A0A087Y0A7_POEFO Loading...

H6 family homeobox 3

Transcription factor involved in specification of neuronal cell types and which is required for inner ear and hypothalamus development. Binds to the 5'-CAAGTG-3' core sequence.

AlphaFold DB , UniProt , Accession A0A087Y0A7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 287 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	43.9	Very low	49.1	Very low	253 Å²	253	161.7 Å²	161.7	100%	1.246	84%	0.843	S	S	*	*				0	109.7	0	-80	159.9	139.7	0	0	108.2
2	A	40.3	Very low	50	Low	101 Å²	101	152.3 Å²	152.3	84%	0.835	81%	0.807	S	S	*	*			trans	-170.7	108.1	160.6	0	0	0	0	0	105.3
3	E	42.7	Very low	50.7	Low	199 Å²	199	147.4 Å²	147.4	93%	0.93	80%	0.8	S	S	*	*			trans	-85	135.5	178.4	-67.4	172.7	114.9	0	0	109.2	D5	E3-D5 PolarHBondContact O-N 3.21Å
4	S	54.2	Low	51.2	Low	113 Å²	113	147.5 Å²	147.5	79%	0.79	79%	0.79	S	S	*	*			trans	-91.8	101.5	174.6	-65.3	0	0	0	0	109.8	T6	S4-T6 PolarHBondContact O-N 3.22Å
5	D	46	Very low	52	Low	136 Å²	136	145.7 Å²	145.7	73%	0.727	78%	0.78	S	S	*	*			trans	-59.6	126.3	178.4	-160.4	-22.4	0	0	0	111.1	E3	E3-D5 PolarHBondContact O-N 3.21Å
6	T	53	Low	53.6	Low	127 Å²	127	139.3 Å²	139.3	78%	0.779	75%	0.75	S	S	*	*			trans	-112.2	91.7	-179.8	-52.5	0	0	0	0	109.1	S4 E8	S4-T6 PolarHBondContact O-N 3.22Å; T6-E8 PolarHBondContact O-N 2.94Å
7	Q	47.9	Very low	54.9	Low	166 Å²	166	137.1 Å²	137.1	78%	0.776	75%	0.745	S	S	*	*			trans	-73.6	94.7	-178.7	-69.3	-171.7	-12.2	0	0	111.6	T9	Q7-T9 PolarHBondContact O-N 3.04Å
8	E	49.9	Very low	55.7	Low	155 Å²	155	138.8 Å²	138.8	72%	0.724	74%	0.744	S	S	*	*			trans	-70.5	106.6	170.9	-173.2	-178.6	105	0	0	110.7	T6 R10	T6-E8 PolarHBondContact O-N 2.94Å; E8-R10 PolarHBondContact O-N 2.89Å
9	T	55	Low	56.8	Low	129 Å²	129	132.6 Å²	132.6	79%	0.791	71%	0.713	S	S	*	*			trans	-70.5	86.5	-180	-49.7	0	0	0	0	111.7	Q7 Q11	Q7-T9 PolarHBondContact O-N 3.04Å; T9-Q11 PolarHBondContact O-N 2.85Å
10	R	53.4	Low	57.7	Low	216 Å²	216	132.3 Å²	132.3	82%	0.815	71%	0.71	S	S	*	*			trans	-62.4	100	172.1	-73.2	-175.6	172.8	-177.3	-0.7	111.4	E8 A12	E8-R10 PolarHBondContact O-N 2.89Å; R10-A12 PolarHBondContact O-N 2.93Å
11	Q	54	Low	58.5	Low	184 Å²	184	133.6 Å²	133.6	86%	0.86	71%	0.709	S	S	*	*			trans	-59.4	134.5	167	-71.3	-177.8	-16.1	0	0	110.1	T9 A13	T9-Q11 PolarHBondContact O-N 2.85Å; Q11-A13 PolarHBondContact O-N 2.97Å
12	A	59.7	Low	59.8	Low	49 Å²	49	125.8 Å²	125.8	41%	0.405	67%	0.672	S	S	.	*			trans	-69.7	124.6	-174.2	0	0	0	0	0	111.2	R10 K14 D15	R10-A12 PolarHBondContact O-N 2.93Å; A12-K14 HydrophobicContact CB-CD 4.37Å; A12-K14 HydrophobicContact CB-CG 3.83Å; A12-K14 PolarHBondContact O-N 3.21Å; A12-D15 PolarHBondContact O-N 3.49Å
13	A	58.8	Low	61.4	Low	88 Å²	88	126.6 Å²	126.6	73%	0.727	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-59.5	-8.3	-172.8	0	0	0	0	0	116.2	Q11 D15	Q11-A13 PolarHBondContact O-N 2.97Å; A13-D15 VanDerWaalsContact C-N 3.33Å
14	K	58.5	Low	62.9	Low	149 Å²	149	122.5 Å²	122.5	65%	0.648	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-65.7	-32.3	176	39.2	175.8	175.7	173.4	0	113	A12 S19	A12-K14 HydrophobicContact CB-CD 4.37Å; A12-K14 HydrophobicContact CB-CG 3.83Å; A12-K14 PolarHBondContact O-N 3.21Å; K14-S19 PolarHBondContact O-OG 2.99Å
15	D	62.8	Low	63.2	Low	121 Å²	121	123.3 Å²	123.3	65%	0.647	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-96	10.1	-173.9	-51	-49.8	0	0	0	113.1	A12 A13	A12-D15 PolarHBondContact O-N 3.49Å; A13-D15 VanDerWaalsContact C-N 3.33Å
16	S	78.1	Confident	63.9	Low	43 Å²	43	122.6 Å²	122.6	30%	0.301	64%	0.636	S	S	.	*			trans	-62.2	137.3	176.1	175.4	0	0	0	0	111.5	F18 S19 N22	S16-F18 PolarHBondContact O-N 3.09Å; S16-F18 PolarHBondContact OG-N 3.08Å; S16-S19 WeakPolarHBondContact O-CB 3.3Å; S16-S19 PolarHBondContact O-N 2.73Å; S16-N22 PolarHBondContact O-ND2 3.1Å
17	P	74.4	Confident	64.1	Low	101 Å²	101	124.1 Å²	124.1	66%	0.656	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-10.2	173.3	27.4	-34.8	0	0	0	113.4
18	F	69.3	Low	64.5	Low	168 Å²	168	123.7 Å²	123.7	74%	0.737	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	5.7	172.6	-60.2	-79.9	0	0	0	113.3	S16 I20	S16-F18 PolarHBondContact O-N 3.09Å; S16-F18 PolarHBondContact OG-N 3.08Å; F18-I20 PolarHBondContact O-N 2.78Å
19	S	78.1	Confident	64.2	Low	22 Å²	22	125.7 Å²	125.7	15%	0.154	64%	0.644	C	S	.	*			trans	-61	131.3	175.7	-178.6	0	0	0	0	110.5	K14 S16 K21 N22 L23	K14-S19 PolarHBondContact O-OG 2.99Å; S16-S19 WeakPolarHBondContact O-CB 3.3Å; S16-S19 PolarHBondContact O-N 2.73Å; S19-K21 PolarHBondContact O-N 3Å; S19-K21 VanDerWaalsContact O-N 3.1Å; S19-N22 PolarHBondContact O-N 2.95Å; S19-L23 PolarHBondContact O-N 2.97Å
20	I	74.1	Confident	63.7	Low	126 Å²	126	125.7 Å²	125.7	65%	0.646	65%	0.646	S	S	*	*	H	α-helix	trans	-56.4	-31.9	-178.1	-61.6	172.4	0	0	0	111.2	F18 L23 L24	F18-I20 PolarHBondContact O-N 2.78Å; I20-L23 PolarHBondContact O-N 2.82Å; I20-L24 HydrophobicContact CG2-CD1 3.77Å; I20-L24 HydrophobicContact CG2-CG 4.32Å; I20-L24 WeakPolarHBondContact O-CB 3.46Å; I20-L24 VanDerWaalsContact O-CG 3.31Å; I20-L24 WeakPolarHBondContact O-CG 3.44Å; I20-L24 PolarHBondContact O-N 2.98Å; I20-L24 VanDerWaalsContact O-N 3.09Å
21	K	75.1	Confident	63	Low	159 Å²	159	120.5 Å²	120.5	69%	0.691	64%	0.643	S	S	*	*	H	α-helix	trans	-63.7	-44.3	176.6	-62.1	-172.3	176.7	-170	0	112.3	S19 L24 N25	S19-K21 PolarHBondContact O-N 3Å; S19-K21 VanDerWaalsContact O-N 3.1Å; K21-L24 PolarHBondContact O-N 3.27Å; K21-N25 PolarHBondContact O-N 2.82Å
22	N	70.6	Confident	62.4	Low	89 Å²	89	121 Å²	121	48%	0.476	64%	0.642	S	S	.	*	H	α-helix	trans	-68.3	-37.7	175.8	-74.6	-13.1	0	0	0	111.8	S16 S19 L24 N25	S16-N22 PolarHBondContact O-ND2 3.1Å; S19-N22 PolarHBondContact O-N 2.95Å; N22-L24 PolarHBondContact O-N 3.44Å; N22-N25 PolarHBondContact O-N 3.41Å
23	L	73.7	Confident	61.5	Low	119 Å²	119	124.8 Å²	124.8	62%	0.623	66%	0.663	S	S	*	*	H	α-helix	trans	-67.1	-23.6	176.6	-68.1	172.8	0	0	0	113.6	S19 I20	S19-L23 PolarHBondContact O-N 2.97Å; I20-L23 PolarHBondContact O-N 2.82Å
24	L	73.4	Confident	60.8	Low	112 Å²	112	124.9 Å²	124.9	59%	0.586	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-2.9	179.2	-65.2	176.1	0	0	0	113.9	I20 K21 N22 I26	I20-L24 HydrophobicContact CG2-CD1 3.77Å; I20-L24 HydrophobicContact CG2-CG 4.32Å; I20-L24 WeakPolarHBondContact O-CB 3.46Å; I20-L24 VanDerWaalsContact O-CG 3.31Å; I20-L24 WeakPolarHBondContact O-CG 3.44Å; I20-L24 PolarHBondContact O-N 2.98Å; I20-L24 VanDerWaalsContact O-N 3.09Å; K21-L24 PolarHBondContact O-N 3.27Å; N22-L24 PolarHBondContact O-N 3.44Å; L24-I26 HydrophobicContact CB-CD1 3.85Å; L24-I26 HydrophobicContact CB-CG1 3.81Å; L24-I26 HydrophobicContact CD1-CD1 4.17Å; L24-I26 PolarHBondContact O-N 2.96Å; L24-I26 VanDerWaalsContact O-N 3.16Å
25	N	61.4	Low	59.9	Low	131 Å²	131	123.8 Å²	123.8	70%	0.701	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.5	37.2	179.4	-153.2	104.9	0	0	0	113.5	K21 N22 E27	K21-N25 PolarHBondContact O-N 2.82Å; N22-N25 PolarHBondContact O-N 3.41Å; N25-E27 VanDerWaalsContact C-N 3.31Å; N25-E27 PolarHBondContact O-N 3.36Å; N25-E27 VanDerWaalsContact O-N 3.15Å
26	I	60.3	Low	58.8	Low	121 Å²	121	124.8 Å²	124.8	62%	0.621	68%	0.682	S	S	*	*			trans	-88.3	74.7	177.5	-50.3	174.4	0	0	0	108.1	L24	L24-I26 HydrophobicContact CB-CD1 3.85Å; L24-I26 HydrophobicContact CB-CG1 3.81Å; L24-I26 HydrophobicContact CD1-CD1 4.17Å; L24-I26 PolarHBondContact O-N 2.96Å; L24-I26 VanDerWaalsContact O-N 3.16Å
27	E	57.4	Low	56.7	Low	159 Å²	159	131.3 Å²	131.3	74%	0.743	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-95.3	127	163.4	-71.5	-173.8	140.2	0	0	109	N25 K29	N25-E27 VanDerWaalsContact C-N 3.31Å; N25-E27 PolarHBondContact O-N 3.36Å; N25-E27 VanDerWaalsContact O-N 3.15Å; E27-K29 PolarHBondContact O-N 3.17Å
28	D	57	Low	54.8	Low	156 Å²	156	130.1 Å²	130.1	83%	0.834	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-63.1	121.2	178.6	-77.6	-61.4	0	0	0	111	P30	D28-P30 VanDerWaalsContact O-CD 3.29Å; D28-P30 WeakPolarHBondContact O-CD 3.5Å
29	K	44.1	Very low	53.3	Low	198 Å²	198	127.7 Å²	127.7	86%	0.861	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-75.1	120.2	173.7	-74.1	-170.3	174.4	-174.2	0	110.8	E27	E27-K29 PolarHBondContact O-N 3.17Å
30	P	42.8	Very low	51.6	Low	129 Å²	129	132.3 Å²	132.3	84%	0.838	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-68.2	144.8	160.2	29.8	-33	0	0	0	110	D28	D28-P30 VanDerWaalsContact O-CD 3.29Å; D28-P30 WeakPolarHBondContact O-CD 3.5Å
31	S	38.7	Very low	50	Low	107 Å²	107	136.3 Å²	136.3	75%	0.748	77%	0.767	S	S	*	*			trans	-114.4	133.6	-165.9	60	0	0	0	0	114.1
32	K	42.3	Very low	48.3	Very low	193 Å²	193	132.5 Å²	132.5	84%	0.839	77%	0.773	S	S	*	*			trans	62	144.3	160	-68.8	179.9	175.3	176.8	0	118.8
33	P	40.4	Very low	47	Very low	130 Å²	130	134.8 Å²	134.8	84%	0.844	79%	0.791	S	S	*	*				-116	173	109.2	34.2	-34.6	0	0	0	113.4
34	A	44.3	Very low	45.1	Very low	90 Å²	90	138.9 Å²	138.9	74%	0.744	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-86.4	156	-167.7	0	0	0	0	0	114.7
35	P	40.4	Very low	43.5	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-84.5	129.8	173	33.1	-32.1	0	0	0	112.1
36	T	38.7	Very low	42.2	Very low	142 Å²	142	138 Å²	138	87%	0.871	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.3	122.4	165.7	44.4	0	0	0	0	110	G38	T36-G38 PolarHBondContact O-N 3.43Å
37	L	35.3	Very low	41.5	Very low	180 Å²	180	137.7 Å²	137.7	94%	0.942	82%	0.816	S	S	*	*			trans	-77.3	101.7	175.5	-90.9	160.9	0	0	0	110.6
38	G	33.7	Very low	40.9	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	82%	0.819	S	S	*	*			trans	-85.7	119.1	165.7	0	0	0	0	0	110.8	T36	T36-G38 PolarHBondContact O-N 3.43Å
39	S	37.6	Very low	40.3	Very low	118 Å²	118	139.3 Å²	139.3	83%	0.825	81%	0.814	S	S	*	*			trans	-94.2	121	174.1	-173.4	0	0	0	0	110.6
40	S	41.8	Very low	40.3	Very low	118 Å²	118	135.6 Å²	135.6	83%	0.825	81%	0.813	S	S	*	*			trans	-147.4	134.6	161.4	51.6	0	0	0	0	110.8
41	K	41.3	Very low	40.4	Very low	210 Å²	210	140.3 Å²	140.3	91%	0.913	81%	0.814	S	S	*	*			trans	-85.3	142.1	-177.1	-63.9	168.5	177.5	173.2	0	109.7
42	G	38.8	Very low	40.8	Very low	79 Å²	79	143.1 Å²	143.1	81%	0.814	82%	0.82	S	S	*	*			trans	-147.2	113.3	170.1	0	0	0	0	0	110.1
43	V	44	Very low	40.7	Very low	138 Å²	138	139 Å²	139	84%	0.836	82%	0.816	S	S	*	*			trans	-95.8	131.6	179.7	172	0	0	0	0	109.1
44	F	33.3	Very low	41.1	Very low	204 Å²	204	139.4 Å²	139.4	90%	0.895	81%	0.811	S	S	*	*			trans	-150.8	143.1	144.5	-160.9	-106.8	0	0	0	111.2
45	E	40.3	Very low	41.3	Very low	150 Å²	150	143.2 Å²	143.2	70%	0.701	82%	0.817	S	S	*	*			trans	-97.6	148.4	-170.3	-168.9	175.7	173.6	0	0	110.6
46	G	34.5	Very low	41.7	Very low	76 Å²	76	142.2 Å²	142.2	78%	0.784	81%	0.814	S	S	*	*			trans	-152.5	50.3	-166.8	0	0	0	0	0	114	F48	G46-F48 PolarHBondContact O-N 3.08Å
47	T	46.1	Very low	42.4	Very low	113 Å²	113	142.7 Å²	142.7	69%	0.693	81%	0.81	S	S	*	*			trans	-71.9	102	-174	-47.4	0	0	0	0	112.4
48	F	43.9	Very low	43.1	Very low	184 Å²	184	139.4 Å²	139.4	81%	0.807	80%	0.8	S	S	*	*			trans	-136.6	98.7	167.6	-119.3	-106.2	0	0	0	112.6	G46	G46-F48 PolarHBondContact O-N 3.08Å
49	F	44.6	Very low	44	Very low	166 Å²	166	145.7 Å²	145.7	73%	0.728	80%	0.8	S	S	*	*			trans	54.9	101.7	156.6	-61	-92.6	0	0	0	120.8
50	S	44.3	Very low	44.3	Very low	119 Å²	119	148.5 Å²	148.5	83%	0.832	80%	0.797	S	S	*	*			trans	-87.5	119.2	142	-47.1	0	0	0	0	110.3
51	R	45.1	Very low	44.6	Very low	228 Å²	228	149.4 Å²	149.4	86%	0.86	79%	0.789	S	S	*	*			trans	177.9	163.4	149.6	-104.1	173.7	-171.6	-145.8	2	110.4
52	L	46.9	Very low	45.2	Very low	167 Å²	167	145.8 Å²	145.8	87%	0.874	78%	0.779	S	S	*	*			trans	72.7	87.2	-161.9	-47.6	179.8	0	0	0	109.6
53	S	40	Very low	45.4	Very low	107 Å²	107	147 Å²	147	75%	0.748	77%	0.772	S	S	*	*			cis	58.2	115.9	38.4	-46.6	0	0	0	0	112.7
54	D	49.4	Very low	45.9	Very low	138 Å²	138	144.5 Å²	144.5	74%	0.738	77%	0.774	S	S	*	*			trans	74.1	86.6	167.3	-147.8	-4.5	0	0	0	118.5	S56	D54-S56 PolarHBondContact OD1-N 3.31Å
55	L	48.4	Very low	46.7	Very low	169 Å²	169	142.7 Å²	142.7	89%	0.885	77%	0.768	S	S	*	*			trans	-127.9	89.9	137.7	-77.3	-179.4	0	0	0	108.6	L57	L55-L57 PolarHBondContact O-N 3.36Å
56	S	48.8	Very low	47.3	Very low	106 Å²	106	147.3 Å²	147.3	74%	0.741	78%	0.78	S	S	*	*			trans	-56	95.5	166.1	-178.5	0	0	0	0	111.6	D54	D54-S56 PolarHBondContact OD1-N 3.31Å
57	L	53.4	Low	48	Very low	152 Å²	152	150.8 Å²	150.8	80%	0.796	78%	0.778	S	S	*	*			trans	-78.7	127.8	163.6	-73.8	166.4	0	0	0	108.4	L55 R59	L55-L57 PolarHBondContact O-N 3.36Å; L57-R59 PolarHBondContact O-N 3.46Å
58	P	49.3	Very low	48.1	Very low	111 Å²	111	148.7 Å²	148.7	72%	0.721	78%	0.78	S	S	*	*			trans	-66.2	112.1	-179.2	26.4	-33.2	0	0	0	109.9	F60	P58-F60 PolarHBondContact O-N 2.58Å
59	R	52.1	Low	48.1	Very low	207 Å²	207	147.4 Å²	147.4	78%	0.781	78%	0.78	S	S	*	*			trans	-67.6	99.3	173.7	-177.1	178.6	173.6	106	2	109.1	L57 E61	L57-R59 PolarHBondContact O-N 3.46Å; R59-E61 VanDerWaalsContact C-N 3.3Å; R59-E61 HydrophobicContact CG-CG 4.34Å; R59-E61 IonicContact CZ-OE1 3.33Å; R59-E61 IonicContact NE-OE1 2.85Å; R59-E61 PolarHBondContact NE-OE1 3.45Å; R59-E61 IonicContact NH2-OE1 2.89Å; R59-E61 PolarHBondContact NH2-OE1 3.11Å; R59-E61 PolarHBondContact O-N 3.31Å
60	F	43.3	Very low	48.3	Very low	176 Å²	176	144.3 Å²	144.3	77%	0.772	78%	0.779	S	S	*	*			trans	-75.5	81.7	177.9	-138.6	-96	0	0	0	110.2	P58 L62	P58-F60 PolarHBondContact O-N 2.58Å; F60-L62 HydrophobicContact CD1-CD1 4.38Å; F60-L62 HydrophobicContact CD1-CD2 4.37Å; F60-L62 HydrophobicContact CD1-CG 3.99Å; F60-L62 HydrophobicContact CE1-CD2 4.22Å; F60-L62 HydrophobicContact CE1-CG 4.35Å; F60-L62 PolarHBondContact O-N 3.02Å; F60-L62 VanDerWaalsContact O-N 3.09Å
61	E	49.1	Very low	48.5	Very low	137 Å²	137	143.4 Å²	143.4	64%	0.64	78%	0.779	S	S	*	*			trans	-66.5	98.9	168	-75.5	-87	135.9	0	0	109.1	R59	R59-E61 VanDerWaalsContact C-N 3.3Å; R59-E61 HydrophobicContact CG-CG 4.34Å; R59-E61 IonicContact CZ-OE1 3.33Å; R59-E61 IonicContact NE-OE1 2.85Å; R59-E61 PolarHBondContact NE-OE1 3.45Å; R59-E61 IonicContact NH2-OE1 2.89Å; R59-E61 PolarHBondContact NH2-OE1 3.11Å; R59-E61 PolarHBondContact O-N 3.31Å
62	L	53.1	Low	48.8	Very low	135 Å²	135	140.6 Å²	140.6	71%	0.707	78%	0.776	S	S	*	*			trans	-83.3	122.2	166.4	-80.6	161	0	0	0	109	F60 G64	F60-L62 HydrophobicContact CD1-CD1 4.38Å; F60-L62 HydrophobicContact CD1-CD2 4.37Å; F60-L62 HydrophobicContact CD1-CG 3.99Å; F60-L62 HydrophobicContact CE1-CD2 4.22Å; F60-L62 HydrophobicContact CE1-CG 4.35Å; F60-L62 PolarHBondContact O-N 3.02Å; F60-L62 VanDerWaalsContact O-N 3.09Å; L62-G64 PolarHBondContact O-N 2.77Å
63	P	42.7	Very low	49	Very low	104 Å²	104	143.5 Å²	143.5	68%	0.675	78%	0.777	S	S	*	*			trans	-63.6	139.1	173.6	27.7	-33.6	0	0	0	109.3	Q65	P63-Q65 VanDerWaalsContact C-N 3.28Å; P63-Q65 PolarHBondContact O-N 2.94Å
64	G	55.4	Low	49.5	Very low	85 Å²	85	145.8 Å²	145.8	88%	0.876	78%	0.78	S	S	*	*			trans	-67.6	73	-172	0	0	0	0	0	114.9	L62	L62-G64 PolarHBondContact O-N 2.77Å
65	Q	49.4	Very low	49.6	Very low	166 Å²	166	148.2 Å²	148.2	78%	0.776	79%	0.787	S	S	*	*			trans	-89	113.9	163	-72.6	-175.6	3.4	0	0	109	P63 I67	P63-Q65 VanDerWaalsContact C-N 3.28Å; P63-Q65 PolarHBondContact O-N 2.94Å; Q65-I67 PolarHBondContact O-N 3.15Å
66	R	54	Low	49.8	Very low	248 Å²	248	151.7 Å²	151.7	94%	0.936	79%	0.788	S	S	*	*			trans	-69.4	99.3	175	-55.7	-171.1	-124.4	-102.2	5.8	107.9	G68	R66-G68 PolarHBondContact O-N 3.21Å
67	I	49	Very low	49.7	Very low	148 Å²	148	150 Å²	150	76%	0.759	78%	0.781	S	S	*	*			trans	-67.8	87.8	170.3	-57.5	174.5	0	0	0	107.2	Q65 L69	Q65-I67 PolarHBondContact O-N 3.15Å; I67-L69 VanDerWaalsContact C-N 3.34Å; I67-L69 HydrophobicContact CG2-CD2 4.12Å; I67-L69 PolarHBondContact O-N 2.83Å
68	G	47.2	Very low	49.7	Very low	70 Å²	70	147 Å²	147	72%	0.722	77%	0.772	S	S	*	*			trans	-66.4	95.8	167.3	0	0	0	0	0	108.3	R66 S70	R66-G68 PolarHBondContact O-N 3.21Å; G68-S70 PolarHBondContact O-N 3.2Å
69	L	44.8	Very low	50	Low	157 Å²	157	144.4 Å²	144.4	82%	0.822	76%	0.76	S	S	*	*			trans	-59.8	108.9	170.3	-66.9	175.3	0	0	0	107.9	I67 A71	I67-L69 VanDerWaalsContact C-N 3.34Å; I67-L69 HydrophobicContact CG2-CD2 4.12Å; I67-L69 PolarHBondContact O-N 2.83Å; L69-A71 PolarHBondContact O-N 3.35Å; L69-A71 VanDerWaalsContact O-N 3.15Å
70	S	48.6	Very low	50.4	Low	100 Å²	100	144.8 Å²	144.8	70%	0.699	76%	0.762	S	S	*	*			trans	-57.4	119.2	176.3	-179.6	0	0	0	0	109.3	G68 Q72	G68-S70 PolarHBondContact O-N 3.2Å; S70-Q72 PolarHBondContact O-N 3.46Å
71	A	49.5	Very low	51.1	Low	101 Å²	101	145.5 Å²	145.5	84%	0.835	76%	0.759	S	S	*	*	S	Bend	trans	-77.1	46	-174.1	0	0	0	0	0	113	L69	L69-A71 PolarHBondContact O-N 3.35Å; L69-A71 VanDerWaalsContact O-N 3.15Å
72	Q	51.4	Low	51	Low	169 Å²	169	145.6 Å²	145.6	79%	0.79	76%	0.755	S	S	*	*			trans	-105	23.2	-177.9	-78.6	-133	-29.6	0	0	114.2	S70	S70-Q72 PolarHBondContact O-N 3.46Å
73	Y	49.3	Very low	51.1	Low	227 Å²	227	144.5 Å²	144.5	89%	0.89	76%	0.756	S	S	*	*	S	Bend	trans	-134.5	23.7	-179.6	-130.6	-92.4	0	0	0	116.4
74	L	50.8	Low	51.5	Low	156 Å²	156	148.9 Å²	148.9	82%	0.817	76%	0.761	S	S	*	*	S	Bend	trans	-125.6	13.3	172.9	-145.5	71.1	0	0	0	115.2
75	E	52.1	Low	51.4	Low	188 Å²	188	150.7 Å²	150.7	88%	0.879	76%	0.755	S	S	*	*	S	Bend	trans	-88.6	1.2	176.5	-92	-82.7	121.9	0	0	113.9
76	R	52.7	Low	51.5	Low	242 Å²	242	149.1 Å²	149.1	91%	0.913	75%	0.751	S	S	*	*			trans	-133.4	26.7	-176.4	-148.2	126.6	71.1	-177.5	3.8	115.5
77	A	46.3	Very low	50.8	Low	71 Å²	71	141.2 Å²	141.2	59%	0.587	75%	0.746	S	S	*	*			trans	-91.4	109.5	161.8	0	0	0	0	0	109	A79	A77-A79 PolarHBondContact O-N 3.23Å
78	S	54.8	Low	50.2	Low	89 Å²	89	138.7 Å²	138.7	62%	0.622	75%	0.748	S	S	*	*			trans	-63.5	97.4	170.8	-34.9	0	0	0	0	108.9	W80	S78-W80 VanDerWaalsContact CB-NE1 3.26Å; S78-W80 PolarHBondContact O-N 2.98Å
79	A	55.1	Low	50	Low	57 Å²	57	143.8 Å²	143.8	47%	0.471	75%	0.753	S	S	.	*			trans	-75.5	62.2	-172.6	0	0	0	0	0	112.5	A77 W81 Y82	A77-A79 PolarHBondContact O-N 3.23Å; A79-W81 PolarHBondContact O-N 3.35Å; A79-Y82 HydrophobicContact CB-CD2 4.32Å; A79-Y82 PolarHBondContact O-N 2.87Å
80	W	60.9	Low	49.5	Very low	215 Å²	215	146.1 Å²	146.1	81%	0.814	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	5.9	-176.3	-63.5	-10.9	0	0	0	115.3	S78	S78-W80 VanDerWaalsContact CB-NE1 3.26Å; S78-W80 PolarHBondContact O-N 2.98Å
81	W	57.6	Low	48.8	Very low	190 Å²	190	152.5 Å²	152.5	72%	0.72	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	1.6	-178.6	63.8	-89.5	0	0	0	114.4	A79 P83	A79-W81 PolarHBondContact O-N 3.35Å; W81-P83 VanDerWaalsContact O-CD 3.27Å; W81-P83 WeakPolarHBondContact O-CD 3.24Å
82	Y	47.1	Very low	47.8	Very low	139 Å²	139	154.3 Å²	154.3	55%	0.545	77%	0.766	S	S	.	*			trans	-101.1	106.1	174.8	-88.9	-79.1	0	0	0	111.9	A79	A79-Y82 HydrophobicContact CB-CD2 4.32Å; A79-Y82 PolarHBondContact O-N 2.87Å
83	P	55	Low	46.8	Very low	113 Å²	113	150.9 Å²	150.9	73%	0.734	77%	0.767	S	S	*	*			trans	-76.2	136.5	153.9	32.6	-29.5	0	0	0	108.8	W81	W81-P83 VanDerWaalsContact O-CD 3.27Å; W81-P83 WeakPolarHBondContact O-CD 3.24Å
84	Y	49.8	Very low	45.9	Very low	195 Å²	195	146.6 Å²	146.6	77%	0.765	77%	0.77	S	S	*	*			trans	68.3	85.1	174	-106.9	-109.8	0	0	0	117.3	L86	Y84-L86 HydrophobicContact CD1-CD1 3.74Å; Y84-L86 HydrophobicContact CD2-CD1 4.47Å; Y84-L86 HydrophobicContact CE1-CD1 3.43Å; Y84-L86 VanDerWaalsContact CE1-CD1 3.43Å; Y84-L86 HydrophobicContact CE1-CD2 4.42Å; Y84-L86 HydrophobicContact CE2-CD1 4.2Å; Y84-L86 HydrophobicContact CG-CD1 4.25Å
85	T	54.5	Low	44.9	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	76%	0.764	S	S	*	*			trans	-124.8	102.4	142	55.1	0	0	0	0	108.6
86	L	51.9	Low	43.9	Very low	133 Å²	133	138.9 Å²	138.9	70%	0.696	76%	0.76	S	S	*	*			trans	-76.2	137.4	174.2	-103.6	65.1	0	0	0	111.1	Y84	Y84-L86 HydrophobicContact CD1-CD1 3.74Å; Y84-L86 HydrophobicContact CD2-CD1 4.47Å; Y84-L86 HydrophobicContact CE1-CD1 3.43Å; Y84-L86 VanDerWaalsContact CE1-CD1 3.43Å; Y84-L86 HydrophobicContact CE1-CD2 4.42Å; Y84-L86 HydrophobicContact CE2-CD1 4.2Å; Y84-L86 HydrophobicContact CG-CD1 4.25Å
87	G	38.7	Very low	43.1	Very low	81 Å²	81	136.3 Å²	136.3	84%	0.835	76%	0.759	S	S	*	*			trans	41.8	106.2	138.1	0	0	0	0	0	120.2
88	A	36.6	Very low	42.5	Very low	96 Å²	96	142.4 Å²	142.4	79%	0.793	77%	0.772	S	S	*	*			trans	-138.8	122.9	144.9	0	0	0	0	0	109.8
89	H	42.2	Very low	41.3	Very low	177 Å²	177	146 Å²	146	82%	0.819	78%	0.782	S	S	*	*			trans	-83.5	127.5	170.4	-78	-95.9	0	0	0	110.1
90	F	34.5	Very low	40	Very low	206 Å²	206	147.5 Å²	147.5	90%	0.904	79%	0.79	S	S	*	*			trans	-138.7	141.7	151.9	-80.9	-73.9	0	0	0	111
91	R	33.8	Very low	38.5	Very low	234 Å²	234	145.9 Å²	145.9	88%	0.883	79%	0.791	S	S	*	*			trans	-115.9	134.3	179.8	-44.7	177.8	-146.1	-144.2	3.2	109.9
92	T	28.2	Very low	37.2	Very low	138 Å²	138	146.8 Å²	146.8	85%	0.847	79%	0.794	S	S	*	*			trans	-161.9	109.6	149.9	48.8	0	0	0	0	106.1
93	A	30.1	Very low	36.7	Very low	98 Å²	98	148.4 Å²	148.4	81%	0.81	81%	0.807	S	S	*	*				76.1	119.6	70	0	0	0	0	0	115.2
94	S	30.4	Very low	35.9	Very low	137 Å²	137	150.5 Å²	150.5	96%	0.958	81%	0.807	S	S	*	*			trans	96.8	139.4	161	-152.2	0	0	0	0	121
95	G	29.6	Very low	35.2	Very low	66 Å²	66	147 Å²	147	68%	0.68	80%	0.801	S	S	*	*			trans	85.7	107.9	175	0	0	0	0	0	114.9
96	S	32.7	Very low	34.2	Very low	116 Å²	116	150.8 Å²	150.8	81%	0.811	80%	0.802	S	S	*	*			cis	53.1	119.5	40.5	-158.9	0	0	0	0	111
97	E	34.4	Very low	33.3	Very low	188 Å²	188	155.8 Å²	155.8	88%	0.879	81%	0.811	S	S	*	*				-137.4	175.5	56	-67.6	170.9	120.8	0	0	115.9
98	K	35.1	Very low	33.4	Very low	198 Å²	198	157.3 Å²	157.3	86%	0.861	81%	0.809	S	S	*	*			trans	-116.2	151.3	-178.8	-65.1	176.2	176.4	178.7	0	112.1
99	I	28.8	Very low	34	Very low	165 Å²	165	158.9 Å²	158.9	85%	0.846	81%	0.811	S	S	*	*			trans	-152.9	101.3	143.8	-133	73.4	0	0	0	107.1
100	S	27.3	Very low	33.5	Very low	89 Å²	89	157.4 Å²	157.4	62%	0.622	81%	0.809	S	S	*	*				57.4	92.8	99.6	-157.5	0	0	0	0	113.9
101	Q	31	Very low	33.8	Very low	180 Å²	180	154.9 Å²	154.9	84%	0.841	80%	0.804	S	S	*	*				60	117.9	89.5	-79.9	-170.2	-39.6	0	0	116
102	R	30.2	Very low	34.1	Very low	209 Å²	209	153.3 Å²	153.3	79%	0.789	81%	0.807	S	S	*	*				-158.4	135.6	119.9	-145.2	163.4	-177.1	-86.9	-8.9	111.4	E104	R102-E104 IonicContact CZ-OE1 2.69Å; R102-E104 VanDerWaalsContact NH1-CD 3.29Å; R102-E104 IonicContact NH1-OE1 2.77Å; R102-E104 PolarHBondContact NH1-OE1 3.48Å; R102-E104 IonicContact NH1-OE2 3.82Å; R102-E104 PolarHBondContact NH1-OE2 3.32Å; R102-E104 IonicContact NH2-OE1 3.44Å; R102-E104 PolarHBondContact NH2-OE1 3.01Å
103	E	36.7	Very low	34.5	Very low	174 Å²	174	154.6 Å²	154.6	81%	0.813	80%	0.801	S	S	*	*			trans	-93	153.6	170.7	-57.9	172.4	136.5	0	0	109.5
104	E	37.6	Very low	34.8	Very low	157 Å²	157	155.7 Å²	155.7	73%	0.734	80%	0.803	S	S	*	*			trans	-163.8	93.4	151.2	-112.8	156.7	-144.1	0	0	112.1	R102	R102-E104 IonicContact CZ-OE1 2.69Å; R102-E104 VanDerWaalsContact NH1-CD 3.29Å; R102-E104 IonicContact NH1-OE1 2.77Å; R102-E104 PolarHBondContact NH1-OE1 3.48Å; R102-E104 IonicContact NH1-OE2 3.82Å; R102-E104 PolarHBondContact NH1-OE2 3.32Å; R102-E104 IonicContact NH2-OE1 3.44Å; R102-E104 PolarHBondContact NH2-OE1 3.01Å
105	D	34.5	Very low	35.5	Very low	120 Å²	120	154.3 Å²	154.3	64%	0.642	79%	0.785	S	S	*	*			trans	19	141.2	137.7	-132.8	-2.4	0	0	0	123.2
106	R	35	Very low	36	Very low	204 Å²	204	160 Å²	160	77%	0.77	79%	0.793	S	S	*	*			trans	71.7	121.4	154.4	-61.3	161.2	-153.3	-179.7	12.2	121.1
107	R	31.7	Very low	36.3	Very low	238 Å²	238	162 Å²	162	90%	0.898	80%	0.795	S	S	*	*				150.1	136.5	89.8	-132.4	174.1	-171.9	178.2	0.7	111.8
108	S	40	Very low	36.8	Very low	113 Å²	113	156.9 Å²	156.9	79%	0.79	79%	0.785	S	S	*	*			trans	-67.2	161.6	168.7	-46.1	0	0	0	0	112.5
109	P	50.9	Low	37.1	Very low	130 Å²	130	154.9 Å²	154.9	84%	0.844	78%	0.777	S	S	*	*			trans	-120.2	166.6	137.6	35.5	-27.5	0	0	0	112.9
110	D	31.6	Very low	37.7	Very low	145 Å²	145	156.4 Å²	156.4	78%	0.775	78%	0.78	S	S	*	*			trans	-108.5	176.3	-162.1	-168.6	15.7	0	0	0	112.3
111	L	40.9	Very low	38.4	Very low	153 Å²	153	158.7 Å²	158.7	80%	0.801	78%	0.781	S	S	*	*			trans	-45.3	135.6	174.7	-72	147.1	0	0	0	114.2
112	Q	38.4	Very low	38.7	Very low	202 Å²	202	155.2 Å²	155.2	94%	0.944	78%	0.777	S	S	*	*			trans	-130.1	147.1	146.5	-73.5	-160.9	-68.9	0	0	111.2
113	K	37.3	Very low	39.3	Very low	165 Å²	165	149.1 Å²	149.1	72%	0.717	77%	0.77	S	S	*	*			trans	-112.4	138.8	-161.6	-179	-173.8	-177.7	-131	0	109.1	D115	K113-D115 WeakPolarHBondContact CE-OD1 3.39Å; K113-D115 VanDerWaalsContact CE-OD2 3.27Å; K113-D115 WeakPolarHBondContact CE-OD2 3.49Å; K113-D115 IonicContact NZ-OD1 2.73Å; K113-D115 PolarHBondContact NZ-OD1 3.46Å; K113-D115 IonicContact NZ-OD2 3.5Å; K113-D115 PolarHBondContact NZ-OD2 3.11Å
114	S	36.9	Very low	39.8	Very low	120 Å²	120	147.6 Å²	147.6	84%	0.839	77%	0.768	S	S	*	*			trans	-124.4	105.1	171.6	56.5	0	0	0	0	109.8
115	D	44.3	Very low	40.4	Very low	108 Å²	108	148.5 Å²	148.5	58%	0.578	78%	0.778	S	S	*	*			trans	-83.4	127.2	175.3	-65.2	-77.8	0	0	0	111.3	K113	K113-D115 WeakPolarHBondContact CE-OD1 3.39Å; K113-D115 VanDerWaalsContact CE-OD2 3.27Å; K113-D115 WeakPolarHBondContact CE-OD2 3.49Å; K113-D115 IonicContact NZ-OD1 2.73Å; K113-D115 PolarHBondContact NZ-OD1 3.46Å; K113-D115 IonicContact NZ-OD2 3.5Å; K113-D115 PolarHBondContact NZ-OD2 3.11Å
116	Q	39.8	Very low	41.1	Very low	186 Å²	186	148.9 Å²	148.9	87%	0.869	78%	0.78	S	S	*	*			trans	-179.7	126	158.8	-100.7	144.3	98.5	0	0	105.2
117	D	39.7	Very low	41.7	Very low	157 Å²	157	145.9 Å²	145.9	84%	0.84	78%	0.778	S	S	*	*				-160.5	177.4	62.7	-133.6	-59.9	0	0	0	113.6
118	A	44.6	Very low	42.1	Very low	82 Å²	82	140.7 Å²	140.7	68%	0.678	77%	0.773	S	S	*	*			trans	-67.2	137.4	179.9	0	0	0	0	0	112.5
119	K	42.7	Very low	42.5	Very low	156 Å²	156	143.5 Å²	143.5	68%	0.678	78%	0.779	S	S	*	*				48.3	101.9	79.4	-173	177.1	174.3	169.6	0	114.9	E121	K119-E121 WeakPolarHBondContact CE-OE1 3.29Å; K119-E121 WeakPolarHBondContact CE-OE2 3.38Å; K119-E121 IonicContact NZ-OE1 2.75Å; K119-E121 PolarHBondContact NZ-OE1 2.89Å; K119-E121 IonicContact NZ-OE2 2.62Å; K119-E121 PolarHBondContact NZ-OE2 3.15Å
120	E	40.2	Very low	42.5	Very low	197 Å²	197	144.2 Å²	144.2	92%	0.921	78%	0.775	S	S	*	*			trans	-141.4	146.4	139.8	-72.2	-161.7	156.2	0	0	110.7
121	E	42.1	Very low	43.4	Very low	137 Å²	137	145.8 Å²	145.8	64%	0.64	78%	0.778	S	S	*	*			trans	-121	159.1	174.3	64.3	-96.2	67.8	0	0	110.3	K119	K119-E121 WeakPolarHBondContact CE-OE1 3.29Å; K119-E121 WeakPolarHBondContact CE-OE2 3.38Å; K119-E121 IonicContact NZ-OE1 2.75Å; K119-E121 PolarHBondContact NZ-OE1 2.89Å; K119-E121 IonicContact NZ-OE2 2.62Å; K119-E121 PolarHBondContact NZ-OE2 3.15Å
122	S	37.9	Very low	43.9	Very low	107 Å²	107	143.6 Å²	143.6	75%	0.748	78%	0.776	S	S	*	*			cis	-155.9	-147.9	18.6	-160.5	0	0	0	0	110.4
123	A	42.8	Very low	44.6	Very low	80 Å²	80	141.1 Å²	141.1	66%	0.661	77%	0.769	S	S	*	*			trans	90.6	79.7	157.6	0	0	0	0	0	118.4
124	D	46.8	Very low	45.3	Very low	142 Å²	142	137.9 Å²	137.9	76%	0.759	77%	0.773	S	S	*	*				7.3	125.2	113	17.2	-68	0	0	0	118.4
125	D	50.3	Low	45.6	Very low	176 Å²	176	139.3 Å²	139.3	94%	0.941	77%	0.771	S	S	*	*			trans	-152.6	141.4	145.6	-114.6	-42.5	0	0	0	109.7
126	D	50	Low	45.6	Very low	129 Å²	129	140.1 Å²	140.1	69%	0.69	77%	0.771	S	S	*	*			trans	-132.1	157.6	-170.7	179.1	33.9	0	0	0	110.4
127	L	46	Very low	45.5	Very low	140 Å²	140	137 Å²	137	73%	0.733	77%	0.77	S	S	*	*			trans	68.7	153.6	178.6	-41.2	177.2	0	0	0	114.3
128	T	41.4	Very low	45.6	Very low	129 Å²	129	136.4 Å²	136.4	79%	0.791	76%	0.76	S	S	*	*			cis	-149.6	158.9	15.5	-31.8	0	0	0	0	110.6
129	L	48.9	Very low	45.4	Very low	172 Å²	172	141.8 Å²	141.8	90%	0.901	77%	0.768	S	S	*	*			trans	-62.4	140.7	161.6	-73.5	150.5	0	0	0	110.5
130	D	50.4	Low	45.2	Very low	145 Å²	145	140.9 Å²	140.9	78%	0.775	77%	0.766	S	S	*	*			trans	-134.9	131.6	150.7	-167.2	58.8	0	0	0	109.9	S132	D130-S132 PolarHBondContact OD2-OG 3.33Å
131	E	50.3	Low	45	Very low	179 Å²	179	136.5 Å²	136.5	84%	0.836	75%	0.753	S	S	*	*			trans	-106.3	121.7	178.5	-179	-172.4	150.3	0	0	106.7
132	S	51.7	Low	44.8	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	76%	0.757	S	S	*	*			trans	-135	95.2	173.9	-84.9	0	0	0	0	110.9	D130	D130-S132 PolarHBondContact OD2-OG 3.33Å
133	D	53.6	Low	44.9	Very low	150 Å²	150	140 Å²	140	80%	0.802	76%	0.762	S	S	*	*			trans	-64.6	133.7	160.8	176.6	53.2	0	0	0	110.9
134	A	51.5	Low	44.9	Very low	97 Å²	97	143.8 Å²	143.8	80%	0.802	77%	0.766	S	S	*	*			trans	-160.8	127.2	165.6	0	0	0	0	0	111.3
135	D	43.6	Very low	44.8	Very low	149 Å²	149	145 Å²	145	80%	0.797	77%	0.767	S	S	*	*			trans	-92.7	165.4	-168.1	-176.9	-137	0	0	0	114.9
136	E	42.6	Very low	44.4	Very low	125 Å²	125	143 Å²	143	58%	0.584	76%	0.756	S	S	*	*			trans	56.3	115.4	159.3	-96.8	-76.7	67.7	0	0	121.4	K138	E136-K138 PolarHBondContact OE1-N 3.42Å
137	S	38.5	Very low	43.7	Very low	121 Å²	121	148.6 Å²	148.6	85%	0.846	77%	0.768	S	S	*	*				-168.1	86.3	119.1	-84.3	0	0	0	0	112.2	K139	S137-K139 PolarHBondContact O-N 3.09Å
138	K	41.7	Very low	43.7	Very low	145 Å²	145	152.1 Å²	152.1	63%	0.63	77%	0.772	S	S	*	*			trans	-17.3	119.9	153.2	-168.8	170.8	-170.5	165.9	0	116.6	E136 E140	E136-K138 PolarHBondContact OE1-N 3.42Å; K138-E140 VanDerWaalsContact CE-CD 3.47Å; K138-E140 WeakPolarHBondContact CE-OE1 3.26Å; K138-E140 IonicContact NZ-OE1 2.62Å; K138-E140 PolarHBondContact NZ-OE1 2.93Å
139	K	39.9	Very low	43.8	Very low	194 Å²	194	157.4 Å²	157.4	84%	0.843	78%	0.777	S	S	*	*			trans	-145.1	90.2	152.2	-153.6	171.8	-170.3	176.8	0	112.2	S137	S137-K139 PolarHBondContact O-N 3.09Å
140	E	39.6	Very low	43.7	Very low	137 Å²	137	156.8 Å²	156.8	64%	0.64	77%	0.767	S	S	*	*			trans	-54	139.6	169.1	-68.5	154.2	179.8	0	0	110	K138	K138-E140 VanDerWaalsContact CE-CD 3.47Å; K138-E140 WeakPolarHBondContact CE-OE1 3.26Å; K138-E140 IonicContact NZ-OE1 2.62Å; K138-E140 PolarHBondContact NZ-OE1 2.93Å
141	T	35.2	Very low	43.9	Very low	105 Å²	105	155.8 Å²	155.8	64%	0.644	77%	0.768	S	S	*	*			trans	-143	80.5	169.1	-59.6	0	0	0	0	107.4	Q143	T141-Q143 PolarHBondContact O-N 3.34Å; T141-Q143 VanDerWaalsContact O-N 3.11Å
142	D	37.9	Very low	43.8	Very low	134 Å²	134	153 Å²	153	72%	0.717	76%	0.759	S	S	*	*			trans	-57.3	113	172.3	-67.6	-32	0	0	0	109.5
143	Q	39.8	Very low	43.9	Very low	185 Å²	185	156.8 Å²	156.8	86%	0.864	77%	0.765	S	S	*	*			trans	-131.9	47.8	164.8	-80.3	-173.2	93.7	0	0	109.7	T141	T141-Q143 PolarHBondContact O-N 3.34Å; T141-Q143 VanDerWaalsContact O-N 3.11Å
144	E	44	Very low	44	Very low	159 Å²	159	157.3 Å²	157.3	74%	0.743	77%	0.767	S	S	*	*			trans	-113.8	139	157.2	50	-170	131.1	0	0	108.2
145	E	43.1	Very low	44	Very low	166 Å²	166	158.2 Å²	158.2	78%	0.776	76%	0.759	S	S	*	*			trans	119.4	51.8	-172.7	-68	-77.9	177.6	0	0	115.2
146	D	42.2	Very low	44.4	Very low	134 Å²	134	157.3 Å²	157.3	72%	0.717	76%	0.76	S	S	*	*			trans	-133.5	55.5	156.6	-167.5	28	0	0	0	112.6
147	W	35.9	Very low	45	Very low	247 Å²	247	157.3 Å²	157.3	94%	0.936	76%	0.764	S	S	*	*	S	Bend	trans	-126.6	14	168.5	-67.2	113.5	0	0	0	112.9
148	R	45.9	Very low	45.8	Very low	215 Å²	215	160.1 Å²	160.1	81%	0.811	76%	0.761	S	S	*	*			trans	-117.6	30	-170.4	-80.8	-67.9	-166.9	-109.3	1.2	115
149	R	43.3	Very low	46.8	Very low	239 Å²	239	162 Å²	162	90%	0.902	77%	0.77	S	S	*	*			trans	-98.3	92.8	169.2	-140.7	178.2	-152.7	177.3	9.1	112.9
150	K	46.8	Very low	47.6	Very low	160 Å²	160	158.5 Å²	158.5	70%	0.696	77%	0.767	S	S	*	*			trans	-136.4	133.6	153.8	-145.5	-163.1	-175.4	-153.7	0	108.3	D152	K150-D152 WeakPolarHBondContact CE-OD1 3.49Å; K150-D152 IonicContact NZ-OD1 3.94Å; K150-D152 PolarHBondContact NZ-OD1 2.99Å; K150-D152 IonicContact NZ-OD2 2.93Å
151	P	53.9	Low	48.7	Very low	123 Å²	123	157.3 Å²	157.3	80%	0.799	77%	0.772	S	S	*	*				-122.9	163.8	116	2	18.3	0	0	0	111.8
152	D	49.4	Very low	50.1	Low	120 Å²	120	163.7 Å²	163.7	64%	0.642	79%	0.785	S	S	*	*			trans	-69.4	142	175.1	-69.5	-54.3	0	0	0	112.7	K150	K150-D152 WeakPolarHBondContact CE-OD1 3.49Å; K150-D152 IonicContact NZ-OD1 3.94Å; K150-D152 PolarHBondContact NZ-OD1 2.99Å; K150-D152 IonicContact NZ-OD2 2.93Å
153	E	52.9	Low	51.7	Low	187 Å²	187	166.6 Å²	166.6	87%	0.874	79%	0.791	S	S	*	*				-142.1	163.8	130	-81.9	-147.7	144	0	0	109.8
154	L	55.3	Low	53.6	Low	161 Å²	161	167.5 Å²	167.5	84%	0.843	79%	0.792	S	S	*	*			trans	-84.6	128.7	-152.9	-63.8	74.8	0	0	0	115.2
155	D	51.8	Low	55.3	Low	117 Å²	117	169.8 Å²	169.8	63%	0.626	80%	0.8	S	S	*	*			trans	-157.7	114.4	141.5	-173.2	-57.2	0	0	0	109.7	D157	D155-D157 PolarHBondContact OD1-N 3.39Å; D155-D157 VanDerWaalsContact OD1-N 3.08Å
156	P	53.6	Low	57.3	Low	129 Å²	129	168.2 Å²	168.2	84%	0.838	80%	0.801	S	S	*	*			trans	-104.4	29.3	-174.7	40.1	-35.5	0	0	0	115.3
157	D	54.5	Low	59.6	Low	125 Å²	125	172.6 Å²	172.6	67%	0.668	81%	0.808	S	S	*	*			trans	-142.2	44.2	178.6	-142.4	-10.2	0	0	0	118.4	D155	D155-D157 PolarHBondContact OD1-N 3.39Å; D155-D157 VanDerWaalsContact OD1-N 3.08Å
158	K	55.8	Low	62.1	Low	180 Å²	180	165.5 Å²	165.5	78%	0.783	79%	0.792	S	S	*	*			trans	-129.1	73.4	165.2	-67.6	-176.8	-175	160.9	0	113.2	P160	K158-P160 VanDerWaalsContact O-CD 3.3Å; K158-P160 WeakPolarHBondContact O-CD 3.4Å; K158-P160 VanDerWaalsContact O-N 3.13Å
159	K	61	Low	64.5	Low	186 Å²	186	161.7 Å²	161.7	81%	0.809	79%	0.792	S	S	*	*			trans	-48.3	117.2	161.5	-66.5	171.6	-175.4	167.1	0	108.8	C161	K159-C161 VanDerWaalsContact C-N 3.28Å; K159-C161 PolarHBondContact O-N 3.32Å
160	P	58.6	Low	67.1	Low	120 Å²	120	152.7 Å²	152.7	78%	0.779	76%	0.76	S	S	*	*			trans	-72.2	87.4	178.5	28.3	-33.4	0	0	0	109.2	K158 R162	K158-P160 VanDerWaalsContact O-CD 3.3Å; K158-P160 WeakPolarHBondContact O-CD 3.4Å; K158-P160 VanDerWaalsContact O-N 3.13Å; P160-R162 PolarHBondContact O-N 2.87Å
161	C	61.6	Low	69.5	Low	112 Å²	112	148.3 Å²	148.3	76%	0.757	75%	0.749	S	S	*	*			trans	-54.9	108.8	172.5	-175.2	0	0	0	0	107.9	K159 K163	K159-C161 VanDerWaalsContact C-N 3.28Å; K159-C161 PolarHBondContact O-N 3.32Å; C161-K163 VanDerWaalsContact C-N 3.33Å; C161-K163 PolarHBondContact O-N 3.1Å
162	R	64.7	Low	71.7	Confident	238 Å²	238	152.3 Å²	152.3	90%	0.898	75%	0.748	S	S	*	*			trans	-64.4	91.9	-173.3	-65	-173.9	-175.9	-164.6	2.2	109.2	P160 K164	P160-R162 PolarHBondContact O-N 2.87Å; R162-K164 PolarHBondContact O-N 3.48Å
163	K	72	Confident	74	Confident	196 Å²	196	149.8 Å²	149.8	85%	0.852	74%	0.74	S	S	*	*			trans	-55.3	111.9	-177.8	-63.3	-178.7	-177.7	177.3	0	108.9	C161 K165	C161-K163 VanDerWaalsContact C-N 3.33Å; C161-K163 PolarHBondContact O-N 3.1Å; K163-K165 PolarHBondContact O-N 3.3Å
164	K	78.5	Confident	76.2	Confident	203 Å²	203	142.7 Å²	142.7	88%	0.883	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-58.2	122.8	176.7	-73.4	177.5	177.5	173.9	0	108.2	R162 T166	R162-K164 PolarHBondContact O-N 3.48Å; K164-T166 PolarHBondContact O-N 3.02Å
165	K	79.9	Confident	78.2	Confident	208 Å²	208	136.6 Å²	136.6	90%	0.904	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-65.1	116.4	176.5	-68.8	177.7	175.9	-179.9	0	108.8	K163 R167	K163-K165 PolarHBondContact O-N 3.3Å; K165-R167 PolarHBondContact O-N 3.16Å
166	T	86.4	Confident	80.5	Confident	133 Å²	133	137.6 Å²	137.6	82%	0.816	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-56.9	135.4	173.6	-57.1	0	0	0	0	109.8	K164 T168	K164-T166 PolarHBondContact O-N 3.02Å; T166-T168 PolarHBondContact O-N 3.15Å
167	R	89.8	Confident	82.6	Confident	225 Å²	225	135 Å²	135	85%	0.849	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-68.4	123.6	179.5	-176.7	179.6	178.7	-159.1	-0.3	109.9	K165	K165-R167 PolarHBondContact O-N 3.16Å
168	T	89.1	Confident	84.7	Confident	98 Å²	98	129 Å²	129	60%	0.601	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-76.5	151.3	172.6	55.2	0	0	0	0	111.4	T166	T166-T168 PolarHBondContact O-N 3.15Å
169	V	95.3	Very high	86.8	Confident	135 Å²	135	123 Å²	123	82%	0.818	60%	0.595	S	S	*	*			trans	-120.6	137.6	176.3	-173.8	0	0	0	0	107.9
170	F	97.9	Very high	88.6	Confident	51 Å²	51	116.9 Å²	116.9	22%	0.224	58%	0.575	C	S	.	*			trans	-84.9	146.8	177.7	-57.4	-42.6	0	0	0	111.2	Q174 V175 L178 L202 Q206 W210	F170-Q174 HydrophobicContact CB-CB 4.29Å; F170-V175 HydrophobicContact CB-CG2 3.98Å; F170-L178 HydrophobicContact CD2-CD1 4.48Å; F170-L202 HydrophobicContact CD1-CD1 4.34Å; F170-L202 HydrophobicContact CD1-CD2 3.74Å; F170-L202 HydrophobicContact CE1-CD1 4.31Å; F170-L202 HydrophobicContact CE1-CD2 3.67Å; F170-Q206 HydrophobicContact CE1-CB 4.33Å; F170-Q206 HydrophobicContact CE1-CG 4.33Å; F170-Q206 HydrophobicContact CZ-CB 3.93Å; F170-Q206 HydrophobicContact CZ-CG 4.16Å; F170-W210 AromaticContact CD2-CD1 3.8Å; F170-W210 HydrophobicContact CE2-CB 4.35Å; F170-W210 AromaticContact CE2-CD1 3.74Å; F170-W210 HydrophobicContact CE2-CG 4.4Å
171	S	98.5	Very high	90.5	Very high	68 Å²	68	113.1 Å²	113.1	48%	0.476	55%	0.55	S	S	.	*			trans	-62.7	153.7	174.7	174.2	0	0	0	0	111.6	S173 Q174 V175	S171-S173 VanDerWaalsContact C-N 3.25Å; S171-S173 PolarHBondContact O-N 3.11Å; S171-Q174 WeakPolarHBondContact O-CB 3.4Å; S171-Q174 PolarHBondContact O-N 3.23Å; S171-Q174 VanDerWaalsContact O-N 3.1Å; S171-V175 WeakPolarHBondContact O-CG2 3.39Å; S171-V175 PolarHBondContact O-N 3.19Å
172	R	98.3	Very high	92.2	Very high	206 Å²	206	107.8 Å²	107.8	78%	0.777	51%	0.514	S	S	*	.	H	α-helix	trans	-57.5	-37.8	177.9	-175	61.6	179.1	-156.7	3.5	112.5	V175 F176	R172-V175 PolarHBondContact O-N 3.37Å; R172-F176 WeakPolarHBondContact O-CB 3.19Å; R172-F176 PolarHBondContact O-N 3.35Å
173	S	98.4	Very high	93.8	Very high	67 Å²	67	100.3 Å²	100.3	47%	0.469	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-42.4	176	176	0	0	0	0	112.1	S171 F176 Q177	S171-S173 VanDerWaalsContact C-N 3.25Å; S171-S173 PolarHBondContact O-N 3.11Å; S173-F176 PolarHBondContact O-N 3.45Å; S173-Q177 PolarHBondContact O-N 2.88Å; S173-Q177 VanDerWaalsContact O-N 3.08Å; S173-Q177 PolarHBondContact OG-NE2 3.1Å
174	Q	98.6	Very high	95.1	Very high	39 Å²	39	97.8 Å²	97.8	18%	0.182	49%	0.486	C	S	.	.	H	α-helix	trans	-62.1	-45.5	175.5	-68.1	171.4	-38.2	0	0	111	F170 S171 Q177 L178 L200	F170-Q174 HydrophobicContact CB-CB 4.29Å; S171-Q174 WeakPolarHBondContact O-CB 3.4Å; S171-Q174 PolarHBondContact O-N 3.23Å; S171-Q174 VanDerWaalsContact O-N 3.1Å; Q174-Q177 PolarHBondContact O-N 3.41Å; Q174-L178 WeakPolarHBondContact O-CB 3.42Å; Q174-L178 WeakPolarHBondContact O-CD1 3.16Å; Q174-L178 WeakPolarHBondContact O-CG 3.48Å; Q174-L178 PolarHBondContact O-N 2.93Å; Q174-L200 HydrophobicContact CG-CB 4.46Å; Q174-L200 PolarHBondContact NE2-O 3.38Å
175	V	98.6	Very high	96	Very high	33 Å²	33	92.2 Å²	92.2	20%	0.2	46%	0.462	C	S	.	.	H	α-helix	trans	-62.3	-43.8	177.3	176.6	0	0	0	0	111.4	F170 S171 R172 Q177 L178 E179	F170-V175 HydrophobicContact CB-CG2 3.98Å; S171-V175 WeakPolarHBondContact O-CG2 3.39Å; S171-V175 PolarHBondContact O-N 3.19Å; R172-V175 PolarHBondContact O-N 3.37Å; V175-Q177 PolarHBondContact O-N 3.43Å; V175-L178 PolarHBondContact O-N 3.48Å; V175-E179 HydrophobicContact CG1-CG 4.26Å; V175-E179 WeakPolarHBondContact O-CB 3.37Å; V175-E179 WeakPolarHBondContact O-CG 3.49Å; V175-E179 PolarHBondContact O-N 2.97Å
176	F	98.6	Very high	96.9	Very high	138 Å²	138	86.3 Å²	86.3	61%	0.605	43%	0.434	S	S	*	.	H	α-helix	trans	-59.3	-46.8	178.5	173.7	-101.4	0	0	0	112.5	R172 S173 E179 S180	R172-F176 WeakPolarHBondContact O-CB 3.19Å; R172-F176 PolarHBondContact O-N 3.35Å; S173-F176 PolarHBondContact O-N 3.45Å; F176-E179 PolarHBondContact O-N 2.62Å; F176-S180 WeakPolarHBondContact O-CB 3.37Å; F176-S180 PolarHBondContact O-N 2.89Å
177	Q	98.7	Very high	97.5	Very high	74 Å²	74	87.2 Å²	87.2	35%	0.346	42%	0.424	S	S	.	.	H	α-helix	trans	-66.1	-41.7	177.9	-69.8	-178.3	70.3	0	0	111.9	S173 Q174 V175 E179 S180 T181 L200	S173-Q177 PolarHBondContact O-N 2.88Å; S173-Q177 VanDerWaalsContact O-N 3.08Å; S173-Q177 PolarHBondContact OG-NE2 3.1Å; Q174-Q177 PolarHBondContact O-N 3.41Å; V175-Q177 PolarHBondContact O-N 3.43Å; Q177-E179 VanDerWaalsContact C-N 3.33Å; Q177-E179 PolarHBondContact O-N 2.8Å; Q177-S180 PolarHBondContact O-N 3.27Å; Q177-T181 PolarHBondContact O-N 2.89Å; Q177-T181 PolarHBondContact O-OG1 3.46Å; Q177-T181 VanDerWaalsContact O-OG1 3.09Å; Q177-L200 HydrophobicContact CB-CD1 4.44Å; Q177-L200 HydrophobicContact CB-CD2 3.74Å; Q177-L200 VanDerWaalsContact CD-CD2 3.4Å; Q177-L200 HydrophobicContact CG-CD2 4.16Å
178	L	98.8	Very high	97.9	Very high	0 Å²	0	77.8 Å²	77.8	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-60.2	-39.6	174	-72	165.1	0	0	0	112.5	F170 Q174 V175 F182 L196 L200 L202 V207 W210 F211	F170-L178 HydrophobicContact CD2-CD1 4.48Å; Q174-L178 WeakPolarHBondContact O-CB 3.42Å; Q174-L178 WeakPolarHBondContact O-CD1 3.16Å; Q174-L178 WeakPolarHBondContact O-CG 3.48Å; Q174-L178 PolarHBondContact O-N 2.93Å; V175-L178 PolarHBondContact O-N 3.48Å; L178-F182 WeakPolarHBondContact O-CB 3.38Å; L178-F182 PolarHBondContact O-N 3.3Å; L178-L196 HydrophobicContact CD2-CD2 3.98Å; L178-L196 HydrophobicContact CD2-CG 4.49Å; L178-L200 HydrophobicContact CD1-CD1 4.36Å; L178-L200 HydrophobicContact CD2-CD1 3.8Å; L178-L200 HydrophobicContact CG-CD1 3.67Å; L178-L202 HydrophobicContact CD1-CD1 4.2Å; L178-V207 HydrophobicContact CD2-CG1 4.2Å; L178-W210 VanDerWaalsContact C-CH2 3.47Å; L178-W210 HydrophobicContact CB-CD2 3.92Å; L178-W210 HydrophobicContact CB-CE3 3.88Å; L178-W210 HydrophobicContact CB-CH2 3.7Å; L178-W210 HydrophobicContact CB-CZ2 3.71Å; L178-W210 HydrophobicContact CB-CZ3 3.78Å; L178-W210 HydrophobicContact CD1-CD2 3.94Å; L178-W210 HydrophobicContact CD1-CG 3.91Å; L178-W210 HydrophobicContact CD2-CD2 4.37Å; L178-W210 HydrophobicContact CD2-CE3 4.23Å; L178-W210 HydrophobicContact CG-CD2 4.3Å; L178-W210 HydrophobicContact CG-CE3 4.45Å; L178-W210 WeakPolarHBondContact O-CH2 3.38Å; L178-W210 WeakPolarHBondContact O-CZ3 3.5Å; L178-F211 HydrophobicContact CD2-CD2 4.49Å; L178-F211 HydrophobicContact CD2-CE2 3.95Å
179	E	98.7	Very high	98.3	Very high	54 Å²	54	75.4 Å²	75.4	25%	0.252	38%	0.377	S	S	.	.	H	α-helix	trans	-68.4	-46.9	175.2	-71.6	-174.7	134.2	0	0	111.6	V175 F176 Q177 T181 F182 D183 W210 R214	V175-E179 HydrophobicContact CG1-CG 4.26Å; V175-E179 WeakPolarHBondContact O-CB 3.37Å; V175-E179 WeakPolarHBondContact O-CG 3.49Å; V175-E179 PolarHBondContact O-N 2.97Å; F176-E179 PolarHBondContact O-N 2.62Å; Q177-E179 VanDerWaalsContact C-N 3.33Å; Q177-E179 PolarHBondContact O-N 2.8Å; E179-T181 PolarHBondContact O-N 3.06Å; E179-F182 WeakPolarHBondContact O-CB 3.41Å; E179-F182 PolarHBondContact O-N 3.4Å; E179-F182 VanDerWaalsContact O-N 3.1Å; E179-D183 VanDerWaalsContact O-CG 3.29Å; E179-D183 PolarHBondContact O-N 3.26Å; E179-W210 HydrophobicContact CB-CH2 4.44Å; E179-W210 HydrophobicContact CG-CH2 3.72Å; E179-W210 HydrophobicContact CG-CZ2 3.71Å; E179-R214 IonicContact OE1-CZ 3.96Å; E179-R214 IonicContact OE1-NH1 3.72Å; E179-R214 PolarHBondContact OE1-NH1 3.34Å; E179-R214 IonicContact OE1-NH2 2.58Å
180	S	98.6	Very high	98.5	Very high	56 Å²	56	72.4 Å²	72.4	39%	0.392	36%	0.362	S	S	.	.	H	α-helix	trans	-57.1	-49.1	176.5	179.2	0	0	0	0	112.5	F176 Q177 F182 D183 I184	F176-S180 WeakPolarHBondContact O-CB 3.37Å; F176-S180 PolarHBondContact O-N 2.89Å; Q177-S180 PolarHBondContact O-N 3.27Å; S180-F182 VanDerWaalsContact C-N 3.31Å; S180-F182 PolarHBondContact O-N 2.93Å; S180-D183 PolarHBondContact O-N 3.38Å; S180-I184 PolarHBondContact O-N 2.95Å
181	T	98.5	Very high	98.5	Very high	41 Å²	41	74.3 Å²	74.3	25%	0.252	38%	0.382	S	S	.	.	H	α-helix	trans	-63.8	-36.9	175.4	-50.8	0	0	0	0	112	Q177 E179 I184 K185 L188 L196 F211	Q177-T181 PolarHBondContact O-N 2.89Å; Q177-T181 PolarHBondContact O-OG1 3.46Å; Q177-T181 VanDerWaalsContact O-OG1 3.09Å; E179-T181 PolarHBondContact O-N 3.06Å; T181-I184 PolarHBondContact O-N 3.27Å; T181-K185 PolarHBondContact O-N 3.35Å; T181-L188 HydrophobicContact CG2-CD2 4.15Å; T181-L196 HydrophobicContact CG2-CD2 4.08Å; T181-F211 HydrophobicContact CG2-CZ 4.33Å
182	F	98.8	Very high	98.5	Very high	1 Å²	1	74.6 Å²	74.6	0%	0.004	38%	0.376	C	S	.	.	H	α-helix	trans	-66	-40.1	178.4	178.8	-92.5	0	0	0	112.6	L178 E179 S180 I184 K185 R186 W210 F211 R214 R215 W218	L178-F182 WeakPolarHBondContact O-CB 3.38Å; L178-F182 PolarHBondContact O-N 3.3Å; E179-F182 WeakPolarHBondContact O-CB 3.41Å; E179-F182 PolarHBondContact O-N 3.4Å; E179-F182 VanDerWaalsContact O-N 3.1Å; S180-F182 VanDerWaalsContact C-N 3.31Å; S180-F182 PolarHBondContact O-N 2.93Å; F182-I184 VanDerWaalsContact C-N 3.25Å; F182-I184 PolarHBondContact O-N 2.88Å; F182-K185 CarbonylContact O-C 3.3Å; F182-K185 VanDerWaalsContact O-C 3.3Å; F182-K185 PolarHBondContact O-N 3.44Å; F182-R186 HydrophobicContact CE2-CB 4.07Å; F182-R186 HydrophobicContact CE2-CG 4.49Å; F182-R186 HydrophobicContact CZ-CB 4.28Å; F182-R186 HydrophobicContact CZ-CG 4.29Å; F182-R186 WeakPolarHBondContact O-CD 3.36Å; F182-R186 PolarHBondContact O-NE 3.02Å; F182-W210 HydrophobicContact CB-CH2 4.33Å; F182-W210 HydrophobicContact CB-CZ3 4.03Å; F182-W210 HydrophobicContact CD2-CZ3 4.5Å; F182-W210 HydrophobicContact CG-CZ3 4.41Å; F182-F211 HydrophobicContact CB-CE1 4.02Å; F182-F211 HydrophobicContact CB-CZ 4.16Å; F182-F211 AromaticContact CD2-CD1 3.78Å; F182-F211 HydrophobicContact CD2-CD1 3.78Å; F182-F211 AromaticContact CD2-CE1 3.75Å; F182-F211 HydrophobicContact CD2-CE1 3.75Å; F182-F211 HydrophobicContact CE2-CD1 4.49Å; F182-F211 HydrophobicContact CG-CE1 4.39Å; F182-R214 HydrophobicContact CB-CG 4.42Å; F182-R214 HydrophobicContact CD1-CG 3.55Å; F182-R214 HydrophobicContact CD2-CB 4.14Å; F182-R214 HydrophobicContact CD2-CG 3.53Å; F182-R214 HydrophobicContact CE1-CG 3.54Å; F182-R214 HydrophobicContact CE2-CB 4.05Å; F182-R214 HydrophobicContact CE2-CG 3.54Å; F182-R214 HydrophobicContact CG-CG 3.54Å; F182-R214 HydrophobicContact CZ-CB 4.36Å; F182-R214 HydrophobicContact CZ-CG 3.53Å; F182-R215 HydrophobicContact CE2-CG 3.78Å; F182-R215 HydrophobicContact CZ-CG 4.21Å; F182-W218 HydrophobicContact CE1-CD2 4.44Å; F182-W218 AromaticContact CE1-CE3 3.69Å; F182-W218 HydrophobicContact CE1-CE3 3.69Å; F182-W218 HydrophobicContact CE1-CZ3 4.24Å; F182-W218 HydrophobicContact CZ-CE3 4.33Å
183	D	98.4	Very high	98.5	Very high	80 Å²	80	66.9 Å²	66.9	43%	0.428	35%	0.347	S	S	.	.	H	α-helix	trans	-64	-35.5	-179.2	-67.5	-21	0	0	0	110.7	E179 S180 R186 R214	E179-D183 VanDerWaalsContact O-CG 3.29Å; E179-D183 PolarHBondContact O-N 3.26Å; S180-D183 PolarHBondContact O-N 3.38Å; D183-R186 PolarHBondContact O-NH2 3.38Å; D183-R214 IonicContact OD1-NH2 3.46Å
184	I	98.3	Very high	98.6	Very high	144 Å²	144	65.6 Å²	65.6	74%	0.738	34%	0.34	S	S	*	.	H	α-helix	trans	-68.4	-52.5	169.2	-58.8	166	0	0	0	111.7	S180 T181 F182	S180-I184 PolarHBondContact O-N 2.95Å; T181-I184 PolarHBondContact O-N 3.27Å; F182-I184 VanDerWaalsContact C-N 3.25Å; F182-I184 PolarHBondContact O-N 2.88Å
185	K	98.1	Very high	98.6	Very high	86 Å²	86	65.9 Å²	65.9	37%	0.374	35%	0.353	S	S	.	.			trans	-139.2	115.8	-173	-158.6	-176.5	-172.2	-175.8	0	112.6	T181 F182 Y187 L188 E192 F211	T181-K185 PolarHBondContact O-N 3.35Å; F182-K185 CarbonylContact O-C 3.3Å; F182-K185 VanDerWaalsContact O-C 3.3Å; F182-K185 PolarHBondContact O-N 3.44Å; K185-Y187 VanDerWaalsContact C-N 3.33Å; K185-Y187 WeakPolarHBondContact CD-O 3.43Å; K185-Y187 VanDerWaalsContact CE-O 3.25Å; K185-Y187 WeakPolarHBondContact CE-O 3.25Å; K185-Y187 WeakPolarHBondContact CG-O 3.42Å; K185-Y187 PolarHBondContact O-N 3.13Å; K185-L188 HydrophobicContact CB-CD2 4.26Å; K185-L188 HydrophobicContact CD-CD2 4.16Å; K185-E192 IonicContact NZ-OE1 3.36Å; K185-E192 PolarHBondContact NZ-OE1 3.38Å; K185-E192 IonicContact NZ-OE2 3.41Å; K185-E192 PolarHBondContact NZ-OE2 3Å; K185-F211 WeakPolarHBondContact O-CE1 3.23Å
186	R	98.2	Very high	98.6	Very high	83 Å²	83	65.2 Å²	65.2	31%	0.313	35%	0.349	S	S	.	.	S	Bend	trans	-75.3	-18	-174.7	-50.5	-62.7	150.7	79.4	0.9	114.7	F182 D183 R215	F182-R186 HydrophobicContact CE2-CB 4.07Å; F182-R186 HydrophobicContact CE2-CG 4.49Å; F182-R186 HydrophobicContact CZ-CB 4.28Å; F182-R186 HydrophobicContact CZ-CG 4.29Å; F182-R186 WeakPolarHBondContact O-CD 3.36Å; F182-R186 PolarHBondContact O-NE 3.02Å; D183-R186 PolarHBondContact O-NH2 3.38Å; R186-R215 VanDerWaalsContact O-CD 3.3Å; R186-R215 WeakPolarHBondContact O-CD 3.38Å
187	Y	98.4	Very high	98.6	Very high	153 Å²	153	58.9 Å²	58.9	60%	0.6	32%	0.322	S	S	*	.	S	Bend	trans	-135.9	121.6	-177.9	-65.9	-105.5	0	0	0	108.9	K185 R215	K185-Y187 VanDerWaalsContact C-N 3.33Å; K185-Y187 WeakPolarHBondContact CD-O 3.43Å; K185-Y187 VanDerWaalsContact CE-O 3.25Å; K185-Y187 WeakPolarHBondContact CE-O 3.25Å; K185-Y187 WeakPolarHBondContact CG-O 3.42Å; K185-Y187 PolarHBondContact O-N 3.13Å; Y187-R215 VanDerWaalsContact CZ-CD 3.46Å
188	L	98.5	Very high	98.6	Very high	27 Å²	27	58.6 Å²	58.6	14%	0.141	33%	0.332	C	S	.	.			trans	-99.6	139.2	178.1	-58.3	-174.1	0	0	0	111.6	T181 K185 E192 R193 L196 V207 F211	T181-L188 HydrophobicContact CG2-CD2 4.15Å; K185-L188 HydrophobicContact CB-CD2 4.26Å; K185-L188 HydrophobicContact CD-CD2 4.16Å; L188-E192 WeakPolarHBondContact CA-OE2 3.35Å; L188-E192 HydrophobicContact CB-CB 4.1Å; L188-E192 HydrophobicContact CD2-CB 4.3Å; L188-R193 PolarHBondContact O-NH2 2.81Å; L188-L196 HydrophobicContact CD1-CD2 3.84Å; L188-V207 HydrophobicContact CD1-CG1 4.43Å; L188-F211 HydrophobicContact CD1-CD1 4.41Å; L188-F211 HydrophobicContact CD1-CD2 4.25Å; L188-F211 HydrophobicContact CD1-CE1 3.87Å; L188-F211 HydrophobicContact CD1-CE2 3.71Å; L188-F211 HydrophobicContact CD1-CZ 3.51Å; L188-F211 HydrophobicContact CD2-CE1 4.12Å; L188-F211 HydrophobicContact CD2-CZ 4.32Å; L188-F211 HydrophobicContact CG-CD1 4.08Å; L188-F211 HydrophobicContact CG-CE1 3.65Å; L188-F211 HydrophobicContact CG-CE2 4.39Å; L188-F211 HydrophobicContact CG-CZ 3.84Å
189	S	98.6	Very high	98.5	Very high	47 Å²	47	62 Å²	62	33%	0.329	36%	0.356	S	S	.	.			trans	-62.4	177.4	166	82.6	0	0	0	0	111	S191 E192 R193	S189-S191 PolarHBondContact OG-N 3.35Å; S189-S191 PolarHBondContact OG-OG 3.1Å; S189-E192 WeakPolarHBondContact CB-OE2 3.2Å; S189-E192 PolarHBondContact N-OE2 3.23Å; S189-E192 WeakPolarHBondContact OG-CG 3.43Å; S189-E192 PolarHBondContact OG-N 3.09Å; S189-E192 VanDerWaalsContact OG-N 3.13Å; S189-E192 PolarHBondContact OG-OE2 3.05Å; S189-R193 WeakPolarHBondContact O-CB 3.32Å; S189-R193 PolarHBondContact O-N 3.25Å; S189-R193 PolarHBondContact O-NH2 3.27Å
190	S	98.5	Very high	98.5	Very high	72 Å²	72	59.7 Å²	59.7	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-71.1	-41.2	174.5	-131.1	0	0	0	0	112.8	R193 A194	S190-R193 PolarHBondContact O-N 2.87Å; S190-R193 PolarHBondContact OG-NH1 2.79Å; S190-A194 PolarHBondContact O-N 2.89Å
191	S	98.5	Very high	98.5	Very high	92 Å²	92	65.3 Å²	65.3	64%	0.643	37%	0.365	S	S	*	.	H	α-helix	trans	-64.9	-44.3	178.2	49.6	0	0	0	0	112.5	S189 R193 A194 G195	S189-S191 PolarHBondContact OG-N 3.35Å; S189-S191 PolarHBondContact OG-OG 3.1Å; S191-R193 VanDerWaalsContact C-N 3.27Å; S191-R193 PolarHBondContact O-N 2.88Å; S191-A194 PolarHBondContact O-N 3.16Å; S191-G195 PolarHBondContact O-N 2.9Å
192	E	98.6	Very high	98.5	Very high	73 Å²	73	64.4 Å²	64.4	34%	0.341	36%	0.359	S	S	.	.	H	α-helix	trans	-59.7	-39.2	175.5	-69.8	171.9	147.5	0	0	111.6	K185 L188 S189 L196	K185-E192 IonicContact NZ-OE1 3.36Å; K185-E192 PolarHBondContact NZ-OE1 3.38Å; K185-E192 IonicContact NZ-OE2 3.41Å; K185-E192 PolarHBondContact NZ-OE2 3Å; L188-E192 WeakPolarHBondContact CA-OE2 3.35Å; L188-E192 HydrophobicContact CB-CB 4.1Å; L188-E192 HydrophobicContact CD2-CB 4.3Å; S189-E192 WeakPolarHBondContact CB-OE2 3.2Å; S189-E192 PolarHBondContact N-OE2 3.23Å; S189-E192 WeakPolarHBondContact OG-CG 3.43Å; S189-E192 PolarHBondContact OG-N 3.09Å; S189-E192 VanDerWaalsContact OG-N 3.13Å; S189-E192 PolarHBondContact OG-OE2 3.05Å; E192-L196 WeakPolarHBondContact O-CB 3.32Å; E192-L196 PolarHBondContact O-N 2.86Å; E192-L196 VanDerWaalsContact O-N 3.1Å
193	R	98.8	Very high	98.5	Very high	44 Å²	44	68 Å²	68	17%	0.166	38%	0.381	C	S	.	.	H	α-helix	trans	-69.6	-40.8	178.1	-164.8	-170.1	-43.4	106.9	11.3	112.3	L188 S189 S190 S191 L196 A197 E204 V207	L188-R193 PolarHBondContact O-NH2 2.81Å; S189-R193 WeakPolarHBondContact O-CB 3.32Å; S189-R193 PolarHBondContact O-N 3.25Å; S189-R193 PolarHBondContact O-NH2 3.27Å; S190-R193 PolarHBondContact O-N 2.87Å; S190-R193 PolarHBondContact OG-NH1 2.79Å; S191-R193 VanDerWaalsContact C-N 3.27Å; S191-R193 PolarHBondContact O-N 2.88Å; R193-L196 PolarHBondContact O-N 3.13Å; R193-A197 WeakPolarHBondContact O-CB 3.48Å; R193-A197 PolarHBondContact O-N 3.29Å; R193-E204 VanDerWaalsContact CD-O 3.25Å; R193-E204 WeakPolarHBondContact CD-O 3.49Å; R193-E204 HydrophobicContact CG-CB 4.42Å; R193-E204 HydrophobicContact CG-CG 4.26Å; R193-E204 IonicContact CZ-OE2 2.75Å; R193-E204 IonicContact NH1-OE2 3.39Å; R193-E204 PolarHBondContact NH1-OE2 2.8Å; R193-V207 HydrophobicContact CG-CB 3.88Å; R193-V207 HydrophobicContact CG-CG1 3.76Å
194	A	98.8	Very high	98.5	Very high	40 Å²	40	67.8 Å²	67.8	33%	0.331	38%	0.377	S	S	.	.	H	α-helix	trans	-62.1	-45.1	175.9	0	0	0	0	0	111.3	S190 S191 A197 A198 E204	S190-A194 PolarHBondContact O-N 2.89Å; S191-A194 PolarHBondContact O-N 3.16Å; A194-A197 PolarHBondContact O-N 3.31Å; A194-A198 WeakPolarHBondContact O-CB 3.31Å; A194-A198 PolarHBondContact O-N 3.39Å; A194-E204 HydrophobicContact CB-CG 4.39Å
195	G	98.6	Very high	98.5	Very high	45 Å²	45	65.2 Å²	65.2	46%	0.464	37%	0.368	S	S	.	.	H	α-helix	trans	-59.8	-47.3	175.5	0	0	0	0	0	113.2	S191 A198 S199	S191-G195 PolarHBondContact O-N 2.9Å; G195-A198 PolarHBondContact O-N 3.06Å; G195-S199 PolarHBondContact O-N 2.9Å; G195-S199 VanDerWaalsContact O-N 3.11Å; G195-S199 PolarHBondContact O-OG 3.37Å
196	L	98.6	Very high	98.5	Very high	19 Å²	19	63.9 Å²	63.9	10%	0.099	36%	0.363	C	S	.	.	H	α-helix	trans	-70.2	-30.3	178.3	-170.7	62.8	0	0	0	113.1	L178 T181 L188 E192 R193 S199 L200 V207 F211	L178-L196 HydrophobicContact CD2-CD2 3.98Å; L178-L196 HydrophobicContact CD2-CG 4.49Å; T181-L196 HydrophobicContact CG2-CD2 4.08Å; L188-L196 HydrophobicContact CD1-CD2 3.84Å; E192-L196 WeakPolarHBondContact O-CB 3.32Å; E192-L196 PolarHBondContact O-N 2.86Å; E192-L196 VanDerWaalsContact O-N 3.1Å; R193-L196 PolarHBondContact O-N 3.13Å; L196-S199 PolarHBondContact O-OG 2.98Å; L196-L200 HydrophobicContact CD1-CD1 3.84Å; L196-L200 HydrophobicContact CD1-CG 4.12Å; L196-L200 HydrophobicContact CG-CD1 3.96Å; L196-L200 HydrophobicContact CG-CG 4.48Å; L196-L200 WeakPolarHBondContact O-CB 3.44Å; L196-L200 VanDerWaalsContact O-CG 3.24Å; L196-L200 WeakPolarHBondContact O-CG 3.4Å; L196-L200 PolarHBondContact O-N 3.26Å; L196-V207 HydrophobicContact CD2-CG1 4.11Å; L196-F211 HydrophobicContact CD2-CE2 3.94Å; L196-F211 HydrophobicContact CD2-CZ 4.27Å
197	A	98.8	Very high	98.5	Very high	5 Å²	5	60 Å²	60	4%	0.041	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-45.8	173.6	0	0	0	0	0	110.9	R193 A194 L200 H201 L202 E204 V207	R193-A197 WeakPolarHBondContact O-CB 3.48Å; R193-A197 PolarHBondContact O-N 3.29Å; A194-A197 PolarHBondContact O-N 3.31Å; A197-L200 PolarHBondContact O-N 3.46Å; A197-H201 PolarHBondContact O-N 3.25Å; A197-H201 VanDerWaalsContact O-N 3.17Å; A197-L202 CarbonylContact C-O 3.45Å; A197-L202 WeakPolarHBondContact CB-O 2.89Å; A197-L202 PolarHBondContact O-N 3.26Å; A197-L202 VanDerWaalsContact O-O 3.07Å; A197-E204 HydrophobicContact CB-CG 4.1Å; A197-V207 HydrophobicContact CB-CG2 4.02Å
198	A	98.6	Very high	98.5	Very high	68 Å²	68	59 Å²	59	56%	0.562	35%	0.348	S	S	*	.	H	α-helix	trans	-61.6	-48	178	0	0	0	0	0	112.6	A194 G195 L200 H201	A194-A198 WeakPolarHBondContact O-CB 3.31Å; A194-A198 PolarHBondContact O-N 3.39Å; G195-A198 PolarHBondContact O-N 3.06Å; A198-L200 VanDerWaalsContact C-N 3.3Å; A198-L200 PolarHBondContact O-N 2.81Å; A198-H201 PolarHBondContact O-N 3.38Å
199	S	98.4	Very high	98.5	Very high	71 Å²	71	62.2 Å²	62.2	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-67.9	-26.4	-178.3	65.4	0	0	0	0	114.2	G195 L196	G195-S199 PolarHBondContact O-N 2.9Å; G195-S199 VanDerWaalsContact O-N 3.11Å; G195-S199 PolarHBondContact O-OG 3.37Å; L196-S199 PolarHBondContact O-OG 2.98Å
200	L	98.2	Very high	98.5	Very high	6 Å²	6	61.5 Å²	61.5	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-96.9	-1.2	-179.9	-60.7	-175.7	0	0	0	114.2	Q174 Q177 L178 L196 A197 A198 L202	Q174-L200 HydrophobicContact CG-CB 4.46Å; Q174-L200 PolarHBondContact NE2-O 3.38Å; Q177-L200 HydrophobicContact CB-CD1 4.44Å; Q177-L200 HydrophobicContact CB-CD2 3.74Å; Q177-L200 VanDerWaalsContact CD-CD2 3.4Å; Q177-L200 HydrophobicContact CG-CD2 4.16Å; L178-L200 HydrophobicContact CD1-CD1 4.36Å; L178-L200 HydrophobicContact CD2-CD1 3.8Å; L178-L200 HydrophobicContact CG-CD1 3.67Å; L196-L200 HydrophobicContact CD1-CD1 3.84Å; L196-L200 HydrophobicContact CD1-CG 4.12Å; L196-L200 HydrophobicContact CG-CD1 3.96Å; L196-L200 HydrophobicContact CG-CG 4.48Å; L196-L200 WeakPolarHBondContact O-CB 3.44Å; L196-L200 VanDerWaalsContact O-CG 3.24Å; L196-L200 WeakPolarHBondContact O-CG 3.4Å; L196-L200 PolarHBondContact O-N 3.26Å; A197-L200 PolarHBondContact O-N 3.46Å; A198-L200 VanDerWaalsContact C-N 3.3Å; A198-L200 PolarHBondContact O-N 2.81Å; L200-L202 VanDerWaalsContact C-N 3.26Å; L200-L202 HydrophobicContact CB-CB 4.49Å; L200-L202 HydrophobicContact CB-CD1 4.05Å; L200-L202 HydrophobicContact CB-CG 4Å; L200-L202 HydrophobicContact CD1-CD1 4.3Å; L200-L202 PolarHBondContact O-N 3.35Å
201	H	98.4	Very high	98.5	Very high	175 Å²	175	58.5 Å²	58.5	81%	0.81	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	44.9	-169.1	-52.7	-57.8	0	0	0	112.6	A197 A198	A197-H201 PolarHBondContact O-N 3.25Å; A197-H201 VanDerWaalsContact O-N 3.17Å; A198-H201 PolarHBondContact O-N 3.38Å
202	L	98.1	Very high	98.5	Very high	22 Å²	22	58 Å²	58	12%	0.115	32%	0.319	C	S	.	.			trans	-115.7	162.8	175.1	-64.5	179.7	0	0	0	110	F170 L178 A197 L200 Q206 V207	F170-L202 HydrophobicContact CD1-CD1 4.34Å; F170-L202 HydrophobicContact CD1-CD2 3.74Å; F170-L202 HydrophobicContact CE1-CD1 4.31Å; F170-L202 HydrophobicContact CE1-CD2 3.67Å; L178-L202 HydrophobicContact CD1-CD1 4.2Å; A197-L202 CarbonylContact C-O 3.45Å; A197-L202 WeakPolarHBondContact CB-O 2.89Å; A197-L202 PolarHBondContact O-N 3.26Å; A197-L202 VanDerWaalsContact O-O 3.07Å; L200-L202 VanDerWaalsContact C-N 3.26Å; L200-L202 HydrophobicContact CB-CB 4.49Å; L200-L202 HydrophobicContact CB-CD1 4.05Å; L200-L202 HydrophobicContact CB-CG 4Å; L200-L202 HydrophobicContact CD1-CD1 4.3Å; L200-L202 PolarHBondContact O-N 3.35Å; L202-Q206 HydrophobicContact CB-CB 4.48Å; L202-V207 HydrophobicContact CB-CG2 4.23Å
203	T	98.5	Very high	98.5	Very high	76 Å²	76	59.2 Å²	59.2	47%	0.466	33%	0.328	S	S	.	.			trans	-81.6	149.6	168.3	61.5	0	0	0	0	110.9	T205 Q206 V207	T203-T205 PolarHBondContact O-N 3.43Å; T203-T205 VanDerWaalsContact O-N 3.15Å; T203-Q206 WeakPolarHBondContact O-CB 3.42Å; T203-Q206 PolarHBondContact O-N 2.79Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.14Å; T203-Q206 VanDerWaalsContact OG1-CD 3.28Å; T203-Q206 VanDerWaalsContact OG1-CG 3.26Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.41Å; T203-Q206 PolarHBondContact OG1-N 3.01Å; T203-Q206 PolarHBondContact OG1-OE1 3.29Å; T203-V207 PolarHBondContact O-N 2.95Å; T203-V207 VanDerWaalsContact O-N 3.11Å
204	E	98.6	Very high	98.5	Very high	76 Å²	76	58.9 Å²	58.9	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-51.2	-38.8	172.1	-85.3	-162.1	-113.6	0	0	112.9	R193 A194 A197 Q206 V207 K208	R193-E204 VanDerWaalsContact CD-O 3.25Å; R193-E204 WeakPolarHBondContact CD-O 3.49Å; R193-E204 HydrophobicContact CG-CB 4.42Å; R193-E204 HydrophobicContact CG-CG 4.26Å; R193-E204 IonicContact CZ-OE2 2.75Å; R193-E204 IonicContact NH1-OE2 3.39Å; R193-E204 PolarHBondContact NH1-OE2 2.8Å; A194-E204 HydrophobicContact CB-CG 4.39Å; A197-E204 HydrophobicContact CB-CG 4.1Å; E204-Q206 PolarHBondContact O-N 2.75Å; E204-V207 PolarHBondContact O-N 3.07Å; E204-K208 WeakPolarHBondContact O-CB 3.4Å; E204-K208 PolarHBondContact O-N 3.2Å
205	T	98.4	Very high	98.5	Very high	89 Å²	89	59.5 Å²	59.5	55%	0.546	32%	0.321	S	S	.	.	H	α-helix	trans	-64.6	-37.9	177.7	-62.9	0	0	0	0	112.1	T203 K208 I209	T203-T205 PolarHBondContact O-N 3.43Å; T203-T205 VanDerWaalsContact O-N 3.15Å; T205-K208 PolarHBondContact O-N 3.4Å; T205-I209 HydrophobicContact CG2-CD1 3.84Å; T205-I209 HydrophobicContact CG2-CG1 4.47Å; T205-I209 WeakPolarHBondContact O-CB 3.25Å; T205-I209 VanDerWaalsContact O-CG1 3.23Å; T205-I209 WeakPolarHBondContact O-CG1 3.33Å; T205-I209 PolarHBondContact O-N 3.44Å
206	Q	98.3	Very high	98.5	Very high	58 Å²	58	59.7 Å²	59.7	27%	0.271	31%	0.311	S	S	.	.	H	α-helix	trans	-64.6	-43.7	173.2	-77.4	162.7	-31.9	0	0	111.5	F170 L202 T203 E204 I209 W210	F170-Q206 HydrophobicContact CE1-CB 4.33Å; F170-Q206 HydrophobicContact CE1-CG 4.33Å; F170-Q206 HydrophobicContact CZ-CB 3.93Å; F170-Q206 HydrophobicContact CZ-CG 4.16Å; L202-Q206 HydrophobicContact CB-CB 4.48Å; T203-Q206 WeakPolarHBondContact O-CB 3.42Å; T203-Q206 PolarHBondContact O-N 2.79Å; T203-Q206 WeakPolarHBondContact OG1-CB 3.14Å; T203-Q206 VanDerWaalsContact OG1-CD 3.28Å; T203-Q206 VanDerWaalsContact OG1-CG 3.26Å; T203-Q206 WeakPolarHBondContact OG1-CG 3.41Å; T203-Q206 PolarHBondContact OG1-N 3.01Å; T203-Q206 PolarHBondContact OG1-OE1 3.29Å; E204-Q206 PolarHBondContact O-N 2.75Å; Q206-I209 PolarHBondContact O-N 2.62Å; Q206-W210 WeakPolarHBondContact O-CB 3.49Å; Q206-W210 PolarHBondContact O-N 2.97Å
207	V	98.7	Very high	98.5	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.006	33%	0.326	C	S	.	.	H	α-helix	trans	-62.8	-45.5	175.3	-177.4	0	0	0	0	110.7	L178 L188 R193 L196 A197 L202 T203 E204 I209 W210 F211	L178-V207 HydrophobicContact CD2-CG1 4.2Å; L188-V207 HydrophobicContact CD1-CG1 4.43Å; R193-V207 HydrophobicContact CG-CB 3.88Å; R193-V207 HydrophobicContact CG-CG1 3.76Å; L196-V207 HydrophobicContact CD2-CG1 4.11Å; A197-V207 HydrophobicContact CB-CG2 4.02Å; L202-V207 HydrophobicContact CB-CG2 4.23Å; T203-V207 PolarHBondContact O-N 2.95Å; T203-V207 VanDerWaalsContact O-N 3.11Å; E204-V207 PolarHBondContact O-N 3.07Å; V207-I209 PolarHBondContact O-N 3.22Å; V207-W210 PolarHBondContact O-N 2.96Å; V207-F211 HydrophobicContact CG1-CD2 3.81Å; V207-F211 HydrophobicContact CG1-CE2 3.97Å; V207-F211 WeakPolarHBondContact O-CD2 3.27Å; V207-F211 PolarHBondContact O-N 2.92Å
208	K	98.5	Very high	98.4	Very high	134 Å²	134	67.5 Å²	67.5	58%	0.583	34%	0.341	S	S	*	.	H	α-helix	trans	-55.8	-48.8	175.4	-178.8	177.4	178	176.9	0	111.8	E204 T205 Q212	E204-K208 WeakPolarHBondContact O-CB 3.4Å; E204-K208 PolarHBondContact O-N 3.2Å; T205-K208 PolarHBondContact O-N 3.4Å; K208-Q212 WeakPolarHBondContact O-CB 3.43Å; K208-Q212 PolarHBondContact O-N 3.26Å
209	I	98.5	Very high	98.3	Very high	93 Å²	93	71 Å²	71	48%	0.477	34%	0.344	S	S	.	.	H	α-helix	trans	-64.9	-42.6	178.4	-70.7	167.4	0	0	0	110.7	T205 Q206 V207 Q212 N213	T205-I209 HydrophobicContact CG2-CD1 3.84Å; T205-I209 HydrophobicContact CG2-CG1 4.47Å; T205-I209 WeakPolarHBondContact O-CB 3.25Å; T205-I209 VanDerWaalsContact O-CG1 3.23Å; T205-I209 WeakPolarHBondContact O-CG1 3.33Å; T205-I209 PolarHBondContact O-N 3.44Å; Q206-I209 PolarHBondContact O-N 2.62Å; V207-I209 PolarHBondContact O-N 3.22Å; I209-Q212 PolarHBondContact O-N 3.05Å; I209-N213 WeakPolarHBondContact O-CB 3.33Å; I209-N213 VanDerWaalsContact O-CG 3.28Å; I209-N213 PolarHBondContact O-N 3.23Å; I209-N213 PolarHBondContact O-ND2 3.46Å
210	W	98.6	Very high	98.2	Very high	33 Å²	33	75.7 Å²	75.7	13%	0.125	35%	0.35	C	S	.	.	H	α-helix	trans	-62.3	-48.1	178	-170.1	99.1	0	0	0	111.4	F170 L178 E179 F182 Q206 V207 Q212 N213 R214	F170-W210 AromaticContact CD2-CD1 3.8Å; F170-W210 HydrophobicContact CE2-CB 4.35Å; F170-W210 AromaticContact CE2-CD1 3.74Å; F170-W210 HydrophobicContact CE2-CG 4.4Å; L178-W210 VanDerWaalsContact C-CH2 3.47Å; L178-W210 HydrophobicContact CB-CD2 3.92Å; L178-W210 HydrophobicContact CB-CE3 3.88Å; L178-W210 HydrophobicContact CB-CH2 3.7Å; L178-W210 HydrophobicContact CB-CZ2 3.71Å; L178-W210 HydrophobicContact CB-CZ3 3.78Å; L178-W210 HydrophobicContact CD1-CD2 3.94Å; L178-W210 HydrophobicContact CD1-CG 3.91Å; L178-W210 HydrophobicContact CD2-CD2 4.37Å; L178-W210 HydrophobicContact CD2-CE3 4.23Å; L178-W210 HydrophobicContact CG-CD2 4.3Å; L178-W210 HydrophobicContact CG-CE3 4.45Å; L178-W210 WeakPolarHBondContact O-CH2 3.38Å; L178-W210 WeakPolarHBondContact O-CZ3 3.5Å; E179-W210 HydrophobicContact CB-CH2 4.44Å; E179-W210 HydrophobicContact CG-CH2 3.72Å; E179-W210 HydrophobicContact CG-CZ2 3.71Å; F182-W210 HydrophobicContact CB-CH2 4.33Å; F182-W210 HydrophobicContact CB-CZ3 4.03Å; F182-W210 HydrophobicContact CD2-CZ3 4.5Å; F182-W210 HydrophobicContact CG-CZ3 4.41Å; Q206-W210 WeakPolarHBondContact O-CB 3.49Å; Q206-W210 PolarHBondContact O-N 2.97Å; V207-W210 PolarHBondContact O-N 2.96Å; W210-Q212 VanDerWaalsContact C-N 3.31Å; W210-Q212 PolarHBondContact O-N 3.1Å; W210-N213 PolarHBondContact O-N 3.43Å; W210-N213 VanDerWaalsContact O-N 3.16Å; W210-R214 HydrophobicContact CE3-CB 4.03Å; W210-R214 HydrophobicContact CH2-CB 4.03Å; W210-R214 HydrophobicContact CH2-CG 3.77Å; W210-R214 HydrophobicContact CZ3-CB 3.72Å; W210-R214 HydrophobicContact CZ3-CG 3.77Å; W210-R214 WeakPolarHBondContact O-CB 3.38Å; W210-R214 PolarHBondContact O-N 3.47Å
211	F	98.8	Very high	98	Very high	8 Å²	8	79.1 Å²	79.1	4%	0.035	37%	0.366	C	S	.	.	H	α-helix	trans	-63.1	-34.4	176.5	-91.1	-102.6	0	0	0	112.7	L178 T181 F182 K185 L188 L196 V207 R215	L178-F211 HydrophobicContact CD2-CD2 4.49Å; L178-F211 HydrophobicContact CD2-CE2 3.95Å; T181-F211 HydrophobicContact CG2-CZ 4.33Å; F182-F211 HydrophobicContact CB-CE1 4.02Å; F182-F211 HydrophobicContact CB-CZ 4.16Å; F182-F211 AromaticContact CD2-CD1 3.78Å; F182-F211 HydrophobicContact CD2-CD1 3.78Å; F182-F211 AromaticContact CD2-CE1 3.75Å; F182-F211 HydrophobicContact CD2-CE1 3.75Å; F182-F211 HydrophobicContact CE2-CD1 4.49Å; F182-F211 HydrophobicContact CG-CE1 4.39Å; K185-F211 WeakPolarHBondContact O-CE1 3.23Å; L188-F211 HydrophobicContact CD1-CD1 4.41Å; L188-F211 HydrophobicContact CD1-CD2 4.25Å; L188-F211 HydrophobicContact CD1-CE1 3.87Å; L188-F211 HydrophobicContact CD1-CE2 3.71Å; L188-F211 HydrophobicContact CD1-CZ 3.51Å; L188-F211 HydrophobicContact CD2-CE1 4.12Å; L188-F211 HydrophobicContact CD2-CZ 4.32Å; L188-F211 HydrophobicContact CG-CD1 4.08Å; L188-F211 HydrophobicContact CG-CE1 3.65Å; L188-F211 HydrophobicContact CG-CE2 4.39Å; L188-F211 HydrophobicContact CG-CZ 3.84Å; L196-F211 HydrophobicContact CD2-CE2 3.94Å; L196-F211 HydrophobicContact CD2-CZ 4.27Å; V207-F211 HydrophobicContact CG1-CD2 3.81Å; V207-F211 HydrophobicContact CG1-CE2 3.97Å; V207-F211 WeakPolarHBondContact O-CD2 3.27Å; V207-F211 PolarHBondContact O-N 2.92Å; F211-R215 WeakPolarHBondContact O-CG 3.11Å; F211-R215 PolarHBondContact O-N 2.97Å; F211-R215 PolarHBondContact O-NE 3.22Å
212	Q	98.7	Very high	97.7	Very high	82 Å²	82	75.1 Å²	75.1	38%	0.383	35%	0.35	S	S	.	.	H	α-helix	trans	-68.1	-41	173.5	-170.7	59.7	65.3	0	0	112	K208 I209 W210 N216	K208-Q212 WeakPolarHBondContact O-CB 3.43Å; K208-Q212 PolarHBondContact O-N 3.26Å; I209-Q212 PolarHBondContact O-N 3.05Å; W210-Q212 VanDerWaalsContact C-N 3.31Å; W210-Q212 PolarHBondContact O-N 3.1Å; Q212-N216 PolarHBondContact NE2-ND2 2.96Å; Q212-N216 PolarHBondContact O-N 3.4Å; Q212-N216 VanDerWaalsContact O-N 3.13Å; Q212-N216 PolarHBondContact O-ND2 3.22Å
213	N	98.4	Very high	97.4	Very high	99 Å²	99	76.7 Å²	76.7	53%	0.529	37%	0.366	S	S	.	.	H	α-helix	trans	-67.6	-40.5	175.7	-72.4	-26.3	0	0	0	111.7	I209 W210 N216 K217	I209-N213 WeakPolarHBondContact O-CB 3.33Å; I209-N213 VanDerWaalsContact O-CG 3.28Å; I209-N213 PolarHBondContact O-N 3.23Å; I209-N213 PolarHBondContact O-ND2 3.46Å; W210-N213 PolarHBondContact O-N 3.43Å; W210-N213 VanDerWaalsContact O-N 3.16Å; N213-N216 PolarHBondContact O-N 2.98Å; N213-K217 PolarHBondContact O-N 3.08Å
214	R	98.6	Very high	97.1	Very high	36 Å²	36	75.9 Å²	75.9	14%	0.136	37%	0.368	C	S	.	.	H	α-helix	trans	-63.2	-46.2	177.4	-174.9	65.1	179.1	-163.7	-4.2	111.8	E179 F182 D183 W210 N216 K217 W218	E179-R214 IonicContact OE1-CZ 3.96Å; E179-R214 IonicContact OE1-NH1 3.72Å; E179-R214 PolarHBondContact OE1-NH1 3.34Å; E179-R214 IonicContact OE1-NH2 2.58Å; F182-R214 HydrophobicContact CB-CG 4.42Å; F182-R214 HydrophobicContact CD1-CG 3.55Å; F182-R214 HydrophobicContact CD2-CB 4.14Å; F182-R214 HydrophobicContact CD2-CG 3.53Å; F182-R214 HydrophobicContact CE1-CG 3.54Å; F182-R214 HydrophobicContact CE2-CB 4.05Å; F182-R214 HydrophobicContact CE2-CG 3.54Å; F182-R214 HydrophobicContact CG-CG 3.54Å; F182-R214 HydrophobicContact CZ-CB 4.36Å; F182-R214 HydrophobicContact CZ-CG 3.53Å; D183-R214 IonicContact OD1-NH2 3.46Å; W210-R214 HydrophobicContact CE3-CB 4.03Å; W210-R214 HydrophobicContact CH2-CB 4.03Å; W210-R214 HydrophobicContact CH2-CG 3.77Å; W210-R214 HydrophobicContact CZ3-CB 3.72Å; W210-R214 HydrophobicContact CZ3-CG 3.77Å; W210-R214 WeakPolarHBondContact O-CB 3.38Å; W210-R214 PolarHBondContact O-N 3.47Å; R214-N216 VanDerWaalsContact C-N 3.34Å; R214-N216 PolarHBondContact O-N 3.34Å; R214-K217 PolarHBondContact O-N 3.41Å; R214-W218 WeakPolarHBondContact O-CB 3.48Å; R214-W218 PolarHBondContact O-N 2.83Å
215	R	98.6	Very high	96.6	Very high	54 Å²	54	77.8 Å²	77.8	20%	0.204	38%	0.377	C	S	.	.	H	α-helix	trans	-59.7	-40.4	172.6	-75.1	-179.2	-77.5	137.4	3.3	112.8	F182 R186 Y187 F211 W218 K219	F182-R215 HydrophobicContact CE2-CG 3.78Å; F182-R215 HydrophobicContact CZ-CG 4.21Å; R186-R215 VanDerWaalsContact O-CD 3.3Å; R186-R215 WeakPolarHBondContact O-CD 3.38Å; Y187-R215 VanDerWaalsContact CZ-CD 3.46Å; F211-R215 WeakPolarHBondContact O-CG 3.11Å; F211-R215 PolarHBondContact O-N 2.97Å; F211-R215 PolarHBondContact O-NE 3.22Å; R215-W218 PolarHBondContact O-N 2.95Å; R215-K219 WeakPolarHBondContact O-CB 3.47Å; R215-K219 PolarHBondContact O-N 3.41Å
216	N	98.4	Very high	96.1	Very high	48 Å²	48	79.3 Å²	79.3	26%	0.257	38%	0.38	S	S	.	.	H	α-helix	trans	-66.6	-38.6	175.8	-83.4	-64.2	0	0	0	112.7	Q212 N213 R214 R220	Q212-N216 PolarHBondContact NE2-ND2 2.96Å; Q212-N216 PolarHBondContact O-N 3.4Å; Q212-N216 VanDerWaalsContact O-N 3.13Å; Q212-N216 PolarHBondContact O-ND2 3.22Å; N213-N216 PolarHBondContact O-N 2.98Å; R214-N216 VanDerWaalsContact C-N 3.34Å; R214-N216 PolarHBondContact O-N 3.34Å; N216-R220 WeakPolarHBondContact O-CG 3.48Å; N216-R220 PolarHBondContact O-N 3.5Å
217	K	97.8	Very high	95.4	Very high	98 Å²	98	82 Å²	82	43%	0.426	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-49.4	173.2	-171.1	-171.1	171.2	-174	0	110.8	N213 R214 K219 R220 Q221	N213-K217 PolarHBondContact O-N 3.08Å; R214-K217 PolarHBondContact O-N 3.41Å; K217-K219 PolarHBondContact O-N 2.99Å; K217-R220 WeakPolarHBondContact O-CB 3.3Å; K217-R220 PolarHBondContact O-N 2.9Å; K217-R220 VanDerWaalsContact O-N 3.1Å; K217-Q221 WeakPolarHBondContact O-CG 3.46Å; K217-Q221 PolarHBondContact O-N 3.37Å
218	W	97	Very high	94.8	Very high	91 Å²	91	84.8 Å²	84.8	35%	0.345	42%	0.416	S	S	.	.	H	α-helix	trans	-52.8	-51.5	176.4	-178.4	-72	0	0	0	112	F182 R214 R215 R220 Q221 L222	F182-W218 HydrophobicContact CE1-CD2 4.44Å; F182-W218 AromaticContact CE1-CE3 3.69Å; F182-W218 HydrophobicContact CE1-CE3 3.69Å; F182-W218 HydrophobicContact CE1-CZ3 4.24Å; F182-W218 HydrophobicContact CZ-CE3 4.33Å; R214-W218 WeakPolarHBondContact O-CB 3.48Å; R214-W218 PolarHBondContact O-N 2.83Å; R215-W218 PolarHBondContact O-N 2.95Å; W218-R220 VanDerWaalsContact C-N 3.26Å; W218-R220 PolarHBondContact O-N 3.12Å; W218-Q221 WeakPolarHBondContact O-CB 3.5Å; W218-Q221 PolarHBondContact O-N 3.32Å; W218-L222 PolarHBondContact O-N 3.48Å; W218-L222 VanDerWaalsContact O-N 3.08Å
219	K	97	Very high	93.9	Very high	142 Å²	142	80.8 Å²	80.8	62%	0.617	41%	0.408	S	S	*	.	H	α-helix	trans	-58.4	-36.8	179	-172.9	175.1	66.8	170.2	0	112.6	R215 K217 A223	R215-K219 WeakPolarHBondContact O-CB 3.47Å; R215-K219 PolarHBondContact O-N 3.41Å; K217-K219 PolarHBondContact O-N 2.99Å; K219-A223 PolarHBondContact O-N 3.2Å
220	R	95.8	Very high	92.8	Very high	168 Å²	168	81 Å²	81	63%	0.634	41%	0.41	S	S	*	.	H	α-helix	trans	-71.7	-33.5	175.7	-71.5	172.6	-179.5	148.9	-0.3	112.8	N216 K217 W218 A224	N216-R220 WeakPolarHBondContact O-CG 3.48Å; N216-R220 PolarHBondContact O-N 3.5Å; K217-R220 WeakPolarHBondContact O-CB 3.3Å; K217-R220 PolarHBondContact O-N 2.9Å; K217-R220 VanDerWaalsContact O-N 3.1Å; W218-R220 VanDerWaalsContact C-N 3.26Å; W218-R220 PolarHBondContact O-N 3.12Å; R220-A224 WeakPolarHBondContact O-CB 3.32Å; R220-A224 PolarHBondContact O-N 3.11Å
221	Q	94.8	Very high	91.7	Very high	79 Å²	79	86 Å²	86	37%	0.369	44%	0.437	S	S	.	.	H	α-helix	trans	-65	-49.9	175.7	-69.4	171.6	-87.7	0	0	110.5	K217 W218 A223 A224 E225	K217-Q221 WeakPolarHBondContact O-CG 3.46Å; K217-Q221 PolarHBondContact O-N 3.37Å; W218-Q221 WeakPolarHBondContact O-CB 3.5Å; W218-Q221 PolarHBondContact O-N 3.32Å; Q221-A223 VanDerWaalsContact C-N 3.31Å; Q221-A223 PolarHBondContact O-N 3.16Å; Q221-A224 PolarHBondContact O-N 3.44Å; Q221-A224 VanDerWaalsContact O-N 3.12Å; Q221-E225 WeakPolarHBondContact O-CG 3.33Å; Q221-E225 PolarHBondContact O-N 3.43Å
222	L	92.6	Very high	90.4	Very high	90 Å²	90	88.8 Å²	88.8	47%	0.471	46%	0.457	S	S	.	.	H	α-helix	trans	-57.9	-41.3	175.6	-63.8	-174.6	0	0	0	112.9	W218 E225 L226	W218-L222 PolarHBondContact O-N 3.48Å; W218-L222 VanDerWaalsContact O-N 3.08Å; L222-E225 PolarHBondContact O-N 2.77Å; L222-L226 PolarHBondContact O-N 3.5Å; L222-L226 VanDerWaalsContact O-N 3.16Å
223	A	91.8	Very high	88.6	Confident	55 Å²	55	90.8 Å²	90.8	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-65.7	-42.1	176.3	0	0	0	0	0	112.2	K219 Q221 L226 E227	K219-A223 PolarHBondContact O-N 3.2Å; Q221-A223 VanDerWaalsContact C-N 3.31Å; Q221-A223 PolarHBondContact O-N 3.16Å; A223-L226 PolarHBondContact O-N 3.36Å; A223-E227 WeakPolarHBondContact O-CG 2.97Å; A223-E227 PolarHBondContact O-N 2.69Å; A223-E227 VanDerWaalsContact O-N 3.11Å
224	A	91.4	Very high	87	Confident	60 Å²	60	88.9 Å²	88.9	50%	0.496	46%	0.464	S	S	.	.	H	α-helix	trans	-67.5	-34.2	177.9	0	0	0	0	0	112.8	R220 Q221 A228	R220-A224 WeakPolarHBondContact O-CB 3.32Å; R220-A224 PolarHBondContact O-N 3.11Å; Q221-A224 PolarHBondContact O-N 3.44Å; Q221-A224 VanDerWaalsContact O-N 3.12Å; A224-A228 VanDerWaalsContact O-CB 3.32Å; A224-A228 WeakPolarHBondContact O-CB 3.33Å; A224-A228 PolarHBondContact O-N 2.87Å
225	E	88.9	Confident	85.2	Confident	116 Å²	116	89.3 Å²	89.3	54%	0.542	48%	0.475	S	S	.	.	H	α-helix	trans	-65.3	-41.1	174.5	-74.8	162.3	-166.5	0	0	111.5	Q221 L222 A228 A229	Q221-E225 WeakPolarHBondContact O-CG 3.33Å; Q221-E225 PolarHBondContact O-N 3.43Å; L222-E225 PolarHBondContact O-N 2.77Å; E225-A228 PolarHBondContact O-N 3.22Å; E225-A229 WeakPolarHBondContact O-CB 2.8Å; E225-A229 PolarHBondContact O-N 2.97Å
226	L	86	Confident	83.4	Confident	120 Å²	120	90.8 Å²	90.8	63%	0.628	50%	0.499	S	S	*	.	H	α-helix	trans	-63.4	-46	174.6	-176.8	64	0	0	0	112.2	L222 A223 A228 A229 N230	L222-L226 PolarHBondContact O-N 3.5Å; L222-L226 VanDerWaalsContact O-N 3.16Å; A223-L226 PolarHBondContact O-N 3.36Å; L226-A228 VanDerWaalsContact C-N 3.35Å; L226-A228 PolarHBondContact O-N 3.21Å; L226-A229 PolarHBondContact O-N 3.4Å; L226-N230 WeakPolarHBondContact O-CB 3.47Å; L226-N230 PolarHBondContact O-N 3.09Å
227	E	85.4	Confident	81.6	Confident	115 Å²	115	95.5 Å²	95.5	54%	0.537	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-38.2	176.6	-68.6	-55.8	137.9	0	0	112.3	A223 N230 M231	A223-E227 WeakPolarHBondContact O-CG 2.97Å; A223-E227 PolarHBondContact O-N 2.69Å; A223-E227 VanDerWaalsContact O-N 3.11Å; E227-N230 PolarHBondContact O-N 3.38Å; E227-M231 WeakPolarHBondContact O-CB 3.45Å; E227-M231 PolarHBondContact O-N 3.44Å
228	A	84.3	Confident	79.7	Confident	60 Å²	60	100.2 Å²	100.2	50%	0.496	54%	0.535	S	S	.	.	H	α-helix	trans	-65.2	-42.4	175.4	0	0	0	0	0	112	A224 E225 L226 M231 S232	A224-A228 VanDerWaalsContact O-CB 3.32Å; A224-A228 WeakPolarHBondContact O-CB 3.33Å; A224-A228 PolarHBondContact O-N 2.87Å; E225-A228 PolarHBondContact O-N 3.22Å; L226-A228 VanDerWaalsContact C-N 3.35Å; L226-A228 PolarHBondContact O-N 3.21Å; A228-M231 PolarHBondContact O-N 3.14Å; A228-S232 PolarHBondContact O-N 3.4Å
229	A	80.3	Confident	77.9	Confident	49 Å²	49	102.3 Å²	102.3	41%	0.405	55%	0.551	S	S	.	*	H	α-helix	trans	-60.9	-48	174.1	0	0	0	0	0	111.2	E225 L226 M231 S232 H233	E225-A229 WeakPolarHBondContact O-CB 2.8Å; E225-A229 PolarHBondContact O-N 2.97Å; L226-A229 PolarHBondContact O-N 3.4Å; A229-M231 PolarHBondContact O-N 2.88Å; A229-S232 WeakPolarHBondContact O-CB 3.1Å; A229-S232 PolarHBondContact O-N 2.89Å; A229-S232 VanDerWaalsContact O-N 3.17Å; A229-S232 PolarHBondContact O-OG 3.2Å; A229-H233 PolarHBondContact O-N 2.95Å; A229-H233 VanDerWaalsContact O-N 3.09Å
230	N	75.8	Confident	76.1	Confident	98 Å²	98	101.5 Å²	101.5	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-59.9	-44	176.9	-173.2	35.4	0	0	0	112.1	L226 E227 S232 H233 A234	L226-N230 WeakPolarHBondContact O-CB 3.47Å; L226-N230 PolarHBondContact O-N 3.09Å; E227-N230 PolarHBondContact O-N 3.38Å; N230-S232 VanDerWaalsContact C-N 3.3Å; N230-S232 PolarHBondContact O-N 3.43Å; N230-H233 PolarHBondContact O-N 2.67Å; N230-A234 WeakPolarHBondContact O-CB 3.27Å; N230-A234 PolarHBondContact O-N 3.17Å
231	M	74.9	Confident	74.5	Confident	139 Å²	139	104 Å²	104	69%	0.685	57%	0.567	S	S	*	*	H	α-helix	trans	-63.9	-34.4	177.1	-166.7	175.4	-63.7	0	0	112.3	E227 A228 A229 A235	E227-M231 WeakPolarHBondContact O-CB 3.45Å; E227-M231 PolarHBondContact O-N 3.44Å; A228-M231 PolarHBondContact O-N 3.14Å; A229-M231 PolarHBondContact O-N 2.88Å; M231-A235 WeakPolarHBondContact O-CB 3.46Å; M231-A235 PolarHBondContact O-N 2.73Å
232	S	71.4	Confident	72.8	Confident	66 Å²	66	105.5 Å²	105.5	46%	0.462	58%	0.582	S	S	.	*	H	α-helix	trans	-65.8	-41.2	173.9	82.8	0	0	0	0	112.4	A228 A229 N230 A235 A236	A228-S232 PolarHBondContact O-N 3.4Å; A229-S232 WeakPolarHBondContact O-CB 3.1Å; A229-S232 PolarHBondContact O-N 2.89Å; A229-S232 VanDerWaalsContact O-N 3.17Å; A229-S232 PolarHBondContact O-OG 3.2Å; N230-S232 VanDerWaalsContact C-N 3.3Å; N230-S232 PolarHBondContact O-N 3.43Å; S232-A235 PolarHBondContact O-N 3Å; S232-A236 PolarHBondContact O-N 2.79Å; S232-A236 VanDerWaalsContact O-N 3.14Å
233	H	61.9	Low	71.2	Confident	124 Å²	124	106.2 Å²	106.2	57%	0.574	59%	0.592	S	S	*	*	H	α-helix	trans	-69.4	-41.8	176.6	-76.6	8.6	0	0	0	111.9	A229 N230 A235 A236 Q237	A229-H233 PolarHBondContact O-N 2.95Å; A229-H233 VanDerWaalsContact O-N 3.09Å; N230-H233 PolarHBondContact O-N 2.67Å; H233-A235 VanDerWaalsContact C-N 3.3Å; H233-A235 PolarHBondContact O-N 3.2Å; H233-A236 PolarHBondContact O-N 3.49Å; H233-Q237 WeakPolarHBondContact O-CG 3.42Å; H233-Q237 PolarHBondContact O-N 3.12Å
234	A	64.3	Low	69.8	Low	58 Å²	58	109.8 Å²	109.8	48%	0.479	60%	0.602	S	S	.	*	H	α-helix	trans	-63.5	-33.5	174.1	0	0	0	0	0	112.7	N230 Q237	N230-A234 WeakPolarHBondContact O-CB 3.27Å; N230-A234 PolarHBondContact O-N 3.17Å; A234-Q237 PolarHBondContact O-N 2.75Å
235	A	61.1	Low	68.4	Low	45 Å²	45	114.4 Å²	114.4	37%	0.372	62%	0.617	S	S	.	*	H	α-helix	trans	-69.4	-35.2	174.4	0	0	0	0	0	112.8	M231 S232 H233	M231-A235 WeakPolarHBondContact O-CB 3.46Å; M231-A235 PolarHBondContact O-N 2.73Å; S232-A235 PolarHBondContact O-N 3Å; H233-A235 VanDerWaalsContact C-N 3.3Å; H233-A235 PolarHBondContact O-N 3.2Å
236	A	59.8	Low	66.7	Low	86 Å²	86	118.5 Å²	118.5	71%	0.711	63%	0.629	S	S	*	*	H	α-helix	trans	-72.5	-33.9	173.9	0	0	0	0	0	112.5	S232 H233 R238	S232-A236 PolarHBondContact O-N 2.79Å; S232-A236 VanDerWaalsContact O-N 3.14Å; H233-A236 PolarHBondContact O-N 3.49Å; A236-R238 PolarHBondContact O-N 3.49Å; A236-R238 VanDerWaalsContact O-N 3.12Å
237	Q	60.8	Low	65.2	Low	146 Å²	146	121.1 Å²	121.1	68%	0.682	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	28.5	175.5	-66.6	-177.9	3.3	0	0	113.8	H233 A234 I239	H233-Q237 WeakPolarHBondContact O-CG 3.42Å; H233-Q237 PolarHBondContact O-N 3.12Å; A234-Q237 PolarHBondContact O-N 2.75Å; Q237-I239 PolarHBondContact O-N 2.93Å
238	R	58.9	Low	63.7	Low	198 Å²	198	124.8 Å²	124.8	75%	0.747	66%	0.655	S	S	*	*			trans	-72.8	73.9	167	-77	-168.4	173.6	104.6	-0.7	110.5	A236 V240	A236-R238 PolarHBondContact O-N 3.49Å; A236-R238 VanDerWaalsContact O-N 3.12Å; R238-V240 PolarHBondContact O-N 3.44Å
239	I	59.6	Low	61.6	Low	135 Å²	135	127 Å²	127	69%	0.692	67%	0.666	S	S	*	*			trans	-45.6	121.8	168.7	-64.6	163.4	0	0	0	108.3	Q237 R241	Q237-I239 PolarHBondContact O-N 2.93Å; I239-R241 PolarHBondContact O-N 2.9Å
240	V	57.3	Low	60.2	Low	124 Å²	124	128.3 Å²	128.3	75%	0.752	69%	0.685	S	S	*	*			trans	-62.1	101	172.2	179.2	0	0	0	0	107.3	R238 V242	R238-V240 PolarHBondContact O-N 3.44Å; V240-V242 VanDerWaalsContact C-N 3.28Å; V240-V242 HydrophobicContact CG1-CG2 4.4Å; V240-V242 PolarHBondContact O-N 3.39Å
241	R	62.6	Low	58.6	Low	221 Å²	221	128.5 Å²	128.5	83%	0.834	70%	0.7	S	S	*	*			trans	-69.4	92.4	168.6	-79.4	-178.8	167.5	76.2	-2.3	107.4	I239 P243	I239-R241 PolarHBondContact O-N 2.9Å; R241-P243 VanDerWaalsContact O-CD 3.3Å; R241-P243 WeakPolarHBondContact O-CD 3.3Å
242	V	59.6	Low	57.2	Low	111 Å²	111	127 Å²	127	67%	0.673	70%	0.703	S	S	*	*			trans	-58.5	119.7	169.5	179.2	0	0	0	0	107.3	V240 I244	V240-V242 VanDerWaalsContact C-N 3.28Å; V240-V242 HydrophobicContact CG1-CG2 4.4Å; V240-V242 PolarHBondContact O-N 3.39Å; V242-I244 PolarHBondContact O-N 2.86Å
243	P	59.8	Low	55.8	Low	105 Å²	105	131.2 Å²	131.2	68%	0.682	72%	0.721	S	S	*	*			trans	-64.4	118	173.3	-18.9	32.7	0	0	0	108.7	R241 L245	R241-P243 VanDerWaalsContact O-CD 3.3Å; R241-P243 WeakPolarHBondContact O-CD 3.3Å; P243-L245 VanDerWaalsContact C-N 3.34Å; P243-L245 PolarHBondContact O-N 3.17Å
244	I	61.2	Low	54.8	Low	130 Å²	130	130 Å²	130	67%	0.667	73%	0.732	S	S	*	*			trans	-71.9	96.9	170.3	-58.8	175.9	0	0	0	106.4	V242 Y246	V242-I244 PolarHBondContact O-N 2.86Å; I244-Y246 HydrophobicContact CB-CD2 4.46Å; I244-Y246 HydrophobicContact CB-CE2 4.19Å; I244-Y246 HydrophobicContact CG2-CD2 3.81Å; I244-Y246 HydrophobicContact CG2-CE2 3.53Å; I244-Y246 PolarHBondContact O-N 2.92Å
245	L	62.9	Low	54	Low	157 Å²	157	133 Å²	133	82%	0.822	75%	0.75	S	S	*	*			trans	-70.2	95.5	170.1	-71.8	171.5	0	0	0	108.2	P243 H247	P243-L245 VanDerWaalsContact C-N 3.34Å; P243-L245 PolarHBondContact O-N 3.17Å; L245-H247 PolarHBondContact O-N 3.28Å
246	Y	53.3	Low	52.9	Low	202 Å²	202	134.4 Å²	134.4	79%	0.792	77%	0.769	S	S	*	*			trans	-66.3	117.8	164.6	-78.4	-92.3	0	0	0	108.4	I244 E248	I244-Y246 HydrophobicContact CB-CD2 4.46Å; I244-Y246 HydrophobicContact CB-CE2 4.19Å; I244-Y246 HydrophobicContact CG2-CD2 3.81Å; I244-Y246 HydrophobicContact CG2-CE2 3.53Å; I244-Y246 PolarHBondContact O-N 2.92Å; Y246-E248 PolarHBondContact O-N 3.06Å
247	H	53.3	Low	52	Low	175 Å²	175	136.1 Å²	136.1	81%	0.81	78%	0.776	S	S	*	*			trans	-73.5	107.1	167.4	-112.2	-83.3	0	0	0	108.4	L245 S249	L245-H247 PolarHBondContact O-N 3.28Å; H247-S249 PolarHBondContact O-N 3.14Å; H247-S249 VanDerWaalsContact O-N 3.13Å
248	E	53.7	Low	51.5	Low	192 Å²	192	135.5 Å²	135.5	90%	0.897	78%	0.784	S	S	*	*			trans	-77.9	91.6	167.7	-173.2	157.4	98.6	0	0	108.9	Y246 G250	Y246-E248 PolarHBondContact O-N 3.06Å; E248-G250 PolarHBondContact O-N 3Å
249	S	41.5	Very low	50.5	Low	105 Å²	105	129.6 Å²	129.6	73%	0.734	78%	0.784	S	S	*	*			trans	-78.6	95.9	171.5	-68.2	0	0	0	0	109.6	H247 A251	H247-S249 PolarHBondContact O-N 3.14Å; H247-S249 VanDerWaalsContact O-N 3.13Å; S249-A251 PolarHBondContact O-N 2.85Å
250	G	50.3	Low	49.9	Very low	78 Å²	78	129.1 Å²	129.1	80%	0.804	79%	0.788	S	S	*	*			trans	-62.2	125.6	165.5	0	0	0	0	0	110.8	E248	E248-G250 PolarHBondContact O-N 3Å
251	A	42.2	Very low	49.2	Very low	101 Å²	101	130.2 Å²	130.2	84%	0.835	79%	0.79	S	S	*	*			trans	-128.7	132.9	165.1	0	0	0	0	0	108.1	S249	S249-A251 PolarHBondContact O-N 2.85Å
252	S	46.3	Very low	48.7	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	79%	0.79	S	S	*	*			trans	-93.4	165.3	-164.3	48.5	0	0	0	0	114.5
253	D	41.6	Very low	48.1	Very low	156 Å²	156	125.8 Å²	125.8	83%	0.834	80%	0.795	S	S	*	*			trans	64.1	112.7	162.9	-67.6	-49.4	0	0	0	119.7
254	A	41.3	Very low	47.3	Very low	97 Å²	97	124.1 Å²	124.1	80%	0.802	80%	0.797	S	S	*	*				-167.1	136.5	100	0	0	0	0	0	113.3
255	S	46.2	Very low	47	Very low	122 Å²	122	124 Å²	124	85%	0.853	81%	0.808	S	S	*	*			trans	-21	142.7	165	56	0	0	0	0	120.6
256	G	38.9	Very low	46.4	Very low	75 Å²	75	123.8 Å²	123.8	77%	0.773	80%	0.802	S	S	*	*			trans	155.6	94.4	143.9	0	0	0	0	0	120
257	S	40	Very low	46.3	Very low	122 Å²	122	119.3 Å²	119.3	85%	0.853	80%	0.8	S	S	*	*			trans	66.4	150.5	155.9	-92.8	0	0	0	0	121.5
258	P	50.3	Low	46.1	Very low	133 Å²	133	117.7 Å²	117.7	86%	0.864	80%	0.797	S	S	*	*			trans	-85.6	121.2	177.9	33.7	-31.7	0	0	0	111.8
259	G	39.3	Very low	46	Very low	73 Å²	73	114.8 Å²	114.8	75%	0.753	79%	0.787	S	S	*	*			trans	-125.3	128.1	178.4	0	0	0	0	0	112
260	T	47.3	Very low	46.3	Very low	125 Å²	125	114.2 Å²	114.2	77%	0.767	79%	0.789	S	S	*	*			trans	-49.1	158.5	175.7	50.5	0	0	0	0	116.1
261	N	42.7	Very low	46.3	Very low	147 Å²	147	118.3 Å²	118.3	79%	0.786	79%	0.785	S	S	*	*			trans	95	104.7	160.1	-57	-23.5	0	0	0	117.5	P263	N261-P263 WeakPolarHBondContact O-CD 3.26Å
262	S	50.3	Low	47.1	Very low	119 Å²	119	119.3 Å²	119.3	83%	0.832	78%	0.783	S	S	*	*			trans	-77.1	134.5	150.9	171.5	0	0	0	0	110
263	P	46.8	Very low	47.2	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	78%	0.783	S	S	*	*			trans	-125.2	151.3	152.5	36.6	-26	0	0	0	112.1	N261	N261-P263 WeakPolarHBondContact O-CD 3.26Å
264	G	44.6	Very low	48	Very low	71 Å²	71	120.7 Å²	120.7	73%	0.732	77%	0.772	S	S	*	*			trans	107.2	26.3	147.1	0	0	0	0	0	119.7	Q266	G264-Q266 PolarHBondContact O-N 2.96Å
265	S	54.1	Low	48.5	Very low	127 Å²	127	123.5 Å²	123.5	89%	0.888	77%	0.77	S	S	*	*			trans	-78.8	73.2	155.2	-62.9	0	0	0	0	110.7
266	Q	51	Low	48.7	Very low	152 Å²	152	127.4 Å²	127.4	71%	0.71	77%	0.768	S	S	*	*			trans	-116.4	91.4	169.9	-79	-79.9	7.4	0	0	108.7	G264 L268	G264-Q266 PolarHBondContact O-N 2.96Å; Q266-L268 VanDerWaalsContact C-N 3.28Å; Q266-L268 PolarHBondContact O-N 2.88Å
267	S	50.7	Low	49.4	Very low	108 Å²	108	132.7 Å²	132.7	76%	0.755	77%	0.765	S	S	*	*			trans	-74.2	84.3	171	-170.3	0	0	0	0	109.1	L269	S267-L269 VanDerWaalsContact C-N 3.31Å; S267-L269 PolarHBondContact O-N 3.29Å
268	L	49.4	Very low	49.9	Very low	141 Å²	141	132 Å²	132	74%	0.738	76%	0.761	S	S	*	*			trans	-77.9	84.7	174.6	-64.8	-174.8	0	0	0	110	Q266 A270	Q266-L268 VanDerWaalsContact C-N 3.28Å; Q266-L268 PolarHBondContact O-N 2.88Å; L268-A270 PolarHBondContact O-N 3.27Å
269	L	51.8	Low	49.9	Very low	131 Å²	131	132.5 Å²	132.5	69%	0.686	75%	0.751	S	S	*	*			trans	-66.5	78.3	157.8	-67.5	177.5	0	0	0	108.9	S267 F271	S267-L269 VanDerWaalsContact C-N 3.31Å; S267-L269 PolarHBondContact O-N 3.29Å; L269-F271 VanDerWaalsContact C-N 3.26Å; L269-F271 HydrophobicContact CB-CD2 4.23Å; L269-F271 HydrophobicContact CB-CE2 3.96Å; L269-F271 HydrophobicContact CD1-CE2 4.42Å; L269-F271 WeakPolarHBondContact O-CD2 3.31Å; L269-F271 PolarHBondContact O-N 3.28Å
270	A	46.8	Very low	51	Low	93 Å²	93	134.6 Å²	134.6	77%	0.769	75%	0.752	S	S	*	*			trans	-71.2	81.2	174.2	0	0	0	0	0	110	L268	L268-A270 PolarHBondContact O-N 3.27Å
271	F	51.3	Low	51.6	Low	164 Å²	164	134.1 Å²	134.1	72%	0.719	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-64.8	130.3	164.2	-73.5	-85.9	0	0	0	108.8	L269 H273	L269-F271 VanDerWaalsContact C-N 3.26Å; L269-F271 HydrophobicContact CB-CD2 4.23Å; L269-F271 HydrophobicContact CB-CE2 3.96Å; L269-F271 HydrophobicContact CD1-CE2 4.42Å; L269-F271 WeakPolarHBondContact O-CD2 3.31Å; L269-F271 PolarHBondContact O-N 3.28Å; F271-H273 PolarHBondContact O-N 3.04Å
272	P	58.5	Low	52.4	Low	123 Å²	123	133.5 Å²	133.5	80%	0.799	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-63.8	127.6	176	26	-32.7	0	0	0	109.4	H274	P272-H274 PolarHBondContact O-N 2.98Å
273	H	48.4	Very low	53	Low	161 Å²	161	134.9 Å²	134.9	75%	0.745	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-56.2	134.4	176.1	-79.5	-97.1	0	0	0	110.4	F271 M275	F271-H273 PolarHBondContact O-N 3.04Å; H273-M275 PolarHBondContact O-N 3.15Å; H273-M275 VanDerWaalsContact O-N 3.14Å
274	H	57.5	Low	53.4	Low	130 Å²	130	136.5 Å²	136.5	60%	0.602	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-59.4	117.7	166.3	49.5	-87.9	0	0	0	108.2	P272 Y276	P272-H274 PolarHBondContact O-N 2.98Å; H274-Y276 AromaticContact CD2-CD2 3.77Å; H274-Y276 AromaticContact CD2-CE2 3.51Å; H274-Y276 AromaticContact NE2-CD2 3.98Å; H274-Y276 AromaticContact NE2-CE2 3.26Å; H274-Y276 VanDerWaalsContact NE2-CE2 3.26Å; H274-Y276 WeakPolarHBondContact NE2-CE2 3.46Å; H274-Y276 AromaticContact NE2-CZ 3.8Å; H274-Y276 PolarHBondContact O-N 3.14Å; H274-Y276 VanDerWaalsContact O-N 3.15Å
275	M	53.8	Low	54	Low	156 Å²	156	144 Å²	144	77%	0.768	76%	0.757	S	S	*	*			trans	-66.9	115.2	170.1	-72	-81.5	86.7	0	0	108	H273 Y277	H273-M275 PolarHBondContact O-N 3.15Å; H273-M275 VanDerWaalsContact O-N 3.14Å; M275-Y277 VanDerWaalsContact C-N 3.29Å; M275-Y277 PolarHBondContact O-N 2.92Å
276	Y	50.3	Low	54.1	Low	204 Å²	204	143.7 Å²	143.7	80%	0.8	75%	0.752	S	S	*	*			trans	-63.2	92.1	167.5	-84.9	-91.7	0	0	0	108.8	H274 S278	H274-Y276 AromaticContact CD2-CD2 3.77Å; H274-Y276 AromaticContact CD2-CE2 3.51Å; H274-Y276 AromaticContact NE2-CD2 3.98Å; H274-Y276 AromaticContact NE2-CE2 3.26Å; H274-Y276 VanDerWaalsContact NE2-CE2 3.26Å; H274-Y276 WeakPolarHBondContact NE2-CE2 3.46Å; H274-Y276 AromaticContact NE2-CZ 3.8Å; H274-Y276 PolarHBondContact O-N 3.14Å; H274-Y276 VanDerWaalsContact O-N 3.15Å; Y276-S278 VanDerWaalsContact C-N 3.28Å; Y276-S278 PolarHBondContact O-N 3.06Å
277	Y	53.1	Low	54.5	Low	186 Å²	186	146.7 Å²	146.7	73%	0.729	78%	0.781	S	S	*	*			trans	-72.9	89	170.1	-124.4	-84.5	0	0	0	108.7	M275 H279	M275-Y277 VanDerWaalsContact C-N 3.29Å; M275-Y277 PolarHBondContact O-N 2.92Å; Y277-H279 AromaticContact CD1-CE1 3.71Å; Y277-H279 PolarHBondContact O-N 3.21Å
278	S	49.7	Very low	54.7	Low	108 Å²	108	148.7 Å²	148.7	76%	0.755	78%	0.782	S	S	*	*			trans	-67.2	100.5	167.3	-171.8	0	0	0	0	108.2	Y276 P280	Y276-S278 VanDerWaalsContact C-N 3.28Å; Y276-S278 PolarHBondContact O-N 3.06Å; S278-P280 WeakPolarHBondContact O-CD 3.34Å
279	H	50.6	Low	54.9	Low	144 Å²	144	149.1 Å²	149.1	67%	0.667	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.2	116.6	173.1	-72.5	-68.5	0	0	0	109.4	Y277 T281	Y277-H279 AromaticContact CD1-CE1 3.71Å; Y277-H279 PolarHBondContact O-N 3.21Å; H279-T281 PolarHBondContact O-N 3.13Å
280	P	62.2	Low	55.1	Low	117 Å²	117	150.1 Å²	150.1	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-68.8	120.6	172.1	27.9	-32.4	0	0	0	109.5	S278 P282	S278-P280 WeakPolarHBondContact O-CD 3.34Å; P280-P282 VanDerWaalsContact O-CD 3.31Å; P280-P282 WeakPolarHBondContact O-CD 3.48Å
281	T	60	Low	55.6	Low	115 Å²	115	153.4 Å²	153.4	71%	0.706	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.9	117.8	172.8	50.7	0	0	0	0	110	H279 L283	H279-T281 PolarHBondContact O-N 3.13Å; T281-L283 PolarHBondContact O-N 3.38Å; T281-L283 VanDerWaalsContact O-N 3.14Å
282	P	59.5	Low	55.9	Low	133 Å²	133	152.8 Å²	152.8	86%	0.864	80%	0.796	S	S	*	*			trans	-74.7	102.9	168.4	29.9	-31.6	0	0	0	109.5	P280	P280-P282 VanDerWaalsContact O-CD 3.31Å; P280-P282 WeakPolarHBondContact O-CD 3.48Å
283	L	62.6	Low	55.7	Low	148 Å²	148	154.7 Å²	154.7	78%	0.775	80%	0.795	S	S	*	*			trans	-95.8	125.7	163.1	-69	176	0	0	0	108.7	T281	T281-L283 PolarHBondContact O-N 3.38Å; T281-L283 VanDerWaalsContact O-N 3.14Å
284	L	56.6	Low	56.2	Low	155 Å²	155	154.3 Å²	154.3	81%	0.812	80%	0.799	S	S	*	*			trans	154.3	97.6	157.1	-85.8	154.5	0	0	0	106.4
285	R	55.7	Low	56.1	Low	228 Å²	228	156.2 Å²	156.2	86%	0.86	81%	0.814	S	S	*	*				79.2	139	81.5	-91	-161.4	178.5	124.4	0.3	114
286	P	56.4	Low	56.3	Low	120 Å²	120	156.2 Å²	156.2	78%	0.779	82%	0.818	S	S	*	*			trans	-85	161.2	-176.4	36.4	-36.5	0	0	0	113.3
287	V	58.9	Low	56.8	Low	216 Å²	216	151.8 Å²	151.8	100%	1.309	82%	0.82	S	S	*	*			trans	-123.5	0	151.6	163.9	0	0	0	0	106

Retrieved 287 of 287 residues in 41.1 ms (Link to these results)

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