticContact CZ2-CD1 3.7Å; W174-F203 HydrophobicContact CZ2-CD1 3.7Å; W174-F203 AromaticContact CZ2-CE1 3.86Å; W174-F203 HydrophobicContact CZ2-CE1 3.86Å
175	P	96.4	Very high	97	Very high	103 Å²	103	46 Å²	46	67%	0.669	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.7	-175.1	-28.4	36.3	0	0	0	115.1	F177 A209	P175-F177 VanDerWaalsContact C-N 3.35Å; P175-A209 HydrophobicContact CB-CB 4.25Å
176	L	96.9	Very high	96.8	Very high	9 Å²	9	50.6 Å²	50.6	5%	0.047	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.1	178.6	-72.6	173.1	0	0	0	113.5	W174 S178 V179 F180 F203 A209 L211 F227	W174-L176 HydrophobicContact CD2-CB 4.42Å; W174-L176 HydrophobicContact CZ2-CB 3.86Å; W174-L176 PolarHBondContact O-N 2.85Å; W174-L176 VanDerWaalsContact O-N 3.14Å; L176-S178 PolarHBondContact O-N 3.27Å; L176-V179 PolarHBondContact O-N 3.05Å; L176-V179 VanDerWaalsContact O-N 3.16Å; L176-F180 WeakPolarHBondContact O-CB 3.45Å; L176-F180 PolarHBondContact O-N 3.32Å; L176-F203 HydrophobicContact CD1-CE1 4.41Å; L176-A209 WeakPolarHBondContact CD2-O 3.43Å; L176-A209 HydrophobicContact CG-CB 4.44Å; L176-L211 HydrophobicContact CD1-CD2 3.64Å; L176-L211 HydrophobicContact CD1-CG 4.49Å; L176-F227 HydrophobicContact CB-CZ 4.44Å; L176-F227 HydrophobicContact CD1-CE1 4.5Å
177	F	98	Very high	96.7	Very high	18 Å²	18	51.2 Å²	51.2	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-58.3	-44.8	-171.9	178.6	-99.9	0	0	0	113.3	L166 A167 L170 W174 P175 V179 F180 Y181	L166-F177 HydrophobicContact CB-CE2 3.66Å; L166-F177 HydrophobicContact CB-CZ 4.26Å; L166-F177 WeakPolarHBondContact O-CE2 3.23Å; A167-F177 HydrophobicContact CB-CE1 3.84Å; A167-F177 HydrophobicContact CB-CZ 3.62Å; A167-F177 VanDerWaalsContact N-CZ 3.29Å; L170-F177 HydrophobicContact CB-CD2 4Å; W174-F177 HydrophobicContact CB-CB 4.21Å; W174-F177 HydrophobicContact CD2-CB 4.26Å; W174-F177 HydrophobicContact CE3-CB 3.81Å; W174-F177 AromaticContact CE3-CD2 3.81Å; W174-F177 HydrophobicContact CE3-CD2 3.81Å; W174-F177 HydrophobicContact CE3-CG 4.34Å; W174-F177 HydrophobicContact CG-CB 4.48Å; W174-F177 HydrophobicContact CZ3-CD2 4.13Å; W174-F177 VanDerWaalsContact O-CB 3.23Å; W174-F177 WeakPolarHBondContact O-CB 3.27Å; W174-F177 PolarHBondContact O-N 3.41Å; P175-F177 VanDerWaalsContact C-N 3.35Å; F177-V179 VanDerWaalsContact C-N 3.27Å; F177-V179 PolarHBondContact O-N 3.43Å; F177-F180 PolarHBondContact O-N 3.3Å; F177-Y181 AromaticContact CE1-CD2 3.95Å; F177-Y181 HydrophobicContact CE1-CD2 3.95Å; F177-Y181 HydrophobicContact CE1-CG 4.48Å; F177-Y181 HydrophobicContact CE2-CD2 4.44Å; F177-Y181 AromaticContact CZ-CD2 3.57Å; F177-Y181 HydrophobicContact CZ-CD2 3.57Å; F177-Y181 HydrophobicContact CZ-CE2 4.4Å; F177-Y181 HydrophobicContact CZ-CG 4.37Å; F177-Y181 WeakPolarHBondContact O-CB 3.38Å; F177-Y181 PolarHBondContact O-N 3Å
178	S	97.1	Very high	96.6	Very high	84 Å²	84	56.3 Å²	56.3	59%	0.587	29%	0.285	S	S	*	.	H	α-helix	trans	-60.8	-39.1	-179.4	55	0	0	0	0	112.3	L176 Q182	L176-S178 PolarHBondContact O-N 3.27Å; S178-Q182 PolarHBondContact O-N 3.15Å; S178-Q182 VanDerWaalsContact O-N 3.15Å
179	V	96.9	Very high	96.7	Very high	25 Å²	25	55.7 Å²	55.7	15%	0.152	28%	0.279	C	S	.	.	H	α-helix	trans	-71.2	-43.1	178	178.9	0	0	0	0	110.6	L176 F177 Q182 Y183 F227 W230 Q231	L176-V179 PolarHBondContact O-N 3.05Å; L176-V179 VanDerWaalsContact O-N 3.16Å; F177-V179 VanDerWaalsContact C-N 3.27Å; F177-V179 PolarHBondContact O-N 3.43Å; V179-Q182 PolarHBondContact O-N 2.63Å; V179-Y183 PolarHBondContact O-N 2.62Å; V179-F227 HydrophobicContact CG1-CE2 4.06Å; V179-F227 HydrophobicContact CG1-CZ 4.46Å; V179-W230 HydrophobicContact CG1-CZ3 3.71Å; V179-Q231 VanDerWaalsContact CG1-CD 3.45Å; V179-Q231 HydrophobicContact CG1-CG 4.3Å
180	F	98.2	Very high	96.7	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.8	-41.4	175.7	-176.5	-108.3	0	0	0	112.3	L166 W174 L176 F177 Q182 Y183 L184 V200 L223 L224 F227	L166-F180 HydrophobicContact CD1-CE1 4.06Å; W174-F180 HydrophobicContact CH2-CB 3.47Å; W174-F180 VanDerWaalsContact CH2-CB 3.47Å; W174-F180 AromaticContact CH2-CD1 3.66Å; W174-F180 HydrophobicContact CH2-CD1 3.66Å; W174-F180 AromaticContact CH2-CD2 3.8Å; W174-F180 HydrophobicContact CH2-CD2 3.8Å; W174-F180 HydrophobicContact CH2-CE1 4.27Å; W174-F180 HydrophobicContact CH2-CE2 4.43Å; W174-F180 AromaticContact CH2-CG 3.35Å; W174-F180 HydrophobicContact CH2-CG 3.35Å; W174-F180 HydrophobicContact CZ2-CB 4.36Å; W174-F180 HydrophobicContact CZ3-CB 3.67Å; W174-F180 AromaticContact CZ3-CD1 3.44Å; W174-F180 HydrophobicContact CZ3-CD1 3.44Å; W174-F180 VanDerWaalsContact CZ3-CD1 3.44Å; W174-F180 HydrophobicContact CZ3-CD2 4.44Å; W174-F180 HydrophobicContact CZ3-CE1 4.14Å; W174-F180 AromaticContact CZ3-CG 3.6Å; W174-F180 HydrophobicContact CZ3-CG 3.6Å; L176-F180 WeakPolarHBondContact O-CB 3.45Å; L176-F180 PolarHBondContact O-N 3.32Å; F177-F180 PolarHBondContact O-N 3.3Å; F180-Q182 VanDerWaalsContact C-N 3.34Å; F180-Q182 PolarHBondContact O-N 2.86Å; F180-Y183 HydrophobicContact CD2-CD1 4.11Å; F180-Y183 HydrophobicContact CE2-CD1 4.1Å; F180-Y183 HydrophobicContact CE2-CE1 4.32Å; F180-Y183 WeakPolarHBondContact O-CB 3.41Å; F180-Y183 PolarHBondContact O-N 3.28Å; F180-L184 HydrophobicContact CD1-CD1 4.04Å; F180-L184 HydrophobicContact CD1-CG 4.3Å; F180-L184 HydrophobicContact CE1-CD1 3.6Å; F180-L184 HydrophobicContact CE1-CD2 4.32Å; F180-L184 HydrophobicContact CE1-CG 4.01Å; F180-L184 HydrophobicContact CE2-CD2 4.4Å; F180-L184 HydrophobicContact CZ-CD1 4.13Å; F180-L184 HydrophobicContact CZ-CD2 4Å; F180-L184 HydrophobicContact CZ-CG 4.17Å; F180-L184 WeakPolarHBondContact O-CG 3.15Å; F180-L184 PolarHBondContact O-N 2.88Å; F180-V200 HydrophobicContact CE1-CG1 4.09Å; F180-V200 HydrophobicContact CE1-CG2 4.09Å; F180-V200 HydrophobicContact CZ-CG1 4.45Å; F180-V200 HydrophobicContact CZ-CG2 3.73Å; F180-L223 HydrophobicContact CE2-CD2 3.75Å; F180-L223 HydrophobicContact CZ-CD2 3.65Å; F180-L224 HydrophobicContact CE2-CD2 3.9Å; F180-L224 HydrophobicContact CZ-CD2 4.27Å; F180-F227 HydrophobicContact CB-CD2 4.49Å; F180-F227 HydrophobicContact CB-CE2 3.9Å; F180-F227 HydrophobicContact CB-CZ 3.99Å; F180-F227 HydrophobicContact CD2-CB 4.28Å; F180-F227 AromaticContact CD2-CD1 3.88Å; F180-F227 HydrophobicContact CD2-CD1 3.88Å; F180-F227 AromaticContact CD2-CD2 3.66Å; F180-F227 HydrophobicContact CD2-CD2 3.66Å; F180-F227 HydrophobicContact CD2-CE1 4.1Å; F180-F227 AromaticContact CD2-CE2 3.87Å; F180-F227 HydrophobicContact CD2-CE2 3.87Å; F180-F227 AromaticContact CD2-CG 3.65Å; F180-F227 HydrophobicContact CD2-CG 3.65Å; F180-F227 HydrophobicContact CD2-CZ 4.09Å; F180-F227 HydrophobicContact CE2-CB 4.28Å; F180-F227 HydrophobicContact CE2-CD1 4.38Å; F180-F227 HydrophobicContact CE2-CD2 4.46Å; F180-F227 HydrophobicContact CE2-CG 4.11Å; F180-F227 HydrophobicContact CG-CE2 4.41Å
181	Y	98.1	Very high	96.7	Very high	66 Å²	66	66.7 Å²	66.7	26%	0.259	33%	0.328	S	S	.	.	H	α-helix	trans	-57.9	-48.1	174.7	-168.8	-80.7	0	0	0	110.8	K163 A167 F177 Y183 L184 E185	K163-Y181 HydrophobicContact CB-CD2 4.2Å; K163-Y181 HydrophobicContact CB-CE2 3.58Å; K163-Y181 HydrophobicContact CD-CD2 4.5Å; K163-Y181 HydrophobicContact CD-CE1 4.19Å; K163-Y181 HydrophobicContact CD-CE2 4.15Å; K163-Y181 HydrophobicContact CG-CD2 4.25Å; K163-Y181 HydrophobicContact CG-CE2 4.01Å; A167-Y181 HydrophobicContact CB-CE2 4.42Å; F177-Y181 AromaticContact CE1-CD2 3.95Å; F177-Y181 HydrophobicContact CE1-CD2 3.95Å; F177-Y181 HydrophobicContact CE1-CG 4.48Å; F177-Y181 HydrophobicContact CE2-CD2 4.44Å; F177-Y181 AromaticContact CZ-CD2 3.57Å; F177-Y181 HydrophobicContact CZ-CD2 3.57Å; F177-Y181 HydrophobicContact CZ-CE2 4.4Å; F177-Y181 HydrophobicContact CZ-CG 4.37Å; F177-Y181 WeakPolarHBondContact O-CB 3.38Å; F177-Y181 PolarHBondContact O-N 3Å; Y181-Y183 VanDerWaalsContact C-N 3.32Å; Y181-Y183 PolarHBondContact O-N 3.38Å; Y181-L184 PolarHBondContact O-N 3.13Å; Y181-L184 VanDerWaalsContact O-N 3.15Å; Y181-E185 HydrophobicContact CD1-CG 4.06Å; Y181-E185 HydrophobicContact CE1-CG 3.93Å; Y181-E185 WeakPolarHBondContact CE1-OE1 3.49Å; Y181-E185 WeakPolarHBondContact O-CG 3.37Å; Y181-E185 PolarHBondContact O-N 3.42Å
182	Q	97.2	Very high	96.8	Very high	64 Å²	64	65 Å²	65	30%	0.299	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-39	176.9	-174.1	176.9	19.7	0	0	112.4	S178 V179 F180 E185 Q186 W230	S178-Q182 PolarHBondContact O-N 3.15Å; S178-Q182 VanDerWaalsContact O-N 3.15Å; V179-Q182 PolarHBondContact O-N 2.63Å; F180-Q182 VanDerWaalsContact C-N 3.34Å; F180-Q182 PolarHBondContact O-N 2.86Å; Q182-E185 PolarHBondContact O-N 3.2Å; Q182-Q186 WeakPolarHBondContact O-CG 3.22Å; Q182-Q186 PolarHBondContact O-N 3.46Å; Q182-W230 HydrophobicContact CB-CH2 4.35Å; Q182-W230 HydrophobicContact CG-CH2 4.19Å
183	Y	98	Very high	97.1	Very high	10 Å²	10	56.3 Å²	56.3	4%	0.039	28%	0.283	C	S	.	.	H	α-helix	trans	-59.1	-48.6	172.8	160.1	-105.3	0	0	0	111	V179 F180 Y181 E185 Q186 S187 Y189 L223 E226 F227 W230	V179-Y183 PolarHBondContact O-N 2.62Å; F180-Y183 HydrophobicContact CD2-CD1 4.11Å; F180-Y183 HydrophobicContact CE2-CD1 4.1Å; F180-Y183 HydrophobicContact CE2-CE1 4.32Å; F180-Y183 WeakPolarHBondContact O-CB 3.41Å; F180-Y183 PolarHBondContact O-N 3.28Å; Y181-Y183 VanDerWaalsContact C-N 3.32Å; Y181-Y183 PolarHBondContact O-N 3.38Å; Y183-E185 VanDerWaalsContact C-N 3.29Å; Y183-E185 PolarHBondContact O-N 2.92Å; Y183-Q186 PolarHBondContact O-N 3.31Å; Y183-Q186 VanDerWaalsContact O-N 3.1Å; Y183-S187 VanDerWaalsContact O-CB 3.26Å; Y183-S187 WeakPolarHBondContact O-CB 3.25Å; Y183-S187 PolarHBondContact O-N 3.49Å; Y183-Y189 WeakPolarHBondContact OH-CE2 3.47Å; Y183-L223 HydrophobicContact CE1-CD2 4.28Å; Y183-L223 HydrophobicContact CE1-CG 4.35Å; Y183-L223 PolarHBondContact OH-O 3.36Å; Y183-E226 HydrophobicContact CE2-CB 4.44Å; Y183-E226 WeakPolarHBondContact OH-CB 3.42Å; Y183-F227 HydrophobicContact CD1-CB 3.78Å; Y183-F227 AromaticContact CD1-CD2 3.81Å; Y183-F227 HydrophobicContact CD1-CD2 3.81Å; Y183-F227 HydrophobicContact CD1-CG 4.19Å; Y183-F227 HydrophobicContact CE1-CB 3.62Å; Y183-F227 HydrophobicContact CE1-CG 4.49Å; Y183-F227 HydrophobicContact CE2-CB 4.43Å; Y183-F227 HydrophobicContact CG-CB 4.23Å; Y183-F227 AromaticContact CG-CD2 3.79Å; Y183-F227 HydrophobicContact CG-CD2 3.79Å; Y183-F227 HydrophobicContact CG-CG 4.49Å; Y183-F227 PolarHBondContact OH-N 3.48Å; Y183-W230 HydrophobicContact CD2-CB 4.05Å; Y183-W230 HydrophobicContact CD2-CD2 4.03Å; Y183-W230 HydrophobicContact CD2-CE3 4.32Å; Y183-W230 AromaticContact CD2-CG 3.92Å; Y183-W230 HydrophobicContact CD2-CG 3.92Å; Y183-W230 HydrophobicContact CE2-CB 4.33Å; Y183-W230 HydrophobicContact CG-CE3 4.48Å
184	L	98	Very high	97.3	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-58.8	-40.3	179	-67.3	-177.1	0	0	0	112.1	I159 K163 L166 F180 Y181 Q186 S187 M192 L223	I159-L184 HydrophobicContact CD1-CB 4.44Å; I159-L184 HydrophobicContact CD1-CD1 4.29Å; I159-L184 HydrophobicContact CD1-CD2 4.23Å; K163-L184 HydrophobicContact CD-CB 4.1Å; K163-L184 HydrophobicContact CG-CB 4.1Å; K163-L184 HydrophobicContact CG-CD1 3.9Å; L166-L184 HydrophobicContact CD1-CD1 4.28Å; F180-L184 HydrophobicContact CD1-CD1 4.04Å; F180-L184 HydrophobicContact CD1-CG 4.3Å; F180-L184 HydrophobicContact CE1-CD1 3.6Å; F180-L184 HydrophobicContact CE1-CD2 4.32Å; F180-L184 HydrophobicContact CE1-CG 4.01Å; F180-L184 HydrophobicContact CE2-CD2 4.4Å; F180-L184 HydrophobicContact CZ-CD1 4.13Å; F180-L184 HydrophobicContact CZ-CD2 4Å; F180-L184 HydrophobicContact CZ-CG 4.17Å; F180-L184 WeakPolarHBondContact O-CG 3.15Å; F180-L184 PolarHBondContact O-N 2.88Å; Y181-L184 PolarHBondContact O-N 3.13Å; Y181-L184 VanDerWaalsContact O-N 3.15Å; L184-Q186 VanDerWaalsContact C-N 3.29Å; L184-Q186 PolarHBondContact O-N 2.82Å; L184-S187 PolarHBondContact O-N 2.79Å; L184-S187 PolarHBondContact O-OG 3.02Å; L184-M192 HydrophobicContact CD1-CE 4.07Å; L184-M192 HydrophobicContact CD2-CE 4.46Å; L184-L223 HydrophobicContact CD2-CD1 4.26Å; L184-L223 HydrophobicContact CD2-CD2 4.35Å
185	E	96.6	Very high	97.3	Very high	109 Å²	109	60.4 Å²	60.4	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-60.2	-35.9	176.2	-69.7	-176.7	131.1	0	0	113.6	K163 Y181 Q182 Y183	K163-E185 HydrophobicContact CD-CG 4.11Å; Y181-E185 HydrophobicContact CD1-CG 4.06Å; Y181-E185 HydrophobicContact CE1-CG 3.93Å; Y181-E185 WeakPolarHBondContact CE1-OE1 3.49Å; Y181-E185 WeakPolarHBondContact O-CG 3.37Å; Y181-E185 PolarHBondContact O-N 3.42Å; Q182-E185 PolarHBondContact O-N 3.2Å; Y183-E185 VanDerWaalsContact C-N 3.29Å; Y183-E185 PolarHBondContact O-N 2.92Å
186	Q	95	Very high	97.4	Very high	117 Å²	117	56.7 Å²	56.7	55%	0.547	27%	0.273	S	S	.	.	H	α-helix	trans	-93.8	-11.5	-177.3	-62.5	176.7	14.2	0	0	112.7	Q182 Y183 L184	Q182-Q186 WeakPolarHBondContact O-CG 3.22Å; Q182-Q186 PolarHBondContact O-N 3.46Å; Y183-Q186 PolarHBondContact O-N 3.31Å; Y183-Q186 VanDerWaalsContact O-N 3.1Å; L184-Q186 VanDerWaalsContact C-N 3.29Å; L184-Q186 PolarHBondContact O-N 2.82Å
187	S	95.4	Very high	97.5	Very high	14 Å²	14	56.3 Å²	56.3	10%	0.098	27%	0.271	C	S	.	.	S	Bend	trans	-73.8	167.4	-174.7	78.2	0	0	0	0	113.3	Y183 L184 Y189 R190	Y183-S187 VanDerWaalsContact O-CB 3.26Å; Y183-S187 WeakPolarHBondContact O-CB 3.25Å; Y183-S187 PolarHBondContact O-N 3.49Å; L184-S187 PolarHBondContact O-N 2.79Å; L184-S187 PolarHBondContact O-OG 3.02Å; S187-Y189 VanDerWaalsContact C-N 3.27Å; S187-Y189 PolarHBondContact OG-N 3.24Å; S187-R190 PolarHBondContact O-NH1 3.18Å
188	K	96.6	Very high	97.5	Very high	143 Å²	143	58.4 Å²	58.4	62%	0.622	28%	0.278	S	S	*	.	S	Bend	trans	-76.3	-11.9	171	66	-172.4	174.2	-167.3	0	113.5	E226	K188-E226 VanDerWaalsContact CE-OE1 3.29Å; K188-E226 WeakPolarHBondContact CE-OE1 3.29Å; K188-E226 VanDerWaalsContact CE-OE2 3.31Å; K188-E226 WeakPolarHBondContact CE-OE2 3.46Å; K188-E226 IonicContact NZ-OE1 3.61Å; K188-E226 PolarHBondContact NZ-OE1 3Å; K188-E226 IonicContact NZ-OE2 2.65Å
189	Y	97.6	Very high	97.5	Very high	34 Å²	34	55.9 Å²	55.9	13%	0.133	26%	0.258	C	S	.	.			trans	-69.3	135.3	-175.8	-63.4	-80.6	0	0	0	110.5	Y183 S187 L223 E226	Y183-Y189 WeakPolarHBondContact OH-CE2 3.47Å; S187-Y189 VanDerWaalsContact C-N 3.27Å; S187-Y189 PolarHBondContact OG-N 3.24Å; Y189-L223 HydrophobicContact CD1-CD1 3.99Å; Y189-L223 HydrophobicContact CD2-CD1 3.99Å; Y189-L223 HydrophobicContact CD2-CG 4.12Å; Y189-L223 HydrophobicContact CE1-CB 4.09Å; Y189-L223 HydrophobicContact CE1-CD1 4.17Å; Y189-L223 HydrophobicContact CE1-CG 4.41Å; Y189-L223 HydrophobicContact CE2-CB 4.08Å; Y189-L223 HydrophobicContact CE2-CD1 4.21Å; Y189-L223 HydrophobicContact CE2-CG 3.92Å; Y189-L223 HydrophobicContact CG-CD1 3.92Å; Y189-L223 WeakPolarHBondContact OH-CA 3.33Å; Y189-L223 PolarHBondContact OH-N 3.14Å; Y189-E226 WeakPolarHBondContact CE2-OE2 3.14Å; Y189-E226 VanDerWaalsContact CZ-OE2 3.26Å; Y189-E226 PolarHBondContact OH-OE2 2.95Å
190	R	97.5	Very high	97.6	Very high	166 Å²	166	54.7 Å²	54.7	63%	0.626	25%	0.251	S	S	*	.	S	Bend	trans	-117.3	-13	176	-60.5	-63.1	174.3	-106	3.6	112.5	I159 S187	I159-R190 PolarHBondContact N-O 3.2Å; S187-R190 PolarHBondContact O-NH1 3.18Å
191	V	97.9	Very high	97.6	Very high	70 Å²	70	55.3 Å²	55.3	42%	0.424	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	157.4	176.9	-62.3	0	0	0	0	109.9	L157	L157-V191 CarbonylContact O-C 3.6Å; L157-V191 WeakPolarHBondContact O-CA 3.39Å; L157-V191 VanDerWaalsContact O-CB 3.24Å; L157-V191 WeakPolarHBondContact O-CB 3.48Å
192	M	98.3	Very high	97.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.9	170.3	-172.6	173.8	-65.6	0	0	109.4	F146 S156 L157 I159 A162 L166 L184 Q196 W197 L223	F146-M192 WeakPolarHBondContact CE2-O 3.49Å; S156-M192 CarbonylContact C-O 3.54Å; S156-M192 WeakPolarHBondContact CA-O 3.27Å; S156-M192 VanDerWaalsContact CB-O 3.31Å; S156-M192 WeakPolarHBondContact CB-O 3.26Å; L157-M192 PolarHBondContact N-O 3.44Å; L157-M192 PolarHBondContact O-N 3.39Å; I159-M192 HydrophobicContact CD1-CE 4.48Å; A162-M192 HydrophobicContact CB-CB 3.99Å; A162-M192 HydrophobicContact CB-CE 4.47Å; A162-M192 HydrophobicContact CB-SD 4.4Å; L166-M192 HydrophobicContact CD1-CE 3.9Å; L166-M192 HydrophobicContact CD1-SD 4.23Å; L184-M192 HydrophobicContact CD1-CE 4.07Å; L184-M192 HydrophobicContact CD2-CE 4.46Å; M192-Q196 HydrophobicContact CG-CB 3.8Å; M192-W197 HydrophobicContact CG-CB 4.45Å; M192-W197 HydrophobicContact SD-CB 4.27Å; M192-W197 HydrophobicContact SD-CE3 3.64Å; M192-W197 HydrophobicContact SD-CZ3 4.4Å; M192-L223 HydrophobicContact CE-CD1 4.41Å
193	N	98	Very high	97.6	Very high	63 Å²	63	53 Å²	53	34%	0.337	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	172.1	177.6	74.4	34.3	0	0	0	111.6	D195 Q196 W197	N193-D195 VanDerWaalsContact C-N 3.33Å; N193-D195 PolarHBondContact O-N 3.45Å; N193-D195 PolarHBondContact OD1-N 3.36Å; N193-D195 VanDerWaalsContact OD1-N 3.08Å; N193-Q196 PolarHBondContact O-N 3.46Å; N193-Q196 WeakPolarHBondContact OD1-CB 3.49Å; N193-Q196 WeakPolarHBondContact OD1-CG 3.46Å; N193-Q196 PolarHBondContact OD1-N 2.94Å; N193-W197 WeakPolarHBondContact O-CB 3.49Å; N193-W197 PolarHBondContact O-N 3.33Å
194	K	97.9	Very high	97.6	Very high	76 Å²	76	53.2 Å²	53.2	33%	0.33	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-38.1	-175.8	-168	165	-169.9	147.9	0	113.5	F146 D147 Y198	F146-K194 HydrophobicContact CD1-CB 4.23Å; F146-K194 HydrophobicContact CD1-CD 4.24Å; F146-K194 HydrophobicContact CD1-CG 4.01Å; F146-K194 HydrophobicContact CE1-CB 3.62Å; F146-K194 HydrophobicContact CE1-CD 4.07Å; F146-K194 HydrophobicContact CE1-CG 3.87Å; F146-K194 HydrophobicContact CE2-CB 4.32Å; F146-K194 VanDerWaalsContact CZ-CA 3.48Å; F146-K194 HydrophobicContact CZ-CB 3.68Å; F146-K194 HydrophobicContact CZ-CG 4.36Å; F146-K194 VanDerWaalsContact CZ-N 3.31Å; D147-K194 VanDerWaalsContact CG-NZ 3.35Å; D147-K194 IonicContact OD1-NZ 3.67Å; D147-K194 PolarHBondContact OD1-NZ 3.48Å; D147-K194 IonicContact OD2-NZ 2.76Å; D147-K194 PolarHBondContact OD2-NZ 2.85Å; K194-Y198 VanDerWaalsContact CE-CZ 3.44Å; K194-Y198 WeakPolarHBondContact CE-OH 3.37Å; K194-Y198 HydrophobicContact CG-CE1 4.05Å; K194-Y198 HydrophobicContact CG-CE2 4.25Å; K194-Y198 WeakPolarHBondContact O-CD1 3.48Å; K194-Y198 PolarHBondContact O-N 2.87Å
195	D	98	Very high	97.5	Very high	94 Å²	94	59.5 Å²	59.5	50%	0.503	27%	0.272	S	S	.	.	H	α-helix	trans	-68.8	-46.8	-179.7	177.2	68.7	0	0	0	111.2	N193 W197 Y198 N199 P221	N193-D195 VanDerWaalsContact C-N 3.33Å; N193-D195 PolarHBondContact O-N 3.45Å; N193-D195 PolarHBondContact OD1-N 3.36Å; N193-D195 VanDerWaalsContact OD1-N 3.08Å; D195-W197 PolarHBondContact O-N 2.96Å; D195-Y198 PolarHBondContact O-N 2.96Å; D195-N199 WeakPolarHBondContact O-CB 3.42Å; D195-N199 PolarHBondContact O-N 2.88Å; D195-N199 PolarHBondContact O-ND2 3.25Å; D195-N199 PolarHBondContact OD1-ND2 2.79Å; D195-N199 VanDerWaalsContact OD1-ND2 3.15Å; D195-P221 WeakPolarHBondContact OD2-CG 3.23Å
196	Q	98.4	Very high	97.5	Very high	25 Å²	25	57.1 Å²	57.1	12%	0.117	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-47.9	172.6	-70.7	166.4	-23.1	0	0	111.1	M192 N193 Y198 N199 V200 P221	M192-Q196 HydrophobicContact CG-CB 3.8Å; N193-Q196 PolarHBondContact O-N 3.46Å; N193-Q196 WeakPolarHBondContact OD1-CB 3.49Å; N193-Q196 WeakPolarHBondContact OD1-CG 3.46Å; N193-Q196 PolarHBondContact OD1-N 2.94Å; Q196-Y198 PolarHBondContact O-N 3.34Å; Q196-N199 PolarHBondContact O-N 3.16Å; Q196-V200 VanDerWaalsContact O-CG2 3.31Å; Q196-V200 WeakPolarHBondContact O-CG2 3.45Å; Q196-V200 PolarHBondContact O-N 3.31Å; Q196-P221 HydrophobicContact CG-CB 3.96Å; Q196-P221 HydrophobicContact CG-CG 4.49Å
197	W	98.6	Very high	97.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.2	-50.2	176.6	-176.1	-98.8	0	0	0	111.1	Y142 A145 F146 L157 A162 M165 L166 L169 M192 N193 D195 N199 V200 L201	Y142-W197 AromaticContact CD1-CD1 3.93Å; Y142-W197 AromaticContact CD1-NE1 3.4Å; Y142-W197 AromaticContact CE1-CD1 3.36Å; Y142-W197 HydrophobicContact CE1-CD2 4.2Å; Y142-W197 AromaticContact CE1-CE2 3.65Å; Y142-W197 AromaticContact CE1-CG 3.99Å; Y142-W197 HydrophobicContact CE1-CG 3.99Å; Y142-W197 HydrophobicContact CE1-CZ2 4.34Å; Y142-W197 AromaticContact CE1-NE1 3.08Å; Y142-W197 VanDerWaalsContact CE1-O 3.27Å; Y142-W197 WeakPolarHBondContact CE1-O 3.48Å; Y142-W197 HydrophobicContact CE2-CZ2 4.08Å; Y142-W197 AromaticContact CZ-CE2 3.63Å; Y142-W197 AromaticContact CZ-CZ2 3.98Å; Y142-W197 AromaticContact CZ-NE1 3.59Å; Y142-W197 PolarHBondContact O-NE1 3.42Å; Y142-W197 PolarHBondContact OH-O 3.04Å; A145-W197 HydrophobicContact CB-CZ2 4.18Å; F146-W197 HydrophobicContact CB-CD2 4.24Å; F146-W197 HydrophobicContact CB-CG 3.99Å; F146-W197 HydrophobicContact CD2-CB 3.67Å; F146-W197 HydrophobicContact CD2-CD2 4.01Å; F146-W197 HydrophobicContact CD2-CE3 4.38Å; F146-W197 AromaticContact CD2-CG 3.65Å; F146-W197 HydrophobicContact CD2-CG 3.65Å; F146-W197 HydrophobicContact CE2-CB 4.17Å; F146-W197 HydrophobicContact CG-CB 4.45Å; F146-W197 HydrophobicContact CG-CG 4.17Å; L157-W197 HydrophobicContact CD1-CE3 3.89Å; L157-W197 HydrophobicContact CD1-CZ3 3.89Å; A162-W197 HydrophobicContact CB-CZ3 4.26Å; M165-W197 HydrophobicContact CB-CH2 3.52Å; M165-W197 HydrophobicContact CB-CZ2 4.42Å; M165-W197 HydrophobicContact CB-CZ3 4.2Å; L166-W197 HydrophobicContact CD1-CZ3 4.25Å; L166-W197 HydrophobicContact CD2-CD2 4.48Å; L166-W197 HydrophobicContact CD2-CE3 4.02Å; L166-W197 HydrophobicContact CD2-CH2 3.59Å; L166-W197 HydrophobicContact CD2-CZ2 4.14Å; L166-W197 HydrophobicContact CD2-CZ3 3.57Å; L166-W197 HydrophobicContact CG-CE3 4.25Å; L166-W197 HydrophobicContact CG-CH2 3.75Å; L166-W197 HydrophobicContact CG-CZ3 3.5Å; L166-W197 VanDerWaalsContact CG-CZ3 3.5Å; L169-W197 HydrophobicContact CD1-CH2 4.27Å; L169-W197 HydrophobicContact CD1-CZ2 3.78Å; M192-W197 HydrophobicContact CG-CB 4.45Å; M192-W197 HydrophobicContact SD-CB 4.27Å; M192-W197 HydrophobicContact SD-CE3 3.64Å; M192-W197 HydrophobicContact SD-CZ3 4.4Å; N193-W197 WeakPolarHBondContact O-CB 3.49Å; N193-W197 PolarHBondContact O-N 3.33Å; D195-W197 PolarHBondContact O-N 2.96Å; W197-N199 PolarHBondContact O-N 3.05Å; W197-V200 PolarHBondContact O-N 2.49Å; W197-L201 PolarHBondContact O-N 2.78Å
198	Y	98.1	Very high	97.6	Very high	62 Å²	62	56.5 Å²	56.5	24%	0.243	26%	0.261	C	S	.	.	H	α-helix	trans	-65.6	-38.6	-178	-73	7.9	0	0	0	112.6	R143 K194 D195 Q196 L201 E202	R143-Y198 HydrophobicContact CB-CE1 3.96Å; R143-Y198 HydrophobicContact CG-CD1 4.11Å; R143-Y198 HydrophobicContact CG-CE1 3.57Å; R143-Y198 HydrophobicContact CG-CE2 4.24Å; K194-Y198 VanDerWaalsContact CE-CZ 3.44Å; K194-Y198 WeakPolarHBondContact CE-OH 3.37Å; K194-Y198 HydrophobicContact CG-CE1 4.05Å; K194-Y198 HydrophobicContact CG-CE2 4.25Å; K194-Y198 WeakPolarHBondContact O-CD1 3.48Å; K194-Y198 PolarHBondContact O-N 2.87Å; D195-Y198 PolarHBondContact O-N 2.96Å; Q196-Y198 PolarHBondContact O-N 3.34Å; Y198-L201 PolarHBondContact O-N 3.23Å; Y198-E202 PolarHBondContact O-N 3.36Å
199	N	98.3	Very high	97.5	Very high	31 Å²	31	52.3 Å²	52.3	17%	0.166	25%	0.253	C	S	.	.	H	α-helix	trans	-71	-29.2	177.8	-80	-75.8	0	0	0	112.8	D195 Q196 W197 L201 E202 F203 W220 P221 L224	D195-N199 WeakPolarHBondContact O-CB 3.42Å; D195-N199 PolarHBondContact O-N 2.88Å; D195-N199 PolarHBondContact O-ND2 3.25Å; D195-N199 PolarHBondContact OD1-ND2 2.79Å; D195-N199 VanDerWaalsContact OD1-ND2 3.15Å; Q196-N199 PolarHBondContact O-N 3.16Å; W197-N199 PolarHBondContact O-N 3.05Å; N199-L201 VanDerWaalsContact C-N 3.3Å; N199-L201 PolarHBondContact O-N 3.4Å; N199-E202 PolarHBondContact O-N 2.8Å; N199-F203 WeakPolarHBondContact O-CB 3.4Å; N199-F203 PolarHBondContact O-N 3.44Å; N199-W220 HydrophobicContact CB-CE3 4.17Å; N199-W220 HydrophobicContact CB-CZ3 4.21Å; N199-P221 HydrophobicContact CB-CG 3.63Å; N199-L224 HydrophobicContact CB-CD1 3.93Å
200	V	98.5	Very high	97.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-42.1	172.3	168.3	0	0	0	0	110.8	L166 L170 W174 F180 Q196 W197 S204 L224	L166-V200 HydrophobicContact CD1-CG1 4.43Å; L166-V200 HydrophobicContact CD2-CG1 3.94Å; L170-V200 HydrophobicContact CD1-CG1 3.92Å; W174-V200 HydrophobicContact CZ3-CG1 4.21Å; F180-V200 HydrophobicContact CE1-CG1 4.09Å; F180-V200 HydrophobicContact CE1-CG2 4.09Å; F180-V200 HydrophobicContact CZ-CG1 4.45Å; F180-V200 HydrophobicContact CZ-CG2 3.73Å; Q196-V200 VanDerWaalsContact O-CG2 3.31Å; Q196-V200 WeakPolarHBondContact O-CG2 3.45Å; Q196-V200 PolarHBondContact O-N 3.31Å; W197-V200 PolarHBondContact O-N 2.49Å; V200-S204 WeakPolarHBondContact O-CB 3.43Å; V200-S204 PolarHBondContact O-N 3.3Å; V200-L224 HydrophobicContact CG2-CD2 4.12Å
201	L	98.2	Very high	97.2	Very high	13 Å²	13	47.9 Å²	47.9	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-48.7	173.4	176.6	60.4	0	0	0	111.4	F138 K139 Y142 L170 W197 Y198 N199 F203 S204 R205	F138-L201 HydrophobicContact CD1-CD1 4.27Å; F138-L201 HydrophobicContact CE1-CD1 3.68Å; K139-L201 HydrophobicContact CB-CD2 4.48Å; K139-L201 HydrophobicContact CG-CD2 4.18Å; Y142-L201 HydrophobicContact CD1-CB 3.82Å; Y142-L201 HydrophobicContact CD1-CD2 3.66Å; Y142-L201 HydrophobicContact CD1-CG 4.28Å; Y142-L201 HydrophobicContact CD2-CB 4.39Å; Y142-L201 HydrophobicContact CD2-CD1 4.32Å; Y142-L201 HydrophobicContact CD2-CD2 4.39Å; Y142-L201 HydrophobicContact CE1-CB 3.48Å; Y142-L201 VanDerWaalsContact CE1-CB 3.48Å; Y142-L201 HydrophobicContact CE1-CD2 4.24Å; Y142-L201 HydrophobicContact CE1-CG 4.42Å; Y142-L201 HydrophobicContact CE2-CB 4.11Å; Y142-L201 HydrophobicContact CG-CB 4.27Å; Y142-L201 HydrophobicContact CG-CD1 4.49Å; Y142-L201 HydrophobicContact CG-CD2 3.76Å; Y142-L201 HydrophobicContact CG-CG 4.4Å; L170-L201 HydrophobicContact CD2-CD1 4.25Å; W197-L201 PolarHBondContact O-N 2.78Å; Y198-L201 PolarHBondContact O-N 3.23Å; N199-L201 VanDerWaalsContact C-N 3.3Å; N199-L201 PolarHBondContact O-N 3.4Å; L201-F203 PolarHBondContact O-N 2.65Å; L201-S204 PolarHBondContact O-N 3.44Å; L201-S204 PolarHBondContact O-OG 3.28Å; L201-R205 HydrophobicContact CD1-CG 4.33Å; L201-R205 WeakPolarHBondContact O-CG 3.39Å; L201-R205 PolarHBondContact O-N 3.38Å
202	E	97.4	Very high	97.1	Very high	83 Å²	83	48.4 Å²	48.4	39%	0.388	25%	0.251	S	S	.	.	H	α-helix	trans	-60.5	-47.4	-178.7	-169.2	63.1	-153	0	0	111.3	Y198 N199 S204 R205 T206 W220	Y198-E202 PolarHBondContact O-N 3.36Å; N199-E202 PolarHBondContact O-N 2.8Å; E202-S204 VanDerWaalsContact C-N 3.3Å; E202-S204 PolarHBondContact O-N 2.98Å; E202-R205 PolarHBondContact O-N 3.27Å; E202-T206 HydrophobicContact CG-CG2 4.37Å; E202-T206 PolarHBondContact O-N 2.79Å; E202-T206 PolarHBondContact O-OG1 3.48Å; E202-T206 WeakPolarHBondContact OE1-CG2 3.49Å; E202-W220 HydrophobicContact CB-CH2 4.12Å; E202-W220 HydrophobicContact CB-CZ3 4.05Å; E202-W220 HydrophobicContact CG-CH2 3.83Å; E202-W220 HydrophobicContact CG-CZ3 4.17Å
203	F	98.1	Very high	97	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.4	-44.7	175	-174.8	-75.7	0	0	0	111.4	W174 L176 N199 L201 R205 T206 V207 L211 Y214 W220 L224 F227 V228	W174-F203 HydrophobicContact CH2-CD1 4.47Å; W174-F203 AromaticContact CZ2-CD1 3.7Å; W174-F203 HydrophobicContact CZ2-CD1 3.7Å; W174-F203 AromaticContact CZ2-CE1 3.86Å; W174-F203 HydrophobicContact CZ2-CE1 3.86Å; L176-F203 HydrophobicContact CD1-CE1 4.41Å; N199-F203 WeakPolarHBondContact O-CB 3.4Å; N199-F203 PolarHBondContact O-N 3.44Å; L201-F203 PolarHBondContact O-N 2.65Å; F203-R205 PolarHBondContact O-N 2.96Å; F203-R205 VanDerWaalsContact O-N 3.08Å; F203-T206 PolarHBondContact O-N 3.13Å; F203-V207 HydrophobicContact CD1-CB 4.09Å; F203-V207 HydrophobicContact CD1-CG2 4.31Å; F203-V207 HydrophobicContact CD2-CB 4.22Å; F203-V207 HydrophobicContact CD2-CG2 3.63Å; F203-V207 HydrophobicContact CE1-CB 3.93Å; F203-V207 HydrophobicContact CE1-CG1 4.04Å; F203-V207 HydrophobicContact CE1-CG2 4.39Å; F203-V207 HydrophobicContact CE2-CB 4.12Å; F203-V207 HydrophobicContact CE2-CG1 4.09Å; F203-V207 HydrophobicContact CE2-CG2 3.78Å; F203-V207 HydrophobicContact CG-CB 4.22Å; F203-V207 HydrophobicContact CG-CG2 3.92Å; F203-V207 HydrophobicContact CZ-CB 3.96Å; F203-V207 HydrophobicContact CZ-CG1 3.72Å; F203-V207 HydrophobicContact CZ-CG2 4.15Å; F203-V207 WeakPolarHBondContact O-CB 3.41Å; F203-V207 PolarHBondContact O-N 3.21Å; F203-L211 HydrophobicContact CE1-CD2 4.4Å; F203-L211 HydrophobicContact CZ-CD2 3.95Å; F203-Y214 HydrophobicContact CD2-CD2 4.38Å; F203-Y214 HydrophobicContact CD2-CE2 4.01Å; F203-Y214 AromaticContact CE2-CD2 3.65Å; F203-Y214 HydrophobicContact CE2-CD2 3.65Å; F203-Y214 AromaticContact CE2-CE2 3.45Å; F203-Y214 HydrophobicContact CE2-CE2 3.45Å; F203-Y214 VanDerWaalsContact CE2-CE2 3.45Å; F203-Y214 HydrophobicContact CZ-CD2 4.4Å; F203-W220 HydrophobicContact CB-CH2 4.21Å; F203-W220 HydrophobicContact CB-CZ3 4.04Å; F203-L224 HydrophobicContact CB-CD1 3.88Å; F203-L224 HydrophobicContact CB-CD2 4.43Å; F203-L224 HydrophobicContact CD2-CB 4.19Å; F203-L224 HydrophobicContact CD2-CD1 3.85Å; F203-L224 HydrophobicContact CD2-CD2 4.1Å; F203-L224 HydrophobicContact CD2-CG 4.28Å; F203-L224 HydrophobicContact CE2-CB 4.34Å; F203-L224 HydrophobicContact CG-CD1 4.14Å; F203-L224 HydrophobicContact CG-CD2 4.15Å; F203-F227 HydrophobicContact CE1-CD1 4.27Å; F203-F227 AromaticContact CE1-CE1 3.88Å; F203-F227 HydrophobicContact CE1-CE1 3.88Å; F203-F227 AromaticContact CZ-CD1 3.98Å; F203-F227 HydrophobicContact CZ-CD1 3.98Å; F203-F227 AromaticContact CZ-CE1 3.91Å; F203-F227 HydrophobicContact CZ-CE1 3.91Å; F203-V228 HydrophobicContact CE2-CG2 3.86Å; F203-V228 HydrophobicContact CZ-CG2 3.8Å
204	S	97.4	Very high	97	Very high	13 Å²	13	49.8 Å²	49.8	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-18.9	179.1	78.5	0	0	0	0	114.2	V200 L201 E202	V200-S204 WeakPolarHBondContact O-CB 3.43Å; V200-S204 PolarHBondContact O-N 3.3Å; L201-S204 PolarHBondContact O-N 3.44Å; L201-S204 PolarHBondContact O-OG 3.28Å; E202-S204 VanDerWaalsContact C-N 3.3Å; E202-S204 PolarHBondContact O-N 2.98Å
205	R	95.7	Very high	96.8	Very high	137 Å²	137	50.4 Å²	50.4	52%	0.517	26%	0.264	S	S	.	.	H	α-helix	trans	-105.5	-27.3	-177.7	-60.2	-56	-179.9	177	-0.3	113.5	L201 E202 F203	L201-R205 HydrophobicContact CD1-CG 4.33Å; L201-R205 WeakPolarHBondContact O-CG 3.39Å; L201-R205 PolarHBondContact O-N 3.38Å; E202-R205 PolarHBondContact O-N 3.27Å; F203-R205 PolarHBondContact O-N 2.96Å; F203-R205 VanDerWaalsContact O-N 3.08Å
206	T	96.4	Very high	96.5	Very high	58 Å²	58	52.2 Å²	52.2	36%	0.356	27%	0.269	S	S	.	.	H	α-helix	trans	-108.1	-27.4	-173.3	58.4	0	0	0	0	113.9	E202 F203 N213	E202-T206 HydrophobicContact CG-CG2 4.37Å; E202-T206 PolarHBondContact O-N 2.79Å; E202-T206 PolarHBondContact O-OG1 3.48Å; E202-T206 WeakPolarHBondContact OE1-CG2 3.49Å; F203-T206 PolarHBondContact O-N 3.13Å; T206-N213 PolarHBondContact O-ND2 3.06Å
207	V	96.9	Very high	96.2	Very high	13 Å²	13	58.8 Å²	58.8	8%	0.079	31%	0.305	C	S	.	.	S	Bend	trans	-92.7	129	-179.3	-176	0	0	0	0	110.2	F203 L211 N213 Y214 W220	F203-V207 HydrophobicContact CD1-CB 4.09Å; F203-V207 HydrophobicContact CD1-CG2 4.31Å; F203-V207 HydrophobicContact CD2-CB 4.22Å; F203-V207 HydrophobicContact CD2-CG2 3.63Å; F203-V207 HydrophobicContact CE1-CB 3.93Å; F203-V207 HydrophobicContact CE1-CG1 4.04Å; F203-V207 HydrophobicContact CE1-CG2 4.39Å; F203-V207 HydrophobicContact CE2-CB 4.12Å; F203-V207 HydrophobicContact CE2-CG1 4.09Å; F203-V207 HydrophobicContact CE2-CG2 3.78Å; F203-V207 HydrophobicContact CG-CB 4.22Å; F203-V207 HydrophobicContact CG-CG2 3.92Å; F203-V207 HydrophobicContact CZ-CB 3.96Å; F203-V207 HydrophobicContact CZ-CG1 3.72Å; F203-V207 HydrophobicContact CZ-CG2 4.15Å; F203-V207 WeakPolarHBondContact O-CB 3.41Å; F203-V207 PolarHBondContact O-N 3.21Å; V207-L211 HydrophobicContact CG1-CD2 3.86Å; V207-N213 WeakPolarHBondContact CA-OD1 3.2Å; V207-Y214 HydrophobicContact CG1-CD2 4.19Å; V207-Y214 HydrophobicContact CG2-CD2 4.03Å; V207-W220 HydrophobicContact CG2-CZ2 4.21Å
208	H	96.1	Very high	96	Very high	105 Å²	105	59.9 Å²	59.9	49%	0.486	32%	0.316	S	S	.	.			trans	-64.5	153	178.5	-64.4	170.6	0	0	0	111.3	D210 L211 S212 N213	H208-D210 WeakPolarHBondContact CB-OD1 3.4Å; H208-D210 PolarHBondContact O-N 3.43Å; H208-L211 PolarHBondContact O-N 3.21Å; H208-S212 PolarHBondContact ND1-OG 3.35Å; H208-N213 WeakPolarHBondContact CB-OD1 3.26Å; H208-N213 PolarHBondContact N-OD1 3.26Å
209	A	94.7	Very high	95.9	Very high	55 Å²	55	62 Å²	62	46%	0.455	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.1	-179.9	0	0	0	0	0	113.6	P175 L176	P175-A209 HydrophobicContact CB-CB 4.25Å; L176-A209 WeakPolarHBondContact CD2-O 3.43Å; L176-A209 HydrophobicContact CG-CB 4.44Å
210	D	93.8	Very high	95.8	Very high	101 Å²	101	62.8 Å²	62.8	54%	0.54	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	0.8	174.6	66.4	-1.9	0	0	0	113.3	H208 S212	H208-D210 WeakPolarHBondContact CB-OD1 3.4Å; H208-D210 PolarHBondContact O-N 3.43Å; D210-S212 VanDerWaalsContact CG-OG 3.26Å; D210-S212 PolarHBondContact O-N 2.97Å; D210-S212 VanDerWaalsContact O-N 3.14Å; D210-S212 VanDerWaalsContact OD1-CB 3.22Å; D210-S212 WeakPolarHBondContact OD1-CB 3.36Å; D210-S212 PolarHBondContact OD1-N 3.34Å; D210-S212 PolarHBondContact OD1-OG 2.65Å; D210-S212 PolarHBondContact OD2-OG 3.03Å
211	L	95.4	Very high	95.8	Very high	7 Å²	7	63.4 Å²	63.4	4%	0.037	35%	0.351	C	S	.	.			trans	60.4	15.6	-178.3	-50.1	175.6	0	0	0	114.2	L176 F203 V207 H208 N213 Y214 V228 Q231	L176-L211 HydrophobicContact CD1-CD2 3.64Å; L176-L211 HydrophobicContact CD1-CG 4.49Å; F203-L211 HydrophobicContact CE1-CD2 4.4Å; F203-L211 HydrophobicContact CZ-CD2 3.95Å; V207-L211 HydrophobicContact CG1-CD2 3.86Å; H208-L211 PolarHBondContact O-N 3.21Å; L211-N213 VanDerWaalsContact C-N 3.29Å; L211-N213 PolarHBondContact O-N 2.82Å; L211-Y214 WeakPolarHBondContact O-CB 3.22Å; L211-Y214 PolarHBondContact O-N 3.32Å; L211-V228 HydrophobicContact CD1-CG1 4.2Å; L211-V228 HydrophobicContact CD1-CG2 4.37Å; L211-V228 HydrophobicContact CD2-CG2 4.26Å; L211-Q231 HydrophobicContact CD1-CB 3.97Å; L211-Q231 HydrophobicContact CD1-CG 3.7Å
212	S	95.1	Very high	95.7	Very high	80 Å²	80	67 Å²	67	56%	0.559	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-27.9	-174.7	56.2	0	0	0	0	114.3	H208 D210	H208-S212 PolarHBondContact ND1-OG 3.35Å; D210-S212 VanDerWaalsContact CG-OG 3.26Å; D210-S212 PolarHBondContact O-N 2.97Å; D210-S212 VanDerWaalsContact O-N 3.14Å; D210-S212 VanDerWaalsContact OD1-CB 3.22Å; D210-S212 WeakPolarHBondContact OD1-CB 3.36Å; D210-S212 PolarHBondContact OD1-N 3.34Å; D210-S212 PolarHBondContact OD1-OG 2.65Å; D210-S212 PolarHBondContact OD2-OG 3.03Å
213	N	96.5	Very high	95.8	Very high	70 Å²	70	63 Å²	63	37%	0.374	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	11.5	-179.4	75.6	-38	0	0	0	113.2	T206 V207 H208 L211 D215	T206-N213 PolarHBondContact O-ND2 3.06Å; V207-N213 WeakPolarHBondContact CA-OD1 3.2Å; H208-N213 WeakPolarHBondContact CB-OD1 3.26Å; H208-N213 PolarHBondContact N-OD1 3.26Å; L211-N213 VanDerWaalsContact C-N 3.29Å; L211-N213 PolarHBondContact O-N 2.82Å; N213-D215 PolarHBondContact O-N 3.39Å
214	Y	97	Very high	95.8	Very high	22 Å²	22	63 Å²	63	9%	0.086	36%	0.355	C	S	.	.			trans	-69.8	128.8	176.1	-170.8	-104.8	0	0	0	110.7	F203 V207 L211 E216 W220 D225 V228	F203-Y214 HydrophobicContact CD2-CD2 4.38Å; F203-Y214 HydrophobicContact CD2-CE2 4.01Å; F203-Y214 AromaticContact CE2-CD2 3.65Å; F203-Y214 HydrophobicContact CE2-CD2 3.65Å; F203-Y214 AromaticContact CE2-CE2 3.45Å; F203-Y214 HydrophobicContact CE2-CE2 3.45Å; F203-Y214 VanDerWaalsContact CE2-CE2 3.45Å; F203-Y214 HydrophobicContact CZ-CD2 4.4Å; V207-Y214 HydrophobicContact CG1-CD2 4.19Å; V207-Y214 HydrophobicContact CG2-CD2 4.03Å; L211-Y214 WeakPolarHBondContact O-CB 3.22Å; L211-Y214 PolarHBondContact O-N 3.32Å; Y214-E216 HydrophobicContact CD1-CG 4.07Å; Y214-E216 HydrophobicContact CE1-CG 4.29Å; Y214-W220 AromaticContact CE2-CD1 3.41Å; Y214-W220 VanDerWaalsContact CE2-CD1 3.41Å; Y214-W220 HydrophobicContact CE2-CD2 4.48Å; Y214-W220 AromaticContact CE2-CG 3.94Å; Y214-W220 HydrophobicContact CE2-CG 3.94Å; Y214-W220 AromaticContact CE2-NE1 3.67Å; Y214-W220 AromaticContact CZ-CD1 3.68Å; Y214-W220 WeakPolarHBondContact OH-CB 3.41Å; Y214-D225 PolarHBondContact OH-N 3.45Å; Y214-D225 PolarHBondContact OH-OD1 2.64Å; Y214-V228 HydrophobicContact CD1-CB 4.13Å; Y214-V228 HydrophobicContact CD1-CG1 3.68Å; Y214-V228 HydrophobicContact CD1-CG2 3.94Å; Y214-V228 HydrophobicContact CD2-CG2 3.9Å; Y214-V228 HydrophobicContact CE1-CB 4.08Å; Y214-V228 HydrophobicContact CE1-CG1 4.08Å; Y214-V228 HydrophobicContact CE1-CG2 3.94Å; Y214-V228 HydrophobicContact CE2-CG2 3.93Å; Y214-V228 HydrophobicContact CG-CG1 4.13Å; Y214-V228 HydrophobicContact CG-CG2 3.89Å
215	D	94.9	Very high	95.8	Very high	89 Å²	89	64.6 Å²	64.6	48%	0.476	36%	0.363	S	S	.	.			trans	-97.1	108.7	176.1	-177	9.4	0	0	0	109.8	N213 D217 G218	N213-D215 PolarHBondContact O-N 3.39Å; D215-D217 VanDerWaalsContact C-N 3.25Å; D215-D217 PolarHBondContact O-N 2.98Å; D215-D217 PolarHBondContact OD1-N 3.34Å; D215-D217 VanDerWaalsContact OD1-N 3.1Å; D215-G218 PolarHBondContact O-N 2.93Å; D215-G218 VanDerWaalsContact O-N 3.13Å
216	E	90.8	Very high	95.9	Very high	132 Å²	132	60.4 Å²	60.4	62%	0.617	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-21.2	179.8	-65.1	-179.4	177.5	0	0	112.7	Y214 G218 K232	Y214-E216 HydrophobicContact CD1-CG 4.07Å; Y214-E216 HydrophobicContact CE1-CG 4.29Å; E216-G218 VanDerWaalsContact C-N 3.3Å; E216-K232 IonicContact OE1-NZ 2.64Å; E216-K232 PolarHBondContact OE1-NZ 2.93Å
217	D	92.7	Very high	95.9	Very high	163 Å²	163	57.6 Å²	57.6	87%	0.872	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	4.7	173.5	-66.2	-51.4	0	0	0	111.9	D215	D215-D217 VanDerWaalsContact C-N 3.25Å; D215-D217 PolarHBondContact O-N 2.98Å; D215-D217 PolarHBondContact OD1-N 3.34Å; D215-D217 VanDerWaalsContact OD1-N 3.1Å
218	G	93.5	Very high	95.9	Very high	23 Å²	23	57.1 Å²	57.1	24%	0.237	33%	0.329	C	S	.	.	S	Bend	trans	-69	163.6	178.7	0	0	0	0	0	113.3	D215 E216 W220	D215-G218 PolarHBondContact O-N 2.93Å; D215-G218 VanDerWaalsContact O-N 3.13Å; E216-G218 VanDerWaalsContact C-N 3.3Å; G218-W220 PolarHBondContact O-N 3.12Å; G218-W220 VanDerWaalsContact O-N 3.1Å
219	A	96.1	Very high	95.9	Very high	106 Å²	106	58.4 Å²	58.4	88%	0.876	34%	0.335	S	S	*	.			trans	-84.9	34.5	178.2	0	0	0	0	0	113
220	W	97.4	Very high	96	Very high	49 Å²	49	58.4 Å²	58.4	19%	0.186	32%	0.323	C	S	.	.			trans	-72	149.5	178.1	-67.2	112.4	0	0	0	110.6	N199 E202 F203 V207 Y214 G218 L224	N199-W220 HydrophobicContact CB-CE3 4.17Å; N199-W220 HydrophobicContact CB-CZ3 4.21Å; E202-W220 HydrophobicContact CB-CH2 4.12Å; E202-W220 HydrophobicContact CB-CZ3 4.05Å; E202-W220 HydrophobicContact CG-CH2 3.83Å; E202-W220 HydrophobicContact CG-CZ3 4.17Å; F203-W220 HydrophobicContact CB-CH2 4.21Å; F203-W220 HydrophobicContact CB-CZ3 4.04Å; V207-W220 HydrophobicContact CG2-CZ2 4.21Å; Y214-W220 AromaticContact CE2-CD1 3.41Å; Y214-W220 VanDerWaalsContact CE2-CD1 3.41Å; Y214-W220 HydrophobicContact CE2-CD2 4.48Å; Y214-W220 AromaticContact CE2-CG 3.94Å; Y214-W220 HydrophobicContact CE2-CG 3.94Å; Y214-W220 AromaticContact CE2-NE1 3.67Å; Y214-W220 AromaticContact CZ-CD1 3.68Å; Y214-W220 WeakPolarHBondContact OH-CB 3.41Å; G218-W220 PolarHBondContact O-N 3.12Å; G218-W220 VanDerWaalsContact O-N 3.1Å; W220-L224 HydrophobicContact CB-CB 4.48Å; W220-L224 HydrophobicContact CE3-CD1 3.79Å; W220-L224 HydrophobicContact CZ3-CD1 4.33Å
221	P	97.5	Very high	96.1	Very high	12 Å²	12	54.4 Å²	54.4	8%	0.078	30%	0.301	C	S	.	.			trans	-60.4	139.9	169.4	-25.4	34.3	0	0	0	111.1	D195 Q196 N199 L223 L224 D225	D195-P221 WeakPolarHBondContact OD2-CG 3.23Å; Q196-P221 HydrophobicContact CG-CB 3.96Å; Q196-P221 HydrophobicContact CG-CG 4.49Å; N199-P221 HydrophobicContact CB-CG 3.63Å; P221-L223 PolarHBondContact O-N 2.9Å; P221-L224 WeakPolarHBondContact O-CB 3.2Å; P221-L224 PolarHBondContact O-N 3.41Å; P221-D225 PolarHBondContact O-N 3.3Å
222	V	97.2	Very high	96	Very high	88 Å²	88	57.7 Å²	57.7	53%	0.533	32%	0.315	S	S	.	.	H	α-helix	trans	-48.1	-30.6	178.4	179.4	0	0	0	0	113.5	L224 D225 E226	V222-L224 VanDerWaalsContact C-N 3.28Å; V222-L224 PolarHBondContact O-N 3.14Å; V222-D225 WeakPolarHBondContact CA-OD2 3.46Å; V222-D225 PolarHBondContact O-N 3.05Å; V222-E226 HydrophobicContact CG1-CG 4.11Å; V222-E226 WeakPolarHBondContact O-CB 3.44Å; V222-E226 WeakPolarHBondContact O-CG 3.2Å; V222-E226 PolarHBondContact O-N 2.97Å
223	L	97.9	Very high	95.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-56.9	-41	174.9	-179.4	153.8	0	0	0	112.7	F180 Y183 L184 Y189 M192 P221 F227	F180-L223 HydrophobicContact CE2-CD2 3.75Å; F180-L223 HydrophobicContact CZ-CD2 3.65Å; Y183-L223 HydrophobicContact CE1-CD2 4.28Å; Y183-L223 HydrophobicContact CE1-CG 4.35Å; Y183-L223 PolarHBondContact OH-O 3.36Å; L184-L223 HydrophobicContact CD2-CD1 4.26Å; L184-L223 HydrophobicContact CD2-CD2 4.35Å; Y189-L223 HydrophobicContact CD1-CD1 3.99Å; Y189-L223 HydrophobicContact CD2-CD1 3.99Å; Y189-L223 HydrophobicContact CD2-CG 4.12Å; Y189-L223 HydrophobicContact CE1-CB 4.09Å; Y189-L223 HydrophobicContact CE1-CD1 4.17Å; Y189-L223 HydrophobicContact CE1-CG 4.41Å; Y189-L223 HydrophobicContact CE2-CB 4.08Å; Y189-L223 HydrophobicContact CE2-CD1 4.21Å; Y189-L223 HydrophobicContact CE2-CG 3.92Å; Y189-L223 HydrophobicContact CG-CD1 3.92Å; Y189-L223 WeakPolarHBondContact OH-CA 3.33Å; Y189-L223 PolarHBondContact OH-N 3.14Å; M192-L223 HydrophobicContact CE-CD1 4.41Å; P221-L223 PolarHBondContact O-N 2.9Å; L223-F227 WeakPolarHBondContact O-CB 3.34Å; L223-F227 PolarHBondContact O-N 3.19Å; L223-F227 VanDerWaalsContact O-N 3.13Å
224	L	98.2	Very high	95.6	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-78.2	-35.4	179.6	-66.2	176.4	0	0	0	111.4	F180 N199 V200 F203 W220 P221 V222 F227 V228	F180-L224 HydrophobicContact CE2-CD2 3.9Å; F180-L224 HydrophobicContact CZ-CD2 4.27Å; N199-L224 HydrophobicContact CB-CD1 3.93Å; V200-L224 HydrophobicContact CG2-CD2 4.12Å; F203-L224 HydrophobicContact CB-CD1 3.88Å; F203-L224 HydrophobicContact CB-CD2 4.43Å; F203-L224 HydrophobicContact CD2-CB 4.19Å; F203-L224 HydrophobicContact CD2-CD1 3.85Å; F203-L224 HydrophobicContact CD2-CD2 4.1Å; F203-L224 HydrophobicContact CD2-CG 4.28Å; F203-L224 HydrophobicContact CE2-CB 4.34Å; F203-L224 HydrophobicContact CG-CD1 4.14Å; F203-L224 HydrophobicContact CG-CD2 4.15Å; W220-L224 HydrophobicContact CB-CB 4.48Å; W220-L224 HydrophobicContact CE3-CD1 3.79Å; W220-L224 HydrophobicContact CZ3-CD1 4.33Å; P221-L224 WeakPolarHBondContact O-CB 3.2Å; P221-L224 PolarHBondContact O-N 3.41Å; V222-L224 VanDerWaalsContact C-N 3.28Å; V222-L224 PolarHBondContact O-N 3.14Å; L224-F227 WeakPolarHBondContact O-CB 3.49Å; L224-F227 PolarHBondContact O-N 2.8Å; L224-V228 WeakPolarHBondContact O-CG2 3.39Å; L224-V228 PolarHBondContact O-N 3.25Å
225	D	97.5	Very high	95	Very high	46 Å²	46	63.9 Å²	63.9	25%	0.246	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-51.6	171.5	-62.7	-45.9	0	0	0	110.9	Y214 P221 V222 F227 V228 E229	Y214-D225 PolarHBondContact OH-N 3.45Å; Y214-D225 PolarHBondContact OH-OD1 2.64Å; P221-D225 PolarHBondContact O-N 3.3Å; V222-D225 WeakPolarHBondContact CA-OD2 3.46Å; V222-D225 PolarHBondContact O-N 3.05Å; D225-F227 VanDerWaalsContact C-N 3.25Å; D225-F227 PolarHBondContact O-N 3.1Å; D225-V228 PolarHBondContact O-N 3.13Å; D225-V228 VanDerWaalsContact O-N 3.13Å; D225-E229 PolarHBondContact O-N 3.45Å
226	E	97.5	Very high	94.5	Very high	48 Å²	48	65.4 Å²	65.4	22%	0.224	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-32.5	178.2	-74.1	-180	168.9	0	0	111.9	Y183 K188 Y189 V222 W230	Y183-E226 HydrophobicContact CE2-CB 4.44Å; Y183-E226 WeakPolarHBondContact OH-CB 3.42Å; K188-E226 VanDerWaalsContact CE-OE1 3.29Å; K188-E226 WeakPolarHBondContact CE-OE1 3.29Å; K188-E226 VanDerWaalsContact CE-OE2 3.31Å; K188-E226 WeakPolarHBondContact CE-OE2 3.46Å; K188-E226 IonicContact NZ-OE1 3.61Å; K188-E226 PolarHBondContact NZ-OE1 3Å; K188-E226 IonicContact NZ-OE2 2.65Å; Y189-E226 WeakPolarHBondContact CE2-OE2 3.14Å; Y189-E226 VanDerWaalsContact CZ-OE2 3.26Å; Y189-E226 PolarHBondContact OH-OE2 2.95Å; V222-E226 HydrophobicContact CG1-CG 4.11Å; V222-E226 WeakPolarHBondContact O-CB 3.44Å; V222-E226 WeakPolarHBondContact O-CG 3.2Å; V222-E226 PolarHBondContact O-N 2.97Å; E226-W230 WeakPolarHBondContact O-CB 3.45Å; E226-W230 PolarHBondContact O-N 3.35Å
227	F	97.9	Very high	93.5	Very high	0 Å²	0	66 Å²	66	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.1	-46.9	173	165.2	-115.9	0	0	0	112	L176 V179 F180 Y183 F203 L223 L224 D225 W230 Q231	L176-F227 HydrophobicContact CB-CZ 4.44Å; L176-F227 HydrophobicContact CD1-CE1 4.5Å; V179-F227 HydrophobicContact CG1-CE2 4.06Å; V179-F227 HydrophobicContact CG1-CZ 4.46Å; F180-F227 HydrophobicContact CB-CD2 4.49Å; F180-F227 HydrophobicContact CB-CE2 3.9Å; F180-F227 HydrophobicContact CB-CZ 3.99Å; F180-F227 HydrophobicContact CD2-CB 4.28Å; F180-F227 AromaticContact CD2-CD1 3.88Å; F180-F227 HydrophobicContact CD2-CD1 3.88Å; F180-F227 AromaticContact CD2-CD2 3.66Å; F180-F227 HydrophobicContact CD2-CD2 3.66Å; F180-F227 HydrophobicContact CD2-CE1 4.1Å; F180-F227 AromaticContact CD2-CE2 3.87Å; F180-F227 HydrophobicContact CD2-CE2 3.87Å; F180-F227 AromaticContact CD2-CG 3.65Å; F180-F227 HydrophobicContact CD2-CG 3.65Å; F180-F227 HydrophobicContact CD2-CZ 4.09Å; F180-F227 HydrophobicContact CE2-CB 4.28Å; F180-F227 HydrophobicContact CE2-CD1 4.38Å; F180-F227 HydrophobicContact CE2-CD2 4.46Å; F180-F227 HydrophobicContact CE2-CG 4.11Å; F180-F227 HydrophobicContact CG-CE2 4.41Å; Y183-F227 HydrophobicContact CD1-CB 3.78Å; Y183-F227 AromaticContact CD1-CD2 3.81Å; Y183-F227 HydrophobicContact CD1-CD2 3.81Å; Y183-F227 HydrophobicContact CD1-CG 4.19Å; Y183-F227 HydrophobicContact CE1-CB 3.62Å; Y183-F227 HydrophobicContact CE1-CG 4.49Å; Y183-F227 HydrophobicContact CE2-CB 4.43Å; Y183-F227 HydrophobicContact CG-CB 4.23Å; Y183-F227 AromaticContact CG-CD2 3.79Å; Y183-F227 HydrophobicContact CG-CD2 3.79Å; Y183-F227 HydrophobicContact CG-CG 4.49Å; Y183-F227 PolarHBondContact OH-N 3.48Å; F203-F227 HydrophobicContact CE1-CD1 4.27Å; F203-F227 AromaticContact CE1-CE1 3.88Å; F203-F227 HydrophobicContact CE1-CE1 3.88Å; F203-F227 AromaticContact CZ-CD1 3.98Å; F203-F227 HydrophobicContact CZ-CD1 3.98Å; F203-F227 AromaticContact CZ-CE1 3.91Å; F203-F227 HydrophobicContact CZ-CE1 3.91Å; L223-F227 WeakPolarHBondContact O-CB 3.34Å; L223-F227 PolarHBondContact O-N 3.19Å; L223-F227 VanDerWaalsContact O-N 3.13Å; L224-F227 WeakPolarHBondContact O-CB 3.49Å; L224-F227 PolarHBondContact O-N 2.8Å; D225-F227 VanDerWaalsContact C-N 3.25Å; D225-F227 PolarHBondContact O-N 3.1Å; F227-W230 PolarHBondContact O-N 3.25Å; F227-Q231 HydrophobicContact CE2-CB 4.47Å; F227-Q231 WeakPolarHBondContact O-CB 3.45Å; F227-Q231 PolarHBondContact O-N 3.38Å
228	V	97.3	Very high	93.5	Very high	3 Å²	3	61.1 Å²	61.1	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-45.5	179.9	168.6	0	0	0	0	110.4	F203 L211 Y214 L224 D225 Q231 K232	F203-V228 HydrophobicContact CE2-CG2 3.86Å; F203-V228 HydrophobicContact CZ-CG2 3.8Å; L211-V228 HydrophobicContact CD1-CG1 4.2Å; L211-V228 HydrophobicContact CD1-CG2 4.37Å; L211-V228 HydrophobicContact CD2-CG2 4.26Å; Y214-V228 HydrophobicContact CD1-CB 4.13Å; Y214-V228 HydrophobicContact CD1-CG1 3.68Å; Y214-V228 HydrophobicContact CD1-CG2 3.94Å; Y214-V228 HydrophobicContact CD2-CG2 3.9Å; Y214-V228 HydrophobicContact CE1-CB 4.08Å; Y214-V228 HydrophobicContact CE1-CG1 4.08Å; Y214-V228 HydrophobicContact CE1-CG2 3.94Å; Y214-V228 HydrophobicContact CE2-CG2 3.93Å; Y214-V228 HydrophobicContact CG-CG1 4.13Å; Y214-V228 HydrophobicContact CG-CG2 3.89Å; L224-V228 WeakPolarHBondContact O-CG2 3.39Å; L224-V228 PolarHBondContact O-N 3.25Å; D225-V228 PolarHBondContact O-N 3.13Å; D225-V228 VanDerWaalsContact O-N 3.13Å; V228-Q231 PolarHBondContact O-N 3.08Å; V228-K232 HydrophobicContact CG1-CD 4.06Å; V228-K232 HydrophobicContact CG1-CG 4.43Å; V228-K232 WeakPolarHBondContact O-CB 3.49Å; V228-K232 WeakPolarHBondContact O-CG 3.47Å; V228-K232 PolarHBondContact O-N 2.96Å
229	E	95.7	Very high	93.5	Very high	132 Å²	132	63.1 Å²	63.1	62%	0.617	35%	0.346	S	S	*	.	H	α-helix	trans	-58.6	-50.4	175.4	-173.7	-179.1	-170.6	0	0	111.2	D225 Q231 K232 V233	D225-E229 PolarHBondContact O-N 3.45Å; E229-Q231 VanDerWaalsContact C-N 3.3Å; E229-Q231 PolarHBondContact O-N 3Å; E229-K232 PolarHBondContact O-N 3.17Å; E229-V233 WeakPolarHBondContact O-CG2 3.22Å; E229-V233 PolarHBondContact O-N 2.94Å
230	W	96.3	Very high	93.4	Very high	55 Å²	55	60.7 Å²	60.7	21%	0.208	32%	0.316	C	S	.	.	H	α-helix	trans	-57.5	-42.1	178.6	177.6	90	0	0	0	112.5	V179 Q182 Y183 E226 F227 R234	V179-W230 HydrophobicContact CG1-CZ3 3.71Å; Q182-W230 HydrophobicContact CB-CH2 4.35Å; Q182-W230 HydrophobicContact CG-CH2 4.19Å; Y183-W230 HydrophobicContact CD2-CB 4.05Å; Y183-W230 HydrophobicContact CD2-CD2 4.03Å; Y183-W230 HydrophobicContact CD2-CE3 4.32Å; Y183-W230 AromaticContact CD2-CG 3.92Å; Y183-W230 HydrophobicContact CD2-CG 3.92Å; Y183-W230 HydrophobicContact CE2-CB 4.33Å; Y183-W230 HydrophobicContact CG-CE3 4.48Å; E226-W230 WeakPolarHBondContact O-CB 3.45Å; E226-W230 PolarHBondContact O-N 3.35Å; F227-W230 PolarHBondContact O-N 3.25Å; W230-R234 VanDerWaalsContact CH2-CD 3.43Å; W230-R234 VanDerWaalsContact CZ2-CD 3.43Å; W230-R234 PolarHBondContact O-N 3.29Å; W230-R234 VanDerWaalsContact O-N 3.14Å
231	Q	95.3	Very high	93.2	Very high	16 Å²	16	61.4 Å²	61.4	8%	0.075	32%	0.324	C	S	.	.	H	α-helix	trans	-71.8	-39.1	-180	177.2	60.1	-5.6	0	0	112.4	V179 L211 F227 V228 E229 R234 Q235	V179-Q231 VanDerWaalsContact CG1-CD 3.45Å; V179-Q231 HydrophobicContact CG1-CG 4.3Å; L211-Q231 HydrophobicContact CD1-CB 3.97Å; L211-Q231 HydrophobicContact CD1-CG 3.7Å; F227-Q231 HydrophobicContact CE2-CB 4.47Å; F227-Q231 WeakPolarHBondContact O-CB 3.45Å; F227-Q231 PolarHBondContact O-N 3.38Å; V228-Q231 PolarHBondContact O-N 3.08Å; E229-Q231 VanDerWaalsContact C-N 3.3Å; E229-Q231 PolarHBondContact O-N 3Å; Q231-R234 PolarHBondContact O-N 3.01Å; Q231-Q235 WeakPolarHBondContact O-CG 3.17Å; Q231-Q235 PolarHBondContact O-N 3.22Å
232	K	93.4	Very high	92.9	Very high	77 Å²	77	64.5 Å²	64.5	34%	0.335	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-45.8	174.9	-75.6	177.3	-179.5	-178.6	0	111	E216 V228 E229 R234 Q235 T236	E216-K232 IonicContact OE1-NZ 2.64Å; E216-K232 PolarHBondContact OE1-NZ 2.93Å; V228-K232 HydrophobicContact CG1-CD 4.06Å; V228-K232 HydrophobicContact CG1-CG 4.43Å; V228-K232 WeakPolarHBondContact O-CB 3.49Å; V228-K232 WeakPolarHBondContact O-CG 3.47Å; V228-K232 PolarHBondContact O-N 2.96Å; E229-K232 PolarHBondContact O-N 3.17Å; K232-R234 VanDerWaalsContact C-N 3.33Å; K232-R234 PolarHBondContact O-N 3.14Å; K232-Q235 PolarHBondContact O-N 3.1Å; K232-T236 PolarHBondContact O-N 3.48Å; K232-T236 PolarHBondContact O-OG1 3.27Å
233	V	92.9	Very high	92.6	Very high	80 Å²	80	62.9 Å²	62.9	49%	0.485	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-42.2	177	173.6	0	0	0	0	111.5	E229 Q235 T236 S237	E229-V233 WeakPolarHBondContact O-CG2 3.22Å; E229-V233 PolarHBondContact O-N 2.94Å; V233-Q235 VanDerWaalsContact C-N 3.34Å; V233-Q235 PolarHBondContact O-N 2.78Å; V233-T236 PolarHBondContact O-N 3.33Å; V233-T236 PolarHBondContact O-OG1 3.26Å; V233-S237 PolarHBondContact O-N 2.63Å; V233-S237 PolarHBondContact O-OG 2.79Å
234	R	89.9	Confident	92.2	Very high	108 Å²	108	67.4 Å²	67.4	41%	0.408	35%	0.35	S	S	.	.	H	α-helix	trans	-64.8	-31.6	177	-101.6	-174.3	67.5	147.1	-6	114.6	W230 Q231 K232 T236	W230-R234 VanDerWaalsContact CH2-CD 3.43Å; W230-R234 VanDerWaalsContact CZ2-CD 3.43Å; W230-R234 PolarHBondContact O-N 3.29Å; W230-R234 VanDerWaalsContact O-N 3.14Å; Q231-R234 PolarHBondContact O-N 3.01Å; K232-R234 VanDerWaalsContact C-N 3.33Å; K232-R234 PolarHBondContact O-N 3.14Å; R234-T236 VanDerWaalsContact C-N 3.33Å
235	Q	86.2	Confident	91.8	Very high	114 Å²	114	72.5 Å²	72.5	53%	0.533	38%	0.376	S	S	.	.	H	α-helix	trans	-76.8	-24.2	177	-71.6	-179.9	13	0	0	112.4	Q231 K232 V233	Q231-Q235 WeakPolarHBondContact O-CG 3.17Å; Q231-Q235 PolarHBondContact O-N 3.22Å; K232-Q235 PolarHBondContact O-N 3.1Å; V233-Q235 VanDerWaalsContact C-N 3.34Å; V233-Q235 PolarHBondContact O-N 2.78Å
236	T	83.9	Confident	91.3	Very high	121 Å²	121	74.8 Å²	74.8	74%	0.742	39%	0.387	S	S	*	.	H	α-helix	trans	-87.8	-13.5	176.9	54.9	0	0	0	0	114.6	K232 V233 R234	K232-T236 PolarHBondContact O-N 3.48Å; K232-T236 PolarHBondContact O-OG1 3.27Å; V233-T236 PolarHBondContact O-N 3.33Å; V233-T236 PolarHBondContact O-OG1 3.26Å; R234-T236 VanDerWaalsContact C-N 3.33Å
237	S	69.3	Low	90.7	Very high	143 Å²	143	77.2 Å²	77.2	100%	1	40%	0.402	S	S	*	.			trans	-97.1	0	-179	-56.2	0	0	0	0	111.7	V233	V233-S237 PolarHBondContact O-N 2.63Å; V233-S237 PolarHBondContact O-OG 2.79Å

Retrieved 237 of 237 residues in 827.8 ms (Link to these results)

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