A0A087Y7K6_POEFO Loading...

Homeobox D12a

Sequence-specific transcription factor which is part of a developmental regulatory system that provides cells with specific positional identities on the anterior-posterior axis.

AlphaFold DB , UniProt , Accession A0A087Y7K6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 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	38.4	Very low	51.7	Low	230 Å²	230	157.6 Å²	157.6	100%	1.133	81%	0.812	S	S	*	*				0	114.9	0	-77.5	62.2	174.4	0	0	107.6
2	E	49	Very low	52	Low	197 Å²	197	149.4 Å²	149.4	92%	0.921	80%	0.795	S	S	*	*			trans	-77.6	153.2	158.4	-73.5	169.6	101.5	0	0	109
3	M	47.3	Very low	52.9	Low	180 Å²	180	147.2 Å²	147.2	89%	0.887	77%	0.77	S	S	*	*			trans	-118.5	104	-174.1	42.9	-161.4	164	0	0	108.9	E5	M3-E5 PolarHBondContact O-N 3.27Å
4	C	49.9	Very low	53.6	Low	123 Å²	123	146.6 Å²	146.6	83%	0.831	78%	0.775	S	S	*	*			trans	-55.3	124.3	-168.8	-55.4	0	0	0	0	112.7	R6	C4-R6 PolarHBondContact O-N 3.28Å
5	E	50.7	Low	53.7	Low	193 Å²	193	138.7 Å²	138.7	90%	0.902	74%	0.743	S	S	*	*			trans	-62.4	129.5	174	-63.1	-168.9	120.9	0	0	111	M3 N7	M3-E5 PolarHBondContact O-N 3.27Å; E5-N7 PolarHBondContact O-N 3.03Å; E5-N7 VanDerWaalsContact O-N 3.17Å
6	R	56.5	Low	54	Low	210 Å²	210	137.2 Å²	137.2	79%	0.792	75%	0.747	S	S	*	*			trans	-87.1	85.1	-178.5	-70.3	179.6	174.9	155.1	-2.7	110.4	C4 P8	C4-R6 PolarHBondContact O-N 3.28Å; R6-P8 VanDerWaalsContact O-CD 3.3Å; R6-P8 WeakPolarHBondContact O-CD 3.3Å
7	N	56.2	Low	54.3	Low	109 Å²	109	139.4 Å²	139.4	58%	0.583	76%	0.756	S	S	*	*			trans	-61.1	115.6	172.4	-179.5	-2	0	0	0	110.8	E5 L9	E5-N7 PolarHBondContact O-N 3.03Å; E5-N7 VanDerWaalsContact O-N 3.17Å; N7-L9 VanDerWaalsContact C-N 3.28Å; N7-L9 PolarHBondContact O-N 3.48Å; N7-L9 WeakPolarHBondContact OD1-CB 3.18Å; N7-L9 PolarHBondContact OD1-N 3.26Å; N7-L9 VanDerWaalsContact OD1-N 3.07Å
8	P	58.2	Low	54.7	Low	95 Å²	95	140.1 Å²	140.1	62%	0.617	76%	0.759	S	S	*	*	S	Bend	trans	-79.6	-4.1	-175.1	33.4	-36.3	0	0	0	114.1	R6 N10	R6-P8 VanDerWaalsContact O-CD 3.3Å; R6-P8 WeakPolarHBondContact O-CD 3.3Å; P8-N10 VanDerWaalsContact C-N 3.28Å; P8-N10 PolarHBondContact O-N 3.47Å
9	L	56.6	Low	54.7	Low	149 Å²	149	140.6 Å²	140.6	78%	0.78	76%	0.761	S	S	*	*			trans	-87.1	21.3	-172.1	-61.4	174.2	0	0	0	114.6	N7	N7-L9 VanDerWaalsContact C-N 3.28Å; N7-L9 PolarHBondContact O-N 3.48Å; N7-L9 WeakPolarHBondContact OD1-CB 3.18Å; N7-L9 PolarHBondContact OD1-N 3.26Å; N7-L9 VanDerWaalsContact OD1-N 3.07Å
10	N	51.2	Low	54	Low	108 Å²	108	144.3 Å²	144.3	58%	0.578	77%	0.77	S	S	*	*			trans	-92.5	123.7	177.1	-171.4	-42.6	0	0	0	111.1	P8 G12 Y13	P8-N10 VanDerWaalsContact C-N 3.28Å; P8-N10 PolarHBondContact O-N 3.47Å; N10-G12 PolarHBondContact O-N 3.08Å; N10-G12 PolarHBondContact OD1-N 3.08Å; N10-Y13 PolarHBondContact O-N 2.81Å
11	P	54.8	Low	53.6	Low	140 Å²	140	142.3 Å²	142.3	91%	0.909	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-13.3	-179.2	-27	35.6	0	0	0	116.6
12	G	55.8	Low	53.8	Low	59 Å²	59	135.7 Å²	135.7	61%	0.608	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	0.9	175.6	0	0	0	0	0	115.8	N10 V14	N10-G12 PolarHBondContact O-N 3.08Å; N10-G12 PolarHBondContact OD1-N 3.08Å; G12-V14 PolarHBondContact O-N 3.31Å
13	Y	63.7	Low	53.8	Low	121 Å²	121	131.6 Å²	131.6	48%	0.475	75%	0.746	S	S	.	*			trans	-79.2	93.2	-172	-172.3	-104.1	0	0	0	113.3	N10 G15	N10-Y13 PolarHBondContact O-N 2.81Å; Y13-G15 PolarHBondContact O-N 3.28Å
14	V	61.7	Low	53.8	Low	138 Å²	138	131.1 Å²	131.1	84%	0.836	74%	0.741	S	S	*	*			trans	-82.2	88.8	168	-171.3	0	0	0	0	109.1	G12	G12-V14 PolarHBondContact O-N 3.31Å
15	G	55.5	Low	54	Low	29 Å²	29	130.1 Å²	130.1	30%	0.299	74%	0.736	S	S	.	*			trans	-59.1	139.1	177.9	0	0	0	0	0	112.9	Y13 L17	Y13-G15 PolarHBondContact O-N 3.28Å; G15-L17 PolarHBondContact O-N 3.27Å
16	S	58.6	Low	53.9	Low	114 Å²	114	128 Å²	128	80%	0.797	73%	0.73	S	S	*	*			trans	-67.5	99	-178	-52.2	0	0	0	0	112.1	L18	S16-L18 PolarHBondContact O-N 2.74Å
17	L	59.6	Low	53.7	Low	174 Å²	174	127.5 Å²	127.5	91%	0.911	73%	0.73	S	S	*	*			trans	-74.3	54.3	174	-68	174.5	0	0	0	112.4	G15	G15-L17 PolarHBondContact O-N 3.27Å
18	L	61.2	Low	53.2	Low	153 Å²	153	130.8 Å²	130.8	80%	0.801	74%	0.739	S	S	*	*			trans	-141.7	66.2	177.8	-74	178.4	0	0	0	111.1	S16	S16-L18 PolarHBondContact O-N 2.74Å
19	N	54	Low	53	Low	149 Å²	149	129.3 Å²	129.3	80%	0.797	73%	0.731	S	S	*	*			trans	173.5	92.1	136.8	-94	-40.3	0	0	0	111.4
20	F	42.2	Very low	52.6	Low	215 Å²	215	129.5 Å²	129.5	94%	0.943	73%	0.733	S	S	*	*			trans	-128.5	103.6	146.2	-83.1	-75.7	0	0	0	107.1	A22	F20-A22 PolarHBondContact O-N 3.45Å; F20-A22 VanDerWaalsContact O-N 3.11Å
21	A	44.7	Very low	52.8	Low	102 Å²	102	132.3 Å²	132.3	84%	0.843	75%	0.747	S	S	*	*			trans	-78.4	90.8	175.7	0	0	0	0	0	109.1
22	A	41.9	Very low	52.8	Low	91 Å²	91	131.6 Å²	131.6	75%	0.752	74%	0.744	S	S	*	*			trans	-89.6	127.2	161.7	0	0	0	0	0	108.5	F20	F20-A22 PolarHBondContact O-N 3.45Å; F20-A22 VanDerWaalsContact O-N 3.11Å
23	P	49.4	Very low	52.1	Low	111 Å²	111	131.9 Å²	131.9	72%	0.721	75%	0.747	S	S	*	*			trans	-70.4	173.3	167.2	32.2	-34.3	0	0	0	110.7
24	E	47	Very low	51.3	Low	170 Å²	170	134.1 Å²	134.1	79%	0.794	77%	0.767	S	S	*	*	S	Bend	trans	68.4	89.1	-179.6	-58.8	-49	125.1	0	0	117.8
25	S	54.4	Low	50.8	Low	102 Å²	102	131.7 Å²	131.7	71%	0.713	77%	0.77	S	S	*	*			trans	58	77.1	130.2	-156.6	0	0	0	0	119.2
26	L	48.5	Very low	50.3	Low	150 Å²	150	134.7 Å²	134.7	79%	0.785	79%	0.792	S	S	*	*			trans	-125.2	84.3	148.4	-74.4	179.1	0	0	0	110.5	F28	L26-F28 HydrophobicContact CB-CD2 4.43Å; L26-F28 HydrophobicContact CB-CE2 4.24Å; L26-F28 PolarHBondContact O-N 3.07Å
27	Y	53.2	Low	49.7	Very low	199 Å²	199	137.4 Å²	137.4	78%	0.78	79%	0.791	S	S	*	*			trans	-72.7	83.5	-176.8	-176.3	-109.7	0	0	0	112.4	S29	Y27-S29 VanDerWaalsContact CE1-CB 3.43Å; Y27-S29 WeakPolarHBondContact CE1-OG 3.32Å; Y27-S29 PolarHBondContact O-N 3.1Å; Y27-S29 PolarHBondContact OH-OG 3.42Å
28	F	45.7	Very low	49	Very low	177 Å²	177	136.1 Å²	136.1	78%	0.776	78%	0.784	S	S	*	*			trans	-73.2	68.9	171	-79.4	-79.7	0	0	0	112.3	L26	L26-F28 HydrophobicContact CB-CD2 4.43Å; L26-F28 HydrophobicContact CB-CE2 4.24Å; L26-F28 PolarHBondContact O-N 3.07Å
29	S	54.4	Low	48.1	Very low	65 Å²	65	134.1 Å²	134.1	46%	0.455	78%	0.78	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61	135.2	166.3	-146.3	0	0	0	0	110	Y27	Y27-S29 VanDerWaalsContact CE1-CB 3.43Å; Y27-S29 WeakPolarHBondContact CE1-OG 3.32Å; Y27-S29 PolarHBondContact O-N 3.1Å; Y27-S29 PolarHBondContact OH-OG 3.42Å
30	N	47.4	Very low	48.2	Very low	153 Å²	153	131 Å²	131	82%	0.818	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.6	14.4	176.2	-63	-55.9	0	0	0	117.1	C32	N30-C32 PolarHBondContact O-N 3.17Å
31	L	54.6	Low	48.4	Very low	166 Å²	166	128.7 Å²	128.7	87%	0.869	78%	0.78	S	S	*	*			trans	-86.7	90	159	-74.8	173.4	0	0	0	110.7	G33	L31-G33 VanDerWaalsContact C-N 3.31Å; L31-G33 PolarHBondContact O-N 3.32Å
32	C	54.6	Low	48.5	Very low	125 Å²	125	132.3 Å²	132.3	85%	0.845	78%	0.779	S	S	*	*			trans	-72.5	85.4	167.8	-72.4	0	0	0	0	110.4	N30	N30-C32 PolarHBondContact O-N 3.17Å
33	G	42.6	Very low	48.9	Very low	65 Å²	65	137 Å²	137	67%	0.67	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-65.4	142	160.5	0	0	0	0	0	110.4	L31	L31-G33 VanDerWaalsContact C-N 3.31Å; L31-G33 PolarHBondContact O-N 3.32Å
34	N	47.1	Very low	49.2	Very low	169 Å²	169	138.8 Å²	138.8	90%	0.904	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-63.9	144.8	176.3	-72.5	-41.7	0	0	0	110.7
35	G	50.2	Low	49.3	Very low	86 Å²	86	135 Å²	135	89%	0.887	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-66.6	134.1	-158.7	0	0	0	0	0	115.9
36	A	44.9	Very low	49.2	Very low	92 Å²	92	135 Å²	135	76%	0.76	78%	0.784	S	S	*	*			trans	-125.2	120	156.8	0	0	0	0	0	107.9	I38	A36-I38 PolarHBondContact O-N 3.05Å
37	H	45.9	Very low	49.1	Very low	171 Å²	171	137.8 Å²	137.8	79%	0.792	79%	0.786	S	S	*	*			trans	-91	100.2	-174	-176.8	-78.3	0	0	0	110.7	P39	H37-P39 WeakPolarHBondContact O-CD 3.32Å
38	I	46	Very low	48.8	Very low	148 Å²	148	131 Å²	131	76%	0.759	78%	0.777	S	S	*	*			trans	-75.4	121.7	175.8	-57.2	179.5	0	0	0	109.2	A36	A36-I38 PolarHBondContact O-N 3.05Å
39	P	42.2	Very low	49.1	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	79%	0.787	S	S	*	*	S	Bend	trans	-73	143.5	174.6	-12.3	28.4	0	0	0	111.5	H37	H37-P39 WeakPolarHBondContact O-CD 3.32Å
40	G	55.3	Low	49	Very low	85 Å²	85	141.5 Å²	141.5	88%	0.876	80%	0.801	S	S	*	*			trans	119.9	15.8	161.5	0	0	0	0	0	118.6
41	L	45.9	Very low	49.3	Very low	166 Å²	166	142.5 Å²	142.5	87%	0.869	80%	0.801	S	S	*	*			trans	-117.3	133.8	175.8	-139	156.7	0	0	0	111.6	Q43	L41-Q43 PolarHBondContact O-N 3.29Å
42	H	46.9	Very low	49.3	Very low	178 Å²	178	141 Å²	141	82%	0.824	80%	0.799	S	S	*	*			trans	-58.5	128.7	-171.8	-113.4	-115.2	0	0	0	113.1	L44	H42-L44 PolarHBondContact O-N 3.34Å
43	Q	51.1	Low	49.1	Very low	190 Å²	190	141.3 Å²	141.3	89%	0.888	80%	0.8	S	S	*	*			trans	-86	90.7	-175.4	-166.4	160.3	73.7	0	0	110.9	L41	L41-Q43 PolarHBondContact O-N 3.29Å
44	L	54.9	Low	49.8	Very low	148 Å²	148	142.4 Å²	142.4	78%	0.775	80%	0.803	S	S	*	*			trans	-66.9	153.2	171.3	-70.7	175.5	0	0	0	111.3	H42 A46	H42-L44 PolarHBondContact O-N 3.34Å; L44-A46 PolarHBondContact O-N 2.9Å
45	P	49.3	Very low	49.8	Very low	90 Å²	90	142.5 Å²	142.5	58%	0.584	80%	0.798	S	S	*	*			trans	-58.1	126.1	-175	-25.8	35.2	0	0	0	113	Y47	P45-Y47 VanDerWaalsContact C-N 3.32Å; P45-Y47 HydrophobicContact CB-CE2 4.1Å; P45-Y47 VanDerWaalsContact O-CD2 3.24Å; P45-Y47 WeakPolarHBondContact O-CD2 3.49Å; P45-Y47 PolarHBondContact O-N 2.98Å
46	A	52.6	Low	50.2	Low	101 Å²	101	143.3 Å²	143.3	84%	0.835	79%	0.787	S	S	*	*			trans	-75.4	81.6	177.6	0	0	0	0	0	111	L44 G48	L44-A46 PolarHBondContact O-N 2.9Å; A46-G48 PolarHBondContact O-N 3.27Å
47	Y	46.7	Very low	50.5	Low	209 Å²	209	151.2 Å²	151.2	82%	0.82	80%	0.798	S	S	*	*			trans	-56.3	112.4	168.9	-67.8	-83.2	0	0	0	109.4	P45 R49	P45-Y47 VanDerWaalsContact C-N 3.32Å; P45-Y47 HydrophobicContact CB-CE2 4.1Å; P45-Y47 VanDerWaalsContact O-CD2 3.24Å; P45-Y47 WeakPolarHBondContact O-CD2 3.49Å; P45-Y47 PolarHBondContact O-N 2.98Å; Y47-R49 PolarHBondContact O-N 3.23Å
48	G	47.2	Very low	50.7	Low	57 Å²	57	147.5 Å²	147.5	59%	0.588	79%	0.791	S	S	*	*			trans	-63.9	124.3	-166.9	0	0	0	0	0	112.5	A46 R50	A46-G48 PolarHBondContact O-N 3.27Å; G48-R50 PolarHBondContact O-N 3.24Å
49	R	50.4	Low	50.9	Low	264 Å²	264	146.3 Å²	146.3	100%	0.996	79%	0.793	S	S	*	*	S	Bend	trans	-75.2	55.1	-178.1	-159.5	-174.7	-168.2	-116.9	6.4	113.4	Y47	Y47-R49 PolarHBondContact O-N 3.23Å
50	R	54.1	Low	51.1	Low	199 Å²	199	146.9 Å²	146.9	75%	0.751	80%	0.8	S	S	*	*			trans	-118.3	155.4	162.4	64.3	-177.2	-171.7	-113.5	1.3	108.3	G48	G48-R50 PolarHBondContact O-N 3.24Å
51	E	52.5	Low	50.7	Low	173 Å²	173	148.1 Å²	148.1	81%	0.808	79%	0.794	S	S	*	*	S	Bend	trans	70.6	39.9	178.1	-58.1	174.9	-124.9	0	0	116.9
52	V	54.8	Low	50.5	Low	136 Å²	136	146.1 Å²	146.1	82%	0.824	79%	0.794	S	S	*	*			trans	-127.9	62.2	154.4	-167.3	0	0	0	0	110.3
53	C	50.3	Low	50.1	Low	130 Å²	130	144.1 Å²	144.1	88%	0.878	80%	0.799	S	S	*	*	S	Bend	trans	-159.4	35	170.5	-132.1	0	0	0	0	112.8
54	A	58	Low	49.8	Very low	89 Å²	89	140 Å²	140	74%	0.736	80%	0.798	S	S	*	*			trans	-132.1	37.7	-175.9	0	0	0	0	0	112.8	P56	A54-P56 WeakPolarHBondContact O-CD 3.27Å
55	H	47.7	Very low	49.2	Very low	170 Å²	170	138 Å²	138	79%	0.787	80%	0.803	S	S	*	*			trans	-87.9	120	166	-78.4	-63.5	0	0	0	110
56	P	58	Low	49.2	Very low	103 Å²	103	138.2 Å²	138.2	67%	0.669	81%	0.812	S	S	*	*			trans	-62.3	151.1	168.5	-19.5	32.6	0	0	0	111	A54 S58	A54-P56 WeakPolarHBondContact O-CD 3.27Å; P56-S58 PolarHBondContact O-N 3.4Å; P56-S58 VanDerWaalsContact O-N 3.09Å
57	W	50.2	Low	49.2	Very low	259 Å²	259	139.2 Å²	139.2	98%	0.981	81%	0.81	S	S	*	*			trans	-73.2	95.2	159.1	-81.1	35.2	0	0	0	108.1	P59	W57-P59 WeakPolarHBondContact O-CD 3.44Å
58	S	51.8	Low	49.7	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	80%	0.804	S	S	*	*			trans	-84	118.5	173.9	-62.6	0	0	0	0	110.7	P56 S60	P56-S58 PolarHBondContact O-N 3.4Å; P56-S58 VanDerWaalsContact O-N 3.09Å; S58-S60 PolarHBondContact O-N 3.41Å
59	P	49.2	Very low	49.5	Very low	123 Å²	123	137.9 Å²	137.9	80%	0.799	81%	0.814	S	S	*	*			trans	-75.3	118.5	165.2	-9.1	27.4	0	0	0	109.1	W57 S61	W57-P59 WeakPolarHBondContact O-CD 3.44Å; P59-S61 PolarHBondContact O-N 3.05Å
60	S	46.7	Very low	49.3	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	80%	0.804	S	S	*	*			trans	-83.9	91.3	-177.2	-63.9	0	0	0	0	113.2	S58	S58-S60 PolarHBondContact O-N 3.41Å
61	S	47.6	Very low	48.7	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	80%	0.802	S	S	*	*			trans	-160.5	105	154	60.3	0	0	0	0	111.5	P59	P59-S61 PolarHBondContact O-N 3.05Å
62	S	40.2	Very low	48.4	Very low	124 Å²	124	131.9 Å²	131.9	87%	0.867	81%	0.807	S	S	*	*			trans	-87	125.2	175.5	-60	0	0	0	0	111.6
63	C	39.9	Very low	48.5	Very low	137 Å²	137	130.3 Å²	130.3	93%	0.926	80%	0.799	S	S	*	*			trans	-127.4	111.8	157.8	-73.8	0	0	0	0	107.9
64	A	43.3	Very low	48.1	Very low	104 Å²	104	134.3 Å²	134.3	86%	0.86	80%	0.802	S	S	*	*			trans	-123.2	123.1	-178.1	0	0	0	0	0	110.7
65	A	42.3	Very low	47	Very low	106 Å²	106	133.1 Å²	133.1	88%	0.876	80%	0.799	S	S	*	*			trans	-145.4	139.3	165.3	0	0	0	0	0	107.8
66	A	48.8	Very low	46.8	Very low	94 Å²	94	128.6 Å²	128.6	78%	0.777	80%	0.798	S	S	*	*			trans	-91.6	153.5	-167.5	0	0	0	0	0	113.5
67	P	54	Low	45.9	Very low	121 Å²	121	133.5 Å²	133.5	79%	0.786	81%	0.809	S	S	*	*			trans	-87.4	159.7	170.3	36.7	-35	0	0	0	112.1
68	P	56.7	Low	46	Very low	108 Å²	108	127.2 Å²	127.2	70%	0.701	80%	0.803	S	S	*	*			trans	-134.2	126.8	150	33.7	-19	0	0	0	114.2
69	T	42.6	Very low	46.4	Very low	130 Å²	130	128.4 Å²	128.4	80%	0.798	81%	0.809	S	S	*	*			trans	61.9	162.1	147	73.7	0	0	0	0	118.3
70	Q	46.3	Very low	46.7	Very low	170 Å²	170	128.3 Å²	128.3	79%	0.794	81%	0.808	S	S	*	*			cis	-136.6	164.9	13.6	-59.5	175.6	33.6	0	0	113.6
71	S	42.6	Very low	46.4	Very low	102 Å²	102	130.8 Å²	130.8	71%	0.713	80%	0.804	S	S	*	*			trans	38	108.8	149.8	59.1	0	0	0	0	122.6
72	R	46.3	Very low	46.1	Very low	239 Å²	239	131 Å²	131	90%	0.902	80%	0.801	S	S	*	*				8	160	110	-87.4	-176.7	179.2	-132.6	0.9	119.5
73	P	55.9	Low	45.9	Very low	102 Å²	102	129.8 Å²	129.8	66%	0.662	79%	0.792	S	S	*	*			cis	-141.6	-177.9	-3.5	38.1	-17.4	0	0	0	117
74	F	41.4	Very low	45.7	Very low	214 Å²	214	128.9 Å²	128.9	94%	0.939	79%	0.787	S	S	*	*			trans	63.1	132.9	145.4	-108.7	-102.2	0	0	0	122.1
75	G	36.5	Very low	45.6	Very low	65 Å²	65	128.6 Å²	128.6	67%	0.67	79%	0.785	S	S	*	*				110	53.7	117.6	0	0	0	0	0	122.5
76	G	41.9	Very low	45.2	Very low	74 Å²	74	127.4 Å²	127.4	76%	0.763	78%	0.783	S	S	*	*			trans	72.4	-168.2	144.7	0	0	0	0	0	119.9
77	F	39.8	Very low	44.3	Very low	207 Å²	207	127 Å²	127	91%	0.908	79%	0.787	S	S	*	*			trans	57.5	118	178.7	-74.1	-85.8	0	0	0	119.7
78	C	51.3	Low	43.6	Very low	127 Å²	127	129.1 Å²	129.1	86%	0.858	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.8	134.3	158.9	-54.6	0	0	0	0	110.4
79	P	60.8	Low	42.8	Very low	117 Å²	117	129 Å²	129	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-91.7	154.7	158.3	34.9	-31.1	0	0	0	111.5
80	P	55.7	Low	42.5	Very low	120 Å²	120	131.3 Å²	131.3	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-100.2	161.6	-176.4	38.4	-35.7	0	0	0	114.8
81	F	40.8	Very low	41.9	Very low	175 Å²	175	130.1 Å²	130.1	77%	0.768	78%	0.782	S	S	*	*			trans	52.4	120.3	147	-148.7	-129.1	0	0	0	118.3
82	T	40.1	Very low	41.5	Very low	115 Å²	115	134.6 Å²	134.6	71%	0.706	78%	0.783	S	S	*	*				-165.8	146.6	85.3	19.4	0	0	0	0	113
83	S	37.5	Very low	41.1	Very low	98 Å²	98	129.6 Å²	129.6	69%	0.685	77%	0.774	S	S	*	*			trans	27.6	125.9	150.5	-56.1	0	0	0	0	122
84	S	34.4	Very low	40.3	Very low	118 Å²	118	133.2 Å²	133.2	83%	0.825	78%	0.782	S	S	*	*				-159.1	144.9	94.3	-159.9	0	0	0	0	114.6
85	A	42.2	Very low	40.1	Very low	99 Å²	99	127.5 Å²	127.5	82%	0.818	77%	0.774	S	S	*	*			trans	17.8	103.2	162.3	0	0	0	0	0	120.5
86	G	32.9	Very low	40.2	Very low	80 Å²	80	136.8 Å²	136.8	83%	0.825	79%	0.789	S	S	*	*			trans	-105.2	130.9	149.6	0	0	0	0	0	110.5
87	G	31.5	Very low	39.7	Very low	85 Å²	85	138.2 Å²	138.2	88%	0.876	79%	0.787	S	S	*	*			trans	-88.9	141.2	179.1	0	0	0	0	0	113.3
88	L	38.6	Very low	39.3	Very low	166 Å²	166	137.3 Å²	137.3	87%	0.869	78%	0.782	S	S	*	*			trans	-156.1	154.6	-179.4	-175	66.7	0	0	0	110.8
89	V	40.8	Very low	38.8	Very low	105 Å²	105	140.2 Å²	140.2	64%	0.636	78%	0.783	S	S	*	*			trans	132.4	119	144.7	173.1	0	0	0	0	115.6
90	K	35.4	Very low	37.4	Very low	180 Å²	180	142.7 Å²	142.7	78%	0.783	78%	0.782	S	S	*	*			trans	55	123.2	154.3	-70.5	168.8	-173.5	174.2	0	119.9
91	E	33.4	Very low	36.4	Very low	144 Å²	144	141.1 Å²	141.1	67%	0.673	77%	0.77	S	S	*	*				58.1	102.5	56.4	-157.2	-156	-113	0	0	114.7
92	R	35.5	Very low	36.3	Very low	196 Å²	196	141 Å²	141	74%	0.74	77%	0.772	S	S	*	*				163.2	127.4	117.6	-85.4	-176.2	-156.9	175.6	4.8	115.7
93	D	36	Very low	36.1	Very low	134 Å²	134	143.6 Å²	143.6	72%	0.717	78%	0.777	S	S	*	*			trans	50.6	157.9	134.3	-54.9	-54.5	0	0	0	125.7
94	H	39.4	Very low	36	Very low	179 Å²	179	142.7 Å²	142.7	83%	0.829	78%	0.775	S	S	*	*			trans	77.2	83.5	163	-72.6	-75.2	0	0	0	121.5
95	A	37.9	Very low	35.7	Very low	94 Å²	94	140.6 Å²	140.6	78%	0.777	77%	0.772	S	S	*	*				49.8	123.8	120	0	0	0	0	0	122.2
96	R	37.9	Very low	35.4	Very low	259 Å²	259	148 Å²	148	98%	0.977	78%	0.779	S	S	*	*			trans	-152.2	172.8	131.8	-119.1	178.7	-165.6	-157.8	3.5	113.9
97	C	32.3	Very low	35.6	Very low	105 Å²	105	151.4 Å²	151.4	71%	0.709	78%	0.777	S	S	*	*			trans	-115.7	148.3	-160.8	-168.9	0	0	0	0	112.2
98	F	30.5	Very low	35.7	Very low	187 Å²	187	156.1 Å²	156.1	82%	0.82	78%	0.776	S	S	*	*			trans	37.8	119.2	154.6	-88.1	-119.3	0	0	0	121.4
99	Q	40.8	Very low	35.5	Very low	188 Å²	188	155.7 Å²	155.7	88%	0.879	77%	0.77	S	S	*	*			trans	-139.6	132.7	131	-53.6	-172.9	-1.7	0	0	103.6
100	K	32.8	Very low	35.2	Very low	170 Å²	170	155 Å²	155	74%	0.739	78%	0.775	S	S	*	*			cis	51	138.3	43.5	-102.8	-166.6	158.3	-159	0	111.9
101	T	34.2	Very low	35.3	Very low	86 Å²	86	151.4 Å²	151.4	53%	0.528	77%	0.768	S	S	.	*			cis	-160.6	151.9	27	-21	0	0	0	0	110.6
102	E	38.7	Very low	35	Very low	172 Å²	172	154.8 Å²	154.8	80%	0.804	78%	0.776	S	S	*	*			trans	65.2	160.2	153.3	-71.7	150.8	-147.4	0	0	118
103	E	36.2	Very low	35	Very low	171 Å²	171	149.9 Å²	149.9	80%	0.799	78%	0.778	S	S	*	*			cis	-154.1	171.5	-3.6	-134.2	-95.1	88.4	0	0	110
104	A	35.2	Very low	34.9	Very low	79 Å²	79	147.8 Å²	147.8	65%	0.653	78%	0.779	S	S	*	*			trans	48.2	137	161.7	0	0	0	0	0	121
105	G	28.5	Very low	34.6	Very low	74 Å²	74	144.7 Å²	144.7	76%	0.763	78%	0.777	S	S	*	*			cis	122.2	103.2	-2.2	0	0	0	0	0	113.6
106	R	35.9	Very low	34.8	Very low	255 Å²	255	148.2 Å²	148.2	96%	0.962	78%	0.778	S	S	*	*			trans	-152.1	135.1	152.9	-141.7	172.4	-160.1	-175.4	5.2	113.6
107	L	37.1	Very low	35.1	Very low	150 Å²	150	144.5 Å²	144.5	79%	0.785	77%	0.771	S	S	*	*			trans	-75.9	158.6	170.9	-64.3	150.2	0	0	0	110.7
108	Q	32.2	Very low	35	Very low	184 Å²	184	142.7 Å²	142.7	86%	0.86	77%	0.77	S	S	*	*				-158	137.8	112.1	-159	63.4	48.5	0	0	110.1
109	E	35.9	Very low	35.6	Very low	157 Å²	157	141.8 Å²	141.8	73%	0.734	77%	0.772	S	S	*	*			trans	-131.2	138.5	177.7	-176.4	177.7	-178.2	0	0	109.7	V111	E109-V111 HydrophobicContact CG-CG2 4.33Å
110	A	33.6	Very low	35.4	Very low	91 Å²	91	144 Å²	144	75%	0.752	77%	0.772	S	S	*	*			trans	-163.3	118.8	165.3	0	0	0	0	0	106.2
111	V	38.2	Very low	35.4	Very low	104 Å²	104	138.9 Å²	138.9	63%	0.63	77%	0.768	S	S	*	*			cis	71.5	111.8	42.1	-172.8	0	0	0	0	113	E109	E109-V111 HydrophobicContact CG-CG2 4.33Å
112	Y	27.2	Very low	35.6	Very low	215 Å²	215	142.1 Å²	142.1	84%	0.843	78%	0.78	S	S	*	*			trans	164.1	113	145	-80.4	-56.8	0	0	0	105.6
113	A	34.2	Very low	35.6	Very low	93 Å²	93	138.2 Å²	138.2	77%	0.769	77%	0.772	S	S	*	*				68.9	140.8	72.2	0	0	0	0	0	113.2
114	A	33.6	Very low	35.9	Very low	90 Å²	90	137.6 Å²	137.6	74%	0.744	77%	0.769	S	S	*	*			cis	-167.5	-164.6	-13.5	0	0	0	0	0	108.8
115	S	34.8	Very low	36.3	Very low	114 Å²	114	142.3 Å²	142.3	80%	0.797	78%	0.782	S	S	*	*			trans	81.2	126.1	178.6	-46.3	0	0	0	0	115.1
116	E	41.7	Very low	36.8	Very low	169 Å²	169	147 Å²	147	79%	0.79	78%	0.784	S	S	*	*			cis	102.7	152.6	16.8	-65.5	-140.7	140.3	0	0	117.2
117	H	43	Very low	36.6	Very low	181 Å²	181	140.9 Å²	140.9	84%	0.838	78%	0.776	S	S	*	*			trans	75.4	131.4	176.8	-56.6	22.6	0	0	0	116.3
118	G	30.6	Very low	36.2	Very low	66 Å²	66	142.2 Å²	142.2	68%	0.68	78%	0.778	S	S	*	*			cis	161.7	155.4	-13.9	0	0	0	0	0	115.1
119	I	42.3	Very low	36.1	Very low	168 Å²	168	137.5 Å²	137.5	86%	0.862	77%	0.765	S	S	*	*			trans	71.8	140.3	162.7	-46.2	-53.5	0	0	0	115.1
120	R	36.7	Very low	35.8	Very low	235 Å²	235	138.8 Å²	138.8	89%	0.887	77%	0.771	S	S	*	*			cis	-145	150.4	23.6	-139.8	163.2	175.2	170.7	-4	107.7
121	G	33.5	Very low	35.8	Very low	63 Å²	63	140 Å²	140	65%	0.649	77%	0.773	S	S	*	*			cis	82.8	116.6	38.8	0	0	0	0	0	109.5
122	I	37.8	Very low	35.7	Very low	154 Å²	154	140.2 Å²	140.2	79%	0.79	78%	0.779	S	S	*	*			cis	-139.3	-175.9	16.7	51.9	178.3	0	0	0	108.9
123	S	39.1	Very low	35.9	Very low	90 Å²	90	138.7 Å²	138.7	63%	0.629	78%	0.779	S	S	*	*			cis	-154.4	166.8	19.7	-89.3	0	0	0	0	110.3
124	E	42.2	Very low	35.8	Very low	157 Å²	157	141.3 Å²	141.3	73%	0.734	79%	0.786	S	S	*	*			cis	103	87.9	9.9	-176.6	-173.7	-127.5	0	0	115.9
125	L	44.7	Very low	36.3	Very low	178 Å²	178	144.8 Å²	144.8	93%	0.932	79%	0.787	S	S	*	*			trans	-166.8	149.4	150.6	-114.9	168.6	0	0	0	112.2
126	E	37.7	Very low	36.3	Very low	172 Å²	172	147.1 Å²	147.1	80%	0.804	79%	0.789	S	S	*	*			trans	-104.7	158.4	-168.4	-57.8	167.6	101.7	0	0	113.9
127	T	32.4	Very low	36.5	Very low	128 Å²	128	145.6 Å²	145.6	79%	0.785	79%	0.787	S	S	*	*				-168.5	125.8	129	9.2	0	0	0	0	112.7
128	E	29.2	Very low	37.2	Very low	177 Å²	177	142.7 Å²	142.7	83%	0.827	78%	0.784	S	S	*	*				26.7	150.4	124.9	-66.9	-158.3	100.7	0	0	122.5
129	S	30	Very low	37.4	Very low	85 Å²	85	146.1 Å²	146.1	59%	0.594	79%	0.787	S	S	*	*			cis	-173.5	174.7	-11.2	-175.4	0	0	0	0	110.1
130	H	29.4	Very low	37.2	Very low	184 Å²	184	142.8 Å²	142.8	85%	0.852	78%	0.779	S	S	*	*			trans	76.6	151	164.3	-84.9	70.3	0	0	0	121.9
131	C	34.4	Very low	37.4	Very low	118 Å²	118	136.9 Å²	136.9	80%	0.797	77%	0.773	S	S	*	*			trans	-132.5	-156.1	179.4	-165.3	0	0	0	0	108.2
132	S	34.3	Very low	37.7	Very low	107 Å²	107	138 Å²	138	75%	0.748	78%	0.776	S	S	*	*			trans	78.6	123.6	-172.6	-50.5	0	0	0	0	113.1
133	E	32.5	Very low	38.3	Very low	183 Å²	183	137 Å²	137	86%	0.855	78%	0.78	S	S	*	*			cis	80.3	105.8	35.9	-163.5	-177.4	134.2	0	0	113.7
134	T	32.5	Very low	38.4	Very low	149 Å²	149	140.7 Å²	140.7	91%	0.914	79%	0.792	S	S	*	*			trans	-157	151.7	146.7	-13.7	0	0	0	0	110.3
135	Q	43.4	Very low	37.9	Very low	162 Å²	162	139.3 Å²	139.3	76%	0.757	80%	0.799	S	S	*	*			trans	-102.3	163.1	-174.5	-175.9	-178.5	7	0	0	110.7
136	L	34.4	Very low	37.3	Very low	163 Å²	163	134.1 Å²	134.1	85%	0.853	79%	0.788	S	S	*	*			trans	161.1	121.6	135.6	-86	170.5	0	0	0	113.3
137	D	45.8	Very low	37.1	Very low	137 Å²	137	133.1 Å²	133.1	73%	0.733	79%	0.794	S	S	*	*			trans	-87.7	-170	157.5	-43.5	-101.3	0	0	0	109.7
138	P	58.1	Low	37.2	Very low	120 Å²	120	136.2 Å²	136.2	78%	0.779	80%	0.797	S	S	*	*			cis	-134.7	-175.9	-12.4	40	-21.9	0	0	0	114.3
139	D	34	Very low	37.4	Very low	139 Å²	139	137 Å²	137	74%	0.743	80%	0.8	S	S	*	*				150.7	144.5	115.6	-165.9	26.5	0	0	0	115
140	S	39.2	Very low	37.3	Very low	98 Å²	98	140.8 Å²	140.8	69%	0.685	81%	0.809	S	S	*	*			trans	46.9	147.5	152.3	-76.9	0	0	0	0	122.2
141	S	40.3	Very low	37.5	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	81%	0.807	S	S	*	*			cis	-153.7	154.7	14.4	51.9	0	0	0	0	113
142	A	40.7	Very low	37.6	Very low	85 Å²	85	143.6 Å²	143.6	70%	0.702	81%	0.808	S	S	*	*			trans	-90.6	171.4	162.3	0	0	0	0	0	111.9
143	P	49.1	Very low	37.8	Very low	134 Å²	134	143.8 Å²	143.8	87%	0.87	81%	0.806	S	S	*	*				-141.1	176.5	107.3	38.4	-25.8	0	0	0	115.2
144	L	41.5	Very low	37.7	Very low	168 Å²	168	140.3 Å²	140.3	88%	0.88	80%	0.798	S	S	*	*			trans	-108.3	141	-168.4	-68.7	158.5	0	0	0	113.8
145	S	33.3	Very low	37.7	Very low	127 Å²	127	142.1 Å²	142.1	89%	0.888	80%	0.796	S	S	*	*			trans	177.6	151.1	138.8	45.6	0	0	0	0	111.7
146	G	31.6	Very low	37.3	Very low	69 Å²	69	139.2 Å²	139.2	71%	0.711	80%	0.799	S	S	*	*			cis	143.4	65.2	-16.1	0	0	0	0	0	117.1
147	T	33.7	Very low	37.6	Very low	151 Å²	151	135.6 Å²	135.6	93%	0.926	79%	0.793	S	S	*	*			trans	-153.4	152.9	167.2	15.8	0	0	0	0	113.8
148	K	34.9	Very low	37.4	Very low	193 Å²	193	134.3 Å²	134.3	84%	0.839	80%	0.795	S	S	*	*			trans	-77.6	154	170.2	-58.5	173.4	176.8	177.4	0	110.6
149	Q	32.6	Very low	36.5	Very low	193 Å²	193	135.3 Å²	135.3	90%	0.902	79%	0.793	S	S	*	*				-171.4	151.3	107.1	-102.5	172	7.8	0	0	113.4
150	E	26.8	Very low	37.5	Very low	166 Å²	166	135.9 Å²	135.9	78%	0.776	80%	0.797	S	S	*	*			trans	-93.2	153.2	167	175.2	178.8	98.6	0	0	108.6
151	H	35.1	Very low	38	Very low	175 Å²	175	136.6 Å²	136.6	81%	0.81	80%	0.799	S	S	*	*			trans	173.7	143.9	139.2	-97.6	-68.1	0	0	0	112
152	K	36.6	Very low	37.7	Very low	186 Å²	186	137.2 Å²	137.2	81%	0.809	80%	0.802	S	S	*	*			trans	-123.3	121.2	171.3	173.9	-141.5	171.2	-169	0	109.6
153	P	38.1	Very low	38	Very low	110 Å²	110	138.1 Å²	138.1	71%	0.714	80%	0.803	S	S	*	*			trans	-132.9	164.7	134.1	16.6	4.5	0	0	0	109.9
154	T	31	Very low	37.8	Very low	111 Å²	111	142 Å²	142	68%	0.681	80%	0.8	S	S	*	*			cis	-178.7	161.4	-13.8	-88.1	0	0	0	0	104.1
155	E	31.8	Very low	38.3	Very low	187 Å²	187	140.9 Å²	140.9	87%	0.874	79%	0.793	S	S	*	*			trans	-35.6	138.5	179.7	-58.1	169.6	159.2	0	0	117.3
156	A	35.5	Very low	39	Very low	100 Å²	100	139.9 Å²	139.9	83%	0.826	78%	0.782	S	S	*	*			trans	-130.8	102.5	159	0	0	0	0	0	109	S158	A156-S158 PolarHBondContact O-N 3.44Å
157	A	40.6	Very low	39.6	Very low	87 Å²	87	146.1 Å²	146.1	72%	0.719	79%	0.79	S	S	*	*			trans	-79	104	-177.8	0	0	0	0	0	111.4	N159	A157-N159 PolarHBondContact O-N 3.08Å
158	S	40.5	Very low	39.9	Very low	111 Å²	111	142.4 Å²	142.4	78%	0.776	78%	0.782	S	S	*	*			trans	-84.2	96.4	173.6	-168.8	0	0	0	0	110.9	A156 N160	A156-S158 PolarHBondContact O-N 3.44Å; S158-N160 PolarHBondContact O-N 2.72Å
159	N	40.5	Very low	40.8	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	79%	0.789	S	S	*	*			trans	-81.6	99.1	-179.5	-72.5	-49.4	0	0	0	111.7	A157 P161	A157-N159 PolarHBondContact O-N 3.08Å; N159-P161 VanDerWaalsContact O-CD 3.27Å; N159-P161 WeakPolarHBondContact O-CD 3.39Å
160	N	54	Low	41.7	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	78%	0.779	S	S	*	*			trans	-105.7	97.1	167	-91.1	-1.6	0	0	0	111.3	S158	S158-N160 PolarHBondContact O-N 2.72Å
161	P	49.7	Very low	43	Very low	113 Å²	113	132.2 Å²	132.2	73%	0.734	77%	0.766	S	S	*	*			trans	-80.9	170.4	164.3	35.2	-34.5	0	0	0	111.5	N159	N159-P161 VanDerWaalsContact O-CD 3.27Å; N159-P161 WeakPolarHBondContact O-CD 3.39Å
162	C	35	Very low	44.1	Very low	124 Å²	124	130 Å²	130	84%	0.838	77%	0.767	S	S	*	*			trans	71.6	140.4	-173.5	-129.8	0	0	0	0	113.3
163	S	45.8	Very low	45.1	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	77%	0.772	S	S	*	*			cis	-108.1	119.8	13.9	-55.9	0	0	0	0	114.1
164	R	45.4	Very low	45.7	Very low	215 Å²	215	131.9 Å²	131.9	81%	0.811	77%	0.769	S	S	*	*			trans	-98.6	93.1	162.8	-178.7	-168.8	-69.1	-174.8	0.2	108.6	T166	R164-T166 HydrophobicContact CG-CG2 3.9Å; R164-T166 PolarHBondContact O-N 2.93Å
165	I	51.7	Low	46.9	Very low	144 Å²	144	130.6 Å²	130.6	74%	0.738	76%	0.764	S	S	*	*			trans	-85.8	97.9	172.1	-57.2	-180	0	0	0	108.6	F167	I165-F167 PolarHBondContact O-N 3.4Å
166	T	48.5	Very low	48.1	Very low	106 Å²	106	127.5 Å²	127.5	65%	0.65	76%	0.763	S	S	*	*			trans	-95.3	75.3	174	37.4	0	0	0	0	111.7	R164	R164-T166 HydrophobicContact CG-CG2 3.9Å; R164-T166 PolarHBondContact O-N 2.93Å
167	F	44.7	Very low	49.2	Very low	200 Å²	200	130.1 Å²	130.1	88%	0.877	76%	0.758	S	S	*	*			trans	-145.1	131.3	161.7	-71.3	-76.5	0	0	0	108.1	I165	I165-F167 PolarHBondContact O-N 3.4Å
168	G	39.6	Very low	50.2	Low	74 Å²	74	131.5 Å²	131.5	76%	0.763	76%	0.757	S	S	*	*			cis	-156.6	-177.8	-6.3	0	0	0	0	0	110.7
169	Q	53.5	Low	51.6	Low	210 Å²	210	134.8 Å²	134.8	98%	0.981	76%	0.757	S	S	*	*			trans	-73.1	126	177	-69.5	168	-17.4	0	0	110.6
170	G	51.2	Low	53.3	Low	68 Å²	68	132.8 Å²	132.8	70%	0.701	76%	0.761	S	S	*	*			trans	178	137.7	175.5	0	0	0	0	0	113.7
171	A	55.2	Low	54.6	Low	59 Å²	59	136.6 Å²	136.6	49%	0.488	76%	0.764	S	S	.	*			trans	54.1	95.5	172.8	0	0	0	0	0	117.4	W173 C174	A171-W173 PolarHBondContact O-N 2.89Å; A171-C174 PolarHBondContact O-N 2.74Å; A171-C174 VanDerWaalsContact O-N 3.15Å
172	P	56.8	Low	56.3	Low	129 Å²	129	140.7 Å²	140.7	84%	0.838	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-1	175.5	29.3	-35.8	0	0	0	114.8
173	W	57.7	Low	58.9	Low	239 Å²	239	144.2 Å²	144.2	91%	0.905	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-22.4	176.6	-62.3	70.5	0	0	0	112.1	A171 S175	A171-W173 PolarHBondContact O-N 2.89Å; W173-S175 PolarHBondContact O-N 3.37Å
174	C	50.3	Low	61.1	Low	97 Å²	97	150.9 Å²	150.9	66%	0.655	78%	0.78	S	S	*	*	S	Bend	trans	-76.3	90.2	170	-71.3	0	0	0	0	108.9	A171 S176	A171-C174 PolarHBondContact O-N 2.74Å; A171-C174 VanDerWaalsContact O-N 3.15Å; C174-S176 PolarHBondContact O-N 3.09Å
175	S	58	Low	63.4	Low	84 Å²	84	149.8 Å²	149.8	59%	0.587	78%	0.781	S	S	*	*			trans	-62.5	95.2	176.8	-171.5	0	0	0	0	110.5	W173 H177 V178	W173-S175 PolarHBondContact O-N 3.37Å; S175-H177 PolarHBondContact O-N 3.2Å; S175-V178 PolarHBondContact O-N 3.49Å
176	S	56.9	Low	65.6	Low	121 Å²	121	148.7 Å²	148.7	85%	0.846	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	18.1	179.2	-153.6	0	0	0	0	113.4	C174	C174-S176 PolarHBondContact O-N 3.09Å
177	H	57.8	Low	67.9	Low	155 Å²	155	146.8 Å²	146.8	72%	0.718	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	27.8	174.6	-71.6	-9.7	0	0	0	112.2	S175 K179	S175-H177 PolarHBondContact O-N 3.2Å; H177-K179 PolarHBondContact O-N 2.85Å
178	V	61.2	Low	70.5	Confident	117 Å²	117	140.7 Å²	140.7	71%	0.709	74%	0.744	S	S	*	*			trans	-64.8	74	151.9	-174.7	0	0	0	0	108.5	S175 A180	S175-V178 PolarHBondContact O-N 3.49Å; V178-A180 PolarHBondContact O-N 2.97Å
179	K	69.8	Low	73.3	Confident	179 Å²	179	146.2 Å²	146.2	78%	0.778	75%	0.747	S	S	*	*			trans	-52.2	114.3	171.4	-69.6	-177.4	178.4	-179.4	0	107	H177 R181	H177-K179 PolarHBondContact O-N 2.85Å; K179-R181 PolarHBondContact O-N 2.86Å
180	A	75.9	Confident	75.4	Confident	99 Å²	99	140.3 Å²	140.3	82%	0.818	73%	0.727	S	S	*	*			trans	-51.1	110.5	-170.5	0	0	0	0	0	110.1	V178 K182	V178-A180 PolarHBondContact O-N 2.97Å; A180-K182 PolarHBondContact O-N 3.06Å; A180-K182 VanDerWaalsContact O-N 3.08Å
181	R	81.6	Confident	77.6	Confident	232 Å²	232	138.6 Å²	138.6	88%	0.875	70%	0.701	S	S	*	*			trans	-62.1	118.5	-170.1	-66.9	-176	-179	-177.6	1.6	108.5	K179 K183	K179-R181 PolarHBondContact O-N 2.86Å; R181-K183 PolarHBondContact O-N 3.4Å; R181-K183 VanDerWaalsContact O-N 3.1Å
182	K	86	Confident	79.7	Confident	198 Å²	198	139.1 Å²	139.1	86%	0.861	70%	0.695	S	S	*	*			trans	-44.3	118.7	178.1	-169	86.5	167.3	-172.8	0	108.9	A180 R184	A180-K182 PolarHBondContact O-N 3.06Å; A180-K182 VanDerWaalsContact O-N 3.08Å; K182-R184 PolarHBondContact O-N 2.81Å; K182-R184 VanDerWaalsContact O-N 3.15Å
183	K	89.2	Confident	81.7	Confident	199 Å²	199	135.9 Å²	135.9	87%	0.865	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-52.5	124.3	179.2	-74.7	-169.9	177.4	-176.7	0	108.6	R181 K185	R181-K183 PolarHBondContact O-N 3.4Å; R181-K183 VanDerWaalsContact O-N 3.1Å; K183-K185 PolarHBondContact O-N 3.03Å
184	R	92.9	Very high	83.6	Confident	243 Å²	243	127.5 Å²	127.5	92%	0.917	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-67.2	129.3	-179.3	-73.8	179.5	168.4	175	-5.4	109.2	K182	K182-R184 PolarHBondContact O-N 2.81Å; K182-R184 VanDerWaalsContact O-N 3.15Å
185	K	93.8	Very high	85.9	Confident	192 Å²	192	122.9 Å²	122.9	84%	0.835	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-80.8	137.5	161.3	-65.6	-172.3	175.5	-171.8	0	108.3	K183	K183-K185 PolarHBondContact O-N 3.03Å
186	P	96.4	Very high	87.9	Confident	121 Å²	121	121.6 Å²	121.6	79%	0.786	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-67.9	155.6	166.7	31	-34.2	0	0	0	110.1
187	Y	98.1	Very high	89.8	Confident	67 Å²	67	120.2 Å²	120.2	26%	0.263	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-78.9	148.2	168.8	-57.8	-56.5	0	0	0	110.1	L192 L219 W227	Y187-L192 HydrophobicContact CD2-CD2 4.17Å; Y187-L192 HydrophobicContact CG-CD2 4.47Å; Y187-L219 HydrophobicContact CD1-CD1 4.22Å; Y187-L219 HydrophobicContact CD1-CD2 3.83Å; Y187-L219 HydrophobicContact CE1-CD1 4.12Å; Y187-L219 HydrophobicContact CE1-CD2 3.71Å; Y187-W227 AromaticContact CD2-CD1 3.88Å; Y187-W227 AromaticContact CE2-CD1 3.76Å
188	T	98.4	Very high	91.8	Very high	72 Å²	72	113.9 Å²	113.9	44%	0.442	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-76.6	162.6	178.8	68.6	0	0	0	0	111.4	Q191 L192	T188-Q191 PolarHBondContact O-N 3.45Å; T188-Q191 VanDerWaalsContact OG1-CG 3.3Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.25Å; T188-Q191 PolarHBondContact OG1-N 3.1Å; T188-Q191 PolarHBondContact OG1-OE1 2.82Å; T188-L192 WeakPolarHBondContact O-CG 3.48Å; T188-L192 PolarHBondContact O-N 3.15Å
189	K	98.3	Very high	93.5	Very high	190 Å²	190	108.6 Å²	108.6	83%	0.826	53%	0.525	S	S	*	.	H	α-helix	trans	-52.8	-50.3	175.9	-69	-174.2	178.5	-178.1	0	113.4	L192 A193	K189-L192 PolarHBondContact O-N 2.65Å; K189-A193 PolarHBondContact O-N 2.83Å
190	P	98.1	Very high	94.9	Very high	86 Å²	86	106.3 Å²	106.3	56%	0.558	52%	0.521	S	S	*	.	H	α-helix	trans	-65.1	-38.5	178.1	23.5	-33.5	0	0	0	113.3	L192 A193 E194	P190-L192 VanDerWaalsContact C-N 3.27Å; P190-L192 PolarHBondContact O-N 3.42Å; P190-A193 PolarHBondContact O-N 3.29Å; P190-A193 VanDerWaalsContact O-N 3.08Å; P190-E194 PolarHBondContact O-N 2.81Å; P190-E194 VanDerWaalsContact O-N 3.08Å
191	Q	98.4	Very high	95.9	Very high	31 Å²	31	107.8 Å²	107.8	15%	0.145	51%	0.514	C	S	.	.	H	α-helix	trans	-57.4	-41.4	174	-73.8	175.9	-27.9	0	0	112	T188 L195 L217	T188-Q191 PolarHBondContact O-N 3.45Å; T188-Q191 VanDerWaalsContact OG1-CG 3.3Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.25Å; T188-Q191 PolarHBondContact OG1-N 3.1Å; T188-Q191 PolarHBondContact OG1-OE1 2.82Å; Q191-L195 WeakPolarHBondContact O-CB 3.27Å; Q191-L195 VanDerWaalsContact O-CD1 3.27Å; Q191-L195 WeakPolarHBondContact O-CD1 3.41Å; Q191-L195 WeakPolarHBondContact O-CG 3.16Å; Q191-L195 PolarHBondContact O-N 2.71Å; Q191-L217 HydrophobicContact CG-CB 4.26Å; Q191-L217 HydrophobicContact CG-CD2 4.29Å; Q191-L217 PolarHBondContact NE2-O 3.47Å
192	L	98.5	Very high	96.6	Very high	70 Å²	70	101 Å²	101	37%	0.366	50%	0.495	S	S	.	.	H	α-helix	trans	-69.5	-35	176.3	-67.9	174.6	0	0	0	112.5	Y187 T188 K189 P190 E196	Y187-L192 HydrophobicContact CD2-CD2 4.17Å; Y187-L192 HydrophobicContact CG-CD2 4.47Å; T188-L192 WeakPolarHBondContact O-CG 3.48Å; T188-L192 PolarHBondContact O-N 3.15Å; K189-L192 PolarHBondContact O-N 2.65Å; P190-L192 VanDerWaalsContact C-N 3.27Å; P190-L192 PolarHBondContact O-N 3.42Å; L192-E196 VanDerWaalsContact O-CB 3.25Å; L192-E196 WeakPolarHBondContact O-CB 3.19Å; L192-E196 PolarHBondContact O-N 2.96Å
193	A	98.4	Very high	97.2	Very high	61 Å²	61	94.5 Å²	94.5	50%	0.504	47%	0.468	S	S	.	.	H	α-helix	trans	-66	-47.8	179.3	0	0	0	0	0	112.5	K189 P190 E196 N197	K189-A193 PolarHBondContact O-N 2.83Å; P190-A193 PolarHBondContact O-N 3.29Å; P190-A193 VanDerWaalsContact O-N 3.08Å; A193-E196 PolarHBondContact O-N 3.13Å; A193-N197 WeakPolarHBondContact O-CB 3.35Å; A193-N197 PolarHBondContact O-N 3.16Å
194	E	98.3	Very high	97.6	Very high	64 Å²	64	91.1 Å²	91.1	30%	0.299	45%	0.453	S	S	.	.	H	α-helix	trans	-65.2	-41.1	176.4	-77.9	-170.7	-108	0	0	112.4	P190 E196 N197 E198 L213 R216 L217	P190-E194 PolarHBondContact O-N 2.81Å; P190-E194 VanDerWaalsContact O-N 3.08Å; E194-E196 VanDerWaalsContact C-N 3.3Å; E194-E196 PolarHBondContact O-N 2.85Å; E194-N197 PolarHBondContact O-N 3.29Å; E194-E198 WeakPolarHBondContact O-CB 3.19Å; E194-E198 WeakPolarHBondContact O-CG 3.44Å; E194-E198 PolarHBondContact O-N 2.83Å; E194-L213 HydrophobicContact CB-CD2 4.37Å; E194-R216 IonicContact OE2-CZ 3.42Å; E194-R216 IonicContact OE2-NE 2.89Å; E194-R216 IonicContact OE2-NH1 3.4Å; E194-R216 PolarHBondContact OE2-NH1 2.96Å; E194-L217 HydrophobicContact CB-CD1 4.27Å; E194-L217 HydrophobicContact CB-CD2 4.01Å; E194-L217 HydrophobicContact CG-CD2 4.27Å; E194-L217 WeakPolarHBondContact OE1-CD2 3.25Å
195	L	98.6	Very high	97.8	Very high	0 Å²	0	80.6 Å²	80.6	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-62.9	-36.5	176.4	-72	168.2	0	0	0	112.3	Q191 F199 L213 L217 L219 V224 W227 F228	Q191-L195 WeakPolarHBondContact O-CB 3.27Å; Q191-L195 VanDerWaalsContact O-CD1 3.27Å; Q191-L195 WeakPolarHBondContact O-CD1 3.41Å; Q191-L195 WeakPolarHBondContact O-CG 3.16Å; Q191-L195 PolarHBondContact O-N 2.71Å; L195-F199 VanDerWaalsContact O-CB 3.3Å; L195-F199 WeakPolarHBondContact O-CB 3.21Å; L195-F199 PolarHBondContact O-N 3.06Å; L195-F199 VanDerWaalsContact O-N 3.16Å; L195-L213 HydrophobicContact CD2-CD1 4.25Å; L195-L217 HydrophobicContact CD1-CD1 4.17Å; L195-L217 HydrophobicContact CD2-CD1 3.94Å; L195-L217 HydrophobicContact CG-CD1 3.63Å; L195-L219 HydrophobicContact CD1-CD1 4.09Å; L195-V224 HydrophobicContact CD2-CG1 4.08Å; L195-W227 VanDerWaalsContact C-CH2 3.49Å; L195-W227 HydrophobicContact CB-CD2 3.89Å; L195-W227 HydrophobicContact CB-CE3 3.91Å; L195-W227 HydrophobicContact CB-CH2 3.77Å; L195-W227 HydrophobicContact CB-CZ2 3.71Å; L195-W227 HydrophobicContact CB-CZ3 3.85Å; L195-W227 HydrophobicContact CD1-CB 4.48Å; L195-W227 HydrophobicContact CD1-CD2 3.93Å; L195-W227 HydrophobicContact CD1-CG 3.82Å; L195-W227 HydrophobicContact CD2-CD2 4.45Å; L195-W227 HydrophobicContact CD2-CE3 4.37Å; L195-W227 HydrophobicContact CG-CD2 4.31Å; L195-W227 WeakPolarHBondContact O-CH2 3.24Å; L195-W227 VanDerWaalsContact O-CZ3 3.29Å; L195-W227 WeakPolarHBondContact O-CZ3 3.45Å; L195-F228 HydrophobicContact CD2-CE2 3.98Å
196	E	98.6	Very high	98.1	Very high	56 Å²	56	75.9 Å²	75.9	26%	0.262	40%	0.399	S	S	.	.	H	α-helix	trans	-74	-42.4	176.8	-166.5	67.5	-144.2	0	0	111.9	L192 A193 E194 E198 F199 L200 W227 R231	L192-E196 VanDerWaalsContact O-CB 3.25Å; L192-E196 WeakPolarHBondContact O-CB 3.19Å; L192-E196 PolarHBondContact O-N 2.96Å; A193-E196 PolarHBondContact O-N 3.13Å; E194-E196 VanDerWaalsContact C-N 3.3Å; E194-E196 PolarHBondContact O-N 2.85Å; E196-E198 PolarHBondContact O-N 3Å; E196-F199 WeakPolarHBondContact O-CB 3.27Å; E196-F199 PolarHBondContact O-N 3.34Å; E196-F199 VanDerWaalsContact O-N 3.13Å; E196-L200 WeakPolarHBondContact O-CG 3.08Å; E196-L200 PolarHBondContact O-N 3.27Å; E196-W227 HydrophobicContact CB-CH2 4.4Å; E196-W227 WeakPolarHBondContact OE2-CH2 2.83Å; E196-R231 IonicContact OE1-CZ 2.65Å; E196-R231 IonicContact OE1-NE 3.96Å; E196-R231 PolarHBondContact OE1-NE 3.02Å; E196-R231 IonicContact OE1-NH2 2.83Å; E196-R231 PolarHBondContact OE1-NH2 2.99Å; E196-R231 WeakPolarHBondContact OE2-CD 3.01Å; E196-R231 IonicContact OE2-CZ 3.98Å; E196-R231 IonicContact OE2-NE 3.14Å; E196-R231 PolarHBondContact OE2-NE 3.49Å; E196-R231 IonicContact OE2-NH2 2.82Å
197	N	98.2	Very high	98.1	Very high	93 Å²	93	80.3 Å²	80.3	50%	0.497	40%	0.4	S	S	.	.	H	α-helix	trans	-57.2	-47.8	175.5	-177.5	67.3	0	0	0	111.7	A193 E194 F199 L200 L201	A193-N197 WeakPolarHBondContact O-CB 3.35Å; A193-N197 PolarHBondContact O-N 3.16Å; E194-N197 PolarHBondContact O-N 3.29Å; N197-F199 VanDerWaalsContact C-N 3.28Å; N197-F199 PolarHBondContact O-N 3.25Å; N197-L200 PolarHBondContact O-N 3.31Å; N197-L201 PolarHBondContact O-N 3.03Å
198	E	98.2	Very high	98.1	Very high	21 Å²	21	82.7 Å²	82.7	10%	0.098	41%	0.413	C	S	.	.	H	α-helix	trans	-70.3	-26	178.9	-61	-92.5	-150.1	0	0	111.8	E194 E196 L201 N202 K209 L213 R216 F228	E194-E198 WeakPolarHBondContact O-CB 3.19Å; E194-E198 WeakPolarHBondContact O-CG 3.44Å; E194-E198 PolarHBondContact O-N 2.83Å; E196-E198 PolarHBondContact O-N 3Å; E198-L201 PolarHBondContact O-N 3.01Å; E198-N202 PolarHBondContact O-N 2.95Å; E198-K209 WeakPolarHBondContact OE1-CE 3.29Å; E198-K209 IonicContact OE1-NZ 3.54Å; E198-K209 PolarHBondContact OE1-NZ 3.17Å; E198-K209 WeakPolarHBondContact OE2-CE 3.44Å; E198-K209 IonicContact OE2-NZ 2.74Å; E198-K209 PolarHBondContact OE2-NZ 3.36Å; E198-L213 HydrophobicContact CB-CD1 3.87Å; E198-L213 HydrophobicContact CG-CD1 3.78Å; E198-L213 HydrophobicContact CG-CD2 4.07Å; E198-L213 HydrophobicContact CG-CG 4.37Å; E198-R216 IonicContact OE1-CZ 3.63Å; E198-R216 IonicContact OE1-NH1 2.74Å; E198-R216 PolarHBondContact OE1-NH1 3.3Å; E198-R216 IonicContact OE1-NH2 3.4Å; E198-R216 PolarHBondContact OE1-NH2 3.07Å; E198-F228 HydrophobicContact CB-CZ 4.33Å
199	F	98.6	Very high	98.1	Very high	6 Å²	6	82.1 Å²	82.1	3%	0.026	41%	0.405	C	S	.	.	H	α-helix	trans	-72.5	-32	172.2	-179.4	-97.1	0	0	0	113.3	L195 E196 N197 N202 E203 W227 F228 R231 R232 K235	L195-F199 VanDerWaalsContact O-CB 3.3Å; L195-F199 WeakPolarHBondContact O-CB 3.21Å; L195-F199 PolarHBondContact O-N 3.06Å; L195-F199 VanDerWaalsContact O-N 3.16Å; E196-F199 WeakPolarHBondContact O-CB 3.27Å; E196-F199 PolarHBondContact O-N 3.34Å; E196-F199 VanDerWaalsContact O-N 3.13Å; N197-F199 VanDerWaalsContact C-N 3.28Å; N197-F199 PolarHBondContact O-N 3.25Å; F199-N202 CarbonylContact O-C 3.36Å; F199-E203 HydrophobicContact CD2-CB 4.29Å; F199-E203 HydrophobicContact CE1-CG 4.24Å; F199-E203 VanDerWaalsContact CE2-CA 3.49Å; F199-E203 HydrophobicContact CE2-CB 3.59Å; F199-E203 HydrophobicContact CE2-CG 3.74Å; F199-E203 HydrophobicContact CZ-CB 3.96Å; F199-E203 HydrophobicContact CZ-CG 3.58Å; F199-W227 HydrophobicContact CB-CH2 4.31Å; F199-W227 HydrophobicContact CB-CZ3 4.03Å; F199-W227 HydrophobicContact CG-CZ3 4.4Å; F199-F228 HydrophobicContact CB-CE1 4.05Å; F199-F228 HydrophobicContact CB-CZ 4.36Å; F199-F228 AromaticContact CD2-CD1 3.94Å; F199-F228 HydrophobicContact CD2-CD1 3.94Å; F199-F228 AromaticContact CD2-CE1 3.95Å; F199-F228 HydrophobicContact CD2-CE1 3.95Å; F199-R231 HydrophobicContact CB-CG 4.42Å; F199-R231 HydrophobicContact CD1-CG 3.62Å; F199-R231 HydrophobicContact CD2-CB 4.24Å; F199-R231 HydrophobicContact CD2-CG 3.59Å; F199-R231 HydrophobicContact CE1-CG 3.72Å; F199-R231 VanDerWaalsContact CE1-CZ 3.44Å; F199-R231 HydrophobicContact CE2-CB 4.25Å; F199-R231 HydrophobicContact CE2-CG 3.69Å; F199-R231 HydrophobicContact CG-CG 3.57Å; F199-R231 HydrophobicContact CZ-CG 3.77Å; F199-R232 HydrophobicContact CE2-CG 3.62Å; F199-R232 HydrophobicContact CZ-CG 4.06Å; F199-K235 HydrophobicContact CE1-CD 4.47Å; F199-K235 HydrophobicContact CZ-CD 4.4Å
200	L	97.9	Very high	98.1	Very high	132 Å²	132	75.5 Å²	75.5	69%	0.691	38%	0.375	S	S	*	.	H	α-helix	trans	-68.4	-35.6	172.2	-67	171.5	0	0	0	111.6	E196 N197	E196-L200 WeakPolarHBondContact O-CG 3.08Å; E196-L200 PolarHBondContact O-N 3.27Å; N197-L200 PolarHBondContact O-N 3.31Å
201	L	97.6	Very high	98.1	Very high	130 Å²	130	76.8 Å²	76.8	68%	0.681	37%	0.372	S	S	*	.	H	α-helix	trans	-70.7	-41	173.3	-63	176.7	0	0	0	112.4	N197 E198	N197-L201 PolarHBondContact O-N 3.03Å; E198-L201 PolarHBondContact O-N 3.01Å
202	N	96.8	Very high	98.1	Very high	90 Å²	90	78.4 Å²	78.4	48%	0.481	38%	0.379	S	S	.	.			trans	-156.8	122.2	176.1	-171	-20.9	0	0	0	112.5	E198 F199 F204	E198-N202 PolarHBondContact O-N 2.95Å; F199-N202 CarbonylContact O-C 3.36Å; N202-F204 PolarHBondContact O-N 3.33Å; N202-F204 VanDerWaalsContact O-N 3.11Å; N202-F204 PolarHBondContact OD1-N 3.08Å; N202-F204 PolarHBondContact OD1-O 2.93Å
203	E	97.6	Very high	98.1	Very high	60 Å²	60	75 Å²	75	28%	0.28	36%	0.362	S	S	.	.	S	Bend	trans	-64.6	-16.4	178.2	-60.6	-160.2	-168.6	0	0	114.8	F199 R232 K235	F199-E203 HydrophobicContact CD2-CB 4.29Å; F199-E203 HydrophobicContact CE1-CG 4.24Å; F199-E203 VanDerWaalsContact CE2-CA 3.49Å; F199-E203 HydrophobicContact CE2-CB 3.59Å; F199-E203 HydrophobicContact CE2-CG 3.74Å; F199-E203 HydrophobicContact CZ-CB 3.96Å; F199-E203 HydrophobicContact CZ-CG 3.58Å; E203-R232 HydrophobicContact CB-CG 4.22Å; E203-R232 VanDerWaalsContact O-CD 3.29Å; E203-R232 WeakPolarHBondContact O-CD 3.37Å; E203-R232 PolarHBondContact O-NE 3.2Å; E203-K235 VanDerWaalsContact OE1-CD 3.3Å; E203-K235 WeakPolarHBondContact OE1-CD 3.3Å; E203-K235 WeakPolarHBondContact OE1-CE 3.29Å; E203-K235 IonicContact OE1-NZ 3.56Å; E203-K235 PolarHBondContact OE1-NZ 3.24Å
204	F	98.2	Very high	98.1	Very high	128 Å²	128	72.8 Å²	72.8	56%	0.561	34%	0.342	S	S	*	.	S	Bend	trans	-122.8	95.5	-173.9	-70.7	-104.4	0	0	0	111.6	N202 N206	N202-F204 PolarHBondContact O-N 3.33Å; N202-F204 VanDerWaalsContact O-N 3.11Å; N202-F204 PolarHBondContact OD1-N 3.08Å; N202-F204 PolarHBondContact OD1-O 2.93Å; F204-N206 PolarHBondContact O-N 3.34Å
205	I	97.9	Very high	98.1	Very high	22 Å²	22	74.7 Å²	74.7	11%	0.113	35%	0.354	C	S	.	.			trans	-71.5	120.9	-178.4	-162.9	167.3	0	0	0	113.8	K209 R210 L213 V224 F228	I205-K209 HydrophobicContact CD1-CB 4.43Å; I205-K209 HydrophobicContact CD1-CG 4.31Å; I205-K209 HydrophobicContact CG1-CB 4.01Å; I205-K209 HydrophobicContact CG1-CG 4.2Å; I205-R210 HydrophobicContact CD1-CB 4.03Å; I205-R210 HydrophobicContact CG1-CB 4.06Å; I205-R210 HydrophobicContact CG2-CB 4.39Å; I205-R210 PolarHBondContact O-NH2 2.97Å; I205-L213 HydrophobicContact CD1-CD1 3.57Å; I205-V224 HydrophobicContact CD1-CG1 4.02Å; I205-F228 HydrophobicContact CB-CD1 3.88Å; I205-F228 HydrophobicContact CB-CD2 4.18Å; I205-F228 HydrophobicContact CB-CE1 3.84Å; I205-F228 HydrophobicContact CB-CE2 4.15Å; I205-F228 HydrophobicContact CB-CG 4.06Å; I205-F228 HydrophobicContact CB-CZ 3.99Å; I205-F228 HydrophobicContact CD1-CD2 4.31Å; I205-F228 HydrophobicContact CD1-CE2 3.71Å; I205-F228 HydrophobicContact CD1-CZ 3.88Å; I205-F228 HydrophobicContact CG1-CZ 4.43Å; I205-F228 HydrophobicContact CG2-CB 4.08Å; I205-F228 HydrophobicContact CG2-CD1 3.95Å; I205-F228 HydrophobicContact CG2-CD2 3.74Å; I205-F228 HydrophobicContact CG2-CE1 4.35Å; I205-F228 HydrophobicContact CG2-CE2 4.17Å; I205-F228 HydrophobicContact CG2-CG 3.63Å; I205-F228 HydrophobicContact CG2-CZ 4.46Å
206	N	98.1	Very high	98.1	Very high	93 Å²	93	80.2 Å²	80.2	50%	0.497	38%	0.375	S	S	.	.			trans	-67.1	175.9	175.4	78.3	40.7	0	0	0	112.1	F204 Q208 K209 R210	F204-N206 PolarHBondContact O-N 3.34Å; N206-Q208 PolarHBondContact OD1-N 3.42Å; N206-K209 WeakPolarHBondContact OD1-CB 3.35Å; N206-K209 PolarHBondContact OD1-N 2.78Å; N206-R210 VanDerWaalsContact O-CB 3.22Å; N206-R210 WeakPolarHBondContact O-CB 3.4Å; N206-R210 PolarHBondContact O-N 3.35Å
207	R	98	Very high	98.1	Very high	214 Å²	214	78 Å²	78	81%	0.808	37%	0.365	S	S	*	.	H	α-helix	trans	-66.8	-46.6	-177.4	-178	-179.5	176.5	-173.4	-2	113	K211	R207-K211 PolarHBondContact O-N 2.91Å
208	Q	98.1	Very high	98.1	Very high	117 Å²	117	78 Å²	78	55%	0.547	38%	0.378	S	S	.	.	H	α-helix	trans	-65.5	-52.2	-175.1	172.2	55.5	26.1	0	0	111	N206 R210 K211 E212	N206-Q208 PolarHBondContact OD1-N 3.42Å; Q208-R210 PolarHBondContact O-N 3.16Å; Q208-K211 WeakPolarHBondContact O-CB 3.34Å; Q208-K211 PolarHBondContact O-N 3.38Å; Q208-E212 WeakPolarHBondContact CG-OE1 3.5Å; Q208-E212 PolarHBondContact NE2-OE1 3.12Å; Q208-E212 PolarHBondContact O-N 2.63Å
209	K	98	Very high	98	Very high	61 Å²	61	78 Å²	78	27%	0.265	38%	0.378	S	S	.	.	H	α-helix	trans	-63	-30.5	-179.2	-164.6	57.3	170.2	170.8	0	113.2	E198 I205 N206 E212 L213	E198-K209 WeakPolarHBondContact OE1-CE 3.29Å; E198-K209 IonicContact OE1-NZ 3.54Å; E198-K209 PolarHBondContact OE1-NZ 3.17Å; E198-K209 WeakPolarHBondContact OE2-CE 3.44Å; E198-K209 IonicContact OE2-NZ 2.74Å; E198-K209 PolarHBondContact OE2-NZ 3.36Å; I205-K209 HydrophobicContact CD1-CB 4.43Å; I205-K209 HydrophobicContact CD1-CG 4.31Å; I205-K209 HydrophobicContact CG1-CB 4.01Å; I205-K209 HydrophobicContact CG1-CG 4.2Å; N206-K209 WeakPolarHBondContact OD1-CB 3.35Å; N206-K209 PolarHBondContact OD1-N 2.78Å; K209-E212 WeakPolarHBondContact CD-OE2 3.29Å; K209-E212 IonicContact NZ-OE2 3.95Å; K209-E212 PolarHBondContact NZ-OE2 3.14Å; K209-E212 PolarHBondContact O-N 3.14Å; K209-L213 PolarHBondContact O-N 3.01Å; K209-L213 VanDerWaalsContact O-N 3.09Å
210	R	98.6	Very high	98	Very high	50 Å²	50	79.9 Å²	79.9	19%	0.189	39%	0.392	C	S	.	.	H	α-helix	trans	-66	-41.9	173	-174	-171	-53.5	140.9	12.8	112	I205 N206 Q208 L213 S214 D221 V224	I205-R210 HydrophobicContact CD1-CB 4.03Å; I205-R210 HydrophobicContact CG1-CB 4.06Å; I205-R210 HydrophobicContact CG2-CB 4.39Å; I205-R210 PolarHBondContact O-NH2 2.97Å; N206-R210 VanDerWaalsContact O-CB 3.22Å; N206-R210 WeakPolarHBondContact O-CB 3.4Å; N206-R210 PolarHBondContact O-N 3.35Å; Q208-R210 PolarHBondContact O-N 3.16Å; R210-L213 PolarHBondContact O-N 3.39Å; R210-S214 WeakPolarHBondContact O-CB 3.41Å; R210-S214 PolarHBondContact O-N 2.95Å; R210-D221 WeakPolarHBondContact CD-O 3.34Å; R210-D221 VanDerWaalsContact CD-OD2 3.25Å; R210-D221 WeakPolarHBondContact CD-OD2 3.43Å; R210-D221 IonicContact NH1-OD2 2.63Å; R210-V224 HydrophobicContact CG-CB 3.99Å; R210-V224 HydrophobicContact CG-CG1 3.84Å
211	K	98.5	Very high	98	Very high	113 Å²	113	76.5 Å²	76.5	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-47	174.6	-164	-157	171.3	-151.3	0	110.4	R207 Q208 L213 S214 D215	R207-K211 PolarHBondContact O-N 2.91Å; Q208-K211 WeakPolarHBondContact O-CB 3.34Å; Q208-K211 PolarHBondContact O-N 3.38Å; K211-L213 PolarHBondContact O-N 2.98Å; K211-S214 WeakPolarHBondContact O-CA 3.39Å; K211-S214 VanDerWaalsContact O-CB 3.29Å; K211-S214 WeakPolarHBondContact O-CB 3.39Å; K211-S214 PolarHBondContact O-N 3.36Å; K211-D215 WeakPolarHBondContact CE-OD2 3.42Å; K211-D215 IonicContact NZ-OD2 3.82Å; K211-D215 WeakPolarHBondContact O-CB 3.36Å; K211-D215 VanDerWaalsContact O-CG 3.3Å; K211-D215 PolarHBondContact O-N 2.87Å
212	E	98.3	Very high	98	Very high	65 Å²	65	75.5 Å²	75.5	30%	0.304	37%	0.367	S	S	.	.	H	α-helix	trans	-56	-34.6	176.3	-69.7	167	-154.4	0	0	113.8	Q208 K209 R216	Q208-E212 WeakPolarHBondContact CG-OE1 3.5Å; Q208-E212 PolarHBondContact NE2-OE1 3.12Å; Q208-E212 PolarHBondContact O-N 2.63Å; K209-E212 WeakPolarHBondContact CD-OE2 3.29Å; K209-E212 IonicContact NZ-OE2 3.95Å; K209-E212 PolarHBondContact NZ-OE2 3.14Å; K209-E212 PolarHBondContact O-N 3.14Å; E212-R216 VanDerWaalsContact O-CB 3.32Å; E212-R216 WeakPolarHBondContact O-CB 3.41Å; E212-R216 WeakPolarHBondContact O-CG 3.3Å; E212-R216 PolarHBondContact O-N 3.11Å; E212-R216 PolarHBondContact O-NE 2.93Å; E212-R216 VanDerWaalsContact O-NE 3.1Å
213	L	98.2	Very high	98.1	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-81.8	-30.5	172.5	-77.6	174	0	0	0	113.3	E194 L195 E198 I205 K209 R210 K211 R216 L217 V224 F228	E194-L213 HydrophobicContact CB-CD2 4.37Å; L195-L213 HydrophobicContact CD2-CD1 4.25Å; E198-L213 HydrophobicContact CB-CD1 3.87Å; E198-L213 HydrophobicContact CG-CD1 3.78Å; E198-L213 HydrophobicContact CG-CD2 4.07Å; E198-L213 HydrophobicContact CG-CG 4.37Å; I205-L213 HydrophobicContact CD1-CD1 3.57Å; K209-L213 PolarHBondContact O-N 3.01Å; K209-L213 VanDerWaalsContact O-N 3.09Å; R210-L213 PolarHBondContact O-N 3.39Å; K211-L213 PolarHBondContact O-N 2.98Å; L213-R216 VanDerWaalsContact CD2-CZ 3.47Å; L213-L217 HydrophobicContact CD2-CD1 4.06Å; L213-L217 HydrophobicContact CD2-CG 4.37Å; L213-L217 WeakPolarHBondContact O-CB 3.46Å; L213-L217 WeakPolarHBondContact O-CG 3.22Å; L213-L217 PolarHBondContact O-N 3.41Å; L213-L217 VanDerWaalsContact O-N 3.07Å; L213-V224 HydrophobicContact CB-CG1 4.32Å; L213-F228 HydrophobicContact CD1-CE2 4.32Å
214	S	98.5	Very high	98.1	Very high	13 Å²	13	71.5 Å²	71.5	9%	0.091	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-49.6	171.9	-160.1	0	0	0	0	110.2	R210 K211 A218 L219 S220 D221	R210-S214 WeakPolarHBondContact O-CB 3.41Å; R210-S214 PolarHBondContact O-N 2.95Å; K211-S214 WeakPolarHBondContact O-CA 3.39Å; K211-S214 VanDerWaalsContact O-CB 3.29Å; K211-S214 WeakPolarHBondContact O-CB 3.39Å; K211-S214 PolarHBondContact O-N 3.36Å; S214-A218 PolarHBondContact O-N 2.75Å; S214-L219 PolarHBondContact O-N 3.03Å; S214-L219 VanDerWaalsContact O-N 3.08Å; S214-L219 VanDerWaalsContact O-O 3.13Å; S214-L219 PolarHBondContact OG-O 2.83Å; S214-S220 VanDerWaalsContact OG-CA 3.27Å; S214-S220 WeakPolarHBondContact OG-CA 3.43Å; S214-D221 PolarHBondContact OG-N 3.33Å
215	D	98.3	Very high	98.1	Very high	104 Å²	104	69.9 Å²	69.9	56%	0.556	34%	0.338	S	S	*	.	H	α-helix	trans	-67.9	-49.8	-177.3	-63.4	-17.5	0	0	0	110.7	K211 L217	K211-D215 WeakPolarHBondContact CE-OD2 3.42Å; K211-D215 IonicContact NZ-OD2 3.82Å; K211-D215 WeakPolarHBondContact O-CB 3.36Å; K211-D215 VanDerWaalsContact O-CG 3.3Å; K211-D215 PolarHBondContact O-N 2.87Å; D215-L217 PolarHBondContact O-N 3.19Å
216	R	97.9	Very high	98.2	Very high	117 Å²	117	71.5 Å²	71.5	44%	0.442	35%	0.346	S	S	.	.	H	α-helix	trans	-60.4	-42.7	177.3	-82.5	-175.6	-74.6	157.5	-15.5	113.9	E194 E198 E212 L213	E194-R216 IonicContact OE2-CZ 3.42Å; E194-R216 IonicContact OE2-NE 2.89Å; E194-R216 IonicContact OE2-NH1 3.4Å; E194-R216 PolarHBondContact OE2-NH1 2.96Å; E198-R216 IonicContact OE1-CZ 3.63Å; E198-R216 IonicContact OE1-NH1 2.74Å; E198-R216 PolarHBondContact OE1-NH1 3.3Å; E198-R216 IonicContact OE1-NH2 3.4Å; E198-R216 PolarHBondContact OE1-NH2 3.07Å; E212-R216 VanDerWaalsContact O-CB 3.32Å; E212-R216 WeakPolarHBondContact O-CB 3.41Å; E212-R216 WeakPolarHBondContact O-CG 3.3Å; E212-R216 PolarHBondContact O-N 3.11Å; E212-R216 PolarHBondContact O-NE 2.93Å; E212-R216 VanDerWaalsContact O-NE 3.1Å; L213-R216 VanDerWaalsContact CD2-CZ 3.47Å
217	L	97.9	Very high	98.2	Very high	10 Å²	10	68.3 Å²	68.3	5%	0.052	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	1.7	-170	-62	-176.9	0	0	0	114.4	Q191 E194 L195 L213 D215 L219	Q191-L217 HydrophobicContact CG-CB 4.26Å; Q191-L217 HydrophobicContact CG-CD2 4.29Å; Q191-L217 PolarHBondContact NE2-O 3.47Å; E194-L217 HydrophobicContact CB-CD1 4.27Å; E194-L217 HydrophobicContact CB-CD2 4.01Å; E194-L217 HydrophobicContact CG-CD2 4.27Å; E194-L217 WeakPolarHBondContact OE1-CD2 3.25Å; L195-L217 HydrophobicContact CD1-CD1 4.17Å; L195-L217 HydrophobicContact CD2-CD1 3.94Å; L195-L217 HydrophobicContact CG-CD1 3.63Å; L213-L217 HydrophobicContact CD2-CD1 4.06Å; L213-L217 HydrophobicContact CD2-CG 4.37Å; L213-L217 WeakPolarHBondContact O-CB 3.46Å; L213-L217 WeakPolarHBondContact O-CG 3.22Å; L213-L217 PolarHBondContact O-N 3.41Å; L213-L217 VanDerWaalsContact O-N 3.07Å; D215-L217 PolarHBondContact O-N 3.19Å; L217-L219 HydrophobicContact CB-CB 4.47Å; L217-L219 HydrophobicContact CB-CD1 4.06Å; L217-L219 HydrophobicContact CB-CG 3.9Å; L217-L219 HydrophobicContact CD1-CD1 4.29Å; L217-L219 PolarHBondContact O-N 3.01Å
218	A	98.1	Very high	98.2	Very high	92 Å²	92	58.3 Å²	58.3	76%	0.76	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	40.9	-169.5	0	0	0	0	0	112.5	S214	S214-A218 PolarHBondContact O-N 2.75Å
219	L	97.6	Very high	98.2	Very high	21 Å²	21	57.1 Å²	57.1	11%	0.11	28%	0.284	C	S	.	.			trans	-106.5	175.5	173.6	-64.4	-176.2	0	0	0	109.7	Y187 L195 S214 L217 V224	Y187-L219 HydrophobicContact CD1-CD1 4.22Å; Y187-L219 HydrophobicContact CD1-CD2 3.83Å; Y187-L219 HydrophobicContact CE1-CD1 4.12Å; Y187-L219 HydrophobicContact CE1-CD2 3.71Å; L195-L219 HydrophobicContact CD1-CD1 4.09Å; S214-L219 PolarHBondContact O-N 3.03Å; S214-L219 VanDerWaalsContact O-N 3.08Å; S214-L219 VanDerWaalsContact O-O 3.13Å; S214-L219 PolarHBondContact OG-O 2.83Å; L217-L219 HydrophobicContact CB-CB 4.47Å; L217-L219 HydrophobicContact CB-CD1 4.06Å; L217-L219 HydrophobicContact CB-CG 3.9Å; L217-L219 HydrophobicContact CD1-CD1 4.29Å; L217-L219 PolarHBondContact O-N 3.01Å; L219-V224 HydrophobicContact CB-CG2 4.12Å; L219-V224 HydrophobicContact CD1-CG2 4.36Å
220	S	98.2	Very high	98.3	Very high	45 Å²	45	59 Å²	59	32%	0.315	30%	0.297	S	S	.	.			trans	-99.1	150.4	166.2	62.7	0	0	0	0	112	S214 Q222 Q223 V224	S214-S220 VanDerWaalsContact OG-CA 3.27Å; S214-S220 WeakPolarHBondContact OG-CA 3.43Å; S220-Q222 PolarHBondContact O-N 2.92Å; S220-Q223 VanDerWaalsContact N-OE1 3.09Å; S220-Q223 WeakPolarHBondContact O-CA 3.48Å; S220-Q223 WeakPolarHBondContact O-CB 3.49Å; S220-Q223 PolarHBondContact O-N 3.26Å; S220-Q223 WeakPolarHBondContact OG-CG 3.34Å; S220-Q223 PolarHBondContact OG-N 3Å; S220-Q223 PolarHBondContact OG-OE1 3.49Å; S220-V224 PolarHBondContact O-N 2.94Å
221	D	98.2	Very high	98.3	Very high	61 Å²	61	58.5 Å²	58.5	33%	0.326	30%	0.295	S	S	.	.	H	α-helix	trans	-44	-38.4	170.6	-129	64.4	0	0	0	112.4	R210 S214 K225	R210-D221 WeakPolarHBondContact CD-O 3.34Å; R210-D221 VanDerWaalsContact CD-OD2 3.25Å; R210-D221 WeakPolarHBondContact CD-OD2 3.43Å; R210-D221 IonicContact NH1-OD2 2.63Å; S214-D221 PolarHBondContact OG-N 3.33Å; D221-K225 VanDerWaalsContact O-CB 3.24Å; D221-K225 WeakPolarHBondContact O-CB 3.37Å; D221-K225 PolarHBondContact O-N 3.36Å
222	Q	97.8	Very high	98.3	Very high	110 Å²	110	56.7 Å²	56.7	51%	0.514	29%	0.285	S	S	.	.	H	α-helix	trans	-71.1	-40	178.8	-168.8	-92.4	13.1	0	0	112.6	S220 I226	S220-Q222 PolarHBondContact O-N 2.92Å; Q222-I226 WeakPolarHBondContact O-CB 3.36Å; Q222-I226 WeakPolarHBondContact O-CG1 3.4Å; Q222-I226 PolarHBondContact O-N 2.82Å
223	Q	98.1	Very high	98.3	Very high	66 Å²	66	58.3 Å²	58.3	31%	0.308	29%	0.294	S	S	.	.	H	α-helix	trans	-67.4	-44.3	173.7	-75.4	165.6	-80.3	0	0	111.8	S220 I226 W227	S220-Q223 VanDerWaalsContact N-OE1 3.09Å; S220-Q223 WeakPolarHBondContact O-CA 3.48Å; S220-Q223 WeakPolarHBondContact O-CB 3.49Å; S220-Q223 PolarHBondContact O-N 3.26Å; S220-Q223 WeakPolarHBondContact OG-CG 3.34Å; S220-Q223 PolarHBondContact OG-N 3Å; S220-Q223 PolarHBondContact OG-OE1 3.49Å; Q223-I226 PolarHBondContact O-N 3.19Å; Q223-W227 WeakPolarHBondContact O-CB 3.33Å; Q223-W227 PolarHBondContact O-N 3.22Å
224	V	98.5	Very high	98.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.4	-46.9	176.3	-178.9	0	0	0	0	110	L195 I205 R210 L213 L219 S220 I226 W227 F228	L195-V224 HydrophobicContact CD2-CG1 4.08Å; I205-V224 HydrophobicContact CD1-CG1 4.02Å; R210-V224 HydrophobicContact CG-CB 3.99Å; R210-V224 HydrophobicContact CG-CG1 3.84Å; L213-V224 HydrophobicContact CB-CG1 4.32Å; L219-V224 HydrophobicContact CB-CG2 4.12Å; L219-V224 HydrophobicContact CD1-CG2 4.36Å; S220-V224 PolarHBondContact O-N 2.94Å; V224-I226 PolarHBondContact O-N 3.15Å; V224-W227 PolarHBondContact O-N 3.23Å; V224-W227 VanDerWaalsContact O-N 3.16Å; V224-F228 HydrophobicContact CG1-CD2 4.05Å; V224-F228 HydrophobicContact CG1-CE2 4.13Å; V224-F228 WeakPolarHBondContact O-CD2 3.3Å; V224-F228 PolarHBondContact O-N 2.85Å
225	K	98.3	Very high	98.2	Very high	93 Å²	93	66.9 Å²	66.9	40%	0.404	33%	0.33	S	S	.	.	H	α-helix	trans	-57.1	-45.1	174.9	-174.6	178.3	69.1	177.5	0	112.5	D221 Q229	D221-K225 VanDerWaalsContact O-CB 3.24Å; D221-K225 WeakPolarHBondContact O-CB 3.37Å; D221-K225 PolarHBondContact O-N 3.36Å; K225-Q229 WeakPolarHBondContact O-CG 3.42Å; K225-Q229 PolarHBondContact O-N 3.36Å; K225-Q229 VanDerWaalsContact O-N 3.12Å
226	I	98.4	Very high	98.2	Very high	57 Å²	57	67.8 Å²	67.8	29%	0.292	33%	0.329	S	S	.	.	H	α-helix	trans	-67.8	-36.6	177.4	-77	178.2	0	0	0	111.6	Q222 Q223 V224 Q229 N230	Q222-I226 WeakPolarHBondContact O-CB 3.36Å; Q222-I226 WeakPolarHBondContact O-CG1 3.4Å; Q222-I226 PolarHBondContact O-N 2.82Å; Q223-I226 PolarHBondContact O-N 3.19Å; V224-I226 PolarHBondContact O-N 3.15Å; I226-Q229 PolarHBondContact O-N 3.36Å; I226-N230 WeakPolarHBondContact CG2-ND2 3.42Å; I226-N230 WeakPolarHBondContact O-CB 3.42Å; I226-N230 VanDerWaalsContact O-CG 3.23Å; I226-N230 PolarHBondContact O-N 3.11Å; I226-N230 PolarHBondContact O-ND2 3.08Å; I226-N230 VanDerWaalsContact O-ND2 3.14Å
227	W	98.5	Very high	98.2	Very high	25 Å²	25	70.9 Å²	70.9	10%	0.095	34%	0.34	C	S	.	.	H	α-helix	trans	-62.1	-49.1	176.2	-170.3	103.6	0	0	0	110.8	Y187 L195 E196 F199 Q223 V224 Q229 N230 R231	Y187-W227 AromaticContact CD2-CD1 3.88Å; Y187-W227 AromaticContact CE2-CD1 3.76Å; L195-W227 VanDerWaalsContact C-CH2 3.49Å; L195-W227 HydrophobicContact CB-CD2 3.89Å; L195-W227 HydrophobicContact CB-CE3 3.91Å; L195-W227 HydrophobicContact CB-CH2 3.77Å; L195-W227 HydrophobicContact CB-CZ2 3.71Å; L195-W227 HydrophobicContact CB-CZ3 3.85Å; L195-W227 HydrophobicContact CD1-CB 4.48Å; L195-W227 HydrophobicContact CD1-CD2 3.93Å; L195-W227 HydrophobicContact CD1-CG 3.82Å; L195-W227 HydrophobicContact CD2-CD2 4.45Å; L195-W227 HydrophobicContact CD2-CE3 4.37Å; L195-W227 HydrophobicContact CG-CD2 4.31Å; L195-W227 WeakPolarHBondContact O-CH2 3.24Å; L195-W227 VanDerWaalsContact O-CZ3 3.29Å; L195-W227 WeakPolarHBondContact O-CZ3 3.45Å; E196-W227 HydrophobicContact CB-CH2 4.4Å; E196-W227 WeakPolarHBondContact OE2-CH2 2.83Å; F199-W227 HydrophobicContact CB-CH2 4.31Å; F199-W227 HydrophobicContact CB-CZ3 4.03Å; F199-W227 HydrophobicContact CG-CZ3 4.4Å; Q223-W227 WeakPolarHBondContact O-CB 3.33Å; Q223-W227 PolarHBondContact O-N 3.22Å; V224-W227 PolarHBondContact O-N 3.23Å; V224-W227 VanDerWaalsContact O-N 3.16Å; W227-Q229 VanDerWaalsContact C-N 3.32Å; W227-Q229 PolarHBondContact O-N 3.36Å; W227-N230 CarbonylContact O-C 3.57Å; W227-N230 PolarHBondContact O-N 2.99Å; W227-N230 VanDerWaalsContact O-N 3.14Å; W227-R231 HydrophobicContact CD2-CB 4.43Å; W227-R231 HydrophobicContact CE3-CB 3.87Å; W227-R231 HydrophobicContact CE3-CG 4.38Å; W227-R231 HydrophobicContact CH2-CB 3.91Å; W227-R231 HydrophobicContact CH2-CG 3.58Å; W227-R231 HydrophobicContact CZ2-CB 4.48Å; W227-R231 HydrophobicContact CZ2-CG 4.38Å; W227-R231 HydrophobicContact CZ3-CB 3.58Å; W227-R231 HydrophobicContact CZ3-CG 3.59Å; W227-R231 WeakPolarHBondContact O-CB 3.41Å; W227-R231 PolarHBondContact O-N 3.18Å
228	F	98.8	Very high	98.1	Very high	5 Å²	5	73.6 Å²	73.6	2%	0.022	36%	0.355	C	S	.	.	H	α-helix	trans	-62.7	-34.4	177.1	-88.5	-98.9	0	0	0	113.2	L195 E198 F199 I205 L213 V224 R232	L195-F228 HydrophobicContact CD2-CE2 3.98Å; E198-F228 HydrophobicContact CB-CZ 4.33Å; F199-F228 HydrophobicContact CB-CE1 4.05Å; F199-F228 HydrophobicContact CB-CZ 4.36Å; F199-F228 AromaticContact CD2-CD1 3.94Å; F199-F228 HydrophobicContact CD2-CD1 3.94Å; F199-F228 AromaticContact CD2-CE1 3.95Å; F199-F228 HydrophobicContact CD2-CE1 3.95Å; I205-F228 HydrophobicContact CB-CD1 3.88Å; I205-F228 HydrophobicContact CB-CD2 4.18Å; I205-F228 HydrophobicContact CB-CE1 3.84Å; I205-F228 HydrophobicContact CB-CE2 4.15Å; I205-F228 HydrophobicContact CB-CG 4.06Å; I205-F228 HydrophobicContact CB-CZ 3.99Å; I205-F228 HydrophobicContact CD1-CD2 4.31Å; I205-F228 HydrophobicContact CD1-CE2 3.71Å; I205-F228 HydrophobicContact CD1-CZ 3.88Å; I205-F228 HydrophobicContact CG1-CZ 4.43Å; I205-F228 HydrophobicContact CG2-CB 4.08Å; I205-F228 HydrophobicContact CG2-CD1 3.95Å; I205-F228 HydrophobicContact CG2-CD2 3.74Å; I205-F228 HydrophobicContact CG2-CE1 4.35Å; I205-F228 HydrophobicContact CG2-CE2 4.17Å; I205-F228 HydrophobicContact CG2-CG 3.63Å; I205-F228 HydrophobicContact CG2-CZ 4.46Å; L213-F228 HydrophobicContact CD1-CE2 4.32Å; V224-F228 HydrophobicContact CG1-CD2 4.05Å; V224-F228 HydrophobicContact CG1-CE2 4.13Å; V224-F228 WeakPolarHBondContact O-CD2 3.3Å; V224-F228 PolarHBondContact O-N 2.85Å; F228-R232 PolarHBondContact O-N 3.01Å
229	Q	98.7	Very high	98	Very high	91 Å²	91	74.2 Å²	74.2	43%	0.425	34%	0.343	S	S	.	.	H	α-helix	trans	-64.4	-49.2	171.2	-73.2	172.2	-15.7	0	0	111.5	K225 I226 W227 R231 M233	K225-Q229 WeakPolarHBondContact O-CG 3.42Å; K225-Q229 PolarHBondContact O-N 3.36Å; K225-Q229 VanDerWaalsContact O-N 3.12Å; I226-Q229 PolarHBondContact O-N 3.36Å; W227-Q229 VanDerWaalsContact C-N 3.32Å; W227-Q229 PolarHBondContact O-N 3.36Å; Q229-R231 VanDerWaalsContact C-N 3.32Å; Q229-R231 PolarHBondContact O-N 2.94Å; Q229-M233 WeakPolarHBondContact O-CG 3.46Å; Q229-M233 PolarHBondContact O-N 3.17Å; Q229-M233 VanDerWaalsContact O-N 3.11Å
230	N	98.4	Very high	97.8	Very high	102 Å²	102	79 Å²	79	55%	0.545	37%	0.366	S	S	.	.	H	α-helix	trans	-63.2	-36.3	177.6	-70.1	-32.3	0	0	0	112.3	I226 W227 M233 K234	I226-N230 WeakPolarHBondContact CG2-ND2 3.42Å; I226-N230 WeakPolarHBondContact O-CB 3.42Å; I226-N230 VanDerWaalsContact O-CG 3.23Å; I226-N230 PolarHBondContact O-N 3.11Å; I226-N230 PolarHBondContact O-ND2 3.08Å; I226-N230 VanDerWaalsContact O-ND2 3.14Å; W227-N230 CarbonylContact O-C 3.57Å; W227-N230 PolarHBondContact O-N 2.99Å; W227-N230 VanDerWaalsContact O-N 3.14Å; N230-M233 PolarHBondContact O-N 2.8Å; N230-K234 WeakPolarHBondContact O-CB 3.39Å; N230-K234 PolarHBondContact O-N 3.44Å
231	R	98.6	Very high	97.6	Very high	39 Å²	39	84.5 Å²	84.5	15%	0.147	38%	0.38	C	S	.	.	H	α-helix	trans	-68.7	-40.8	-178.2	-177.8	62.4	-169.9	81.3	-0.9	112.6	E196 F199 W227 Q229 K234 K235	E196-R231 IonicContact OE1-CZ 2.65Å; E196-R231 IonicContact OE1-NE 3.96Å; E196-R231 PolarHBondContact OE1-NE 3.02Å; E196-R231 IonicContact OE1-NH2 2.83Å; E196-R231 PolarHBondContact OE1-NH2 2.99Å; E196-R231 WeakPolarHBondContact OE2-CD 3.01Å; E196-R231 IonicContact OE2-CZ 3.98Å; E196-R231 IonicContact OE2-NE 3.14Å; E196-R231 PolarHBondContact OE2-NE 3.49Å; E196-R231 IonicContact OE2-NH2 2.82Å; F199-R231 HydrophobicContact CB-CG 4.42Å; F199-R231 HydrophobicContact CD1-CG 3.62Å; F199-R231 HydrophobicContact CD2-CB 4.24Å; F199-R231 HydrophobicContact CD2-CG 3.59Å; F199-R231 HydrophobicContact CE1-CG 3.72Å; F199-R231 VanDerWaalsContact CE1-CZ 3.44Å; F199-R231 HydrophobicContact CE2-CB 4.25Å; F199-R231 HydrophobicContact CE2-CG 3.69Å; F199-R231 HydrophobicContact CG-CG 3.57Å; F199-R231 HydrophobicContact CZ-CG 3.77Å; W227-R231 HydrophobicContact CD2-CB 4.43Å; W227-R231 HydrophobicContact CE3-CB 3.87Å; W227-R231 HydrophobicContact CE3-CG 4.38Å; W227-R231 HydrophobicContact CH2-CB 3.91Å; W227-R231 HydrophobicContact CH2-CG 3.58Å; W227-R231 HydrophobicContact CZ2-CB 4.48Å; W227-R231 HydrophobicContact CZ2-CG 4.38Å; W227-R231 HydrophobicContact CZ3-CB 3.58Å; W227-R231 HydrophobicContact CZ3-CG 3.59Å; W227-R231 WeakPolarHBondContact O-CB 3.41Å; W227-R231 PolarHBondContact O-N 3.18Å; Q229-R231 VanDerWaalsContact C-N 3.32Å; Q229-R231 PolarHBondContact O-N 2.94Å; R231-K234 WeakPolarHBondContact O-CB 3.42Å; R231-K234 PolarHBondContact O-N 3.34Å; R231-K235 PolarHBondContact O-N 3.24Å
232	R	98.6	Very high	97.3	Very high	74 Å²	74	86.8 Å²	86.8	28%	0.279	39%	0.389	S	S	.	.	H	α-helix	trans	-65.2	-42.9	170.4	-72.6	-173.5	-75.3	130.6	-0	111.9	F199 E203 F228 K234 K235 K236	F199-R232 HydrophobicContact CE2-CG 3.62Å; F199-R232 HydrophobicContact CZ-CG 4.06Å; E203-R232 HydrophobicContact CB-CG 4.22Å; E203-R232 VanDerWaalsContact O-CD 3.29Å; E203-R232 WeakPolarHBondContact O-CD 3.37Å; E203-R232 PolarHBondContact O-NE 3.2Å; F228-R232 PolarHBondContact O-N 3.01Å; R232-K234 VanDerWaalsContact C-N 3.28Å; R232-K234 PolarHBondContact O-N 3.18Å; R232-K235 PolarHBondContact O-N 3.46Å; R232-K235 VanDerWaalsContact O-N 3.15Å; R232-K236 PolarHBondContact O-N 2.95Å
233	M	98.6	Very high	96.9	Very high	99 Å²	99	88.1 Å²	88.1	49%	0.488	40%	0.395	S	S	.	.	H	α-helix	trans	-63.4	-32.5	174.4	-68.6	-56.1	-63.3	0	0	112.7	Q229 N230 R237	Q229-M233 WeakPolarHBondContact O-CG 3.46Å; Q229-M233 PolarHBondContact O-N 3.17Å; Q229-M233 VanDerWaalsContact O-N 3.11Å; N230-M233 PolarHBondContact O-N 2.8Å; M233-R237 WeakPolarHBondContact O-CB 3.23Å; M233-R237 WeakPolarHBondContact O-CD 3.39Å; M233-R237 VanDerWaalsContact O-CG 3.22Å; M233-R237 WeakPolarHBondContact O-CG 3.38Å; M233-R237 PolarHBondContact O-N 3.34Å; M233-R237 VanDerWaalsContact O-N 3.09Å
234	K	98.1	Very high	96.6	Very high	124 Å²	124	87.6 Å²	87.6	54%	0.539	40%	0.401	S	S	.	.	H	α-helix	trans	-65.9	-47.5	170.1	-171.4	-172.9	176.1	-167.4	0	111.1	N230 R231 R232 K236 R237 L238	N230-K234 WeakPolarHBondContact O-CB 3.39Å; N230-K234 PolarHBondContact O-N 3.44Å; R231-K234 WeakPolarHBondContact O-CB 3.42Å; R231-K234 PolarHBondContact O-N 3.34Å; R232-K234 VanDerWaalsContact C-N 3.28Å; R232-K234 PolarHBondContact O-N 3.18Å; K234-K236 PolarHBondContact O-N 2.97Å; K234-R237 PolarHBondContact O-N 3.45Å; K234-L238 HydrophobicContact CG-CD1 4.2Å; K234-L238 WeakPolarHBondContact O-CG 3.42Å; K234-L238 PolarHBondContact O-N 3.05Å
235	K	97.8	Very high	96	Very high	69 Å²	69	94.8 Å²	94.8	30%	0.3	43%	0.433	S	S	.	.	H	α-helix	trans	-56.1	-52.2	177.1	-169.6	173.2	177	175.6	0	111.2	F199 E203 R231 R232 R237 L238 M239	F199-K235 HydrophobicContact CE1-CD 4.47Å; F199-K235 HydrophobicContact CZ-CD 4.4Å; E203-K235 VanDerWaalsContact OE1-CD 3.3Å; E203-K235 WeakPolarHBondContact OE1-CD 3.3Å; E203-K235 WeakPolarHBondContact OE1-CE 3.29Å; E203-K235 IonicContact OE1-NZ 3.56Å; E203-K235 PolarHBondContact OE1-NZ 3.24Å; R231-K235 PolarHBondContact O-N 3.24Å; R232-K235 PolarHBondContact O-N 3.46Å; R232-K235 VanDerWaalsContact O-N 3.15Å; K235-R237 VanDerWaalsContact C-N 3.33Å; K235-R237 PolarHBondContact O-N 3.09Å; K235-L238 PolarHBondContact O-N 3.15Å; K235-M239 HydrophobicContact CG-CE 4.44Å; K235-M239 HydrophobicContact CG-SD 3.9Å; K235-M239 WeakPolarHBondContact O-CG 3.47Å; K235-M239 PolarHBondContact O-N 3.22Å
236	K	97.9	Very high	95.3	Very high	124 Å²	124	94.4 Å²	94.4	54%	0.539	45%	0.447	S	S	.	.	H	α-helix	trans	-56.9	-42.8	176.6	178.6	169.4	178.7	169.7	0	112.7	R232 K234 M240	R232-K236 PolarHBondContact O-N 2.95Å; K234-K236 PolarHBondContact O-N 2.97Å; K236-M240 HydrophobicContact CD-SD 4.33Å; K236-M240 WeakPolarHBondContact CE-SD 3.28Å; K236-M240 HydrophobicContact CG-CG 4.3Å; K236-M240 HydrophobicContact CG-SD 3.89Å; K236-M240 WeakPolarHBondContact O-CB 3.44Å; K236-M240 VanDerWaalsContact O-CG 3.28Å; K236-M240 WeakPolarHBondContact O-CG 3.43Å; K236-M240 PolarHBondContact O-N 2.71Å
237	R	97.4	Very high	94.5	Very high	181 Å²	181	96 Å²	96	68%	0.683	46%	0.46	S	S	*	.	H	α-helix	trans	-67.7	-32	179.4	-78	172.6	175.2	-177.5	-2.2	113.7	M233 K234 K235 R241	M233-R237 WeakPolarHBondContact O-CB 3.23Å; M233-R237 WeakPolarHBondContact O-CD 3.39Å; M233-R237 VanDerWaalsContact O-CG 3.22Å; M233-R237 WeakPolarHBondContact O-CG 3.38Å; M233-R237 PolarHBondContact O-N 3.34Å; M233-R237 VanDerWaalsContact O-N 3.09Å; K234-R237 PolarHBondContact O-N 3.45Å; K235-R237 VanDerWaalsContact C-N 3.33Å; K235-R237 PolarHBondContact O-N 3.09Å; R237-R241 WeakPolarHBondContact O-CB 3.22Å; R237-R241 PolarHBondContact O-N 3.11Å
238	L	96.4	Very high	92.8	Very high	68 Å²	68	107.6 Å²	107.6	36%	0.356	51%	0.505	S	S	.	.	H	α-helix	trans	-70.2	-52.2	173.8	-69.7	171.6	0	0	0	110.1	K234 K235 M240 R241 E242	K234-L238 HydrophobicContact CG-CD1 4.2Å; K234-L238 WeakPolarHBondContact O-CG 3.42Å; K234-L238 PolarHBondContact O-N 3.05Å; K235-L238 PolarHBondContact O-N 3.15Å; L238-M240 VanDerWaalsContact C-N 3.32Å; L238-M240 PolarHBondContact O-N 2.8Å; L238-R241 CarbonylContact O-C 3.58Å; L238-R241 WeakPolarHBondContact O-CA 3.49Å; L238-R241 WeakPolarHBondContact O-CB 3.36Å; L238-R241 PolarHBondContact O-N 2.97Å; L238-E242 VanDerWaalsContact O-CD 3.31Å; L238-E242 WeakPolarHBondContact O-CG 3.33Å; L238-E242 PolarHBondContact O-N 3.3Å
239	M	94.9	Very high	92.5	Very high	104 Å²	104	112.7 Å²	112.7	51%	0.512	53%	0.53	S	S	.	.	H	α-helix	trans	-55.5	-42.6	176.7	-69.3	169.4	140.7	0	0	113.3	K235 R241 E242 H243	K235-M239 HydrophobicContact CG-CE 4.44Å; K235-M239 HydrophobicContact CG-SD 3.9Å; K235-M239 WeakPolarHBondContact O-CG 3.47Å; K235-M239 PolarHBondContact O-N 3.22Å; M239-R241 VanDerWaalsContact C-N 3.32Å; M239-R241 PolarHBondContact O-N 2.97Å; M239-E242 WeakPolarHBondContact CA-OE2 3.46Å; M239-E242 PolarHBondContact O-N 3.43Å; M239-H243 WeakPolarHBondContact O-CB 3.41Å; M239-H243 PolarHBondContact O-N 2.94Å
240	M	93.8	Very high	92.1	Very high	121 Å²	121	113.8 Å²	113.8	60%	0.596	54%	0.535	S	S	*	.	H	α-helix	trans	-68.2	-29	176	-71.4	-178.6	74	0	0	113.2	K236 L238 A244	K236-M240 HydrophobicContact CD-SD 4.33Å; K236-M240 WeakPolarHBondContact CE-SD 3.28Å; K236-M240 HydrophobicContact CG-CG 4.3Å; K236-M240 HydrophobicContact CG-SD 3.89Å; K236-M240 WeakPolarHBondContact O-CB 3.44Å; K236-M240 VanDerWaalsContact O-CG 3.28Å; K236-M240 WeakPolarHBondContact O-CG 3.43Å; K236-M240 PolarHBondContact O-N 2.71Å; L238-M240 VanDerWaalsContact C-N 3.32Å; L238-M240 PolarHBondContact O-N 2.8Å; M240-A244 WeakPolarHBondContact O-CB 3.5Å; M240-A244 PolarHBondContact O-N 2.88Å
241	R	94.3	Very high	91.8	Very high	161 Å²	161	114.5 Å²	114.5	61%	0.608	53%	0.534	S	S	*	.	H	α-helix	trans	-75.8	-42.6	174.1	167.1	179.2	-76.7	-170.5	-7.2	111.3	R237 L238 M239 A244 F245	R237-R241 WeakPolarHBondContact O-CB 3.22Å; R237-R241 PolarHBondContact O-N 3.11Å; L238-R241 CarbonylContact O-C 3.58Å; L238-R241 WeakPolarHBondContact O-CA 3.49Å; L238-R241 WeakPolarHBondContact O-CB 3.36Å; L238-R241 PolarHBondContact O-N 2.97Å; M239-R241 VanDerWaalsContact C-N 3.32Å; M239-R241 PolarHBondContact O-N 2.97Å; R241-A244 PolarHBondContact O-N 3.39Å; R241-F245 HydrophobicContact CG-CD2 3.8Å; R241-F245 HydrophobicContact CG-CE2 3.51Å; R241-F245 VanDerWaalsContact O-CD2 3.23Å; R241-F245 WeakPolarHBondContact O-CD2 3.47Å; R241-F245 PolarHBondContact O-N 3.44Å
242	E	91.3	Very high	91.4	Very high	110 Å²	110	118.9 Å²	118.9	51%	0.514	56%	0.557	S	S	.	*	H	α-helix	trans	-61.5	-46.6	177.3	-72.7	146.3	-163.5	0	0	110.5	L238 M239 A244 F245 A246	L238-E242 VanDerWaalsContact O-CD 3.31Å; L238-E242 WeakPolarHBondContact O-CG 3.33Å; L238-E242 PolarHBondContact O-N 3.3Å; M239-E242 WeakPolarHBondContact CA-OE2 3.46Å; M239-E242 PolarHBondContact O-N 3.43Å; E242-A244 VanDerWaalsContact C-N 3.35Å; E242-A244 PolarHBondContact O-N 3.49Å; E242-F245 PolarHBondContact O-N 3.31Å; E242-A246 WeakPolarHBondContact O-CB 3.38Å; E242-A246 PolarHBondContact O-N 3.27Å
243	H	90.5	Very high	91	Very high	138 Å²	138	121.8 Å²	121.8	64%	0.639	58%	0.575	S	S	*	*	H	α-helix	trans	-59.2	-43.3	171.3	-173.1	-43.2	0	0	0	112.2	M239 F245 A246 T247	M239-H243 WeakPolarHBondContact O-CB 3.41Å; M239-H243 PolarHBondContact O-N 2.94Å; H243-F245 VanDerWaalsContact C-N 3.26Å; H243-F245 PolarHBondContact O-N 2.79Å; H243-A246 PolarHBondContact O-N 2.91Å; H243-T247 PolarHBondContact ND1-OG1 3.21Å; H243-T247 PolarHBondContact O-N 3.05Å; H243-T247 PolarHBondContact O-OG1 3.46Å
244	A	90.8	Very high	90.4	Very high	54 Å²	54	123.3 Å²	123.3	45%	0.446	58%	0.58	S	S	.	*	H	α-helix	trans	-64.2	-29.4	179.7	0	0	0	0	0	113	M240 R241 E242 Y248	M240-A244 WeakPolarHBondContact O-CB 3.5Å; M240-A244 PolarHBondContact O-N 2.88Å; R241-A244 PolarHBondContact O-N 3.39Å; E242-A244 VanDerWaalsContact C-N 3.35Å; E242-A244 PolarHBondContact O-N 3.49Å; A244-Y248 WeakPolarHBondContact O-CD2 3.24Å
245	F	85.2	Confident	89.9	Confident	151 Å²	151	123.2 Å²	123.2	66%	0.662	58%	0.583	S	S	*	*	H	α-helix	trans	-77.7	-38.7	170.6	-74.1	-58.9	0	0	0	112.6	R241 E242 H243 T247 Y248	R241-F245 HydrophobicContact CG-CD2 3.8Å; R241-F245 HydrophobicContact CG-CE2 3.51Å; R241-F245 VanDerWaalsContact O-CD2 3.23Å; R241-F245 WeakPolarHBondContact O-CD2 3.47Å; R241-F245 PolarHBondContact O-N 3.44Å; E242-F245 PolarHBondContact O-N 3.31Å; H243-F245 VanDerWaalsContact C-N 3.26Å; H243-F245 PolarHBondContact O-N 2.79Å; F245-T247 PolarHBondContact O-N 3.09Å; F245-T247 VanDerWaalsContact O-N 3.08Å; F245-Y248 PolarHBondContact O-N 3.18Å
246	A	84.6	Confident	89.3	Confident	85 Å²	85	127.4 Å²	127.4	70%	0.702	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	10.8	178.8	0	0	0	0	0	114.9	E242 H243	E242-A246 WeakPolarHBondContact O-CB 3.38Å; E242-A246 PolarHBondContact O-N 3.27Å; H243-A246 PolarHBondContact O-N 2.91Å
247	T	82.1	Confident	88.6	Confident	91 Å²	91	127.7 Å²	127.7	56%	0.558	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	5.1	176.5	-43.4	0	0	0	0	111.9	H243 F245	H243-T247 PolarHBondContact ND1-OG1 3.21Å; H243-T247 PolarHBondContact O-N 3.05Å; H243-T247 PolarHBondContact O-OG1 3.46Å; F245-T247 PolarHBondContact O-N 3.09Å; F245-T247 VanDerWaalsContact O-N 3.08Å
248	Y	61.8	Low	87.8	Confident	268 Å²	268	122.8 Å²	122.8	100%	1.051	60%	0.604	S	S	*	*			trans	-127.6	0	176.6	-69.6	-85.2	0	0	0	110.4	A244 F245	A244-Y248 WeakPolarHBondContact O-CD2 3.24Å; F245-Y248 PolarHBondContact O-N 3.18Å

Retrieved 248 of 248 residues in 84.1 ms (Link to these results)

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