A0A087YI76_POEFO Loading...

polynucleotide adenylyltransferase

AlphaFold DB , UniProt , Accession A0A087YI76, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 474 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	31.4	Very low	30.3	Very low	224 Å²	224	185.3 Å²	185.3	100%	1.103	85%	0.853	S	S	*	*				0	126.8	0	-110.2	-177.6	-169	0	0	108.4
2	F	29.6	Very low	30.1	Very low	177 Å²	177	176.4 Å²	176.4	78%	0.776	85%	0.85	S	S	*	*			trans	59.7	108.8	164.5	-60.4	-78.3	0	0	0	119.2
3	H	30.8	Very low	29.9	Very low	180 Å²	180	170.2 Å²	170.2	83%	0.833	85%	0.845	S	S	*	*				60	118	79.8	-89.1	22	0	0	0	114.8
4	R	29.8	Very low	29.7	Very low	254 Å²	254	166.4 Å²	166.4	96%	0.958	84%	0.843	S	S	*	*				-157.7	132.1	126.8	-114.3	171.3	-178.8	170.8	0.1	111.7
5	N	30.5	Very low	29.8	Very low	156 Å²	156	163.5 Å²	163.5	83%	0.834	85%	0.845	S	S	*	*			trans	-128.2	159.3	178	-146.5	-5.8	0	0	0	106.9
6	K	33.7	Very low	29.7	Very low	194 Å²	194	163.6 Å²	163.6	84%	0.843	85%	0.847	S	S	*	*			trans	86.9	121.3	173.7	-61.6	-177.9	174.1	178.6	0	117.4
7	I	30.8	Very low	29.9	Very low	178 Å²	178	162.1 Å²	162.1	91%	0.913	85%	0.847	S	S	*	*				-142.2	144.8	115.2	-85.1	152.6	0	0	0	107.5
8	L	29.6	Very low	30.1	Very low	159 Å²	159	159.9 Å²	159.9	83%	0.832	84%	0.844	S	S	*	*			trans	-142.2	130.4	-174.8	-146.4	164.5	0	0	0	107.5
9	S	27.3	Very low	30.1	Very low	107 Å²	107	163.4 Å²	163.4	75%	0.748	85%	0.847	S	S	*	*			trans	-175.6	107.9	153.8	-164.9	0	0	0	0	109.3
10	R	30	Very low	30.4	Very low	195 Å²	195	161.1 Å²	161.1	74%	0.736	84%	0.842	S	S	*	*				56.5	136.4	98.7	-83.7	-170	172.7	-167.6	0.5	114.6
11	R	30	Very low	30.7	Very low	214 Å²	214	158.9 Å²	158.9	81%	0.808	84%	0.838	S	S	*	*			cis	-174.2	150.3	6.3	-134.6	-179.4	-171.1	-171.4	0.5	110.1
12	G	27.6	Very low	30.7	Very low	79 Å²	79	154.2 Å²	154.2	81%	0.814	82%	0.824	S	S	*	*			trans	90	140.8	150.2	0	0	0	0	0	118.1
13	A	27.6	Very low	30.7	Very low	95 Å²	95	156.9 Å²	156.9	79%	0.785	83%	0.829	S	S	*	*			cis	-163.7	152.8	4.3	0	0	0	0	0	111.9
14	S	27.2	Very low	30.8	Very low	117 Å²	117	152.2 Å²	152.2	82%	0.818	82%	0.822	S	S	*	*			trans	44.2	121.3	151.4	69.5	0	0	0	0	123.4
15	S	31.1	Very low	30.6	Very low	124 Å²	124	145.5 Å²	145.5	87%	0.867	81%	0.811	S	S	*	*				-152.9	132.5	125.5	59.7	0	0	0	0	111.3
16	N	27.8	Very low	30.4	Very low	165 Å²	165	148.5 Å²	148.5	88%	0.882	81%	0.811	S	S	*	*			trans	-90.7	136.7	179.2	-82.2	-30.7	0	0	0	110.2
17	T	32.8	Very low	29.9	Very low	137 Å²	137	149.6 Å²	149.6	84%	0.84	81%	0.811	S	S	*	*			trans	-152.6	147	145.5	38.1	0	0	0	0	110.9
18	P	34.1	Very low	29.7	Very low	124 Å²	124	145.9 Å²	145.9	81%	0.805	80%	0.8	S	S	*	*			trans	-104.5	139.8	-158.6	24.2	-6.1	0	0	0	114
19	Y	30.2	Very low	29.4	Very low	226 Å²	226	145.5 Å²	145.5	89%	0.886	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-86.1	145.4	164.7	-80.2	-91.8	0	0	0	110.4
20	P	36.1	Very low	29.5	Very low	117 Å²	117	150.6 Å²	150.6	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-77.6	150.6	178.7	31.4	-32.8	0	0	0	112.1
21	P	37.6	Very low	29.2	Very low	115 Å²	115	149.6 Å²	149.6	75%	0.747	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-80.8	160.6	-178.9	32.7	-34	0	0	0	113.3
22	P	31.5	Very low	29.2	Very low	125 Å²	125	148.5 Å²	148.5	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-73.3	140.1	179.6	29.2	-32.8	0	0	0	112.5	A24	P22-A24 PolarHBondContact O-N 3.09Å
23	R	29.8	Very low	29	Very low	233 Å²	233	148.2 Å²	148.2	88%	0.879	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-67.7	125.3	175.2	-71.7	-176.7	-176.1	-167.6	-0.2	110.8
24	A	30.8	Very low	28.9	Very low	83 Å²	83	151.8 Å²	151.8	69%	0.686	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80.6	166.8	166.7	0	0	0	0	0	110.7	P22	P22-A24 PolarHBondContact O-N 3.09Å
25	P	27.5	Very low	28.9	Very low	113 Å²	113	152 Å²	152	73%	0.734	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83.3	147.9	-151.2	32.4	-32.9	0	0	0	114.1	Y27	P25-Y27 PolarHBondContact O-N 3.36Å
26	W	25.3	Very low	28.7	Very low	219 Å²	219	152.3 Å²	152.3	83%	0.83	80%	0.802	S	S	*	*			trans	-73	113.6	172.4	-69.1	78.1	0	0	0	109.8
27	Y	23	Very low	28.5	Very low	217 Å²	217	149 Å²	149	85%	0.851	80%	0.798	S	S	*	*			trans	-77.8	126.6	155.4	-101.6	-97.5	0	0	0	107.8	P25	P25-Y27 PolarHBondContact O-N 3.36Å
28	C	26.1	Very low	28.3	Very low	100 Å²	100	146.9 Å²	146.9	68%	0.676	79%	0.794	S	S	*	*			trans	-120	102.8	163.2	-85	0	0	0	0	108.1	Y30	C28-Y30 HydrophobicContact CB-CD2 4.41Å
29	D	24.7	Very low	27.8	Very low	150 Å²	150	148.8 Å²	148.8	80%	0.802	80%	0.798	S	S	*	*			trans	-70.7	132.2	154.4	-96.7	-35.5	0	0	0	108.5
30	Y	29.2	Very low	27.6	Very low	215 Å²	215	143.4 Å²	143.4	84%	0.843	79%	0.793	S	S	*	*			trans	-141.8	101.5	159.4	-90.9	-78.8	0	0	0	110.6	C28	C28-Y30 HydrophobicContact CB-CD2 4.41Å
31	Q	23.5	Very low	27.1	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	80%	0.797	S	S	*	*			trans	-74	139.5	149	-73.7	-177.2	-22.5	0	0	109.2
32	H	29.3	Very low	26.4	Very low	192 Å²	192	145.6 Å²	145.6	89%	0.889	80%	0.801	S	S	*	*			trans	33.8	118.6	159.1	-66.4	-65.8	0	0	0	120.9
33	G	24.3	Very low	26.3	Very low	72 Å²	72	146.1 Å²	146.1	74%	0.742	80%	0.801	S	S	*	*			trans	170.6	93.2	158.9	0	0	0	0	0	111.9
34	E	25.2	Very low	26.5	Very low	171 Å²	171	140.2 Å²	140.2	80%	0.799	79%	0.786	S	S	*	*			trans	-55.5	147.2	165.2	-82.1	-108.8	150.8	0	0	111.1
35	P	26.6	Very low	26.5	Very low	122 Å²	122	142.6 Å²	142.6	79%	0.792	79%	0.788	S	S	*	*				-136.5	139.1	112.6	28.1	-11.9	0	0	0	114.8
36	V	28.5	Very low	27	Very low	130 Å²	130	142.7 Å²	142.7	79%	0.788	78%	0.781	S	S	*	*			trans	-44.3	121.5	166.6	178.8	0	0	0	0	113.3
37	A	23.5	Very low	27.5	Very low	96 Å²	96	136.1 Å²	136.1	79%	0.793	77%	0.765	S	S	*	*			trans	-155.8	125.1	148.1	0	0	0	0	0	110.7
38	A	27.2	Very low	28.1	Very low	92 Å²	92	134.5 Å²	134.5	76%	0.76	77%	0.765	S	S	*	*			trans	-62	133.2	-171	0	0	0	0	0	114.4
39	N	25	Very low	28.7	Very low	163 Å²	163	131.9 Å²	131.9	87%	0.872	74%	0.744	S	S	*	*			trans	-161.1	96.4	140.3	-92.9	-25.5	0	0	0	108.5	C41	N39-C41 PolarHBondContact O-N 3.41Å; N39-C41 VanDerWaalsContact O-N 3.09Å
40	S	25	Very low	29.2	Very low	114 Å²	114	129.4 Å²	129.4	80%	0.797	74%	0.736	S	S	*	*			trans	-66.8	97.6	174.9	52.3	0	0	0	0	110.6
41	C	24.6	Very low	29.5	Very low	124 Å²	124	122.7 Å²	122.7	84%	0.838	72%	0.719	S	S	*	*			trans	-100.3	104.5	157.5	-98	0	0	0	0	107.7	N39 V43	N39-C41 PolarHBondContact O-N 3.41Å; N39-C41 VanDerWaalsContact O-N 3.09Å; C41-V43 PolarHBondContact O-N 2.82Å
42	N	24.8	Very low	30.4	Very low	154 Å²	154	118 Å²	118	82%	0.824	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-56.9	129.4	176.3	-81.9	-28.3	0	0	0	110.6	L44	N42-L44 PolarHBondContact O-N 3.36Å
43	V	28.9	Very low	30.9	Very low	136 Å²	136	113.9 Å²	113.9	82%	0.824	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-53.9	123	179.8	177.3	0	0	0	0	110	C41 N45	C41-V43 PolarHBondContact O-N 2.82Å; V43-N45 PolarHBondContact O-N 3.36Å
44	L	34.4	Very low	31.6	Very low	108 Å²	108	118.3 Å²	118.3	57%	0.565	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-70	118.4	175.6	-72.5	166.5	0	0	0	109.3	N42 I46 S142	N42-L44 PolarHBondContact O-N 3.36Å; L44-I46 PolarHBondContact O-N 3.4Å; L44-I46 VanDerWaalsContact O-N 3.14Å; L44-S142 WeakPolarHBondContact CD2-OG 3.43Å
45	N	29.2	Very low	32	Very low	134 Å²	134	118.1 Å²	118.1	72%	0.717	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-53	117.2	164.8	-78.7	-34	0	0	0	108.6	V43 V47	V43-N45 PolarHBondContact O-N 3.36Å; N45-V47 PolarHBondContact O-N 3.31Å
46	I	37.8	Very low	32.4	Very low	115 Å²	115	116 Å²	116	59%	0.59	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-47.4	116.2	157.2	-63.3	168.5	0	0	0	104.9	L44 E48 P364	L44-I46 PolarHBondContact O-N 3.4Å; L44-I46 VanDerWaalsContact O-N 3.14Å; I46-E48 PolarHBondContact O-N 3.25Å; I46-P364 HydrophobicContact CD1-CG 4.1Å; I46-P364 HydrophobicContact CG1-CG 4.39Å
47	V	37	Very low	32.9	Very low	80 Å²	80	113.8 Å²	113.8	49%	0.485	66%	0.658	S	S	.	*			trans	-51	111	173.5	174	0	0	0	0	106.2	N45 L49 N139	N45-V47 PolarHBondContact O-N 3.31Å; V47-L49 PolarHBondContact O-N 3.14Å; V47-N139 VanDerWaalsContact CG2-ND2 3.26Å; V47-N139 WeakPolarHBondContact CG2-ND2 3.49Å
48	E	34.4	Very low	33.3	Very low	183 Å²	183	114.3 Å²	114.3	86%	0.855	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-53.1	120.4	178.6	-85.2	-173	151.8	0	0	107.4	I46	I46-E48 PolarHBondContact O-N 3.25Å
49	L	40.7	Very low	33.7	Very low	46 Å²	46	114.6 Å²	114.6	24%	0.241	65%	0.647	C	S	.	*	P	Polyproline II helix	trans	-55	135.2	-178.5	-68.2	154.1	0	0	0	107.9	V47 P51 R360	V47-L49 PolarHBondContact O-N 3.14Å; L49-P51 WeakPolarHBondContact O-CD 3.5Å; L49-R360 HydrophobicContact CD1-CG 3.31Å; L49-R360 VanDerWaalsContact CD1-NH1 3.29Å
50	P	34.8	Very low	34.2	Very low	97 Å²	97	113.6 Å²	113.6	63%	0.63	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-55.7	117	150.4	23.4	-28	0	0	0	105.1	Y52	P50-Y52 PolarHBondContact O-N 3.46Å
51	P	34.2	Very low	34.7	Very low	75 Å²	75	117 Å²	117	49%	0.487	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-60.2	140.4	-178.9	25.3	-33.1	0	0	0	108.4	L49 T53	L49-P51 WeakPolarHBondContact O-CD 3.5Å; P51-T53 HydrophobicContact CB-CG2 3.72Å; P51-T53 HydrophobicContact CG-CG2 3.64Å; P51-T53 PolarHBondContact O-N 3.49Å
52	Y	43.3	Very low	35.1	Very low	74 Å²	74	115.4 Å²	115.4	29%	0.29	64%	0.643	S	S	.	*			trans	-70.6	74.7	158	-173.5	-89.9	0	0	0	106.1	P50 W54 R191	P50-Y52 PolarHBondContact O-N 3.46Å; Y52-W54 PolarHBondContact O-N 3.39Å; Y52-R191 VanDerWaalsContact CE1-NH2 3.34Å
53	T	39.3	Very low	35.7	Very low	106 Å²	106	112.6 Å²	112.6	65%	0.65	64%	0.642	S	S	*	*			trans	-79.5	101.5	175.6	36.1	0	0	0	0	107.8	P51 Q55	P51-T53 HydrophobicContact CB-CG2 3.72Å; P51-T53 HydrophobicContact CG-CG2 3.64Å; P51-T53 PolarHBondContact O-N 3.49Å; T53-Q55 PolarHBondContact O-N 3.48Å
54	W	40.2	Very low	36.3	Very low	164 Å²	164	114 Å²	114	62%	0.621	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-67.4	122.7	159.8	-178.2	80.1	0	0	0	108.6	Y52 P56	Y52-W54 PolarHBondContact O-N 3.39Å; W54-P56 HydrophobicContact CE3-CB 4.05Å; W54-P56 VanDerWaalsContact CE3-CD 3.41Å; W54-P56 HydrophobicContact CE3-CG 3.75Å; W54-P56 HydrophobicContact CH2-CB 3.26Å; W54-P56 HydrophobicContact CH2-CG 3.79Å; W54-P56 VanDerWaalsContact CZ2-CA 3.44Å; W54-P56 HydrophobicContact CZ2-CB 3.94Å; W54-P56 VanDerWaalsContact CZ3-CA 3.49Å; W54-P56 HydrophobicContact CZ3-CB 3.32Å; W54-P56 HydrophobicContact CZ3-CG 3.24Å
55	Q	32.7	Very low	36.5	Very low	168 Å²	168	114 Å²	114	79%	0.785	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-92.6	119.7	160.5	-67.4	-117.6	-24.7	0	0	106.7	T53 A57	T53-Q55 PolarHBondContact O-N 3.48Å; Q55-A57 PolarHBondContact O-N 3.16Å
56	P	34.1	Very low	37.1	Very low	77 Å²	77	113.1 Å²	113.1	50%	0.5	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-51.5	142.7	167.9	-4.8	5.6	0	0	0	110.2	W54	W54-P56 HydrophobicContact CE3-CB 4.05Å; W54-P56 VanDerWaalsContact CE3-CD 3.41Å; W54-P56 HydrophobicContact CE3-CG 3.75Å; W54-P56 HydrophobicContact CH2-CB 3.26Å; W54-P56 HydrophobicContact CH2-CG 3.79Å; W54-P56 VanDerWaalsContact CZ2-CA 3.44Å; W54-P56 HydrophobicContact CZ2-CB 3.94Å; W54-P56 VanDerWaalsContact CZ3-CA 3.49Å; W54-P56 HydrophobicContact CZ3-CB 3.32Å; W54-P56 HydrophobicContact CZ3-CG 3.24Å
57	A	40.2	Very low	37.3	Very low	84 Å²	84	113.1 Å²	113.1	69%	0.694	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-56.8	130.7	159.2	0	0	0	0	0	107.2	Q55	Q55-A57 PolarHBondContact O-N 3.16Å
58	P	32.3	Very low	37.3	Very low	106 Å²	106	115.5 Å²	115.5	69%	0.688	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-55.7	142.5	176.7	21.6	-30.4	0	0	0	108.7	V60	P58-V60 PolarHBondContact O-N 3.17Å; P58-V60 VanDerWaalsContact O-N 3.07Å
59	P	34.5	Very low	37.4	Very low	99 Å²	99	111.7 Å²	111.7	64%	0.643	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-53.7	124.2	175.7	20.9	-30.1	0	0	0	108.1	F61	P59-F61 VanDerWaalsContact C-N 3.28Å; P59-F61 HydrophobicContact CG-CE2 4.17Å; P59-F61 PolarHBondContact O-N 3.48Å
60	V	35.8	Very low	37.1	Very low	141 Å²	141	113 Å²	113	86%	0.855	70%	0.701	S	S	*	*			trans	-65.7	96.5	172.7	-178.8	0	0	0	0	105.9	P58 A62	P58-V60 PolarHBondContact O-N 3.17Å; P58-V60 VanDerWaalsContact O-N 3.07Å; V60-A62 PolarHBondContact O-N 3.01Å
61	F	35.1	Very low	37.1	Very low	186 Å²	186	114.1 Å²	114.1	82%	0.816	71%	0.705	S	S	*	*			trans	-62.4	110.8	165.2	-76.3	-81.9	0	0	0	106.3	P59 A63	P59-F61 VanDerWaalsContact C-N 3.28Å; P59-F61 HydrophobicContact CG-CE2 4.17Å; P59-F61 PolarHBondContact O-N 3.48Å; F61-A63 PolarHBondContact O-N 3.27Å
62	A	34.5	Very low	36.9	Very low	91 Å²	91	118.4 Å²	118.4	75%	0.752	72%	0.724	S	S	*	*			trans	-53.5	113.4	170.7	0	0	0	0	0	107.6	V60 L64	V60-A62 PolarHBondContact O-N 3.01Å; A62-L64 PolarHBondContact O-N 2.99Å
63	A	37.3	Very low	36.4	Very low	95 Å²	95	123.3 Å²	123.3	79%	0.785	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-57.7	124.5	173.5	0	0	0	0	0	108.1	F61	F61-A63 PolarHBondContact O-N 3.27Å
64	L	40.2	Very low	35.9	Very low	164 Å²	164	121.6 Å²	121.6	86%	0.859	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-55.2	136.4	170.1	-81.7	156.8	0	0	0	108.9	A62	A62-L64 PolarHBondContact O-N 2.99Å
65	P	40	Very low	35.6	Very low	110 Å²	110	125.9 Å²	125.9	71%	0.714	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-62.5	143.7	176.9	25.3	-31.3	0	0	0	109.9
66	P	41.8	Very low	35.4	Very low	115 Å²	115	127 Å²	127	75%	0.747	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.6	150.8	179.6	27.5	-32.8	0	0	0	110.7
67	P	40.3	Very low	35.4	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-66.6	153.6	178.7	29.1	-33.2	0	0	0	110.7	A69	P67-A69 PolarHBondContact O-N 2.95Å
68	P	37	Very low	34.9	Very low	129 Å²	129	139 Å²	139	84%	0.838	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.8	127.7	-177.1	25.8	-31.5	0	0	0	110.7
69	A	37.6	Very low	34.7	Very low	103 Å²	103	145 Å²	145	85%	0.851	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.8	131.7	175.1	0	0	0	0	0	110.7	P67	P67-A69 PolarHBondContact O-N 2.95Å
70	G	34.1	Very low	34.5	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-60.6	146.8	-179.1	0	0	0	0	0	114
71	V	34.1	Very low	34.2	Very low	120 Å²	120	145.5 Å²	145.5	73%	0.727	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-52.8	130.4	173.9	179.6	0	0	0	0	110.9
72	N	31.9	Very low	34	Very low	165 Å²	165	144.4 Å²	144.4	88%	0.882	79%	0.791	S	S	*	*			trans	-136.4	128.3	154	-106.7	-22.6	0	0	0	110.8
73	H	32	Very low	33.7	Very low	177 Å²	177	145.6 Å²	145.6	82%	0.819	79%	0.794	S	S	*	*			trans	-74.4	142	-173.6	-78.3	-81	0	0	0	113
74	G	28.7	Very low	33.2	Very low	71 Å²	71	145.1 Å²	145.1	73%	0.732	79%	0.79	S	S	*	*			trans	103.6	105.2	139.6	0	0	0	0	0	117.3
75	R	33	Very low	32.7	Very low	254 Å²	254	149.5 Å²	149.5	96%	0.958	80%	0.795	S	S	*	*				179.5	133.9	92.1	-103.2	178.1	173.5	172.2	-1.3	110.8
76	K	29.8	Very low	32.2	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.835	80%	0.797	S	S	*	*			trans	-58.3	140.4	177.2	-69.4	171.4	171	177.6	0	112.8
77	R	33.4	Very low	31.6	Very low	253 Å²	253	149.8 Å²	149.8	96%	0.955	80%	0.801	S	S	*	*			trans	-141.5	124	132.5	-77.8	-164.8	175	172.3	-2.1	110.1
78	H	30.4	Very low	31	Very low	158 Å²	158	152 Å²	152	73%	0.731	80%	0.8	S	S	*	*			trans	-73.3	144.9	170.1	-100.4	-111.4	0	0	0	110.2
79	Y	26.7	Very low	30.7	Very low	234 Å²	234	155.6 Å²	155.6	92%	0.918	80%	0.796	S	S	*	*				-164.8	123.3	123.9	-119.1	-88.6	0	0	0	111.1
80	N	30	Very low	30.2	Very low	114 Å²	114	160 Å²	160	61%	0.61	80%	0.799	S	S	*	*			trans	-36	155	158.9	-95.8	16.2	0	0	0	114.4
81	E	31.2	Very low	29.8	Very low	135 Å²	135	167.3 Å²	167.3	63%	0.631	80%	0.804	S	S	*	*			cis	-178.6	157.9	37	-121.3	171	-143.1	0	0	113.5
82	H	29.3	Very low	29.4	Very low	164 Å²	164	169.7 Å²	169.7	76%	0.759	81%	0.812	S	S	*	*			trans	56.4	139	150.3	-63	114.8	0	0	0	120.3
83	S	28.3	Very low	29.2	Very low	116 Å²	116	168.7 Å²	168.7	81%	0.811	81%	0.806	S	S	*	*			cis	-160	153.2	20.9	173.7	0	0	0	0	111
84	A	27.8	Very low	29.6	Very low	84 Å²	84	165.4 Å²	165.4	69%	0.694	80%	0.801	S	S	*	*			trans	-77.6	162	177.5	0	0	0	0	0	114.6
85	R	30.1	Very low	29.5	Very low	257 Å²	257	167.3 Å²	167.3	97%	0.97	80%	0.803	S	S	*	*				-162.6	126.4	120.1	-103.8	172.1	-171.2	175.9	3.8	111.3
86	A	28.3	Very low	29.9	Very low	93 Å²	93	160.5 Å²	160.5	77%	0.769	79%	0.792	S	S	*	*			trans	-123.1	143.9	173.7	0	0	0	0	0	108.7
87	V	30.6	Very low	29.8	Very low	137 Å²	137	157.7 Å²	157.7	83%	0.83	79%	0.791	S	S	*	*			trans	-152.6	105.5	154.8	-174.4	0	0	0	0	105.9
88	K	27.3	Very low	29.5	Very low	163 Å²	163	151.1 Å²	151.1	71%	0.709	78%	0.783	S	S	*	*				51.9	142.1	95.3	-84.1	-174.4	168.4	170.5	0	113
89	R	29.5	Very low	29.3	Very low	203 Å²	203	148.6 Å²	148.6	77%	0.766	78%	0.783	S	S	*	*			cis	-174.9	155.1	0.4	-109.3	170.6	-176.3	-156.9	1.5	102.8
90	Q	27.6	Very low	29.6	Very low	195 Å²	195	143.6 Å²	143.6	91%	0.911	78%	0.78	S	S	*	*				-178	149.6	90.1	-118.5	171.8	-10.1	0	0	110.8
91	R	26.3	Very low	29.4	Very low	229 Å²	229	143.6 Å²	143.6	86%	0.864	78%	0.784	S	S	*	*			trans	-123.1	137	-177.1	-159.4	-168.7	-149.2	-160.2	6.1	106.4
92	L	25.5	Very low	29	Very low	170 Å²	170	148.7 Å²	148.7	89%	0.89	80%	0.797	S	S	*	*			trans	-145.7	124.8	157.4	-78.7	175.5	0	0	0	109.6
93	N	26.6	Very low	28.9	Very low	143 Å²	143	147.9 Å²	147.9	77%	0.765	80%	0.797	S	S	*	*			trans	-107.3	174	160.8	-98.5	-0.9	0	0	0	106.1
94	P	40.9	Very low	29.4	Very low	109 Å²	109	147 Å²	147	71%	0.708	79%	0.789	S	S	*	*			cis	-153.1	162.6	35.1	38.4	-14.9	0	0	0	120.5
95	S	27.2	Very low	29.4	Very low	111 Å²	111	152 Å²	152	78%	0.776	80%	0.797	S	S	*	*			trans	51.2	171.2	133.7	-56.5	0	0	0	0	123.7
96	P	41.7	Very low	29.3	Very low	111 Å²	111	144.1 Å²	144.1	72%	0.721	78%	0.782	S	S	*	*			cis	-134.7	173.8	-30.7	31.4	-11.9	0	0	0	113.8
97	T	27	Very low	29.3	Very low	133 Å²	133	146.6 Å²	146.6	82%	0.816	78%	0.782	S	S	*	*				177.6	124.9	126.3	40.5	0	0	0	0	114.6
98	S	28.1	Very low	29.2	Very low	114 Å²	114	147.6 Å²	147.6	80%	0.797	78%	0.782	S	S	*	*			trans	55.3	116.2	141.7	63.2	0	0	0	0	123.2
99	S	25.5	Very low	29.2	Very low	105 Å²	105	143.3 Å²	143.3	73%	0.734	78%	0.777	S	S	*	*			trans	-70.5	172.7	149.9	-35.9	0	0	0	0	111.5
100	P	32.9	Very low	29.1	Very low	130 Å²	130	140.8 Å²	140.8	84%	0.844	78%	0.784	S	S	*	*				-143.5	156.2	78.9	34.9	-16	0	0	0	117.2
101	T	25.9	Very low	29.1	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	78%	0.778	S	S	*	*			trans	-73.4	152.2	171.9	-29.9	0	0	0	0	112.1
102	W	22.4	Very low	29.1	Very low	241 Å²	241	133.3 Å²	133.3	91%	0.913	78%	0.779	S	S	*	*			trans	-141.4	121.3	162.2	-115.7	74	0	0	0	110.5
103	I	27.1	Very low	29.6	Very low	147 Å²	147	130.4 Å²	130.4	75%	0.754	77%	0.771	S	S	*	*			trans	-156.2	161.9	164.2	-45.5	175.8	0	0	0	105.6
104	P	39.9	Very low	29.7	Very low	97 Å²	97	128.9 Å²	128.9	63%	0.63	77%	0.771	S	S	*	*			cis	-123.9	177.5	-44.2	34.1	-19.5	0	0	0	112
105	H	27.5	Very low	28.9	Very low	189 Å²	189	129.5 Å²	129.5	88%	0.875	77%	0.773	S	S	*	*			trans	-130	130.5	146.2	-84.1	-70.7	0	0	0	111.9
106	S	28.6	Very low	28.9	Very low	92 Å²	92	134.5 Å²	134.5	64%	0.643	78%	0.781	S	S	*	*			trans	-86.3	155.6	175.1	46.9	0	0	0	0	112.7
107	N	27.7	Very low	28.2	Very low	145 Å²	145	133.4 Å²	133.4	78%	0.775	78%	0.781	S	S	*	*			trans	-165.2	116.4	139.9	-86.5	-25.5	0	0	0	107
108	L	28.2	Very low	28.9	Very low	158 Å²	158	132.8 Å²	132.8	83%	0.827	78%	0.78	S	S	*	*				59.4	128.2	88.4	-83	153.8	0	0	0	111.7
109	A	27.2	Very low	28.9	Very low	74 Å²	74	134.7 Å²	134.7	61%	0.612	79%	0.786	S	S	*	*			cis	-174.1	164.7	7.3	0	0	0	0	0	110.9
110	V	27.7	Very low	28.9	Very low	150 Å²	150	133.2 Å²	133.2	91%	0.909	79%	0.787	S	S	*	*			trans	77	126.1	140.9	178.9	0	0	0	0	120.6
111	G	27.1	Very low	28.7	Very low	76 Å²	76	132.7 Å²	132.7	78%	0.784	79%	0.787	S	S	*	*			trans	158.5	63.4	153.4	0	0	0	0	0	117.5
112	E	26.8	Very low	28.7	Very low	190 Å²	190	135.1 Å²	135.1	89%	0.888	79%	0.79	S	S	*	*			trans	-110	155.9	151	-105.8	-167.6	-164.8	0	0	106.9
113	P	36.7	Very low	28.9	Very low	110 Å²	110	134.3 Å²	134.3	71%	0.714	79%	0.787	S	S	*	*				-141.1	175.2	54.3	31.3	-7	0	0	0	113.1
114	S	27	Very low	28.9	Very low	110 Å²	110	135.6 Å²	135.6	77%	0.769	79%	0.787	S	S	*	*				-178.5	151	65.1	-36.4	0	0	0	0	112
115	T	25.3	Very low	28.3	Very low	122 Å²	122	139.8 Å²	139.8	75%	0.748	80%	0.798	S	S	*	*			trans	-62.5	150.3	175	-34.3	0	0	0	0	114.7
116	F	27.1	Very low	28.2	Very low	216 Å²	216	136.4 Å²	136.4	95%	0.947	80%	0.796	S	S	*	*				-172.2	145.1	128.7	-96.9	-71.1	0	0	0	110.6
117	A	27.4	Very low	28.2	Very low	88 Å²	88	137.4 Å²	137.4	73%	0.727	80%	0.803	S	S	*	*			trans	-103.5	-156.4	-163	0	0	0	0	0	113.2
118	P	41.4	Very low	28.3	Very low	121 Å²	121	136 Å²	136	79%	0.786	80%	0.802	S	S	*	*				-105	-178.1	-121.3	33.1	-12.1	0	0	0	113.8
119	V	26.7	Very low	28.4	Very low	154 Å²	154	134.4 Å²	134.4	93%	0.933	80%	0.801	S	S	*	*			trans	140.7	136.2	164.3	165.9	0	0	0	0	106.8
120	G	25.4	Very low	28.3	Very low	73 Å²	73	137.7 Å²	137.7	75%	0.753	81%	0.808	S	S	*	*			cis	-167.6	166.2	9.7	0	0	0	0	0	109.2
121	S	28.8	Very low	28.8	Very low	120 Å²	120	136.7 Å²	136.7	84%	0.839	80%	0.802	S	S	*	*			trans	-85.9	125	179.8	-158.4	0	0	0	0	109.2
122	E	26.3	Very low	28.8	Very low	164 Å²	164	142 Å²	142	77%	0.766	81%	0.807	S	S	*	*			trans	-130.3	119.1	160.2	-76.3	-158.7	158.2	0	0	110.7	F124	E122-F124 HydrophobicContact CB-CE2 4.43Å
123	R	27.8	Very low	28.8	Very low	224 Å²	224	138.7 Å²	138.7	85%	0.845	80%	0.799	S	S	*	*			trans	-74.1	125.6	166.5	-71	175.1	173	179.5	-2.3	108
124	F	25.9	Very low	28.3	Very low	174 Å²	174	141.8 Å²	141.8	76%	0.763	81%	0.809	S	S	*	*			trans	-121.1	122.9	155.4	-84.9	-81.9	0	0	0	110.1	E122	E122-F124 HydrophobicContact CB-CE2 4.43Å
125	H	27.2	Very low	28.5	Very low	185 Å²	185	143 Å²	143	86%	0.856	81%	0.812	S	S	*	*			trans	-67.7	134.4	164.7	-75.2	-84.5	0	0	0	109.4
126	S	26.4	Very low	28.8	Very low	119 Å²	119	142.1 Å²	142.1	83%	0.832	80%	0.799	S	S	*	*			trans	-140.5	117.8	162.2	48.2	0	0	0	0	109.7
127	S	28.3	Very low	29.5	Very low	112 Å²	112	135.9 Å²	135.9	78%	0.783	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-57.8	162.6	172.1	-55.8	0	0	0	0	112.3
128	P	29.7	Very low	30.2	Very low	117 Å²	117	138.7 Å²	138.7	76%	0.76	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-83.6	147.6	-162.4	34.3	-32.1	0	0	0	112
129	P	30.2	Very low	30.8	Very low	123 Å²	123	137 Å²	137	80%	0.799	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-89.7	119.4	162.9	28.8	-18	0	0	0	110.4
130	N	25.3	Very low	32.1	Very low	144 Å²	144	131.8 Å²	131.8	77%	0.77	73%	0.729	S	S	*	*			trans	10.1	122.4	146.9	-70.6	-26	0	0	0	119.4	E132	N130-E132 PolarHBondContact O-N 3.08Å
131	T	38.8	Very low	33.9	Very low	128 Å²	128	132.3 Å²	132.3	79%	0.785	72%	0.718	S	S	*	*				32.5	81.1	130	-39.7	0	0	0	0	116.5	V133	T131-V133 PolarHBondContact O-N 3.04Å
132	E	26.7	Very low	36.1	Very low	189 Å²	189	128 Å²	128	88%	0.883	69%	0.688	S	S	*	*			trans	-76.7	115	157.2	-78.1	-172.2	162	0	0	109.4	N130 L134	N130-E132 PolarHBondContact O-N 3.08Å; E132-L134 PolarHBondContact O-N 3.14Å
133	V	26.5	Very low	39	Very low	120 Å²	120	120.7 Å²	120.7	73%	0.727	65%	0.654	S	S	*	*			trans	-51	125.2	166.7	173	0	0	0	0	108.7	T131 T135	T131-V133 PolarHBondContact O-N 3.04Å; V133-T135 PolarHBondContact O-N 3.06Å
134	L	26.7	Very low	41.7	Very low	175 Å²	175	116.7 Å²	116.7	92%	0.916	64%	0.639	S	S	*	*			trans	-52.2	94.6	172.4	-77.1	154	0	0	0	110.5	E132 E136	E132-L134 PolarHBondContact O-N 3.14Å; L134-E136 PolarHBondContact O-N 3.41Å
135	T	29.8	Very low	44.8	Very low	134 Å²	134	112.7 Å²	112.7	82%	0.822	63%	0.628	S	S	*	*			trans	-68.9	112.9	167	24.9	0	0	0	0	109	V133	V133-T135 PolarHBondContact O-N 3.06Å
136	E	33.1	Very low	47.9	Very low	104 Å²	104	105 Å²	105	49%	0.486	59%	0.593	S	S	.	*			trans	-52.8	141.2	168.8	-84.4	-163.2	174.2	0	0	110.2	L134 Q138 R144	L134-E136 PolarHBondContact O-N 3.41Å; E136-Q138 PolarHBondContact O-N 3.22Å; E136-R144 IonicContact OE1-NH2 2.95Å; E136-R144 PolarHBondContact OE1-NH2 2.76Å; E136-R144 IonicContact OE2-CZ 3.87Å; E136-R144 IonicContact OE2-NH2 2.99Å; E136-R144 PolarHBondContact OE2-NH2 3.25Å
137	P	40.8	Very low	51.1	Low	86 Å²	86	101.8 Å²	101.8	56%	0.558	57%	0.568	S	S	*	*			trans	-64.5	124.5	179.5	23.9	-30.5	0	0	0	110.6	N139 L140	P137-N139 PolarHBondContact O-N 3.5Å; P137-L140 WeakPolarHBondContact O-CB 3.44Å; P137-L140 PolarHBondContact O-N 3.46Å
138	Q	42.5	Very low	54.3	Low	147 Å²	147	102.3 Å²	102.3	69%	0.687	56%	0.556	S	S	*	*	H	α-helix	trans	-50.1	-22.6	-173.6	-66.2	175.3	-14.7	0	0	115.3	E136 T141 S142	E136-Q138 PolarHBondContact O-N 3.22Å; Q138-T141 PolarHBondContact O-N 2.85Å; Q138-S142 PolarHBondContact O-N 3.11Å; Q138-S142 PolarHBondContact O-OG 3.16Å
139	N	54.3	Low	57.4	Low	84 Å²	84	99.7 Å²	99.7	45%	0.449	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-31.6	173.8	-74.8	-40.9	0	0	0	114	V47 P137 S142 L143	V47-N139 VanDerWaalsContact CG2-ND2 3.26Å; V47-N139 WeakPolarHBondContact CG2-ND2 3.49Å; P137-N139 PolarHBondContact O-N 3.5Å; N139-S142 PolarHBondContact O-N 2.94Å; N139-L143 PolarHBondContact O-N 2.89Å; N139-L143 VanDerWaalsContact O-N 3.16Å
140	L	54.7	Low	60.6	Low	45 Å²	45	100 Å²	100	24%	0.236	52%	0.524	C	S	.	.	H	α-helix	trans	-68.6	-40	178.6	-124.4	84.6	0	0	0	110.4	P137 S142 L143 R144	P137-L140 WeakPolarHBondContact O-CB 3.44Å; P137-L140 PolarHBondContact O-N 3.46Å; L140-S142 VanDerWaalsContact C-N 3.3Å; L140-S142 PolarHBondContact O-N 2.88Å; L140-L143 PolarHBondContact O-N 2.87Å; L140-R144 WeakPolarHBondContact O-CG 3.41Å; L140-R144 PolarHBondContact O-N 3.09Å; L140-R144 VanDerWaalsContact O-N 3.09Å
141	T	61.3	Low	64	Low	85 Å²	85	93.3 Å²	93.3	52%	0.521	49%	0.489	S	S	.	.	H	α-helix	trans	-60.9	-39.2	178.1	-41.6	0	0	0	0	111.4	Q138	Q138-T141 PolarHBondContact O-N 2.85Å
142	S	76	Confident	66.9	Low	28 Å²	28	87.2 Å²	87.2	20%	0.196	45%	0.451	C	S	.	.	H	α-helix	trans	-71.8	-36.4	175.9	-55.2	0	0	0	0	113.5	L44 Q138 N139 L140 R144 V145	L44-S142 WeakPolarHBondContact CD2-OG 3.43Å; Q138-S142 PolarHBondContact O-N 3.11Å; Q138-S142 PolarHBondContact O-OG 3.16Å; N139-S142 PolarHBondContact O-N 2.94Å; L140-S142 VanDerWaalsContact C-N 3.3Å; L140-S142 PolarHBondContact O-N 2.88Å; S142-R144 VanDerWaalsContact C-N 3.34Å; S142-V145 PolarHBondContact O-N 3.48Å
143	L	86.3	Confident	70.2	Confident	12 Å²	12	79 Å²	79	6%	0.063	42%	0.418	C	S	.	.	H	α-helix	trans	-68.2	-34.3	178.2	-172.5	59.9	0	0	0	112.1	N139 L140 V145 F146 V156 V288 P292 L373	N139-L143 PolarHBondContact O-N 2.89Å; N139-L143 VanDerWaalsContact O-N 3.16Å; L140-L143 PolarHBondContact O-N 2.87Å; L143-V145 PolarHBondContact O-N 2.76Å; L143-V145 VanDerWaalsContact O-N 3.16Å; L143-F146 PolarHBondContact O-N 3.24Å; L143-V156 HydrophobicContact CD2-CG1 4.23Å; L143-V156 HydrophobicContact CD2-CG2 3.89Å; L143-V156 HydrophobicContact CG-CG2 4.16Å; L143-V288 HydrophobicContact CD1-CB 4.16Å; L143-V288 HydrophobicContact CD1-CG2 4.04Å; L143-P292 HydrophobicContact CD1-CG 4.22Å; L143-P292 HydrophobicContact CD2-CG 4.05Å; L143-L373 HydrophobicContact CD1-CD1 4.12Å
144	R	85.4	Confident	73.6	Confident	140 Å²	140	74.5 Å²	74.5	53%	0.528	39%	0.389	S	S	.	.	H	α-helix	trans	-56.4	-29.4	178.7	-76.3	-179.4	-170.5	-156.5	10.8	113.4	E136 L140 S142 F146 V147	E136-R144 IonicContact OE1-NH2 2.95Å; E136-R144 PolarHBondContact OE1-NH2 2.76Å; E136-R144 IonicContact OE2-CZ 3.87Å; E136-R144 IonicContact OE2-NH2 2.99Å; E136-R144 PolarHBondContact OE2-NH2 3.25Å; L140-R144 WeakPolarHBondContact O-CG 3.41Å; L140-R144 PolarHBondContact O-N 3.09Å; L140-R144 VanDerWaalsContact O-N 3.09Å; S142-R144 VanDerWaalsContact C-N 3.34Å; R144-F146 PolarHBondContact O-N 3.24Å; R144-V147 WeakPolarHBondContact O-CB 3.49Å; R144-V147 PolarHBondContact O-N 2.99Å
145	V	90.1	Very high	77	Confident	89 Å²	89	66.2 Å²	66.2	54%	0.539	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-28.4	176.3	-179.5	0	0	0	0	112.2	S142 L143 K148	S142-V145 PolarHBondContact O-N 3.48Å; L143-V145 PolarHBondContact O-N 2.76Å; L143-V145 VanDerWaalsContact O-N 3.16Å; V145-K148 WeakPolarHBondContact O-CE 3.35Å
146	F	92.6	Very high	80.2	Confident	25 Å²	25	60.5 Å²	60.5	11%	0.11	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	7.2	179.6	-58.6	-72.5	0	0	0	113.5	L143 R144 K148 V288 R289 S372 L373	L143-F146 PolarHBondContact O-N 3.24Å; R144-F146 PolarHBondContact O-N 3.24Å; F146-K148 PolarHBondContact O-N 3.49Å; F146-V288 HydrophobicContact CD2-CG2 3.76Å; F146-V288 HydrophobicContact CE2-CG2 3.72Å; F146-R289 HydrophobicContact CB-CG 4.04Å; F146-R289 HydrophobicContact CD1-CG 4.3Å; F146-R289 HydrophobicContact CD2-CG 3.8Å; F146-R289 HydrophobicContact CE2-CG 4.3Å; F146-R289 HydrophobicContact CG-CG 3.78Å; F146-S372 WeakPolarHBondContact O-CA 3.36Å; F146-S372 WeakPolarHBondContact O-CB 3.26Å; F146-L373 PolarHBondContact O-N 2.93Å
147	V	94.9	Very high	83.2	Confident	51 Å²	51	59.8 Å²	59.8	31%	0.309	31%	0.309	S	S	.	.			trans	-97.9	81.2	173.8	-174.9	0	0	0	0	108.6	R144 V156	R144-V147 WeakPolarHBondContact O-CB 3.49Å; R144-V147 PolarHBondContact O-N 2.99Å; V147-V156 HydrophobicContact CG2-CG2 3.6Å
148	K	94.1	Very high	85.8	Confident	122 Å²	122	55.7 Å²	55.7	53%	0.53	28%	0.283	S	S	.	.			trans	-100.1	-9.6	-174.9	-61.7	-178.6	-179.2	171.3	0	113.7	V145 F146 Q370	V145-K148 WeakPolarHBondContact O-CE 3.35Å; F146-K148 PolarHBondContact O-N 3.49Å; K148-Q370 PolarHBondContact NZ-O 3.13Å
149	D	95.5	Very high	88.4	Confident	62 Å²	62	49.4 Å²	49.4	33%	0.332	25%	0.253	S	S	.	.	S	Bend	trans	-152.7	170.8	-172.5	63.7	69.6	0	0	0	111.8	L151 S152 G153 S372	D149-L151 VanDerWaalsContact C-N 3.33Å; D149-L151 PolarHBondContact O-N 3.42Å; D149-L151 VanDerWaalsContact OD1-CA 3.32Å; D149-L151 WeakPolarHBondContact OD1-CA 3.34Å; D149-L151 VanDerWaalsContact OD1-CB 3.22Å; D149-L151 WeakPolarHBondContact OD1-CB 3.43Å; D149-L151 PolarHBondContact OD1-N 3.24Å; D149-S152 PolarHBondContact O-N 3.28Å; D149-S152 PolarHBondContact OD1-N 2.87Å; D149-S152 PolarHBondContact OD1-OG 3.39Å; D149-S152 PolarHBondContact OD2-OG 2.97Å; D149-G153 PolarHBondContact O-N 3.34Å; D149-S372 PolarHBondContact OD2-OG 3.11Å
150	K	96.7	Very high	90.3	Very high	130 Å²	130	48.8 Å²	48.8	57%	0.565	25%	0.248	S	C	*	.	H	α-helix	trans	-56.1	-43.7	179.3	-176	-170.2	-178.4	-171.1	0	112.7	G153 Q154 D456	K150-G153 PolarHBondContact O-N 3.44Å; K150-Q154 WeakPolarHBondContact O-CG 3.43Å; K150-Q154 PolarHBondContact O-N 2.77Å; K150-D456 IonicContact NZ-OD2 3.71Å; K150-D456 PolarHBondContact NZ-OD2 2.85Å
151	L	98	Very high	92.1	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-46.3	-178.3	170.5	59.7	0	0	0	110.3	D149 G153 Q154 M155 L377 L451 L457	D149-L151 VanDerWaalsContact C-N 3.33Å; D149-L151 PolarHBondContact O-N 3.42Å; D149-L151 VanDerWaalsContact OD1-CA 3.32Å; D149-L151 WeakPolarHBondContact OD1-CA 3.34Å; D149-L151 VanDerWaalsContact OD1-CB 3.22Å; D149-L151 WeakPolarHBondContact OD1-CB 3.43Å; D149-L151 PolarHBondContact OD1-N 3.24Å; L151-G153 VanDerWaalsContact C-N 3.31Å; L151-G153 PolarHBondContact O-N 2.94Å; L151-Q154 PolarHBondContact O-N 2.85Å; L151-M155 HydrophobicContact CD1-CG 4.43Å; L151-M155 HydrophobicContact CD1-SD 4.5Å; L151-M155 HydrophobicContact CG-SD 4.39Å; L151-M155 VanDerWaalsContact O-CG 3.3Å; L151-M155 WeakPolarHBondContact O-CG 3.32Å; L151-M155 PolarHBondContact O-N 3.03Å; L151-L377 HydrophobicContact CD1-CD2 4.26Å; L151-L451 HydrophobicContact CD1-CD1 3.82Å; L151-L451 HydrophobicContact CD2-CD1 4.05Å; L151-L451 HydrophobicContact CD2-CD2 3.99Å; L151-L451 HydrophobicContact CD2-CG 4.05Å; L151-L457 HydrophobicContact CD1-CB 3.76Å; L151-L457 HydrophobicContact CD1-CD1 4.25Å
152	S	98.1	Very high	93.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.2	-42	175.3	-60.1	0	0	0	0	111.5	D149 M155 V156 G374	D149-S152 PolarHBondContact O-N 3.28Å; D149-S152 PolarHBondContact OD1-N 2.87Å; D149-S152 PolarHBondContact OD1-OG 3.39Å; D149-S152 PolarHBondContact OD2-OG 2.97Å; S152-M155 WeakPolarHBondContact O-CB 3.41Å; S152-M155 PolarHBondContact O-N 3.02Å; S152-V156 PolarHBondContact O-N 3.41Å; S152-V156 VanDerWaalsContact O-N 3.12Å; S152-G374 PolarHBondContact OG-N 2.68Å
153	G	97.4	Very high	94.7	Very high	17 Å²	17	43.6 Å²	43.6	18%	0.175	22%	0.215	C	C	.	.	H	α-helix	trans	-59.8	-50.3	175	0	0	0	0	0	112.2	D149 K150 L151 M155 V156 D157	D149-G153 PolarHBondContact O-N 3.34Å; K150-G153 PolarHBondContact O-N 3.44Å; L151-G153 VanDerWaalsContact C-N 3.31Å; L151-G153 PolarHBondContact O-N 2.94Å; G153-M155 VanDerWaalsContact C-N 3.25Å; G153-M155 PolarHBondContact O-N 2.73Å; G153-V156 PolarHBondContact O-N 3.02Å; G153-D157 PolarHBondContact O-N 3.08Å
154	Q	97.8	Very high	95	Very high	25 Å²	25	44.4 Å²	44.4	12%	0.117	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-32.2	177.7	-69.9	174.3	-48.5	0	0	113.3	K150 L151 L158 D456 L457 L463	K150-Q154 WeakPolarHBondContact O-CG 3.43Å; K150-Q154 PolarHBondContact O-N 2.77Å; L151-Q154 PolarHBondContact O-N 2.85Å; Q154-L158 WeakPolarHBondContact O-CB 3.19Å; Q154-L158 PolarHBondContact O-N 3.37Å; Q154-D456 PolarHBondContact NE2-OD1 3.15Å; Q154-D456 PolarHBondContact OE1-OD1 2.9Å; Q154-L457 HydrophobicContact CB-CB 3.86Å; Q154-L457 HydrophobicContact CB-CD2 4.15Å; Q154-L463 HydrophobicContact CB-CD2 3.94Å; Q154-L463 HydrophobicContact CG-CD2 4Å
155	M	97.9	Very high	95.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.9	-40.2	174	-71	175.6	65.3	0	0	111.8	L151 S152 G153 F159 L293 V296 L373 L377 L457	L151-M155 HydrophobicContact CD1-CG 4.43Å; L151-M155 HydrophobicContact CD1-SD 4.5Å; L151-M155 HydrophobicContact CG-SD 4.39Å; L151-M155 VanDerWaalsContact O-CG 3.3Å; L151-M155 WeakPolarHBondContact O-CG 3.32Å; L151-M155 PolarHBondContact O-N 3.03Å; S152-M155 WeakPolarHBondContact O-CB 3.41Å; S152-M155 PolarHBondContact O-N 3.02Å; G153-M155 VanDerWaalsContact C-N 3.25Å; G153-M155 PolarHBondContact O-N 2.73Å; M155-F159 WeakPolarHBondContact O-CB 3.22Å; M155-F159 PolarHBondContact O-N 2.95Å; M155-L293 HydrophobicContact CE-CD1 4Å; M155-V296 HydrophobicContact CB-CG2 3.9Å; M155-V296 HydrophobicContact CE-CB 4.29Å; M155-V296 HydrophobicContact CE-CG2 4.04Å; M155-V296 HydrophobicContact CG-CG1 4.42Å; M155-V296 HydrophobicContact CG-CG2 3.79Å; M155-L373 HydrophobicContact CE-CB 3.89Å; M155-L373 HydrophobicContact CE-CD2 4.11Å; M155-L373 HydrophobicContact SD-CB 3.92Å; M155-L377 HydrophobicContact CE-CB 3.92Å; M155-L377 HydrophobicContact CE-CD2 4.18Å; M155-L377 HydrophobicContact CG-CD2 4.32Å; M155-L377 HydrophobicContact SD-CB 3.88Å; M155-L377 HydrophobicContact SD-CD2 3.69Å; M155-L377 HydrophobicContact SD-CG 4.43Å; M155-L457 HydrophobicContact CG-CD2 4.05Å
156	V	96.8	Very high	95.5	Very high	15 Å²	15	41.6 Å²	41.6	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-46.1	175.3	174.9	0	0	0	0	110.7	L143 V147 S152 G153 L158 F159 E160 L373	L143-V156 HydrophobicContact CD2-CG1 4.23Å; L143-V156 HydrophobicContact CD2-CG2 3.89Å; L143-V156 HydrophobicContact CG-CG2 4.16Å; V147-V156 HydrophobicContact CG2-CG2 3.6Å; S152-V156 PolarHBondContact O-N 3.41Å; S152-V156 VanDerWaalsContact O-N 3.12Å; G153-V156 PolarHBondContact O-N 3.02Å; V156-L158 VanDerWaalsContact C-N 3.29Å; V156-L158 PolarHBondContact O-N 2.94Å; V156-F159 CarbonylContact O-C 3.5Å; V156-F159 WeakPolarHBondContact O-CA 3.22Å; V156-F159 WeakPolarHBondContact O-CB 3.44Å; V156-F159 PolarHBondContact O-N 3.29Å; V156-E160 HydrophobicContact CG1-CG 4.15Å; V156-E160 WeakPolarHBondContact O-CG 3.4Å; V156-E160 PolarHBondContact O-N 3.33Å; V156-L373 HydrophobicContact CG2-CD1 3.63Å
157	D	95.4	Very high	95.5	Very high	88 Å²	88	43.4 Å²	43.4	47%	0.471	23%	0.228	S	C	.	.	H	α-helix	trans	-55.1	-45.8	176.4	-63.3	-20.8	0	0	0	111.5	G153 A161	G153-D157 PolarHBondContact O-N 3.08Å; D157-A161 WeakPolarHBondContact O-CB 3.38Å; D157-A161 PolarHBondContact O-N 3.06Å; D157-A161 VanDerWaalsContact O-N 3.09Å
158	L	96.6	Very high	95.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-44.5	176.1	-178.6	67.1	0	0	0	111.3	Q154 V156 A161 C162 L295 V296 K299 L457 L461 L463 I466 I467	Q154-L158 WeakPolarHBondContact O-CB 3.19Å; Q154-L158 PolarHBondContact O-N 3.37Å; V156-L158 VanDerWaalsContact C-N 3.29Å; V156-L158 PolarHBondContact O-N 2.94Å; L158-A161 PolarHBondContact O-N 2.89Å; L158-C162 VanDerWaalsContact CD1-SG 3.51Å; L158-C162 WeakPolarHBondContact O-CB 3.3Å; L158-C162 PolarHBondContact O-N 3.42Å; L158-C162 PolarHBondContact O-SG 2.85Å; L158-L295 HydrophobicContact CD2-CD2 4.02Å; L158-L295 HydrophobicContact CG-CD2 3.85Å; L158-V296 HydrophobicContact CD2-CG2 3.88Å; L158-K299 HydrophobicContact CD2-CB 4.36Å; L158-K299 HydrophobicContact CD2-CG 4.4Å; L158-L457 HydrophobicContact CD2-CD2 4.21Å; L158-L461 HydrophobicContact CD2-CD2 3.6Å; L158-L463 HydrophobicContact CB-CD1 3.88Å; L158-L463 HydrophobicContact CD1-CD1 3.94Å; L158-L463 HydrophobicContact CD2-CD1 4.42Å; L158-L463 HydrophobicContact CG-CD1 4.28Å; L158-I466 HydrophobicContact CD1-CB 4.44Å; L158-I466 HydrophobicContact CD1-CG2 3.81Å; L158-I467 HydrophobicContact CD1-CG1 3.95Å
159	F	96.2	Very high	95.5	Very high	15 Å²	15	38 Å²	38	7%	0.066	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-47.2	-179.5	174	-105.1	0	0	0	111.7	M155 V156 A161 C162 Q163 R291 P292 L295	M155-F159 WeakPolarHBondContact O-CB 3.22Å; M155-F159 PolarHBondContact O-N 2.95Å; V156-F159 CarbonylContact O-C 3.5Å; V156-F159 WeakPolarHBondContact O-CA 3.22Å; V156-F159 WeakPolarHBondContact O-CB 3.44Å; V156-F159 PolarHBondContact O-N 3.29Å; F159-A161 PolarHBondContact O-N 2.76Å; F159-C162 PolarHBondContact O-N 2.93Å; F159-Q163 HydrophobicContact CD2-CB 4.32Å; F159-Q163 HydrophobicContact CE2-CB 3.94Å; F159-Q163 HydrophobicContact CZ-CB 4.09Å; F159-Q163 VanDerWaalsContact CZ-OE1 3.28Å; F159-Q163 VanDerWaalsContact O-CB 3.26Å; F159-Q163 WeakPolarHBondContact O-CB 3.36Å; F159-Q163 WeakPolarHBondContact O-CG 3.37Å; F159-Q163 PolarHBondContact O-N 3.02Å; F159-R291 HydrophobicContact CE2-CB 3.69Å; F159-R291 HydrophobicContact CZ-CB 3.94Å; F159-P292 HydrophobicContact CB-CB 4.03Å; F159-P292 HydrophobicContact CB-CG 4.38Å; F159-P292 HydrophobicContact CD1-CB 4.48Å; F159-P292 HydrophobicContact CD1-CG 3.91Å; F159-P292 HydrophobicContact CD2-CB 4.18Å; F159-P292 HydrophobicContact CD2-CG 4.08Å; F159-P292 HydrophobicContact CE1-CG 4.19Å; F159-P292 HydrophobicContact CE2-CG 4.38Å; F159-P292 HydrophobicContact CG-CB 3.97Å; F159-P292 HydrophobicContact CG-CG 3.85Å; F159-P292 HydrophobicContact CZ-CG 4.41Å; F159-L295 HydrophobicContact CD2-CB 4.14Å; F159-L295 HydrophobicContact CD2-CD1 3.77Å; F159-L295 HydrophobicContact CD2-CG 4.46Å; F159-L295 HydrophobicContact CE2-CD1 4.37Å
160	E	93.9	Very high	95.4	Very high	71 Å²	71	39.6 Å²	39.6	33%	0.332	21%	0.212	S	C	.	.	H	α-helix	trans	-62.8	-41.8	179.2	-71.1	-177.7	174	0	0	112.3	V156 C162	V156-E160 HydrophobicContact CG1-CG 4.15Å; V156-E160 WeakPolarHBondContact O-CG 3.4Å; V156-E160 PolarHBondContact O-N 3.33Å; E160-C162 VanDerWaalsContact C-N 3.35Å; E160-C162 PolarHBondContact O-N 3.38Å
161	A	94.2	Very high	95.3	Very high	10 Å²	10	39 Å²	39	8%	0.083	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-35.9	176.9	0	0	0	0	0	112.9	D157 L158 F159 I467	D157-A161 WeakPolarHBondContact O-CB 3.38Å; D157-A161 PolarHBondContact O-N 3.06Å; D157-A161 VanDerWaalsContact O-N 3.09Å; L158-A161 PolarHBondContact O-N 2.89Å; F159-A161 PolarHBondContact O-N 2.76Å; A161-I467 HydrophobicContact CB-CB 4.38Å; A161-I467 HydrophobicContact CB-CG1 4.05Å; A161-I467 HydrophobicContact CB-CG2 3.93Å
162	C	95.3	Very high	95.2	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-99.6	-24.3	-169.1	-63.6	0	0	0	0	114.7	L158 F159 E160 C204 R205 L295 E470	L158-C162 VanDerWaalsContact CD1-SG 3.51Å; L158-C162 WeakPolarHBondContact O-CB 3.3Å; L158-C162 PolarHBondContact O-N 3.42Å; L158-C162 PolarHBondContact O-SG 2.85Å; F159-C162 PolarHBondContact O-N 2.93Å; E160-C162 VanDerWaalsContact C-N 3.35Å; E160-C162 PolarHBondContact O-N 3.38Å; C162-C204 CarbonylContact O-C 3.55Å; C162-C204 WeakPolarHBondContact O-CA 3.48Å; C162-C204 WeakPolarHBondContact O-CB 3.3Å; C162-R205 PolarHBondContact O-N 3.4Å; C162-L295 HydrophobicContact CB-CD1 3.75Å; C162-L295 HydrophobicContact CB-CD2 3.95Å; C162-L295 HydrophobicContact CB-CG 4.38Å; C162-E470 HydrophobicContact CB-CG 4.47Å
163	Q	94.9	Very high	95.1	Very high	39 Å²	39	41.7 Å²	41.7	18%	0.182	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-60.2	142	-172	67.5	178.4	-42.5	0	0	111.3	F159 Q165 R205 R291	F159-Q163 HydrophobicContact CD2-CB 4.32Å; F159-Q163 HydrophobicContact CE2-CB 3.94Å; F159-Q163 HydrophobicContact CZ-CB 4.09Å; F159-Q163 VanDerWaalsContact CZ-OE1 3.28Å; F159-Q163 VanDerWaalsContact O-CB 3.26Å; F159-Q163 WeakPolarHBondContact O-CB 3.36Å; F159-Q163 WeakPolarHBondContact O-CG 3.37Å; F159-Q163 PolarHBondContact O-N 3.02Å; Q163-Q165 PolarHBondContact O-N 3.3Å; Q163-Q165 PolarHBondContact O-NE2 3.12Å; Q163-R205 VanDerWaalsContact O-CG 3.32Å; Q163-R205 WeakPolarHBondContact O-CG 3.26Å; Q163-R291 VanDerWaalsContact OE1-NH2 3.15Å
164	Q	93.9	Very high	95	Very high	29 Å²	29	43.9 Å²	43.9	14%	0.136	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-56.4	129.7	174	-175.4	179	-87.2	0	0	109.7	D168 S198 G203	Q164-D168 HydrophobicContact CG-CB 3.8Å; Q164-S198 PolarHBondContact NE2-O 2.87Å; Q164-G203 WeakPolarHBondContact CB-O 3.42Å; Q164-G203 PolarHBondContact N-O 3.33Å
165	Q	93.1	Very high	95	Very high	66 Å²	66	42.8 Å²	42.8	31%	0.308	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-90.7	164.2	175.5	-55.9	-58.2	-54.8	0	0	111.2	Q163 S167 D168 L169	Q163-Q165 PolarHBondContact O-N 3.3Å; Q163-Q165 PolarHBondContact O-NE2 3.12Å; Q165-S167 VanDerWaalsContact C-N 3.28Å; Q165-S167 PolarHBondContact O-N 3.03Å; Q165-D168 WeakPolarHBondContact CB-OD2 3.38Å; Q165-D168 PolarHBondContact N-OD2 2.98Å; Q165-D168 WeakPolarHBondContact O-CB 3.23Å; Q165-D168 PolarHBondContact O-N 3.31Å; Q165-D168 VanDerWaalsContact O-N 3.08Å; Q165-L169 PolarHBondContact O-N 2.92Å
166	T	93.4	Very high	95	Very high	105 Å²	105	43.9 Å²	43.9	64%	0.644	23%	0.234	S	C	*	.	H	α-helix	trans	-54.9	-45.6	174.1	-47.6	0	0	0	0	111.3	D168 L169 D170	T166-D168 PolarHBondContact O-N 3.31Å; T166-L169 PolarHBondContact O-N 3.17Å; T166-D170 PolarHBondContact O-N 3.06Å
167	S	92.5	Very high	95	Very high	62 Å²	62	45 Å²	45	43%	0.434	25%	0.245	S	C	.	.	H	α-helix	trans	-59	-33.1	177.2	59.7	0	0	0	0	114	Q165 R171	Q165-S167 VanDerWaalsContact C-N 3.28Å; Q165-S167 PolarHBondContact O-N 3.03Å; S167-R171 WeakPolarHBondContact O-CD 3.24Å; S167-R171 WeakPolarHBondContact O-CG 3.23Å; S167-R171 PolarHBondContact O-N 2.98Å
168	D	92.6	Very high	95.1	Very high	21 Å²	21	47 Å²	47	11%	0.112	25%	0.246	C	C	.	.	H	α-helix	trans	-70.6	-41.2	177.8	-54.9	-34.8	0	0	0	110	Q164 Q165 T166 K172 R205	Q164-D168 HydrophobicContact CG-CB 3.8Å; Q165-D168 WeakPolarHBondContact CB-OD2 3.38Å; Q165-D168 PolarHBondContact N-OD2 2.98Å; Q165-D168 WeakPolarHBondContact O-CB 3.23Å; Q165-D168 PolarHBondContact O-N 3.31Å; Q165-D168 VanDerWaalsContact O-N 3.08Å; T166-D168 PolarHBondContact O-N 3.31Å; D168-K172 WeakPolarHBondContact O-CG 3.34Å; D168-K172 PolarHBondContact O-N 2.92Å; D168-R205 IonicContact OD1-NH2 2.76Å
169	L	94.8	Very high	95.1	Very high	38 Å²	38	47 Å²	47	20%	0.199	25%	0.246	C	C	.	.	H	α-helix	trans	-69.7	-43.1	177.9	-176.2	57.2	0	0	0	112	Q165 T166 R171 K172 E173 L194 M199	Q165-L169 PolarHBondContact O-N 2.92Å; T166-L169 PolarHBondContact O-N 3.17Å; L169-R171 VanDerWaalsContact C-N 3.27Å; L169-R171 PolarHBondContact O-N 2.83Å; L169-K172 WeakPolarHBondContact O-CB 3.48Å; L169-K172 PolarHBondContact O-N 3.3Å; L169-K172 VanDerWaalsContact O-N 3.09Å; L169-E173 WeakPolarHBondContact O-CB 3.46Å; L169-E173 PolarHBondContact O-N 3.25Å; L169-L194 HydrophobicContact CD1-CD2 3.75Å; L169-M199 HydrophobicContact CD1-SD 3.95Å
170	D	94.6	Very high	95.2	Very high	96 Å²	96	47.3 Å²	47.3	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-59.1	-40.4	179.3	-64.8	-22.6	0	0	0	111.3	T166 E173 A174	T166-D170 PolarHBondContact O-N 3.06Å; D170-E173 PolarHBondContact O-N 3.09Å; D170-A174 WeakPolarHBondContact O-CB 3.3Å; D170-A174 PolarHBondContact O-N 3.01Å
171	R	93.3	Very high	95.4	Very high	119 Å²	119	48.1 Å²	48.1	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-64.6	-43.3	175	-71.4	172.2	66.3	173.8	8.6	112.3	S167 L169 E173 A174 C175	S167-R171 WeakPolarHBondContact O-CD 3.24Å; S167-R171 WeakPolarHBondContact O-CG 3.23Å; S167-R171 PolarHBondContact O-N 2.98Å; L169-R171 VanDerWaalsContact C-N 3.27Å; L169-R171 PolarHBondContact O-N 2.83Å; R171-E173 VanDerWaalsContact C-N 3.32Å; R171-A174 PolarHBondContact O-N 3.45Å; R171-C175 PolarHBondContact O-N 3.17Å; R171-C175 VanDerWaalsContact O-N 3.12Å
172	K	96	Very high	95.6	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-44	175.8	-70.8	172.7	174.9	-169.5	0	111	D168 L169 C175 R176 L194 S198 S207 D208 A209 L262	D168-K172 WeakPolarHBondContact O-CG 3.34Å; D168-K172 PolarHBondContact O-N 2.92Å; L169-K172 WeakPolarHBondContact O-CB 3.48Å; L169-K172 PolarHBondContact O-N 3.3Å; L169-K172 VanDerWaalsContact O-N 3.09Å; K172-C175 PolarHBondContact O-N 2.8Å; K172-R176 WeakPolarHBondContact O-CB 3.36Å; K172-R176 PolarHBondContact O-N 2.96Å; K172-L194 HydrophobicContact CB-CD1 4.46Å; K172-L194 HydrophobicContact CB-CD2 4Å; K172-S198 WeakPolarHBondContact CD-OG 3.36Å; K172-S198 PolarHBondContact NZ-OG 3.02Å; K172-S207 VanDerWaalsContact CE-O 3.31Å; K172-S207 WeakPolarHBondContact CE-O 3.2Å; K172-S207 PolarHBondContact NZ-O 3.32Å; K172-D208 PolarHBondContact NZ-O 3.01Å; K172-A209 HydrophobicContact CD-CB 4.1Å; K172-A209 HydrophobicContact CG-CB 4.02Å; K172-L262 HydrophobicContact CB-CD2 4.49Å; K172-L262 HydrophobicContact CD-CD1 4.39Å; K172-L262 HydrophobicContact CG-CD1 3.88Å; K172-L262 HydrophobicContact CG-CD2 3.69Å; K172-L262 HydrophobicContact CG-CG 4.4Å
173	E	96.7	Very high	95.7	Very high	55 Å²	55	49.2 Å²	49.2	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-68.3	-40.7	-179.8	-177.2	53.5	-151.4	0	0	112.1	L169 D170 R171 C175 R176 A177	L169-E173 WeakPolarHBondContact O-CB 3.46Å; L169-E173 PolarHBondContact O-N 3.25Å; D170-E173 PolarHBondContact O-N 3.09Å; R171-E173 VanDerWaalsContact C-N 3.32Å; E173-C175 VanDerWaalsContact C-N 3.34Å; E173-C175 PolarHBondContact O-N 2.89Å; E173-R176 WeakPolarHBondContact O-CB 3.33Å; E173-R176 PolarHBondContact O-N 3.46Å; E173-R176 IonicContact OE1-CZ 2.95Å; E173-R176 IonicContact OE1-NE 3.83Å; E173-R176 PolarHBondContact OE1-NE 2.99Å; E173-R176 IonicContact OE1-NH2 3.78Å; E173-R176 PolarHBondContact OE1-NH2 3.29Å; E173-R176 WeakPolarHBondContact OE2-CD 3.48Å; E173-R176 IonicContact OE2-NE 2.75Å; E173-R176 PolarHBondContact OE2-NE 2.93Å; E173-A177 WeakPolarHBondContact O-CB 3.25Å; E173-A177 PolarHBondContact O-N 2.99Å
174	A	95.9	Very high	95.7	Very high	63 Å²	63	50.8 Å²	50.8	52%	0.521	27%	0.269	S	S	.	.	H	α-helix	trans	-59.6	-43.8	174.3	0	0	0	0	0	112	D170 R171 A177 R178	D170-A174 WeakPolarHBondContact O-CB 3.3Å; D170-A174 PolarHBondContact O-N 3.01Å; R171-A174 PolarHBondContact O-N 3.45Å; A174-A177 PolarHBondContact O-N 3.26Å; A174-R178 PolarHBondContact O-N 3.43Å
175	C	96.2	Very high	95.8	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.02	29%	0.293	C	S	.	.	H	α-helix	trans	-65.5	-44.1	175.2	-175	0	0	0	0	111.8	R171 K172 E173 A177 R178 L179 F264	R171-C175 PolarHBondContact O-N 3.17Å; R171-C175 VanDerWaalsContact O-N 3.12Å; K172-C175 PolarHBondContact O-N 2.8Å; E173-C175 VanDerWaalsContact C-N 3.34Å; E173-C175 PolarHBondContact O-N 2.89Å; C175-A177 PolarHBondContact O-N 3.15Å; C175-R178 PolarHBondContact O-N 2.91Å; C175-L179 WeakPolarHBondContact O-CB 3.34Å; C175-L179 WeakPolarHBondContact O-CG 3.38Å; C175-L179 PolarHBondContact O-N 3.12Å; C175-F264 HydrophobicContact CB-CE1 4.01Å; C175-F264 HydrophobicContact CB-CE2 4.17Å; C175-F264 HydrophobicContact CB-CZ 3.42Å; C175-F264 VanDerWaalsContact CB-CZ 3.42Å; C175-F264 VanDerWaalsContact SG-CE2 3.6Å; C175-F264 WeakPolarHBondContact SG-CZ 3.42Å
176	R	97.9	Very high	95.7	Very high	22 Å²	22	58.1 Å²	58.1	8%	0.083	30%	0.301	C	S	.	.	H	α-helix	trans	-57.1	-47.9	175	-175.2	-146.6	66.9	70.3	6.9	111.3	K172 E173 R178 L179 Q180 L192 L211	K172-R176 WeakPolarHBondContact O-CB 3.36Å; K172-R176 PolarHBondContact O-N 2.96Å; E173-R176 WeakPolarHBondContact O-CB 3.33Å; E173-R176 PolarHBondContact O-N 3.46Å; E173-R176 IonicContact OE1-CZ 2.95Å; E173-R176 IonicContact OE1-NE 3.83Å; E173-R176 PolarHBondContact OE1-NE 2.99Å; E173-R176 IonicContact OE1-NH2 3.78Å; E173-R176 PolarHBondContact OE1-NH2 3.29Å; E173-R176 WeakPolarHBondContact OE2-CD 3.48Å; E173-R176 IonicContact OE2-NE 2.75Å; E173-R176 PolarHBondContact OE2-NE 2.93Å; R176-R178 VanDerWaalsContact C-N 3.35Å; R176-R178 PolarHBondContact O-N 3.1Å; R176-L179 PolarHBondContact O-N 3.44Å; R176-Q180 WeakPolarHBondContact O-CB 3.02Å; R176-Q180 PolarHBondContact O-N 3.17Å; R176-L192 WeakPolarHBondContact CD-O 3.28Å; R176-L192 HydrophobicContact CG-CD2 3.91Å; R176-L192 HydrophobicContact CG-CG 4.06Å; R176-L192 PolarHBondContact NH1-O 3.08Å; R176-L211 HydrophobicContact CB-CD2 4.14Å; R176-L211 HydrophobicContact CG-CD2 3.81Å
177	A	97.6	Very high	95.7	Very high	39 Å²	39	55 Å²	55	32%	0.322	28%	0.279	S	S	.	.	H	α-helix	trans	-61.9	-41.9	179.8	0	0	0	0	0	111.9	E173 A174 C175 Q180 V181	E173-A177 WeakPolarHBondContact O-CB 3.25Å; E173-A177 PolarHBondContact O-N 2.99Å; A174-A177 PolarHBondContact O-N 3.26Å; C175-A177 PolarHBondContact O-N 3.15Å; A177-Q180 WeakPolarHBondContact O-CB 3.41Å; A177-Q180 PolarHBondContact O-N 3.29Å; A177-V181 PolarHBondContact O-N 3.47Å
178	R	97.3	Very high	95.7	Very high	129 Å²	129	56.5 Å²	56.5	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-47.4	174.5	-174	178.4	-178.5	168	3.7	112.1	A174 C175 R176 Q180 V181 D182 Y239	A174-R178 PolarHBondContact O-N 3.43Å; C175-R178 PolarHBondContact O-N 2.91Å; R176-R178 VanDerWaalsContact C-N 3.35Å; R176-R178 PolarHBondContact O-N 3.1Å; R178-Q180 VanDerWaalsContact C-N 3.31Å; R178-Q180 PolarHBondContact O-N 3.37Å; R178-V181 PolarHBondContact O-N 3.2Å; R178-D182 PolarHBondContact O-N 3.45Å; R178-Y239 HydrophobicContact CG-CE1 4.35Å; R178-Y239 HydrophobicContact CG-CE2 4.37Å
179	L	97.9	Very high	95.6	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-38.6	177.2	-75.3	167.2	0	0	0	112.4	C175 R176 V181 D182 I183 L192 L211 F234 Y239 L240 F255	C175-L179 WeakPolarHBondContact O-CB 3.34Å; C175-L179 WeakPolarHBondContact O-CG 3.38Å; C175-L179 PolarHBondContact O-N 3.12Å; R176-L179 PolarHBondContact O-N 3.44Å; L179-V181 VanDerWaalsContact C-N 3.32Å; L179-V181 PolarHBondContact O-N 3.03Å; L179-D182 PolarHBondContact O-N 2.96Å; L179-I183 HydrophobicContact CB-CD1 4.47Å; L179-I183 WeakPolarHBondContact O-CB 3.49Å; L179-I183 WeakPolarHBondContact O-CG1 3.29Å; L179-I183 PolarHBondContact O-N 3.24Å; L179-L192 HydrophobicContact CB-CD2 3.65Å; L179-L211 HydrophobicContact CD1-CD1 3.86Å; L179-F234 HydrophobicContact CD2-CE1 4.06Å; L179-F234 HydrophobicContact CD2-CE2 4.05Å; L179-F234 HydrophobicContact CD2-CZ 3.7Å; L179-Y239 HydrophobicContact CD2-CE2 4.35Å; L179-Y239 WeakPolarHBondContact CD2-OH 3.5Å; L179-L240 HydrophobicContact CD2-CD1 3.91Å; L179-F255 HydrophobicContact CD1-CE2 3.79Å; L179-F255 HydrophobicContact CD1-CZ 3.6Å
180	Q	98.1	Very high	95.6	Very high	23 Å²	23	60.1 Å²	60.1	11%	0.107	30%	0.303	C	S	.	.	H	α-helix	trans	-54.1	-49.5	175.5	173.4	65.9	13.5	0	0	111	R176 A177 R178 D182 I183 Q184 S190 L192	R176-Q180 WeakPolarHBondContact O-CB 3.02Å; R176-Q180 PolarHBondContact O-N 3.17Å; A177-Q180 WeakPolarHBondContact O-CB 3.41Å; A177-Q180 PolarHBondContact O-N 3.29Å; R178-Q180 VanDerWaalsContact C-N 3.31Å; R178-Q180 PolarHBondContact O-N 3.37Å; Q180-D182 VanDerWaalsContact C-N 3.35Å; Q180-D182 PolarHBondContact O-N 3.47Å; Q180-I183 PolarHBondContact O-N 3.3Å; Q180-Q184 WeakPolarHBondContact O-CB 3.44Å; Q180-Q184 VanDerWaalsContact O-CG 3.27Å; Q180-Q184 WeakPolarHBondContact O-CG 3.28Å; Q180-Q184 PolarHBondContact O-N 3.02Å; Q180-S190 PolarHBondContact NE2-O 2.9Å; Q180-L192 HydrophobicContact CB-CB 4.34Å
181	V	97.8	Very high	95.7	Very high	88 Å²	88	58.6 Å²	58.6	53%	0.533	29%	0.29	S	S	.	.	H	α-helix	trans	-61.8	-43.3	179.2	175.4	0	0	0	0	111.3	A177 R178 L179 Q184	A177-V181 PolarHBondContact O-N 3.47Å; R178-V181 PolarHBondContact O-N 3.2Å; L179-V181 VanDerWaalsContact C-N 3.32Å; L179-V181 PolarHBondContact O-N 3.03Å; V181-Q184 PolarHBondContact O-N 2.97Å
182	D	97.6	Very high	95.9	Very high	30 Å²	30	52.9 Å²	52.9	16%	0.16	27%	0.268	C	S	.	.	H	α-helix	trans	-68.3	-39.8	-179.9	-75.8	-36.7	0	0	0	112.6	R178 L179 Q180 K185 L237 Y239	R178-D182 PolarHBondContact O-N 3.45Å; L179-D182 PolarHBondContact O-N 2.96Å; Q180-D182 VanDerWaalsContact C-N 3.35Å; Q180-D182 PolarHBondContact O-N 3.47Å; D182-K185 WeakPolarHBondContact O-CB 3.19Å; D182-K185 PolarHBondContact O-N 3.34Å; D182-K185 IonicContact OD1-NZ 2.7Å; D182-K185 PolarHBondContact OD1-NZ 3.43Å; D182-L237 HydrophobicContact CB-CD1 4.22Å; D182-Y239 PolarHBondContact OD2-OH 3.42Å
183	I	96.9	Very high	96	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-39.5	176.9	-68	169.1	0	0	0	111	L179 Q180 K185 Q186 F187 L192 L213 L230 F234 L266	L179-I183 HydrophobicContact CB-CD1 4.47Å; L179-I183 WeakPolarHBondContact O-CB 3.49Å; L179-I183 WeakPolarHBondContact O-CG1 3.29Å; L179-I183 PolarHBondContact O-N 3.24Å; Q180-I183 PolarHBondContact O-N 3.3Å; I183-K185 PolarHBondContact O-N 3.32Å; I183-K185 VanDerWaalsContact O-N 3.15Å; I183-Q186 PolarHBondContact O-N 3.18Å; I183-F187 HydrophobicContact CG2-CB 4.36Å; I183-F187 HydrophobicContact CG2-CD2 4.04Å; I183-F187 PolarHBondContact O-N 3.47Å; I183-L192 HydrophobicContact CD1-CD1 4.2Å; I183-L192 HydrophobicContact CD1-CD2 4.04Å; I183-L213 HydrophobicContact CD1-CD1 4.34Å; I183-L213 HydrophobicContact CG2-CD1 3.78Å; I183-L213 HydrophobicContact CG2-CD2 3.77Å; I183-L213 HydrophobicContact CG2-CG 4.46Å; I183-L230 HydrophobicContact CG1-CD2 3.91Å; I183-L230 HydrophobicContact CG2-CD2 4.23Å; I183-F234 HydrophobicContact CD1-CE1 4.46Å; I183-F234 HydrophobicContact CD1-CZ 4.1Å; I183-F234 HydrophobicContact CG1-CE1 4.01Å; I183-F234 HydrophobicContact CG1-CZ 4.16Å; I183-L266 HydrophobicContact CD1-CD1 4.09Å
184	Q	96.1	Very high	96	Very high	73 Å²	73	50.9 Å²	50.9	34%	0.341	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-18.5	-178.9	-79.7	-179.7	-44.1	0	0	114	Q180 V181 Q186 F187 P188 S190	Q180-Q184 WeakPolarHBondContact O-CB 3.44Å; Q180-Q184 VanDerWaalsContact O-CG 3.27Å; Q180-Q184 WeakPolarHBondContact O-CG 3.28Å; Q180-Q184 PolarHBondContact O-N 3.02Å; V181-Q184 PolarHBondContact O-N 2.97Å; Q184-Q186 PolarHBondContact O-N 2.97Å; Q184-F187 WeakPolarHBondContact CA-O 3.16Å; Q184-F187 CarbonylContact O-C 3.51Å; Q184-P188 WeakPolarHBondContact O-CA 3.39Å; Q184-S190 PolarHBondContact NE2-O 2.87Å
185	K	95.1	Very high	96.1	Very high	145 Å²	145	48.1 Å²	48.1	63%	0.63	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-32.1	171	-65.2	169.7	-178.2	165.9	0	112.4	D182 I183	D182-K185 WeakPolarHBondContact O-CB 3.19Å; D182-K185 PolarHBondContact O-N 3.34Å; D182-K185 IonicContact OD1-NZ 2.7Å; D182-K185 PolarHBondContact OD1-NZ 3.43Å; I183-K185 PolarHBondContact O-N 3.32Å; I183-K185 VanDerWaalsContact O-N 3.15Å
186	Q	91.8	Very high	96.1	Very high	104 Å²	104	49 Å²	49	49%	0.486	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-31.2	179.6	-63.6	-73.7	23.2	0	0	112.3	I183 Q184	I183-Q186 PolarHBondContact O-N 3.18Å; Q184-Q186 PolarHBondContact O-N 2.97Å
187	F	93.5	Very high	95.9	Very high	38 Å²	38	49 Å²	49	17%	0.167	25%	0.248	C	C	.	.			trans	-126.8	77.3	-178.3	-56.2	-81.1	0	0	0	110.3	I183 Q184 E189 S190 V215 V226 Q229 L230	I183-F187 HydrophobicContact CG2-CB 4.36Å; I183-F187 HydrophobicContact CG2-CD2 4.04Å; I183-F187 PolarHBondContact O-N 3.47Å; Q184-F187 WeakPolarHBondContact CA-O 3.16Å; Q184-F187 CarbonylContact O-C 3.51Å; F187-E189 VanDerWaalsContact C-N 3.32Å; F187-E189 PolarHBondContact O-N 2.93Å; F187-S190 WeakPolarHBondContact CB-OG 3.37Å; F187-S190 VanDerWaalsContact O-CB 3.26Å; F187-S190 WeakPolarHBondContact O-CB 3.31Å; F187-S190 PolarHBondContact O-N 3.38Å; F187-S190 VanDerWaalsContact O-N 3.13Å; F187-S190 PolarHBondContact O-OG 3.33Å; F187-V215 HydrophobicContact CD1-CG1 4.28Å; F187-V226 HydrophobicContact CE1-CG1 4.26Å; F187-V226 HydrophobicContact CE1-CG2 4.24Å; F187-V226 HydrophobicContact CE2-CG1 4.07Å; F187-V226 HydrophobicContact CZ-CB 4.39Å; F187-V226 HydrophobicContact CZ-CG1 3.84Å; F187-V226 HydrophobicContact CZ-CG2 4.38Å; F187-Q229 HydrophobicContact CZ-CG 4.45Å; F187-L230 HydrophobicContact CD2-CD2 4.29Å; F187-L230 HydrophobicContact CE2-CD2 3.91Å; F187-L230 HydrophobicContact CE2-CG 4.32Å
188	P	92.6	Very high	95.9	Very high	95 Å²	95	47.2 Å²	47.2	62%	0.617	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-38.8	-171.7	-26.6	35.5	0	0	0	114.1	Q184 S190	Q184-P188 WeakPolarHBondContact O-CA 3.39Å; P188-S190 PolarHBondContact O-N 3.45Å
189	E	91	Very high	95.9	Very high	131 Å²	131	42.4 Å²	42.4	61%	0.612	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	29.8	179.8	-58.3	-176.2	165.3	0	0	112.7	F187 T216	F187-E189 VanDerWaalsContact C-N 3.32Å; F187-E189 PolarHBondContact O-N 2.93Å; E189-T216 PolarHBondContact O-N 3.35Å; E189-T216 VanDerWaalsContact O-N 3.11Å; E189-T216 PolarHBondContact O-OG1 2.82Å
190	S	94.1	Very high	95.8	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.028	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	153	179.6	74	0	0	0	0	113.4	Q180 Q184 F187 P188 V214	Q180-S190 PolarHBondContact NE2-O 2.9Å; Q184-S190 PolarHBondContact NE2-O 2.87Å; F187-S190 WeakPolarHBondContact CB-OG 3.37Å; F187-S190 VanDerWaalsContact O-CB 3.26Å; F187-S190 WeakPolarHBondContact O-CB 3.31Å; F187-S190 PolarHBondContact O-N 3.38Å; F187-S190 VanDerWaalsContact O-N 3.13Å; F187-S190 PolarHBondContact O-OG 3.33Å; P188-S190 PolarHBondContact O-N 3.45Å; S190-V214 CarbonylContact C-O 3.49Å; S190-V214 WeakPolarHBondContact CA-O 3.47Å; S190-V214 WeakPolarHBondContact CB-O 3.49Å
191	R	95.8	Very high	95.6	Very high	63 Å²	63	42 Å²	42	24%	0.238	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	128	179	-170.1	167.3	-177.2	146.5	0.7	111.9	Y52 Y193 V214 D353	Y52-R191 VanDerWaalsContact CE1-NH2 3.34Å; R191-Y193 HydrophobicContact CB-CD2 4.48Å; R191-Y193 HydrophobicContact CB-CE2 3.77Å; R191-Y193 WeakPolarHBondContact CD-OH 3.21Å; R191-Y193 HydrophobicContact CG-CD2 4.15Å; R191-Y193 HydrophobicContact CG-CE2 3.55Å; R191-Y193 WeakPolarHBondContact O-CD2 3.47Å; R191-V214 PolarHBondContact N-O 2.83Å; R191-V214 PolarHBondContact O-N 3.4Å; R191-D353 WeakPolarHBondContact CD-OD1 3.34Å; R191-D353 IonicContact CZ-OD1 2.67Å; R191-D353 IonicContact NE-OD1 3.54Å; R191-D353 PolarHBondContact NE-OD1 2.86Å; R191-D353 IonicContact NH1-OD1 3.67Å; R191-D353 PolarHBondContact NH1-OD1 3.26Å; R191-D353 IonicContact NH1-OD2 2.94Å; R191-D353 IonicContact NH2-OD1 2.8Å
192	L	97.7	Very high	95.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.1	-178.8	-170.7	69.7	0	0	0	110.3	R176 L179 Q180 I183 L211 L213 L266	R176-L192 WeakPolarHBondContact CD-O 3.28Å; R176-L192 HydrophobicContact CG-CD2 3.91Å; R176-L192 HydrophobicContact CG-CG 4.06Å; R176-L192 PolarHBondContact NH1-O 3.08Å; L179-L192 HydrophobicContact CB-CD2 3.65Å; Q180-L192 HydrophobicContact CB-CB 4.34Å; I183-L192 HydrophobicContact CD1-CD1 4.2Å; I183-L192 HydrophobicContact CD1-CD2 4.04Å; L192-L211 HydrophobicContact CD1-CB 4.01Å; L192-L211 HydrophobicContact CD2-CD1 4.31Å; L192-L211 HydrophobicContact CD2-CD2 4.36Å; L192-L211 HydrophobicContact CG-CD2 4.29Å; L192-L213 HydrophobicContact CB-CD1 4.27Å; L192-L213 HydrophobicContact CD1-CB 3.95Å; L192-L213 HydrophobicContact CD1-CD1 4.19Å; L192-L266 HydrophobicContact CD1-CD1 3.91Å; L192-L266 HydrophobicContact CD1-CG 4.34Å
193	Y	97.9	Very high	95.4	Very high	9 Å²	9	37.3 Å²	37.3	4%	0.035	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.7	179.8	-64.3	-99.5	0	0	0	110.6	R191 L211 C212 V214 I274 I352 D353	R191-Y193 HydrophobicContact CB-CD2 4.48Å; R191-Y193 HydrophobicContact CB-CE2 3.77Å; R191-Y193 WeakPolarHBondContact CD-OH 3.21Å; R191-Y193 HydrophobicContact CG-CD2 4.15Å; R191-Y193 HydrophobicContact CG-CE2 3.55Å; R191-Y193 WeakPolarHBondContact O-CD2 3.47Å; Y193-L211 WeakPolarHBondContact O-CA 3.36Å; Y193-C212 PolarHBondContact N-O 3.14Å; Y193-C212 PolarHBondContact O-N 3.47Å; Y193-V214 HydrophobicContact CD2-CB 4.48Å; Y193-V214 HydrophobicContact CD2-CG2 3.81Å; Y193-V214 HydrophobicContact CE2-CB 3.97Å; Y193-V214 HydrophobicContact CE2-CG2 3.56Å; Y193-I274 HydrophobicContact CD1-CD1 4.26Å; Y193-I274 HydrophobicContact CD1-CG2 4.35Å; Y193-I274 HydrophobicContact CD2-CD1 3.68Å; Y193-I274 HydrophobicContact CE2-CD1 4.1Å; Y193-I274 HydrophobicContact CG-CD1 3.75Å; Y193-I274 HydrophobicContact CG-CG1 4.35Å; Y193-I352 HydrophobicContact CE1-CG2 4.2Å; Y193-I352 HydrophobicContact CE2-CG2 4.12Å; Y193-D353 PolarHBondContact OH-OD1 3.31Å
194	L	97.7	Very high	95.2	Very high	8 Å²	8	37.4 Å²	37.4	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	132.4	161.8	-167	64	0	0	0	108.3	L169 K172 M199 A209 L211	L169-L194 HydrophobicContact CD1-CD2 3.75Å; K172-L194 HydrophobicContact CB-CD1 4.46Å; K172-L194 HydrophobicContact CB-CD2 4Å; L194-M199 HydrophobicContact CB-CG 3.87Å; L194-M199 HydrophobicContact CB-SD 4.49Å; L194-M199 HydrophobicContact CD2-CG 4.03Å; L194-M199 HydrophobicContact CD2-SD 3.98Å; L194-M199 HydrophobicContact CG-CG 3.85Å; L194-M199 HydrophobicContact CG-SD 4.43Å; L194-M199 VanDerWaalsContact O-CG 3.32Å; L194-M199 WeakPolarHBondContact O-CG 3.49Å; L194-A209 HydrophobicContact CD1-CB 4.06Å; L194-L211 HydrophobicContact CD1-CD2 3.79Å
195	T	97.1	Very high	94.9	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	-174.9	-171.8	62.3	0	0	0	0	111.1	D210 C212 I274	T195-D210 PolarHBondContact N-O 3Å; T195-D210 WeakPolarHBondContact OG1-CB 3.35Å; T195-D210 PolarHBondContact OG1-O 3.33Å; T195-C212 HydrophobicContact CG2-CB 3.87Å; T195-I274 HydrophobicContact CG2-CB 4.42Å; T195-I274 HydrophobicContact CG2-CG1 3.67Å
196	G	95.9	Very high	94.6	Very high	21 Å²	21	29.9 Å²	29.9	22%	0.216	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	67.1	-139.9	169.6	0	0	0	0	0	112.9	S198 M199 S200 T277	G196-S198 PolarHBondContact O-N 3.49Å; G196-M199 PolarHBondContact O-N 3.5Å; G196-S200 VanDerWaalsContact O-CB 3.24Å; G196-S200 WeakPolarHBondContact O-CB 3.43Å; G196-S200 PolarHBondContact O-N 3.2Å; G196-S200 PolarHBondContact O-OG 3.42Å; G196-T277 PolarHBondContact N-OG1 3.02Å
197	S	95.4	Very high	94.7	Very high	22 Å²	22	25.8 Å²	25.8	15%	0.154	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-64.2	-28.3	-173.1	71	0	0	0	0	113.1	M199 S200 G203 S207	S197-M199 PolarHBondContact O-N 3.1Å; S197-S200 WeakPolarHBondContact CA-OG 3.26Å; S197-G203 VanDerWaalsContact O-CA 3.23Å; S197-G203 WeakPolarHBondContact O-CA 3.44Å; S197-G203 PolarHBondContact O-N 3.35Å; S197-S207 WeakPolarHBondContact OG-CB 3.37Å
198	S	96.4	Very high	94.7	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.007	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-64.9	-39.8	-178.5	-55.6	0	0	0	0	112.5	Q164 K172 G196	Q164-S198 PolarHBondContact NE2-O 2.87Å; K172-S198 WeakPolarHBondContact CD-OG 3.36Å; K172-S198 PolarHBondContact NZ-OG 3.02Å; G196-S198 PolarHBondContact O-N 3.49Å
199	M	96.6	Very high	94.9	Very high	29 Å²	29	22.1 Å²	22.1	14%	0.143	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-19.3	-174.9	-68.3	-56.5	-73.2	0	0	114.1	L169 L194 G196 S197 G201 T277 F278 R281	L169-M199 HydrophobicContact CD1-SD 3.95Å; L194-M199 HydrophobicContact CB-CG 3.87Å; L194-M199 HydrophobicContact CB-SD 4.49Å; L194-M199 HydrophobicContact CD2-CG 4.03Å; L194-M199 HydrophobicContact CD2-SD 3.98Å; L194-M199 HydrophobicContact CG-CG 3.85Å; L194-M199 HydrophobicContact CG-SD 4.43Å; L194-M199 VanDerWaalsContact O-CG 3.32Å; L194-M199 WeakPolarHBondContact O-CG 3.49Å; G196-M199 PolarHBondContact O-N 3.5Å; S197-M199 PolarHBondContact O-N 3.1Å; M199-G201 PolarHBondContact O-N 2.96Å; M199-T277 HydrophobicContact CB-CG2 3.49Å; M199-T277 VanDerWaalsContact CB-CG2 3.49Å; M199-F278 HydrophobicContact CE-CZ 4.46Å; M199-R281 WeakPolarHBondContact O-CD 3.39Å; M199-R281 PolarHBondContact O-NH1 2.84Å
200	S	96.3	Very high	95.2	Very high	4 Å²	4	18.2 Å²	18.2	3%	0.028	10%	0.103	C	C	.	.	S	Bend	trans	-73.6	-6	177.7	57.5	0	0	0	0	114.7	G196 S197 L202 R281 A284	G196-S200 VanDerWaalsContact O-CB 3.24Å; G196-S200 WeakPolarHBondContact O-CB 3.43Å; G196-S200 PolarHBondContact O-N 3.2Å; G196-S200 PolarHBondContact O-OG 3.42Å; S197-S200 WeakPolarHBondContact CA-OG 3.26Å; S200-L202 PolarHBondContact O-N 2.84Å; S200-R281 VanDerWaalsContact O-CA 3.28Å; S200-R281 WeakPolarHBondContact O-CA 3.42Å; S200-A284 VanDerWaalsContact O-CB 3.27Å; S200-A284 WeakPolarHBondContact O-CB 3.32Å
201	G	94.6	Very high	95.4	Very high	10 Å²	10	18 Å²	18	10%	0.103	10%	0.102	C	C	.	.	S	Bend	trans	77.4	5.6	-175	0	0	0	0	0	114.5	M199 R291	M199-G201 PolarHBondContact O-N 2.96Å; G201-R291 PolarHBondContact O-NE 3Å
202	L	96.1	Very high	95.5	Very high	15 Å²	15	15 Å²	15	8%	0.079	9%	0.09	C	C	.	.			trans	-108.6	15.6	-177.9	-55.6	175.9	0	0	0	113	S200 L280 A284 R291 I294 K298 V320	S200-L202 PolarHBondContact O-N 2.84Å; L202-L280 HydrophobicContact CD1-CB 4.38Å; L202-L280 HydrophobicContact CD1-CD1 4.47Å; L202-A284 HydrophobicContact CD2-CB 3.74Å; L202-A284 HydrophobicContact CG-CB 4.11Å; L202-R291 HydrophobicContact CD2-CG 4.12Å; L202-I294 HydrophobicContact CD1-CD1 4.07Å; L202-I294 HydrophobicContact CD1-CG2 4.38Å; L202-I294 HydrophobicContact CD2-CB 4.26Å; L202-I294 HydrophobicContact CD2-CD1 3.71Å; L202-I294 HydrophobicContact CD2-CG2 4.03Å; L202-K298 PolarHBondContact O-NZ 2.92Å; L202-V320 HydrophobicContact CD1-CG1 3.76Å; L202-V320 HydrophobicContact CD1-CG2 3.99Å
203	G	93.8	Very high	95.5	Very high	4 Å²	4	15 Å²	15	4%	0.041	9%	0.09	C	C	.	.			trans	-77.5	149.5	177.7	0	0	0	0	0	112.7	Q164 S197	Q164-G203 WeakPolarHBondContact CB-O 3.42Å; Q164-G203 PolarHBondContact N-O 3.33Å; S197-G203 VanDerWaalsContact O-CA 3.23Å; S197-G203 WeakPolarHBondContact O-CA 3.44Å; S197-G203 PolarHBondContact O-N 3.35Å
204	C	93	Very high	95.5	Very high	5 Å²	5	15.4 Å²	15.4	3%	0.034	9%	0.094	C	C	.	.	B	Isolated β-bridge	trans	-111.8	164	167.4	-54.8	0	0	0	0	109.7	C162 S206 S207	C162-C204 CarbonylContact O-C 3.55Å; C162-C204 WeakPolarHBondContact O-CA 3.48Å; C162-C204 WeakPolarHBondContact O-CB 3.3Å; C204-S206 PolarHBondContact O-N 3.27Å; C204-S206 VanDerWaalsContact O-N 3.16Å; C204-S207 PolarHBondContact N-OG 2.95Å; C204-S207 VanDerWaalsContact O-CB 3.25Å; C204-S207 WeakPolarHBondContact O-CB 3.48Å; C204-S207 PolarHBondContact O-N 3.43Å; C204-S207 PolarHBondContact O-OG 2.79Å; C204-S207 VanDerWaalsContact O-OG 3.13Å
205	R	91.6	Very high	95.2	Very high	38 Å²	38	15.7 Å²	15.7	14%	0.143	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-37.9	176	-54	-173.8	66.8	110.5	11.5	112.7	C162 Q163 D168 S207	C162-R205 PolarHBondContact O-N 3.4Å; Q163-R205 VanDerWaalsContact O-CG 3.32Å; Q163-R205 WeakPolarHBondContact O-CG 3.26Å; D168-R205 IonicContact OD1-NH2 2.76Å; R205-S207 VanDerWaalsContact C-N 3.34Å; R205-S207 PolarHBondContact O-N 3.04Å
206	S	88.4	Confident	94.5	Very high	21 Å²	21	19.4 Å²	19.4	15%	0.147	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	3.8	177.3	57.5	0	0	0	0	116.1	C204 E470	C204-S206 PolarHBondContact O-N 3.27Å; C204-S206 VanDerWaalsContact O-N 3.16Å; S206-E470 VanDerWaalsContact CB-OE1 3.32Å; S206-E470 WeakPolarHBondContact CB-OE1 3.43Å; S206-E470 WeakPolarHBondContact CB-OE2 3.34Å; S206-E470 PolarHBondContact N-OE2 3.08Å; S206-E470 PolarHBondContact OG-OE1 3.36Å; S206-E470 PolarHBondContact OG-OE2 3.39Å
207	S	92.3	Very high	93.2	Very high	19 Å²	19	20 Å²	20	13%	0.133	12%	0.124	C	C	.	.			trans	-80	132.9	-174.5	-59.4	0	0	0	0	112.2	K172 S197 C204 R205	K172-S207 VanDerWaalsContact CE-O 3.31Å; K172-S207 WeakPolarHBondContact CE-O 3.2Å; K172-S207 PolarHBondContact NZ-O 3.32Å; S197-S207 WeakPolarHBondContact OG-CB 3.37Å; C204-S207 PolarHBondContact N-OG 2.95Å; C204-S207 VanDerWaalsContact O-CB 3.25Å; C204-S207 WeakPolarHBondContact O-CB 3.48Å; C204-S207 PolarHBondContact O-N 3.43Å; C204-S207 PolarHBondContact O-OG 2.79Å; C204-S207 VanDerWaalsContact O-OG 3.13Å; R205-S207 VanDerWaalsContact C-N 3.34Å; R205-S207 PolarHBondContact O-N 3.04Å
208	D	94.3	Very high	91.4	Very high	56 Å²	56	27.5 Å²	27.5	30%	0.299	16%	0.163	S	C	.	.			trans	-55.6	162	168.9	-57.9	-2.1	0	0	0	111.1	K172 K254	K172-D208 PolarHBondContact NZ-O 3.01Å; D208-K254 IonicContact OD2-NZ 3.98Å
209	A	96.4	Very high	90.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.8	177.2	0	0	0	0	0	111.2	K172 L194 L262 E263 F264 D265	K172-A209 HydrophobicContact CD-CB 4.1Å; K172-A209 HydrophobicContact CG-CB 4.02Å; L194-A209 HydrophobicContact CD1-CB 4.06Å; A209-L262 HydrophobicContact CB-CD1 4.32Å; A209-E263 PolarHBondContact N-O 3.02Å; A209-F264 HydrophobicContact CB-CD1 3.34Å; A209-F264 HydrophobicContact CB-CE1 3.43Å; A209-F264 VanDerWaalsContact CB-CE1 3.43Å; A209-F264 HydrophobicContact CB-CG 4.1Å; A209-F264 HydrophobicContact CB-CZ 4.24Å; A209-F264 VanDerWaalsContact O-CA 3.26Å; A209-F264 WeakPolarHBondContact O-CA 3.44Å; A209-D265 PolarHBondContact O-N 3.23Å
210	D	97.9	Very high	89.1	Confident	49 Å²	49	47.1 Å²	47.1	26%	0.262	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.9	175.7	-55.5	-79.7	0	0	0	110.6	T195	T195-D210 PolarHBondContact N-O 3Å; T195-D210 WeakPolarHBondContact OG1-CB 3.35Å; T195-D210 PolarHBondContact OG1-O 3.33Å
211	L	98.5	Very high	88.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.2	178.4	-63.9	173.1	0	0	0	110.7	R176 L179 L192 Y193 L194 F255 F264 D265 L266 N267	R176-L211 HydrophobicContact CB-CD2 4.14Å; R176-L211 HydrophobicContact CG-CD2 3.81Å; L179-L211 HydrophobicContact CD1-CD1 3.86Å; L192-L211 HydrophobicContact CD1-CB 4.01Å; L192-L211 HydrophobicContact CD2-CD1 4.31Å; L192-L211 HydrophobicContact CD2-CD2 4.36Å; L192-L211 HydrophobicContact CG-CD2 4.29Å; Y193-L211 WeakPolarHBondContact O-CA 3.36Å; L194-L211 HydrophobicContact CD1-CD2 3.79Å; L211-F255 HydrophobicContact CD1-CZ 3.87Å; L211-F264 HydrophobicContact CD1-CB 4.28Å; L211-F264 HydrophobicContact CD1-CD1 3.68Å; L211-F264 HydrophobicContact CD1-CE1 4.5Å; L211-F264 HydrophobicContact CD1-CG 4.35Å; L211-F264 HydrophobicContact CG-CD1 4.06Å; L211-D265 PolarHBondContact N-O 3.06Å; L211-L266 HydrophobicContact CB-CB 4.07Å; L211-L266 HydrophobicContact CB-CG 4.13Å; L211-L266 HydrophobicContact CD1-CB 4.47Å; L211-L266 HydrophobicContact CD1-CD1 4.36Å; L211-L266 WeakPolarHBondContact O-CA 3.15Å; L211-N267 PolarHBondContact O-N 3.2Å; L211-N267 PolarHBondContact O-ND2 3.18Å; L211-N267 VanDerWaalsContact O-ND2 3.09Å
212	C	98.4	Very high	88.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114	171	-170.8	0	0	0	0	109.4	Y193 T195 N267 I274	Y193-C212 PolarHBondContact N-O 3.14Å; Y193-C212 PolarHBondContact O-N 3.47Å; T195-C212 HydrophobicContact CG2-CB 3.87Å; C212-N267 PolarHBondContact SG-OD1 2.58Å; C212-I274 HydrophobicContact CB-CD1 4.03Å; C212-I274 HydrophobicContact CB-CG1 3.93Å
213	L	98	Very high	88.3	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117.2	171.3	-178.3	66.3	0	0	0	109.3	I183 L192 V215 V226 L230 L266 N267 V268 N269	I183-L213 HydrophobicContact CD1-CD1 4.34Å; I183-L213 HydrophobicContact CG2-CD1 3.78Å; I183-L213 HydrophobicContact CG2-CD2 3.77Å; I183-L213 HydrophobicContact CG2-CG 4.46Å; L192-L213 HydrophobicContact CB-CD1 4.27Å; L192-L213 HydrophobicContact CD1-CB 3.95Å; L192-L213 HydrophobicContact CD1-CD1 4.19Å; L213-V215 HydrophobicContact CD2-CG2 3.94Å; L213-V215 HydrophobicContact CG-CG2 3.93Å; L213-V226 HydrophobicContact CD2-CG1 4.03Å; L213-L230 HydrophobicContact CD2-CD1 3.78Å; L213-L266 HydrophobicContact CB-CD2 4.29Å; L213-N267 PolarHBondContact N-O 3Å; L213-V268 HydrophobicContact CB-CG2 4.26Å; L213-V268 HydrophobicContact CD2-CG2 4.33Å; L213-V268 CarbonylContact O-C 3.55Å; L213-V268 WeakPolarHBondContact O-CA 3.12Å; L213-N269 PolarHBondContact O-N 3.07Å
214	V	96.3	Very high	88.3	Confident	17 Å²	17	56.6 Å²	56.6	10%	0.103	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.8	171.4	-178	0	0	0	0	107.8	S190 R191 Y193 T216 N269 T271 I274 I352	S190-V214 CarbonylContact C-O 3.49Å; S190-V214 WeakPolarHBondContact CA-O 3.47Å; S190-V214 WeakPolarHBondContact CB-O 3.49Å; R191-V214 PolarHBondContact N-O 2.83Å; R191-V214 PolarHBondContact O-N 3.4Å; Y193-V214 HydrophobicContact CD2-CB 4.48Å; Y193-V214 HydrophobicContact CD2-CG2 3.81Å; Y193-V214 HydrophobicContact CE2-CB 3.97Å; Y193-V214 HydrophobicContact CE2-CG2 3.56Å; V214-T216 HydrophobicContact CG1-CG2 4.14Å; V214-N269 WeakPolarHBondContact CA-OD1 3.41Å; V214-T271 HydrophobicContact CG2-CG2 4.15Å; V214-I274 HydrophobicContact CG2-CD1 3.75Å; V214-I352 HydrophobicContact CG2-CG2 4.31Å
215	V	92.8	Very high	88.4	Confident	14 Å²	14	61.3 Å²	61.3	9%	0.085	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111.4	175.6	-175.7	0	0	0	0	107.7	F187 L213 P221 V268 N269	F187-V215 HydrophobicContact CD1-CG1 4.28Å; L213-V215 HydrophobicContact CD2-CG2 3.94Å; L213-V215 HydrophobicContact CG-CG2 3.93Å; V215-P221 HydrophobicContact CB-CG 4.45Å; V215-P221 HydrophobicContact CG1-CG 4.11Å; V215-V268 HydrophobicContact CG2-CG1 4.38Å; V215-N269 PolarHBondContact N-OD1 2.99Å
216	T	81.6	Confident	88.6	Confident	83 Å²	83	59.6 Å²	59.6	51%	0.509	30%	0.3	S	S	.	.			trans	-91.2	158.7	175.1	67.3	0	0	0	0	110.4	E189 V214	E189-T216 PolarHBondContact O-N 3.35Å; E189-T216 VanDerWaalsContact O-N 3.11Å; E189-T216 PolarHBondContact O-OG1 2.82Å; V214-T216 HydrophobicContact CG1-CG2 4.14Å
217	G	69.3	Low	89	Confident	33 Å²	33	58.6 Å²	58.6	34%	0.34	29%	0.293	S	S	.	.	S	Bend	trans	136.2	164.5	-180	0	0	0	0	0	114.7	R219	G217-R219 PolarHBondContact O-N 3.46Å; G217-R219 VanDerWaalsContact O-N 3.15Å
218	N	57.9	Low	89.3	Confident	179 Å²	179	59.5 Å²	59.5	96%	0.957	30%	0.3	S	S	*	.	S	Bend	trans	-61.9	-21.7	-174.2	-76.7	-18.5	0	0	0	114.6
219	R	68.9	Low	89.4	Confident	229 Å²	229	59.7 Å²	59.7	86%	0.864	30%	0.298	S	S	*	.	S	Bend	trans	-120.8	104.4	171.8	-66.3	-175	-177.5	-170.7	1.3	107.6	G217 P221	G217-R219 PolarHBondContact O-N 3.46Å; G217-R219 VanDerWaalsContact O-N 3.15Å; R219-P221 WeakPolarHBondContact O-CD 3.29Å
220	R	75	Confident	89.5	Confident	214 Å²	214	59.8 Å²	59.8	81%	0.808	30%	0.299	S	S	*	.			trans	-71.6	106.7	171.1	-68.7	-175.2	-178.8	-174.5	-0.2	108.1
221	P	84.5	Confident	89.5	Confident	40 Å²	40	59.1 Å²	59.1	26%	0.26	29%	0.294	S	S	.	.			trans	-65.1	149.5	-179	30	-36	0	0	0	109.9	V215 R219 V226	V215-P221 HydrophobicContact CB-CG 4.45Å; V215-P221 HydrophobicContact CG1-CG 4.11Å; R219-P221 WeakPolarHBondContact O-CD 3.29Å; P221-V226 HydrophobicContact CB-CG2 3.63Å; P221-V226 HydrophobicContact CG-CG2 3.35Å
222	H	91.2	Very high	89.4	Confident	114 Å²	114	66.2 Å²	66.2	53%	0.528	32%	0.321	S	S	.	.			trans	-63.6	131.6	176.2	-176.1	-91	0	0	0	109.3	M224 D225 V226	H222-M224 WeakPolarHBondContact ND1-CB 3.4Å; H222-M224 PolarHBondContact ND1-N 3.07Å; H222-M224 PolarHBondContact O-N 3.47Å; H222-M224 VanDerWaalsContact O-N 3.08Å; H222-D225 WeakPolarHBondContact CB-OD2 3.46Å; H222-D225 PolarHBondContact O-N 3.01Å; H222-V226 PolarHBondContact O-N 3.07Å
223	P	93.7	Very high	89.3	Confident	41 Å²	41	68 Å²	68	27%	0.266	33%	0.33	S	S	.	.	H	α-helix	trans	-51.8	-38	-173.6	-32.8	37.3	0	0	0	114.6	D225 V226 L227 V268	P223-D225 VanDerWaalsContact C-N 3.32Å; P223-D225 PolarHBondContact O-N 2.83Å; P223-V226 PolarHBondContact O-N 3.37Å; P223-L227 WeakPolarHBondContact O-CB 3.28Å; P223-L227 VanDerWaalsContact O-CG 3.25Å; P223-L227 WeakPolarHBondContact O-CG 3.26Å; P223-L227 PolarHBondContact O-N 3.22Å; P223-V268 HydrophobicContact CB-CB 4.1Å; P223-V268 HydrophobicContact CB-CG1 4.43Å
224	M	95.3	Very high	89.3	Confident	36 Å²	36	68.1 Å²	68.1	18%	0.177	33%	0.331	C	S	.	.	H	α-helix	trans	-63.5	-35.2	177.8	-73.1	-64.3	-56.5	0	0	113.2	H222 L227 C228 L245 K247 P251	H222-M224 WeakPolarHBondContact ND1-CB 3.4Å; H222-M224 PolarHBondContact ND1-N 3.07Å; H222-M224 PolarHBondContact O-N 3.47Å; H222-M224 VanDerWaalsContact O-N 3.08Å; M224-L227 PolarHBondContact O-N 2.9Å; M224-C228 WeakPolarHBondContact O-CB 3.46Å; M224-C228 PolarHBondContact O-N 3.06Å; M224-C228 PolarHBondContact O-SG 3.35Å; M224-L245 HydrophobicContact CE-CD2 3.83Å; M224-L245 HydrophobicContact CE-CG 4.41Å; M224-K247 HydrophobicContact CE-CG 4.08Å; M224-P251 HydrophobicContact CG-CB 4.46Å; M224-P251 HydrophobicContact CG-CG 4Å; M224-P251 HydrophobicContact SD-CB 3.27Å; M224-P251 WeakPolarHBondContact SD-CB 3.41Å; M224-P251 HydrophobicContact SD-CG 3.31Å; M224-P251 WeakPolarHBondContact SD-CG 3.28Å
225	D	94.3	Very high	89.4	Confident	104 Å²	104	75.2 Å²	75.2	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-71.8	-42.6	-176.9	-61.3	-25.3	0	0	0	109.8	H222 P223 C228 Q229	H222-D225 WeakPolarHBondContact CB-OD2 3.46Å; H222-D225 PolarHBondContact O-N 3.01Å; P223-D225 VanDerWaalsContact C-N 3.32Å; P223-D225 PolarHBondContact O-N 2.83Å; D225-C228 PolarHBondContact O-N 3.21Å; D225-Q229 WeakPolarHBondContact O-CB 3.37Å; D225-Q229 PolarHBondContact O-N 3.2Å
226	V	95.9	Very high	89.5	Confident	2 Å²	2	79.1 Å²	79.1	1%	0.012	38%	0.384	C	S	.	.	H	α-helix	trans	-58.5	-51	172.6	-178.3	0	0	0	0	110.3	F187 L213 P221 H222 P223 C228 Q229 L230 V268	F187-V226 HydrophobicContact CE1-CG1 4.26Å; F187-V226 HydrophobicContact CE1-CG2 4.24Å; F187-V226 HydrophobicContact CE2-CG1 4.07Å; F187-V226 HydrophobicContact CZ-CB 4.39Å; F187-V226 HydrophobicContact CZ-CG1 3.84Å; F187-V226 HydrophobicContact CZ-CG2 4.38Å; L213-V226 HydrophobicContact CD2-CG1 4.03Å; P221-V226 HydrophobicContact CB-CG2 3.63Å; P221-V226 HydrophobicContact CG-CG2 3.35Å; H222-V226 PolarHBondContact O-N 3.07Å; P223-V226 PolarHBondContact O-N 3.37Å; V226-C228 VanDerWaalsContact C-N 3.34Å; V226-C228 PolarHBondContact O-N 3.5Å; V226-Q229 PolarHBondContact O-N 2.79Å; V226-Q229 VanDerWaalsContact O-N 3.14Å; V226-L230 HydrophobicContact CG1-CD1 3.99Å; V226-L230 HydrophobicContact CG1-CG 4.25Å; V226-L230 WeakPolarHBondContact O-CG 3.33Å; V226-L230 PolarHBondContact O-N 2.97Å; V226-V268 HydrophobicContact CB-CG1 4.26Å; V226-V268 HydrophobicContact CB-CG2 4.07Å; V226-V268 HydrophobicContact CG1-CG1 4.23Å; V226-V268 HydrophobicContact CG1-CG2 3.74Å; V226-V268 HydrophobicContact CG2-CG1 4.33Å
227	L	97.6	Very high	90.3	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64.1	-36.8	-179.5	-68.5	170.1	0	0	0	112.8	P223 M224 Q229 Q231 L245 P251 L253 L266 V268	P223-L227 WeakPolarHBondContact O-CB 3.28Å; P223-L227 VanDerWaalsContact O-CG 3.25Å; P223-L227 WeakPolarHBondContact O-CG 3.26Å; P223-L227 PolarHBondContact O-N 3.22Å; M224-L227 PolarHBondContact O-N 2.9Å; L227-Q229 VanDerWaalsContact C-N 3.33Å; L227-Q231 WeakPolarHBondContact O-CB 3.33Å; L227-Q231 PolarHBondContact O-N 3.03Å; L227-L245 HydrophobicContact CB-CD1 3.76Å; L227-L245 HydrophobicContact CD1-CD1 4.15Å; L227-P251 HydrophobicContact CD1-CB 3.64Å; L227-L253 HydrophobicContact CD2-CB 3.77Å; L227-L266 HydrophobicContact CD2-CD2 3.54Å; L227-V268 HydrophobicContact CD2-CG2 3.68Å; L227-V268 HydrophobicContact CG-CG2 3.78Å
228	C	97.2	Very high	91.6	Very high	39 Å²	39	79.2 Å²	79.2	26%	0.264	38%	0.38	S	S	.	.	H	α-helix	trans	-63.4	-40.4	173.6	-72.6	0	0	0	0	111.6	M224 D225 V226 R232	M224-C228 WeakPolarHBondContact O-CB 3.46Å; M224-C228 PolarHBondContact O-N 3.06Å; M224-C228 PolarHBondContact O-SG 3.35Å; D225-C228 PolarHBondContact O-N 3.21Å; V226-C228 VanDerWaalsContact C-N 3.34Å; V226-C228 PolarHBondContact O-N 3.5Å; C228-R232 PolarHBondContact O-N 3.1Å
229	Q	96.5	Very high	93.5	Very high	59 Å²	59	71.6 Å²	71.6	28%	0.276	34%	0.338	S	S	.	.	H	α-helix	trans	-67	-50.4	177	-173.8	53.9	42.5	0	0	111	F187 D225 V226 L227 Q231 R232 D233	F187-Q229 HydrophobicContact CZ-CG 4.45Å; D225-Q229 WeakPolarHBondContact O-CB 3.37Å; D225-Q229 PolarHBondContact O-N 3.2Å; V226-Q229 PolarHBondContact O-N 2.79Å; V226-Q229 VanDerWaalsContact O-N 3.14Å; L227-Q229 VanDerWaalsContact C-N 3.33Å; Q229-Q231 VanDerWaalsContact C-N 3.25Å; Q229-Q231 PolarHBondContact O-N 2.84Å; Q229-R232 WeakPolarHBondContact O-CB 3.48Å; Q229-R232 PolarHBondContact O-N 3.26Å; Q229-D233 PolarHBondContact NE2-OD1 2.81Å; Q229-D233 PolarHBondContact NE2-OD2 3.21Å; Q229-D233 PolarHBondContact O-N 3.28Å
230	L	97.8	Very high	94.8	Very high	2 Å²	2	61 Å²	61	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-57.8	-37	176.1	-68	-179.5	0	0	0	112.4	I183 F187 L213 V226 R232 D233 F234 L253 L266	I183-L230 HydrophobicContact CG1-CD2 3.91Å; I183-L230 HydrophobicContact CG2-CD2 4.23Å; F187-L230 HydrophobicContact CD2-CD2 4.29Å; F187-L230 HydrophobicContact CE2-CD2 3.91Å; F187-L230 HydrophobicContact CE2-CG 4.32Å; L213-L230 HydrophobicContact CD2-CD1 3.78Å; V226-L230 HydrophobicContact CG1-CD1 3.99Å; V226-L230 HydrophobicContact CG1-CG 4.25Å; V226-L230 WeakPolarHBondContact O-CG 3.33Å; V226-L230 PolarHBondContact O-N 2.97Å; L230-R232 VanDerWaalsContact C-N 3.27Å; L230-R232 PolarHBondContact O-N 3.13Å; L230-D233 PolarHBondContact O-N 3.2Å; L230-F234 HydrophobicContact CB-CE1 4.38Å; L230-F234 HydrophobicContact CD2-CE1 4.14Å; L230-F234 VanDerWaalsContact O-CB 3.24Å; L230-F234 WeakPolarHBondContact O-CB 3.36Å; L230-F234 VanDerWaalsContact O-CD1 3.32Å; L230-F234 WeakPolarHBondContact O-CD1 3.47Å; L230-F234 VanDerWaalsContact O-CG 3.24Å; L230-F234 WeakPolarHBondContact O-CG 3.43Å; L230-F234 PolarHBondContact O-N 3.01Å; L230-L253 HydrophobicContact CB-CD2 3.86Å; L230-L266 HydrophobicContact CD1-CD1 4.49Å; L230-L266 HydrophobicContact CD1-CD2 3.99Å
231	Q	98.1	Very high	95.9	Very high	35 Å²	35	52.4 Å²	52.4	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-39.2	174.9	-176.8	178.3	46.1	0	0	112	L227 Q229 R235 I243 L253	L227-Q231 WeakPolarHBondContact O-CB 3.33Å; L227-Q231 PolarHBondContact O-N 3.03Å; Q229-Q231 VanDerWaalsContact C-N 3.25Å; Q229-Q231 PolarHBondContact O-N 2.84Å; Q231-R235 WeakPolarHBondContact O-CG 3.39Å; Q231-I243 HydrophobicContact CG-CG2 3.99Å; Q231-L253 HydrophobicContact CB-CD1 3.76Å; Q231-L253 HydrophobicContact CB-CD2 4.43Å; Q231-L253 HydrophobicContact CG-CD1 3.98Å
232	R	97.5	Very high	96.5	Very high	150 Å²	150	59.4 Å²	59.4	57%	0.566	29%	0.291	S	S	*	.	H	α-helix	trans	-69.9	-46.8	176.8	-63.8	175.5	-170.7	132.8	-0.2	110.5	C228 Q229 L230 F234 R235	C228-R232 PolarHBondContact O-N 3.1Å; Q229-R232 WeakPolarHBondContact O-CB 3.48Å; Q229-R232 PolarHBondContact O-N 3.26Å; L230-R232 VanDerWaalsContact C-N 3.27Å; L230-R232 PolarHBondContact O-N 3.13Å; R232-F234 PolarHBondContact O-N 3.4Å; R232-R235 WeakPolarHBondContact O-CB 3.41Å; R232-R235 PolarHBondContact O-N 3.2Å
233	D	96.9	Very high	96.8	Very high	36 Å²	36	55.4 Å²	55.4	19%	0.193	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-44.1	-178.2	-60.5	-28.3	0	0	0	110.9	Q229 L230 R235 S236	Q229-D233 PolarHBondContact NE2-OD1 2.81Å; Q229-D233 PolarHBondContact NE2-OD2 3.21Å; Q229-D233 PolarHBondContact O-N 3.28Å; L230-D233 PolarHBondContact O-N 3.2Å; D233-R235 PolarHBondContact O-N 3.39Å; D233-S236 WeakPolarHBondContact O-CB 3.36Å; D233-S236 PolarHBondContact O-N 3.03Å; D233-S236 PolarHBondContact O-OG 3.3Å
234	F	97.8	Very high	97	Very high	3 Å²	3	59 Å²	59	1%	0.013	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-26.1	-179.3	-75.3	14.1	0	0	0	112.9	L179 I183 L230 R232 S236 L237 L240 I243 L253 F255 L266	L179-F234 HydrophobicContact CD2-CE1 4.06Å; L179-F234 HydrophobicContact CD2-CE2 4.05Å; L179-F234 HydrophobicContact CD2-CZ 3.7Å; I183-F234 HydrophobicContact CD1-CE1 4.46Å; I183-F234 HydrophobicContact CD1-CZ 4.1Å; I183-F234 HydrophobicContact CG1-CE1 4.01Å; I183-F234 HydrophobicContact CG1-CZ 4.16Å; L230-F234 HydrophobicContact CB-CE1 4.38Å; L230-F234 HydrophobicContact CD2-CE1 4.14Å; L230-F234 VanDerWaalsContact O-CB 3.24Å; L230-F234 WeakPolarHBondContact O-CB 3.36Å; L230-F234 VanDerWaalsContact O-CD1 3.32Å; L230-F234 WeakPolarHBondContact O-CD1 3.47Å; L230-F234 VanDerWaalsContact O-CG 3.24Å; L230-F234 WeakPolarHBondContact O-CG 3.43Å; L230-F234 PolarHBondContact O-N 3.01Å; R232-F234 PolarHBondContact O-N 3.4Å; F234-S236 PolarHBondContact O-N 3.14Å; F234-L237 HydrophobicContact CD1-CD1 3.75Å; F234-L237 HydrophobicContact CE1-CD1 4.29Å; F234-L237 HydrophobicContact CG-CD1 4.33Å; F234-L237 WeakPolarHBondContact O-CB 3.37Å; F234-L237 PolarHBondContact O-N 3.16Å; F234-L237 VanDerWaalsContact O-N 3.07Å; F234-L240 HydrophobicContact CB-CD1 3.89Å; F234-L240 HydrophobicContact CD1-CD1 4.34Å; F234-L240 HydrophobicContact CD2-CD1 3.71Å; F234-L240 HydrophobicContact CE2-CD1 4.32Å; F234-L240 HydrophobicContact CG-CD1 3.73Å; F234-I243 HydrophobicContact CB-CD1 3.75Å; F234-I243 HydrophobicContact CB-CG1 4.3Å; F234-I243 HydrophobicContact CB-CG2 4.28Å; F234-I243 VanDerWaalsContact O-CD1 3.23Å; F234-I243 WeakPolarHBondContact O-CD1 3.38Å; F234-L253 HydrophobicContact CD2-CD2 3.75Å; F234-L253 HydrophobicContact CE2-CD2 3.88Å; F234-L253 HydrophobicContact CG-CD2 4.48Å; F234-F255 HydrophobicContact CD2-CD1 4.09Å; F234-F255 HydrophobicContact CD2-CE1 4.2Å; F234-F255 HydrophobicContact CD2-CG 4.44Å; F234-F255 AromaticContact CE2-CD1 3.99Å; F234-F255 HydrophobicContact CE2-CD1 3.99Å; F234-F255 AromaticContact CE2-CE1 3.63Å; F234-F255 HydrophobicContact CE2-CE1 3.63Å; F234-F255 AromaticContact CE2-CZ 3.97Å; F234-F255 HydrophobicContact CE2-CZ 3.97Å; F234-L266 HydrophobicContact CE2-CD1 4.25Å; F234-L266 HydrophobicContact CZ-CD1 4.12Å
235	R	96.9	Very high	97.1	Very high	167 Å²	167	58.7 Å²	58.7	63%	0.63	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.1	174.9	-73.5	169.7	-176.5	168.6	3.4	112.7	Q231 R232 D233 I243	Q231-R235 WeakPolarHBondContact O-CG 3.39Å; R232-R235 WeakPolarHBondContact O-CB 3.41Å; R232-R235 PolarHBondContact O-N 3.2Å; D233-R235 PolarHBondContact O-N 3.39Å; R235-I243 HydrophobicContact CG-CD1 4.11Å
236	S	96.4	Very high	97.2	Very high	96 Å²	96	56.9 Å²	56.9	67%	0.671	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-14.3	174.8	74.4	0	0	0	0	113.2	D233 F234 S238	D233-S236 WeakPolarHBondContact O-CB 3.36Å; D233-S236 PolarHBondContact O-N 3.03Å; D233-S236 PolarHBondContact O-OG 3.3Å; F234-S236 PolarHBondContact O-N 3.14Å; S236-S238 PolarHBondContact O-N 3.39Å
237	L	97.4	Very high	97.1	Very high	28 Å²	28	65.2 Å²	65.2	15%	0.147	31%	0.311	C	S	.	.			trans	-83.5	107.9	-177.6	-58.9	-179.2	0	0	0	110.3	D182 F234 Y239 L240	D182-L237 HydrophobicContact CB-CD1 4.22Å; F234-L237 HydrophobicContact CD1-CD1 3.75Å; F234-L237 HydrophobicContact CE1-CD1 4.29Å; F234-L237 HydrophobicContact CG-CD1 4.33Å; F234-L237 WeakPolarHBondContact O-CB 3.37Å; F234-L237 PolarHBondContact O-N 3.16Å; F234-L237 VanDerWaalsContact O-N 3.07Å; L237-Y239 HydrophobicContact CB-CD1 4.05Å; L237-Y239 HydrophobicContact CB-CE1 3.7Å; L237-Y239 HydrophobicContact CD1-CE1 4.06Å; L237-Y239 HydrophobicContact CD2-CE1 4.17Å; L237-Y239 HydrophobicContact CG-CE1 4.18Å; L237-Y239 PolarHBondContact O-N 3.19Å; L237-Y239 VanDerWaalsContact O-N 3.09Å; L237-L240 HydrophobicContact CB-CD1 4.08Å; L237-L240 HydrophobicContact CB-CG 4.15Å; L237-L240 HydrophobicContact CD1-CD1 3.84Å; L237-L240 PolarHBondContact O-N 3.42Å
238	S	96.8	Very high	96.7	Very high	89 Å²	89	68 Å²	68	62%	0.622	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.9	-173.7	61.4	0	0	0	0	114.3	S236 L240 R258	S236-S238 PolarHBondContact O-N 3.39Å; S238-L240 VanDerWaalsContact C-N 3.33Å; S238-R258 WeakPolarHBondContact O-CD 3.28Å; S238-R258 PolarHBondContact O-NE 3.5Å
239	Y	96.8	Very high	96.2	Very high	20 Å²	20	73.8 Å²	73.8	8%	0.078	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-1.5	-179.5	69.3	-84.6	0	0	0	113.8	R178 L179 D182 L237 R258	R178-Y239 HydrophobicContact CG-CE1 4.35Å; R178-Y239 HydrophobicContact CG-CE2 4.37Å; L179-Y239 HydrophobicContact CD2-CE2 4.35Å; L179-Y239 WeakPolarHBondContact CD2-OH 3.5Å; D182-Y239 PolarHBondContact OD2-OH 3.42Å; L237-Y239 HydrophobicContact CB-CD1 4.05Å; L237-Y239 HydrophobicContact CB-CE1 3.7Å; L237-Y239 HydrophobicContact CD1-CE1 4.06Å; L237-Y239 HydrophobicContact CD2-CE1 4.17Å; L237-Y239 HydrophobicContact CG-CE1 4.18Å; L237-Y239 PolarHBondContact O-N 3.19Å; L237-Y239 VanDerWaalsContact O-N 3.09Å; Y239-R258 WeakPolarHBondContact O-CB 3.48Å; Y239-R258 PolarHBondContact O-N 3.27Å
240	L	97.7	Very high	96	Very high	6 Å²	6	73.3 Å²	73.3	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	148.1	176.9	-58	-177	0	0	0	111.5	L179 F234 L237 S238 I243 F255 K256	L179-L240 HydrophobicContact CD2-CD1 3.91Å; F234-L240 HydrophobicContact CB-CD1 3.89Å; F234-L240 HydrophobicContact CD1-CD1 4.34Å; F234-L240 HydrophobicContact CD2-CD1 3.71Å; F234-L240 HydrophobicContact CE2-CD1 4.32Å; F234-L240 HydrophobicContact CG-CD1 3.73Å; L237-L240 HydrophobicContact CB-CD1 4.08Å; L237-L240 HydrophobicContact CB-CG 4.15Å; L237-L240 HydrophobicContact CD1-CD1 3.84Å; L237-L240 PolarHBondContact O-N 3.42Å; S238-L240 VanDerWaalsContact C-N 3.33Å; L240-I243 HydrophobicContact CB-CD1 4.29Å; L240-I243 HydrophobicContact CB-CG1 4.48Å; L240-F255 HydrophobicContact CD1-CD2 4.28Å; L240-F255 HydrophobicContact CD1-CE2 4.46Å; L240-F255 HydrophobicContact CD2-CD2 3.76Å; L240-F255 HydrophobicContact CD2-CE2 3.92Å; L240-K256 WeakPolarHBondContact CA-O 3.47Å
241	V	97.6	Very high	95.9	Very high	33 Å²	33	74.2 Å²	74.2	20%	0.2	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	165.8	175.5	-66.4	0	0	0	0	111.2	I243 K256 R258	V241-I243 VanDerWaalsContact C-N 3.32Å; V241-I243 PolarHBondContact O-N 2.9Å; V241-K256 HydrophobicContact CG2-CB 3.97Å; V241-K256 HydrophobicContact CG2-CG 4.16Å; V241-K256 WeakPolarHBondContact CG2-O 3.45Å; V241-K256 PolarHBondContact N-O 3.44Å; V241-K256 PolarHBondContact O-N 3.42Å; V241-R258 HydrophobicContact CG1-CB 4.12Å; V241-R258 HydrophobicContact CG1-CG 4.23Å
242	R	96.8	Very high	95.9	Very high	187 Å²	187	74.7 Å²	74.7	71%	0.706	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.4	43.7	173.6	-59.3	-177.3	176.5	-176.5	-3.1	113.7	Q244	R242-Q244 PolarHBondContact O-N 2.82Å
243	I	98.3	Very high	95.9	Very high	30 Å²	30	67.5 Å²	67.5	15%	0.154	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	114.9	-176.5	-56	152.2	0	0	0	110	Q231 F234 R235 L240 V241 L253 K254 F255	Q231-I243 HydrophobicContact CG-CG2 3.99Å; F234-I243 HydrophobicContact CB-CD1 3.75Å; F234-I243 HydrophobicContact CB-CG1 4.3Å; F234-I243 HydrophobicContact CB-CG2 4.28Å; F234-I243 VanDerWaalsContact O-CD1 3.23Å; F234-I243 WeakPolarHBondContact O-CD1 3.38Å; R235-I243 HydrophobicContact CG-CD1 4.11Å; L240-I243 HydrophobicContact CB-CD1 4.29Å; L240-I243 HydrophobicContact CB-CG1 4.48Å; V241-I243 VanDerWaalsContact C-N 3.32Å; V241-I243 PolarHBondContact O-N 2.9Å; I243-L253 HydrophobicContact CG2-CD1 3.7Å; I243-L253 HydrophobicContact CG2-CG 4.26Å; I243-K254 CarbonylContact C-O 3.32Å; I243-K254 WeakPolarHBondContact CA-O 3.31Å; I243-F255 HydrophobicContact CB-CB 4.38Å; I243-F255 HydrophobicContact CG1-CB 3.89Å
244	Q	97.9	Very high	96	Very high	118 Å²	118	68 Å²	68	55%	0.551	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	126.9	-174.6	-175.4	177.8	16.8	0	0	111.3	R242 I246 K254	R242-Q244 PolarHBondContact O-N 2.82Å; Q244-I246 HydrophobicContact CG-CG1 4.41Å; Q244-K254 PolarHBondContact N-O 2.77Å; Q244-K254 PolarHBondContact O-N 3.44Å
245	L	98	Very high	96	Very high	29 Å²	29	67.9 Å²	67.9	15%	0.152	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	120.2	171.7	-178.7	59.5	0	0	0	109.8	M224 L227 L253	M224-L245 HydrophobicContact CE-CD2 3.83Å; M224-L245 HydrophobicContact CE-CG 4.41Å; L227-L245 HydrophobicContact CB-CD1 3.76Å; L227-L245 HydrophobicContact CD1-CD1 4.15Å; L245-L253 HydrophobicContact CB-CD1 4.28Å
246	I	96	Very high	96	Very high	65 Å²	65	61.4 Å²	61.4	33%	0.333	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.9	178.5	-56	176.3	0	0	0	108.6	Q244 P251 I252 K254	Q244-I246 HydrophobicContact CG-CG1 4.41Å; I246-P251 WeakPolarHBondContact O-CA 3.49Å; I246-I252 PolarHBondContact N-O 3.2Å; I246-I252 PolarHBondContact O-N 3.44Å; I246-I252 VanDerWaalsContact O-N 3.14Å; I246-K254 HydrophobicContact CD1-CB 3.95Å; I246-K254 HydrophobicContact CD1-CD 4.2Å
247	K	93.4	Very high	95.9	Very high	177 Å²	177	59 Å²	59	77%	0.77	29%	0.292	S	S	*	.			trans	-87.6	110.5	177.4	-62.7	-177.5	-177.5	-179.8	0	109.4	M224	M224-K247 HydrophobicContact CE-CG 4.08Å
248	A	88.5	Confident	95.8	Very high	59 Å²	59	64.9 Å²	64.9	49%	0.488	31%	0.313	S	S	.	.	S	Bend	trans	-144.6	-176.4	176.4	0	0	0	0	0	109.7	V250	A248-V250 PolarHBondContact O-N 2.91Å
249	K	86.8	Confident	95.3	Very high	161 Å²	161	64.9 Å²	64.9	70%	0.7	33%	0.326	S	S	*	.	S	Bend	trans	-54.4	-41.9	176	-172.3	-171	178.8	-170.9	0	111.8
250	V	92.2	Very high	94.9	Very high	48 Å²	48	64.3 Å²	64.3	29%	0.291	33%	0.325	S	S	.	.	S	Bend	trans	-109.4	105.5	165.6	-179.1	0	0	0	0	105.8	A248 N267 N270	A248-V250 PolarHBondContact O-N 2.91Å; V250-N267 HydrophobicContact CG1-CB 4.03Å; V250-N270 HydrophobicContact CG1-CB 4.27Å
251	P	96.1	Very high	94.3	Very high	21 Å²	21	72.5 Å²	72.5	14%	0.136	36%	0.361	C	S	.	.			trans	-66.2	142.4	178.2	-21.3	33.5	0	0	0	111.7	M224 L227 I246	M224-P251 HydrophobicContact CG-CB 4.46Å; M224-P251 HydrophobicContact CG-CG 4Å; M224-P251 HydrophobicContact SD-CB 3.27Å; M224-P251 WeakPolarHBondContact SD-CB 3.41Å; M224-P251 HydrophobicContact SD-CG 3.31Å; M224-P251 WeakPolarHBondContact SD-CG 3.28Å; L227-P251 HydrophobicContact CD1-CB 3.64Å; I246-P251 WeakPolarHBondContact O-CA 3.49Å
252	I	97.6	Very high	94	Very high	45 Å²	45	72 Å²	72	23%	0.231	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.9	-175.3	-64.3	169.2	0	0	0	109	I246 D265 L266 N267	I246-I252 PolarHBondContact N-O 3.2Å; I246-I252 PolarHBondContact O-N 3.44Å; I246-I252 VanDerWaalsContact O-N 3.14Å; I252-D265 HydrophobicContact CG2-CB 3.63Å; I252-L266 CarbonylContact C-O 3.48Å; I252-L266 WeakPolarHBondContact CA-O 3.42Å; I252-N267 HydrophobicContact CG1-CB 4.48Å
253	L	98.4	Very high	94	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	104.8	164.7	-176.7	65.2	0	0	0	108.3	L227 L230 Q231 F234 I243 L245 F255 L266	L227-L253 HydrophobicContact CD2-CB 3.77Å; L230-L253 HydrophobicContact CB-CD2 3.86Å; Q231-L253 HydrophobicContact CB-CD1 3.76Å; Q231-L253 HydrophobicContact CB-CD2 4.43Å; Q231-L253 HydrophobicContact CG-CD1 3.98Å; F234-L253 HydrophobicContact CD2-CD2 3.75Å; F234-L253 HydrophobicContact CE2-CD2 3.88Å; F234-L253 HydrophobicContact CG-CD2 4.48Å; I243-L253 HydrophobicContact CG2-CD1 3.7Å; I243-L253 HydrophobicContact CG2-CG 4.26Å; L245-L253 HydrophobicContact CB-CD1 4.28Å; L253-F255 HydrophobicContact CG-CD1 4.42Å; L253-F255 WeakPolarHBondContact O-CD1 3.32Å; L253-L266 PolarHBondContact N-O 3.42Å; L253-L266 PolarHBondContact O-N 3.01Å
254	K	98.4	Very high	94	Very high	46 Å²	46	64.1 Å²	64.1	20%	0.2	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.5	177.4	-177.2	157.4	-174.5	149.3	0	110.2	D208 I243 Q244 I246 E263 F264 D265	D208-K254 IonicContact OD2-NZ 3.98Å; I243-K254 CarbonylContact C-O 3.32Å; I243-K254 WeakPolarHBondContact CA-O 3.31Å; Q244-K254 PolarHBondContact N-O 2.77Å; Q244-K254 PolarHBondContact O-N 3.44Å; I246-K254 HydrophobicContact CD1-CB 3.95Å; I246-K254 HydrophobicContact CD1-CD 4.2Å; K254-E263 WeakPolarHBondContact CE-OE2 3.47Å; K254-E263 IonicContact NZ-OE2 3.46Å; K254-E263 PolarHBondContact NZ-OE2 2.84Å; K254-F264 CarbonylContact C-O 3.52Å; K254-F264 VanDerWaalsContact CA-O 3.32Å; K254-F264 WeakPolarHBondContact CA-O 3.45Å; K254-D265 VanDerWaalsContact CD-OD1 3.27Å; K254-D265 WeakPolarHBondContact CD-OD1 3.32Å; K254-D265 VanDerWaalsContact CG-OD1 3.26Å; K254-D265 WeakPolarHBondContact CG-OD1 3.23Å; K254-D265 IonicContact NZ-OD1 2.66Å
255	F	98.2	Very high	94	Very high	1 Å²	1	59.8 Å²	59.8	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	172.8	176.5	58.8	-88.2	0	0	0	110.9	L179 L211 F234 L240 I243 L253 E263 F264 L266	L179-F255 HydrophobicContact CD1-CE2 3.79Å; L179-F255 HydrophobicContact CD1-CZ 3.6Å; L211-F255 HydrophobicContact CD1-CZ 3.87Å; F234-F255 HydrophobicContact CD2-CD1 4.09Å; F234-F255 HydrophobicContact CD2-CE1 4.2Å; F234-F255 HydrophobicContact CD2-CG 4.44Å; F234-F255 AromaticContact CE2-CD1 3.99Å; F234-F255 HydrophobicContact CE2-CD1 3.99Å; F234-F255 AromaticContact CE2-CE1 3.63Å; F234-F255 HydrophobicContact CE2-CE1 3.63Å; F234-F255 AromaticContact CE2-CZ 3.97Å; F234-F255 HydrophobicContact CE2-CZ 3.97Å; L240-F255 HydrophobicContact CD1-CD2 4.28Å; L240-F255 HydrophobicContact CD1-CE2 4.46Å; L240-F255 HydrophobicContact CD2-CD2 3.76Å; L240-F255 HydrophobicContact CD2-CE2 3.92Å; I243-F255 HydrophobicContact CB-CB 4.38Å; I243-F255 HydrophobicContact CG1-CB 3.89Å; L253-F255 HydrophobicContact CG-CD1 4.42Å; L253-F255 WeakPolarHBondContact O-CD1 3.32Å; F255-E263 WeakPolarHBondContact O-CA 3.27Å; F255-F264 HydrophobicContact CD1-CB 4.27Å; F255-F264 HydrophobicContact CD2-CB 3.85Å; F255-F264 HydrophobicContact CD2-CD2 4.17Å; F255-F264 HydrophobicContact CD2-CG 4.3Å; F255-F264 HydrophobicContact CE1-CB 3.82Å; F255-F264 HydrophobicContact CE2-CB 3.37Å; F255-F264 HydrophobicContact CE2-CD1 4.44Å; F255-F264 AromaticContact CE2-CD2 3.75Å; F255-F264 HydrophobicContact CE2-CD2 3.75Å; F255-F264 AromaticContact CE2-CG 3.62Å; F255-F264 HydrophobicContact CE2-CG 3.62Å; F255-F264 HydrophobicContact CG-CB 4.29Å; F255-F264 HydrophobicContact CZ-CB 3.35Å; F255-F264 HydrophobicContact CZ-CD1 4.48Å; F255-F264 HydrophobicContact CZ-CD2 4.48Å; F255-F264 AromaticContact CZ-CG 3.9Å; F255-F264 HydrophobicContact CZ-CG 3.9Å; F255-F264 PolarHBondContact N-O 2.97Å; F255-F264 PolarHBondContact O-N 3.02Å; F255-L266 HydrophobicContact CE1-CB 3.92Å; F255-L266 HydrophobicContact CE1-CD1 4.44Å
256	K	97.3	Very high	94	Very high	31 Å²	31	58.4 Å²	58.4	14%	0.135	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142	-178.2	178	174.5	-177.6	-175.5	0	110.6	L240 V241 S260 L262 E263	L240-K256 WeakPolarHBondContact CA-O 3.47Å; V241-K256 HydrophobicContact CG2-CB 3.97Å; V241-K256 HydrophobicContact CG2-CG 4.16Å; V241-K256 WeakPolarHBondContact CG2-O 3.45Å; V241-K256 PolarHBondContact N-O 3.44Å; V241-K256 PolarHBondContact O-N 3.42Å; K256-S260 WeakPolarHBondContact CE-O 3.27Å; K256-S260 PolarHBondContact NZ-O 3.47Å; K256-L262 WeakPolarHBondContact CG-O 3.25Å; K256-E263 HydrophobicContact CB-CG 4.45Å; K256-E263 HydrophobicContact CD-CG 4.41Å; K256-E263 HydrophobicContact CG-CG 4.42Å
257	E	94.3	Very high	94.1	Very high	44 Å²	44	56 Å²	56	21%	0.206	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.5	170.7	174.5	-170.2	-120.1	0	0	110.1	G259 S260 L262 F264	E257-G259 PolarHBondContact O-N 2.9Å; E257-S260 WeakPolarHBondContact CB-OG 3.37Å; E257-S260 PolarHBondContact O-N 2.8Å; E257-S260 PolarHBondContact O-OG 2.94Å; E257-S260 WeakPolarHBondContact OE2-CB 3.36Å; E257-S260 PolarHBondContact OE2-OG 3.25Å; E257-L262 PolarHBondContact N-O 3.12Å; E257-L262 VanDerWaalsContact N-O 3.13Å; E257-F264 HydrophobicContact CB-CE2 4.1Å
258	R	94.3	Very high	94.3	Very high	153 Å²	153	48 Å²	48	58%	0.577	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	131.8	-179.2	-176.2	178.7	-65.2	-88.8	2.7	110	S238 Y239 V241 S260	S238-R258 WeakPolarHBondContact O-CD 3.28Å; S238-R258 PolarHBondContact O-NE 3.5Å; Y239-R258 WeakPolarHBondContact O-CB 3.48Å; Y239-R258 PolarHBondContact O-N 3.27Å; V241-R258 HydrophobicContact CG1-CB 4.12Å; V241-R258 HydrophobicContact CG1-CG 4.23Å; R258-S260 VanDerWaalsContact C-N 3.25Å; R258-S260 PolarHBondContact O-N 3.39Å
259	G	87.9	Confident	94.7	Very high	88 Å²	88	47.3 Å²	47.3	91%	0.907	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.9	-2	176.4	0	0	0	0	0	114.6	E257	E257-G259 PolarHBondContact O-N 2.9Å
260	S	87.1	Confident	95.1	Very high	9 Å²	9	42.1 Å²	42.1	6%	0.063	22%	0.223	C	C	.	.	S	Bend	trans	-113.2	-178.6	171.8	75.6	0	0	0	0	112.1	K256 E257 R258 L262	K256-S260 WeakPolarHBondContact CE-O 3.27Å; K256-S260 PolarHBondContact NZ-O 3.47Å; E257-S260 WeakPolarHBondContact CB-OG 3.37Å; E257-S260 PolarHBondContact O-N 2.8Å; E257-S260 PolarHBondContact O-OG 2.94Å; E257-S260 WeakPolarHBondContact OE2-CB 3.36Å; E257-S260 PolarHBondContact OE2-OG 3.25Å; R258-S260 VanDerWaalsContact C-N 3.25Å; R258-S260 PolarHBondContact O-N 3.39Å; S260-L262 WeakPolarHBondContact OG-CB 3.49Å; S260-L262 PolarHBondContact OG-N 2.98Å
261	F	85.9	Confident	95.2	Very high	177 Å²	177	41.8 Å²	41.8	78%	0.776	22%	0.221	S	C	*	.	S	Bend	trans	-98.4	4.7	169	-65.4	-80.4	0	0	0	112.5	E263	F261-E263 PolarHBondContact O-N 2.96Å
262	L	91.3	Very high	95.3	Very high	22 Å²	22	41.7 Å²	41.7	12%	0.115	22%	0.22	C	C	.	.			trans	-84.6	115.5	-168.8	-175.2	59.5	0	0	0	111.7	K172 A209 K256 E257 S260 F264	K172-L262 HydrophobicContact CB-CD2 4.49Å; K172-L262 HydrophobicContact CD-CD1 4.39Å; K172-L262 HydrophobicContact CG-CD1 3.88Å; K172-L262 HydrophobicContact CG-CD2 3.69Å; K172-L262 HydrophobicContact CG-CG 4.4Å; A209-L262 HydrophobicContact CB-CD1 4.32Å; K256-L262 WeakPolarHBondContact CG-O 3.25Å; E257-L262 PolarHBondContact N-O 3.12Å; E257-L262 VanDerWaalsContact N-O 3.13Å; S260-L262 WeakPolarHBondContact OG-CB 3.49Å; S260-L262 PolarHBondContact OG-N 2.98Å; L262-F264 HydrophobicContact CB-CE2 4.26Å; L262-F264 HydrophobicContact CD2-CE1 4.32Å; L262-F264 HydrophobicContact CD2-CE2 3.61Å; L262-F264 HydrophobicContact CD2-CZ 3.33Å; L262-F264 HydrophobicContact CG-CD2 4.27Å; L262-F264 HydrophobicContact CG-CE2 3.51Å; L262-F264 HydrophobicContact CG-CZ 3.69Å
263	E	96.2	Very high	95.2	Very high	53 Å²	53	40.5 Å²	40.5	25%	0.248	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	146.8	174.2	-59.1	-168.2	164.8	0	0	110.6	A209 K254 F255 K256 F261	A209-E263 PolarHBondContact N-O 3.02Å; K254-E263 WeakPolarHBondContact CE-OE2 3.47Å; K254-E263 IonicContact NZ-OE2 3.46Å; K254-E263 PolarHBondContact NZ-OE2 2.84Å; F255-E263 WeakPolarHBondContact O-CA 3.27Å; K256-E263 HydrophobicContact CB-CG 4.45Å; K256-E263 HydrophobicContact CD-CG 4.41Å; K256-E263 HydrophobicContact CG-CG 4.42Å; F261-E263 PolarHBondContact O-N 2.96Å
264	F	98.1	Very high	95.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.3	-179.1	-68	-95.6	0	0	0	110.7	C175 A209 L211 K254 F255 E257 L262	C175-F264 HydrophobicContact CB-CE1 4.01Å; C175-F264 HydrophobicContact CB-CE2 4.17Å; C175-F264 HydrophobicContact CB-CZ 3.42Å; C175-F264 VanDerWaalsContact CB-CZ 3.42Å; C175-F264 VanDerWaalsContact SG-CE2 3.6Å; C175-F264 WeakPolarHBondContact SG-CZ 3.42Å; A209-F264 HydrophobicContact CB-CD1 3.34Å; A209-F264 HydrophobicContact CB-CE1 3.43Å; A209-F264 VanDerWaalsContact CB-CE1 3.43Å; A209-F264 HydrophobicContact CB-CG 4.1Å; A209-F264 HydrophobicContact CB-CZ 4.24Å; A209-F264 VanDerWaalsContact O-CA 3.26Å; A209-F264 WeakPolarHBondContact O-CA 3.44Å; L211-F264 HydrophobicContact CD1-CB 4.28Å; L211-F264 HydrophobicContact CD1-CD1 3.68Å; L211-F264 HydrophobicContact CD1-CE1 4.5Å; L211-F264 HydrophobicContact CD1-CG 4.35Å; L211-F264 HydrophobicContact CG-CD1 4.06Å; K254-F264 CarbonylContact C-O 3.52Å; K254-F264 VanDerWaalsContact CA-O 3.32Å; K254-F264 WeakPolarHBondContact CA-O 3.45Å; F255-F264 HydrophobicContact CD1-CB 4.27Å; F255-F264 HydrophobicContact CD2-CB 3.85Å; F255-F264 HydrophobicContact CD2-CD2 4.17Å; F255-F264 HydrophobicContact CD2-CG 4.3Å; F255-F264 HydrophobicContact CE1-CB 3.82Å; F255-F264 HydrophobicContact CE2-CB 3.37Å; F255-F264 HydrophobicContact CE2-CD1 4.44Å; F255-F264 AromaticContact CE2-CD2 3.75Å; F255-F264 HydrophobicContact CE2-CD2 3.75Å; F255-F264 AromaticContact CE2-CG 3.62Å; F255-F264 HydrophobicContact CE2-CG 3.62Å; F255-F264 HydrophobicContact CG-CB 4.29Å; F255-F264 HydrophobicContact CZ-CB 3.35Å; F255-F264 HydrophobicContact CZ-CD1 4.48Å; F255-F264 HydrophobicContact CZ-CD2 4.48Å; F255-F264 AromaticContact CZ-CG 3.9Å; F255-F264 HydrophobicContact CZ-CG 3.9Å; F255-F264 PolarHBondContact N-O 2.97Å; F255-F264 PolarHBondContact O-N 3.02Å; E257-F264 HydrophobicContact CB-CE2 4.1Å; L262-F264 HydrophobicContact CB-CE2 4.26Å; L262-F264 HydrophobicContact CD2-CE1 4.32Å; L262-F264 HydrophobicContact CD2-CE2 3.61Å; L262-F264 HydrophobicContact CD2-CZ 3.33Å; L262-F264 HydrophobicContact CG-CD2 4.27Å; L262-F264 HydrophobicContact CG-CE2 3.51Å; L262-F264 HydrophobicContact CG-CZ 3.69Å
265	D	98.2	Very high	95.2	Very high	27 Å²	27	39.5 Å²	39.5	14%	0.144	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	103.9	176.7	-77.4	-4.1	0	0	0	108.8	A209 L211 I252 K254	A209-D265 PolarHBondContact O-N 3.23Å; L211-D265 PolarHBondContact N-O 3.06Å; I252-D265 HydrophobicContact CG2-CB 3.63Å; K254-D265 VanDerWaalsContact CD-OD1 3.27Å; K254-D265 WeakPolarHBondContact CD-OD1 3.32Å; K254-D265 VanDerWaalsContact CG-OD1 3.26Å; K254-D265 WeakPolarHBondContact CG-OD1 3.23Å; K254-D265 IonicContact NZ-OD1 2.66Å
266	L	98.6	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.7	-178.9	-173.5	159.9	0	0	0	111.5	I183 L192 L211 L213 L227 L230 F234 I252 L253 F255 V268	I183-L266 HydrophobicContact CD1-CD1 4.09Å; L192-L266 HydrophobicContact CD1-CD1 3.91Å; L192-L266 HydrophobicContact CD1-CG 4.34Å; L211-L266 HydrophobicContact CB-CB 4.07Å; L211-L266 HydrophobicContact CB-CG 4.13Å; L211-L266 HydrophobicContact CD1-CB 4.47Å; L211-L266 HydrophobicContact CD1-CD1 4.36Å; L211-L266 WeakPolarHBondContact O-CA 3.15Å; L213-L266 HydrophobicContact CB-CD2 4.29Å; L227-L266 HydrophobicContact CD2-CD2 3.54Å; L230-L266 HydrophobicContact CD1-CD1 4.49Å; L230-L266 HydrophobicContact CD1-CD2 3.99Å; F234-L266 HydrophobicContact CE2-CD1 4.25Å; F234-L266 HydrophobicContact CZ-CD1 4.12Å; I252-L266 CarbonylContact C-O 3.48Å; I252-L266 WeakPolarHBondContact CA-O 3.42Å; L253-L266 PolarHBondContact N-O 3.42Å; L253-L266 PolarHBondContact O-N 3.01Å; F255-L266 HydrophobicContact CE1-CB 3.92Å; F255-L266 HydrophobicContact CE1-CD1 4.44Å; L266-V268 HydrophobicContact CD2-CG2 4.16Å
267	N	98.1	Very high	95.2	Very high	15 Å²	15	38.8 Å²	38.8	8%	0.08	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	167.1	168.4	67.3	71.4	0	0	0	110.9	L211 C212 L213 V250 I252 N270	L211-N267 PolarHBondContact O-N 3.2Å; L211-N267 PolarHBondContact O-ND2 3.18Å; L211-N267 VanDerWaalsContact O-ND2 3.09Å; C212-N267 PolarHBondContact SG-OD1 2.58Å; L213-N267 PolarHBondContact N-O 3Å; V250-N267 HydrophobicContact CG1-CB 4.03Å; I252-N267 HydrophobicContact CG1-CB 4.48Å; N267-N270 HydrophobicContact CB-CB 4.47Å; N267-N270 WeakPolarHBondContact OD1-CB 3.42Å
268	V	97.4	Very high	95.4	Very high	8 Å²	8	37.3 Å²	37.3	5%	0.048	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.8	179.6	177.1	0	0	0	0	109.9	L213 V215 P223 V226 L227 L266 N270	L213-V268 HydrophobicContact CB-CG2 4.26Å; L213-V268 HydrophobicContact CD2-CG2 4.33Å; L213-V268 CarbonylContact O-C 3.55Å; L213-V268 WeakPolarHBondContact O-CA 3.12Å; V215-V268 HydrophobicContact CG2-CG1 4.38Å; P223-V268 HydrophobicContact CB-CB 4.1Å; P223-V268 HydrophobicContact CB-CG1 4.43Å; V226-V268 HydrophobicContact CB-CG1 4.26Å; V226-V268 HydrophobicContact CB-CG2 4.07Å; V226-V268 HydrophobicContact CG1-CG1 4.23Å; V226-V268 HydrophobicContact CG1-CG2 3.74Å; V226-V268 HydrophobicContact CG2-CG1 4.33Å; L227-V268 HydrophobicContact CD2-CG2 3.68Å; L227-V268 HydrophobicContact CG-CG2 3.78Å; L266-V268 HydrophobicContact CD2-CG2 4.16Å; V268-N270 PolarHBondContact O-N 3.44Å; V268-N270 VanDerWaalsContact O-N 3.13Å
269	N	95.4	Very high	95.6	Very high	44 Å²	44	30.1 Å²	30.1	24%	0.235	18%	0.177	C	C	.	.	S	Bend	trans	57	20.2	175.6	-65.6	-26.7	0	0	0	115.7	L213 V214 V215 T271	L213-N269 PolarHBondContact O-N 3.07Å; V214-N269 WeakPolarHBondContact CA-OD1 3.41Å; V215-N269 PolarHBondContact N-OD1 2.99Å; N269-T271 PolarHBondContact O-N 3.42Å
270	N	95.3	Very high	96.1	Very high	52 Å²	52	26.7 Å²	26.7	28%	0.278	14%	0.138	S	C	.	.			trans	-81.6	63.1	170.7	-172.9	32.9	0	0	0	110.9	V250 N267 V268 V272 G273	V250-N270 HydrophobicContact CG1-CB 4.27Å; N267-N270 HydrophobicContact CB-CB 4.47Å; N267-N270 WeakPolarHBondContact OD1-CB 3.42Å; V268-N270 PolarHBondContact O-N 3.44Å; V268-N270 VanDerWaalsContact O-N 3.13Å; N270-V272 PolarHBondContact O-N 3.24Å; N270-G273 PolarHBondContact O-N 3.32Å
271	T	95.8	Very high	96.6	Very high	42 Å²	42	27.9 Å²	27.9	26%	0.258	14%	0.141	S	C	.	.	H	α-helix	trans	-63.4	-24.7	-170.8	54.5	0	0	0	0	113.8	V214 N269 G273 I274 R275 I352	V214-T271 HydrophobicContact CG2-CG2 4.15Å; N269-T271 PolarHBondContact O-N 3.42Å; T271-G273 PolarHBondContact O-N 3.48Å; T271-I274 WeakPolarHBondContact O-CB 3.42Å; T271-I274 PolarHBondContact O-N 2.92Å; T271-R275 PolarHBondContact O-N 2.74Å; T271-R275 VanDerWaalsContact O-N 3.16Å; T271-I352 HydrophobicContact CG2-CD1 4.09Å; T271-I352 HydrophobicContact CG2-CG1 3.9Å
272	V	96.8	Very high	97.2	Very high	19 Å²	19	20.1 Å²	20.1	12%	0.115	11%	0.108	C	C	.	.	H	α-helix	trans	-61.5	-30.9	172.7	172.2	0	0	0	0	111.9	N270 I274 R275 N276 F422 E423	N270-V272 PolarHBondContact O-N 3.24Å; V272-I274 VanDerWaalsContact C-N 3.29Å; V272-I274 PolarHBondContact O-N 3.44Å; V272-R275 PolarHBondContact O-N 2.96Å; V272-N276 WeakPolarHBondContact CG1-ND2 3.26Å; V272-N276 WeakPolarHBondContact O-CB 3.43Å; V272-N276 VanDerWaalsContact O-CG 3.31Å; V272-N276 PolarHBondContact O-N 3.03Å; V272-N276 PolarHBondContact O-ND2 3.2Å; V272-N276 VanDerWaalsContact O-ND2 3.17Å; V272-F422 HydrophobicContact CG1-CB 4.46Å; V272-E423 HydrophobicContact CG1-CG 4.12Å; V272-E423 HydrophobicContact CG2-CG 3.8Å; V272-E423 VanDerWaalsContact CG2-OE1 3.31Å; V272-E423 WeakPolarHBondContact CG2-OE1 3.22Å
273	G	96.9	Very high	97.5	Very high	19 Å²	19	19.1 Å²	19.1	20%	0.196	10%	0.103	C	C	.	.	H	α-helix	trans	-61.2	-36.9	171.5	0	0	0	0	0	113	N270 T271 T277	N270-G273 PolarHBondContact O-N 3.32Å; T271-G273 PolarHBondContact O-N 3.48Å; G273-T277 WeakPolarHBondContact O-CB 3.43Å; G273-T277 PolarHBondContact O-N 2.85Å; G273-T277 VanDerWaalsContact O-N 3.1Å; G273-T277 PolarHBondContact O-OG1 3.49Å
274	I	97.8	Very high	97.6	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.7	-51.2	176.1	-56.9	168.4	0	0	0	109.3	Y193 T195 C212 V214 T271 V272 N276 T277 F278 I352 V355	Y193-I274 HydrophobicContact CD1-CD1 4.26Å; Y193-I274 HydrophobicContact CD1-CG2 4.35Å; Y193-I274 HydrophobicContact CD2-CD1 3.68Å; Y193-I274 HydrophobicContact CE2-CD1 4.1Å; Y193-I274 HydrophobicContact CG-CD1 3.75Å; Y193-I274 HydrophobicContact CG-CG1 4.35Å; T195-I274 HydrophobicContact CG2-CB 4.42Å; T195-I274 HydrophobicContact CG2-CG1 3.67Å; C212-I274 HydrophobicContact CB-CD1 4.03Å; C212-I274 HydrophobicContact CB-CG1 3.93Å; V214-I274 HydrophobicContact CG2-CD1 3.75Å; T271-I274 WeakPolarHBondContact O-CB 3.42Å; T271-I274 PolarHBondContact O-N 2.92Å; V272-I274 VanDerWaalsContact C-N 3.29Å; V272-I274 PolarHBondContact O-N 3.44Å; I274-N276 PolarHBondContact O-N 3.4Å; I274-T277 VanDerWaalsContact O-CB 3.29Å; I274-T277 WeakPolarHBondContact O-CB 3.38Å; I274-T277 PolarHBondContact O-N 2.95Å; I274-T277 VanDerWaalsContact O-N 3.07Å; I274-F278 HydrophobicContact CG2-CD2 4.21Å; I274-F278 HydrophobicContact CG2-CE2 4.07Å; I274-F278 WeakPolarHBondContact O-CD2 3.47Å; I274-F278 PolarHBondContact O-N 3.25Å; I274-I352 HydrophobicContact CB-CG2 4.43Å; I274-I352 HydrophobicContact CD1-CG2 3.44Å; I274-I352 VanDerWaalsContact CD1-CG2 3.44Å; I274-I352 HydrophobicContact CG2-CG2 4.16Å; I274-V355 HydrophobicContact CG2-CG1 4.22Å
275	R	98.2	Very high	97.4	Very high	25 Å²	25	22.1 Å²	22.1	9%	0.094	11%	0.113	C	C	.	.	H	α-helix	trans	-55.2	-48.6	178	-61.5	-170.6	-173.4	-68.8	-1.1	112.8	T271 V272 T277 F278 L279 D347 P348 M350 I352 V355 F422	T271-R275 PolarHBondContact O-N 2.74Å; T271-R275 VanDerWaalsContact O-N 3.16Å; V272-R275 PolarHBondContact O-N 2.96Å; R275-T277 VanDerWaalsContact C-N 3.28Å; R275-T277 PolarHBondContact O-N 2.88Å; R275-F278 PolarHBondContact O-N 2.97Å; R275-L279 PolarHBondContact O-N 2.94Å; R275-D347 PolarHBondContact NH1-O 3.13Å; R275-P348 PolarHBondContact NE-O 2.9Å; R275-P348 VanDerWaalsContact NE-O 3.16Å; R275-P348 PolarHBondContact NH2-O 2.81Å; R275-M350 VanDerWaalsContact CZ-O 3.25Å; R275-M350 PolarHBondContact NH1-O 2.97Å; R275-M350 PolarHBondContact NH2-O 2.95Å; R275-I352 HydrophobicContact CG-CD1 4.36Å; R275-V355 HydrophobicContact CG-CG1 4.48Å; R275-V355 HydrophobicContact CG-CG2 4.18Å; R275-V355 VanDerWaalsContact NH1-CG2 3.31Å; R275-F422 HydrophobicContact CB-CD1 4.26Å; R275-F422 HydrophobicContact CB-CD2 4.11Å; R275-F422 HydrophobicContact CB-CE1 3.96Å; R275-F422 HydrophobicContact CB-CE2 3.79Å; R275-F422 HydrophobicContact CB-CG 4.33Å; R275-F422 HydrophobicContact CB-CZ 3.73Å
276	N	98	Very high	97.3	Very high	13 Å²	13	21.9 Å²	21.9	7%	0.07	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-37.7	177.2	-76.8	-32.2	0	0	0	113.2	V272 I274 F278 L279 L280 Y317 E420 F422	V272-N276 WeakPolarHBondContact CG1-ND2 3.26Å; V272-N276 WeakPolarHBondContact O-CB 3.43Å; V272-N276 VanDerWaalsContact O-CG 3.31Å; V272-N276 PolarHBondContact O-N 3.03Å; V272-N276 PolarHBondContact O-ND2 3.2Å; V272-N276 VanDerWaalsContact O-ND2 3.17Å; I274-N276 PolarHBondContact O-N 3.4Å; N276-F278 VanDerWaalsContact C-N 3.3Å; N276-F278 PolarHBondContact O-N 3.42Å; N276-L279 PolarHBondContact O-N 3.47Å; N276-L280 VanDerWaalsContact O-CB 3.28Å; N276-L280 WeakPolarHBondContact O-CB 3.19Å; N276-L280 WeakPolarHBondContact O-CG 3.07Å; N276-L280 PolarHBondContact O-N 3.37Å; N276-Y317 HydrophobicContact CB-CE2 4.42Å; N276-Y317 PolarHBondContact ND2-OH 3.2Å; N276-Y317 VanDerWaalsContact ND2-OH 3.13Å; N276-Y317 PolarHBondContact OD1-OH 3.31Å; N276-E420 VanDerWaalsContact CG-OE1 3.26Å; N276-E420 PolarHBondContact ND2-OE1 3.08Å; N276-E420 PolarHBondContact OD1-OE1 3.36Å; N276-E420 VanDerWaalsContact OD1-OE1 3.08Å; N276-F422 WeakPolarHBondContact OD1-CD2 3.13Å; N276-F422 VanDerWaalsContact OD1-CE2 3.3Å; N276-F422 WeakPolarHBondContact OD1-CE2 3.17Å
277	T	98.3	Very high	97.2	Very high	5 Å²	5	22.9 Å²	22.9	3%	0.031	12%	0.12	C	C	.	.	H	α-helix	trans	-57.9	-45.7	179.8	-63.5	0	0	0	0	111.1	G196 M199 G273 I274 R275 R281	G196-T277 PolarHBondContact N-OG1 3.02Å; M199-T277 HydrophobicContact CB-CG2 3.49Å; M199-T277 VanDerWaalsContact CB-CG2 3.49Å; G273-T277 WeakPolarHBondContact O-CB 3.43Å; G273-T277 PolarHBondContact O-N 2.85Å; G273-T277 VanDerWaalsContact O-N 3.1Å; G273-T277 PolarHBondContact O-OG1 3.49Å; I274-T277 VanDerWaalsContact O-CB 3.29Å; I274-T277 WeakPolarHBondContact O-CB 3.38Å; I274-T277 PolarHBondContact O-N 2.95Å; I274-T277 VanDerWaalsContact O-N 3.07Å; R275-T277 VanDerWaalsContact C-N 3.28Å; R275-T277 PolarHBondContact O-N 2.88Å; T277-R281 WeakPolarHBondContact O-CB 3.32Å; T277-R281 PolarHBondContact O-N 2.98Å
278	F	97.9	Very high	97.1	Very high	13 Å²	13	24.4 Å²	24.4	6%	0.057	13%	0.13	C	C	.	.	H	α-helix	trans	-82.6	-28.2	-177.6	-68.2	-77.9	0	0	0	113.3	M199 I274 R275 N276 R281 T282 V355 P356 P359	M199-F278 HydrophobicContact CE-CZ 4.46Å; I274-F278 HydrophobicContact CG2-CD2 4.21Å; I274-F278 HydrophobicContact CG2-CE2 4.07Å; I274-F278 WeakPolarHBondContact O-CD2 3.47Å; I274-F278 PolarHBondContact O-N 3.25Å; R275-F278 PolarHBondContact O-N 2.97Å; N276-F278 VanDerWaalsContact C-N 3.3Å; N276-F278 PolarHBondContact O-N 3.42Å; F278-R281 WeakPolarHBondContact O-CB 3.15Å; F278-R281 PolarHBondContact O-N 3.25Å; F278-T282 PolarHBondContact O-N 2.89Å; F278-T282 PolarHBondContact O-OG1 3.43Å; F278-V355 HydrophobicContact CB-CG1 4.06Å; F278-V355 HydrophobicContact CD2-CG1 3.75Å; F278-V355 HydrophobicContact CG-CG1 4.24Å; F278-P356 HydrophobicContact CD1-CB 4.35Å; F278-P356 HydrophobicContact CD2-CG 4.41Å; F278-P356 HydrophobicContact CE1-CB 3.74Å; F278-P356 HydrophobicContact CE1-CG 4.43Å; F278-P356 HydrophobicContact CE2-CB 3.95Å; F278-P356 HydrophobicContact CE2-CG 3.73Å; F278-P356 HydrophobicContact CZ-CB 3.52Å; F278-P356 HydrophobicContact CZ-CG 3.74Å; F278-P359 HydrophobicContact CB-CG 3.99Å; F278-P359 HydrophobicContact CD1-CG 4.19Å
279	L	98.4	Very high	97.1	Very high	2 Å²	2	24 Å²	24	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-60.4	-50.2	165.4	178.3	62	0	0	0	111.1	R275 N276 R281 T282 Y283 Q339 F346 P421 F422	R275-L279 PolarHBondContact O-N 2.94Å; N276-L279 PolarHBondContact O-N 3.47Å; L279-R281 VanDerWaalsContact C-N 3.3Å; L279-R281 PolarHBondContact O-N 3.35Å; L279-T282 WeakPolarHBondContact O-CB 3.36Å; L279-T282 PolarHBondContact O-N 2.74Å; L279-Y283 HydrophobicContact CD1-CD2 4.13Å; L279-Y283 HydrophobicContact CD1-CE2 3.59Å; L279-Y283 HydrophobicContact CD2-CE2 4.47Å; L279-Y283 HydrophobicContact CG-CD2 4.14Å; L279-Y283 HydrophobicContact CG-CE2 3.86Å; L279-Y283 VanDerWaalsContact O-CD2 3.31Å; L279-Y283 WeakPolarHBondContact O-CD2 3.31Å; L279-Y283 PolarHBondContact O-N 3.36Å; L279-Y283 VanDerWaalsContact O-N 3.16Å; L279-Q339 HydrophobicContact CD1-CG 3.99Å; L279-Q339 HydrophobicContact CD2-CG 4.34Å; L279-F346 HydrophobicContact CB-CD1 4.21Å; L279-F346 HydrophobicContact CB-CE1 4.24Å; L279-F346 HydrophobicContact CD1-CD1 3.78Å; L279-F346 HydrophobicContact CD1-CD2 4.45Å; L279-F346 HydrophobicContact CD1-CE1 3.8Å; L279-F346 HydrophobicContact CD1-CE2 4.49Å; L279-F346 HydrophobicContact CD1-CG 4.12Å; L279-F346 HydrophobicContact CD1-CZ 4.17Å; L279-P421 HydrophobicContact CD2-CB 3.78Å; L279-P421 HydrophobicContact CD2-CG 4.18Å; L279-F422 HydrophobicContact CB-CE2 4.07Å; L279-F422 HydrophobicContact CB-CZ 4.2Å; L279-F422 HydrophobicContact CD2-CE2 3.64Å; L279-F422 HydrophobicContact CD2-CZ 4.1Å; L279-F422 HydrophobicContact CG-CE2 4.48Å
280	L	98.5	Very high	97.3	Very high	16 Å²	16	22 Å²	22	8%	0.084	12%	0.117	C	C	.	.	H	α-helix	trans	-64.4	-35	177.5	-70.1	-175.7	0	0	0	112.2	L202 N276 T282 Y283 A284 Y317 V320 L321 L324	L202-L280 HydrophobicContact CD1-CB 4.38Å; L202-L280 HydrophobicContact CD1-CD1 4.47Å; N276-L280 VanDerWaalsContact O-CB 3.28Å; N276-L280 WeakPolarHBondContact O-CB 3.19Å; N276-L280 WeakPolarHBondContact O-CG 3.07Å; N276-L280 PolarHBondContact O-N 3.37Å; L280-T282 VanDerWaalsContact C-N 3.32Å; L280-T282 PolarHBondContact O-N 3.28Å; L280-Y283 PolarHBondContact O-N 2.96Å; L280-A284 VanDerWaalsContact O-CB 3.32Å; L280-A284 WeakPolarHBondContact O-CB 3.15Å; L280-A284 PolarHBondContact O-N 2.83Å; L280-Y317 HydrophobicContact CD1-CD2 3.88Å; L280-Y317 HydrophobicContact CD1-CE2 3.81Å; L280-Y317 HydrophobicContact CD2-CE2 4.48Å; L280-Y317 HydrophobicContact CG-CE2 4.37Å; L280-V320 HydrophobicContact CD1-CG1 4.04Å; L280-V320 HydrophobicContact CD2-CG1 3.56Å; L280-V320 HydrophobicContact CG-CG1 4.41Å; L280-L321 HydrophobicContact CD2-CD2 4.15Å; L280-L324 HydrophobicContact CD2-CD1 3.56Å
281	R	97.6	Very high	97.4	Very high	34 Å²	34	22 Å²	22	13%	0.128	11%	0.113	C	C	.	.	H	α-helix	trans	-57.4	-47.8	172.3	-168.1	179.4	178	80.2	2.8	111	M199 S200 T277 F278 L279 Y283 A284 Y285	M199-R281 WeakPolarHBondContact O-CD 3.39Å; M199-R281 PolarHBondContact O-NH1 2.84Å; S200-R281 VanDerWaalsContact O-CA 3.28Å; S200-R281 WeakPolarHBondContact O-CA 3.42Å; T277-R281 WeakPolarHBondContact O-CB 3.32Å; T277-R281 PolarHBondContact O-N 2.98Å; F278-R281 WeakPolarHBondContact O-CB 3.15Å; F278-R281 PolarHBondContact O-N 3.25Å; L279-R281 VanDerWaalsContact C-N 3.3Å; L279-R281 PolarHBondContact O-N 3.35Å; R281-Y283 VanDerWaalsContact C-N 3.32Å; R281-Y283 PolarHBondContact O-N 3.38Å; R281-A284 WeakPolarHBondContact O-CB 3.27Å; R281-A284 PolarHBondContact O-N 2.58Å; R281-A284 VanDerWaalsContact O-N 3.14Å; R281-Y285 HydrophobicContact CG-CD2 3.94Å; R281-Y285 HydrophobicContact CG-CE2 3.93Å; R281-Y285 VanDerWaalsContact O-CD2 3.28Å; R281-Y285 WeakPolarHBondContact O-CD2 3.46Å; R281-Y285 PolarHBondContact O-N 2.63Å
282	T	97.8	Very high	97.5	Very high	14 Å²	14	20 Å²	20	9%	0.086	10%	0.101	C	C	.	.	H	α-helix	trans	-57.2	-47.4	178	-52.2	0	0	0	0	110.9	F278 L279 L280 A284 Y285 A286 F338 F346 V362	F278-T282 PolarHBondContact O-N 2.89Å; F278-T282 PolarHBondContact O-OG1 3.43Å; L279-T282 WeakPolarHBondContact O-CB 3.36Å; L279-T282 PolarHBondContact O-N 2.74Å; L280-T282 VanDerWaalsContact C-N 3.32Å; L280-T282 PolarHBondContact O-N 3.28Å; T282-A284 PolarHBondContact O-N 3.24Å; T282-Y285 PolarHBondContact O-N 3.03Å; T282-A286 WeakPolarHBondContact O-CB 3.01Å; T282-A286 PolarHBondContact O-N 3.03Å; T282-A286 VanDerWaalsContact O-N 3.15Å; T282-F338 HydrophobicContact CG2-CD1 4.31Å; T282-F338 HydrophobicContact CG2-CD2 3.67Å; T282-F338 HydrophobicContact CG2-CE1 4.42Å; T282-F338 HydrophobicContact CG2-CE2 3.81Å; T282-F338 HydrophobicContact CG2-CG 3.96Å; T282-F338 HydrophobicContact CG2-CZ 4.2Å; T282-F346 HydrophobicContact CG2-CZ 3.94Å; T282-F346 WeakPolarHBondContact OG1-CZ 3.39Å; T282-V362 HydrophobicContact CG2-CB 4.08Å; T282-V362 HydrophobicContact CG2-CG1 3.84Å; T282-V362 HydrophobicContact CG2-CG2 3.94Å
283	Y	98.6	Very high	97.6	Very high	1 Å²	1	19.1 Å²	19.1	0%	0.004	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-39.6	175.6	-76.1	-64.6	0	0	0	113.8	L279 L280 R281 Y285 A286 L324 Q328 L335 P336 F338 V397	L279-Y283 HydrophobicContact CD1-CD2 4.13Å; L279-Y283 HydrophobicContact CD1-CE2 3.59Å; L279-Y283 HydrophobicContact CD2-CE2 4.47Å; L279-Y283 HydrophobicContact CG-CD2 4.14Å; L279-Y283 HydrophobicContact CG-CE2 3.86Å; L279-Y283 VanDerWaalsContact O-CD2 3.31Å; L279-Y283 WeakPolarHBondContact O-CD2 3.31Å; L279-Y283 PolarHBondContact O-N 3.36Å; L279-Y283 VanDerWaalsContact O-N 3.16Å; L280-Y283 PolarHBondContact O-N 2.96Å; R281-Y283 VanDerWaalsContact C-N 3.32Å; R281-Y283 PolarHBondContact O-N 3.38Å; Y283-Y285 PolarHBondContact O-N 3.33Å; Y283-A286 PolarHBondContact O-N 3.48Å; Y283-L324 HydrophobicContact CD1-CD2 4.45Å; Y283-L324 HydrophobicContact CD2-CD1 3.74Å; Y283-L324 HydrophobicContact CE2-CD1 4.36Å; Y283-L324 HydrophobicContact CG-CD1 3.89Å; Y283-L324 HydrophobicContact CG-CD2 4.14Å; Y283-Q328 PolarHBondContact OH-NE2 3.49Å; Y283-L335 HydrophobicContact CD1-CB 4.41Å; Y283-L335 HydrophobicContact CD1-CD1 3.92Å; Y283-L335 HydrophobicContact CD1-CD2 4.16Å; Y283-L335 HydrophobicContact CD1-CG 4.41Å; Y283-L335 HydrophobicContact CE1-CB 4.46Å; Y283-P336 WeakPolarHBondContact CE1-O 3.3Å; Y283-F338 AromaticContact CD1-CD2 3.51Å; Y283-F338 HydrophobicContact CD1-CD2 3.51Å; Y283-F338 AromaticContact CD1-CE2 3.55Å; Y283-F338 HydrophobicContact CD1-CE2 3.55Å; Y283-F338 HydrophobicContact CD2-CD2 4.36Å; Y283-F338 AromaticContact CE1-CD2 3.29Å; Y283-F338 HydrophobicContact CE1-CD2 3.29Å; Y283-F338 AromaticContact CE1-CE2 3.71Å; Y283-F338 HydrophobicContact CE1-CE2 3.71Å; Y283-F338 HydrophobicContact CE1-CG 4.27Å; Y283-F338 HydrophobicContact CE2-CD2 4.21Å; Y283-F338 HydrophobicContact CG-CD2 4.04Å; Y283-F338 HydrophobicContact CG-CE2 4.24Å; Y283-F338 AromaticContact CZ-CD2 3.67Å; Y283-F338 PolarHBondContact OH-N 3.12Å; Y283-F338 VanDerWaalsContact OH-N 3.1Å; Y283-V397 HydrophobicContact CE2-CG1 3.88Å
284	A	97.1	Very high	97.7	Very high	2 Å²	2	18.3 Å²	18.3	2%	0.017	9%	0.086	C	C	.	.	H	α-helix	trans	-61.6	-32.2	-178.3	0	0	0	0	0	112.6	S200 L202 L280 R281 T282 R291	S200-A284 VanDerWaalsContact O-CB 3.27Å; S200-A284 WeakPolarHBondContact O-CB 3.32Å; L202-A284 HydrophobicContact CD2-CB 3.74Å; L202-A284 HydrophobicContact CG-CB 4.11Å; L280-A284 VanDerWaalsContact O-CB 3.32Å; L280-A284 WeakPolarHBondContact O-CB 3.15Å; L280-A284 PolarHBondContact O-N 2.83Å; R281-A284 WeakPolarHBondContact O-CB 3.27Å; R281-A284 PolarHBondContact O-N 2.58Å; R281-A284 VanDerWaalsContact O-N 3.14Å; T282-A284 PolarHBondContact O-N 3.24Å; A284-R291 HydrophobicContact CB-CG 3.93Å; A284-R291 VanDerWaalsContact O-CD 3.28Å; A284-R291 WeakPolarHBondContact O-CD 3.43Å; A284-R291 WeakPolarHBondContact O-CG 3.37Å
285	Y	95.5	Very high	97.7	Very high	114 Å²	114	18.7 Å²	18.7	45%	0.447	9%	0.089	S	C	.	.	H	α-helix	trans	-103.1	2.4	-179.5	-66.4	-80.1	0	0	0	113.8	R281 T282 Y283	R281-Y285 HydrophobicContact CG-CD2 3.94Å; R281-Y285 HydrophobicContact CG-CE2 3.93Å; R281-Y285 VanDerWaalsContact O-CD2 3.28Å; R281-Y285 WeakPolarHBondContact O-CD2 3.46Å; R281-Y285 PolarHBondContact O-N 2.63Å; T282-Y285 PolarHBondContact O-N 3.03Å; Y283-Y285 PolarHBondContact O-N 3.33Å
286	A	95.6	Very high	97.7	Very high	22 Å²	22	17.5 Å²	17.5	18%	0.182	8%	0.084	C	C	.	.	H	α-helix	trans	-72.7	-31.8	180	0	0	0	0	0	113.7	T282 Y283 L335 F338	T282-A286 WeakPolarHBondContact O-CB 3.01Å; T282-A286 PolarHBondContact O-N 3.03Å; T282-A286 VanDerWaalsContact O-N 3.15Å; Y283-A286 PolarHBondContact O-N 3.48Å; A286-L335 HydrophobicContact CB-CD2 3.67Å; A286-F338 HydrophobicContact CB-CE2 3.69Å; A286-F338 HydrophobicContact CB-CZ 3.63Å
287	D	96.6	Very high	97.8	Very high	20 Å²	20	17 Å²	17	11%	0.107	8%	0.081	C	C	.	.	S	Bend	trans	-147.4	136.9	175.7	-179.3	-62.4	0	0	0	109.4	R289 V290 V334	D287-R289 PolarHBondContact O-N 3.36Å; D287-R289 VanDerWaalsContact OD1-CB 3.23Å; D287-R289 WeakPolarHBondContact OD1-CB 3.38Å; D287-R289 WeakPolarHBondContact OD1-CG 3.38Å; D287-R289 IonicContact OD1-CZ 3.67Å; D287-R289 PolarHBondContact OD1-N 3.18Å; D287-R289 IonicContact OD1-NE 3.37Å; D287-R289 PolarHBondContact OD1-NE 3.33Å; D287-R289 IonicContact OD1-NH2 3.6Å; D287-R289 IonicContact OD2-CZ 3.54Å; D287-R289 IonicContact OD2-NE 2.68Å; D287-R289 PolarHBondContact OD2-NE 3.01Å; D287-R289 IonicContact OD2-NH2 3.99Å; D287-R289 PolarHBondContact OD2-NH2 3.08Å; D287-V290 HydrophobicContact CB-CG2 3.97Å; D287-V290 WeakPolarHBondContact O-CB 3.34Å; D287-V290 WeakPolarHBondContact O-CG2 3.03Å; D287-V290 PolarHBondContact O-N 3.49Å; D287-V290 VanDerWaalsContact O-N 3.08Å; D287-V334 HydrophobicContact CB-CG1 4.03Å
288	V	95.9	Very high	97.7	Very high	47 Å²	47	18 Å²	18	29%	0.285	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.6	-174.6	-61.7	0	0	0	0	113.4	L143 F146 P292	L143-V288 HydrophobicContact CD1-CB 4.16Å; L143-V288 HydrophobicContact CD1-CG2 4.04Å; F146-V288 HydrophobicContact CD2-CG2 3.76Å; F146-V288 HydrophobicContact CE2-CG2 3.72Å; V288-P292 VanDerWaalsContact O-CD 3.23Å; V288-P292 WeakPolarHBondContact O-CD 3.39Å
289	R	97.9	Very high	97.7	Very high	1 Å²	1	18.4 Å²	18.4	0%	0.004	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-18.6	-179	-61	171.2	-71.6	-172.4	-8.4	113.5	F146 D287 P292 L293 N369 S371 L373 L376	F146-R289 HydrophobicContact CB-CG 4.04Å; F146-R289 HydrophobicContact CD1-CG 4.3Å; F146-R289 HydrophobicContact CD2-CG 3.8Å; F146-R289 HydrophobicContact CE2-CG 4.3Å; F146-R289 HydrophobicContact CG-CG 3.78Å; D287-R289 PolarHBondContact O-N 3.36Å; D287-R289 VanDerWaalsContact OD1-CB 3.23Å; D287-R289 WeakPolarHBondContact OD1-CB 3.38Å; D287-R289 WeakPolarHBondContact OD1-CG 3.38Å; D287-R289 IonicContact OD1-CZ 3.67Å; D287-R289 PolarHBondContact OD1-N 3.18Å; D287-R289 IonicContact OD1-NE 3.37Å; D287-R289 PolarHBondContact OD1-NE 3.33Å; D287-R289 IonicContact OD1-NH2 3.6Å; D287-R289 IonicContact OD2-CZ 3.54Å; D287-R289 IonicContact OD2-NE 2.68Å; D287-R289 PolarHBondContact OD2-NE 3.01Å; D287-R289 IonicContact OD2-NH2 3.99Å; D287-R289 PolarHBondContact OD2-NH2 3.08Å; R289-P292 WeakPolarHBondContact O-CD 3.25Å; R289-L293 VanDerWaalsContact O-CB 3.28Å; R289-L293 WeakPolarHBondContact O-CB 3.35Å; R289-L293 PolarHBondContact O-N 3.22Å; R289-N369 PolarHBondContact NH1-O 2.99Å; R289-N369 PolarHBondContact NH1-OD1 3.41Å; R289-N369 PolarHBondContact NH2-O 3.14Å; R289-N369 VanDerWaalsContact NH2-O 3.11Å; R289-S371 PolarHBondContact NH1-O 2.95Å; R289-L373 HydrophobicContact CB-CD2 3.82Å; R289-L373 HydrophobicContact CG-CD2 4.21Å; R289-L373 HydrophobicContact CG-CG 4.5Å; R289-L373 WeakPolarHBondContact O-CD2 3.3Å; R289-L376 HydrophobicContact CB-CD1 4.14Å
290	V	98.4	Very high	97.7	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.4	-51.1	-171.4	175.9	0	0	0	0	111.8	D287 L293 I294 L324 L327 L335	D287-V290 HydrophobicContact CB-CG2 3.97Å; D287-V290 WeakPolarHBondContact O-CB 3.34Å; D287-V290 WeakPolarHBondContact O-CG2 3.03Å; D287-V290 PolarHBondContact O-N 3.49Å; D287-V290 VanDerWaalsContact O-N 3.08Å; V290-L293 PolarHBondContact O-N 2.85Å; V290-I294 HydrophobicContact CG1-CD1 3.62Å; V290-I294 HydrophobicContact CG1-CG1 4.43Å; V290-I294 WeakPolarHBondContact O-CB 3.47Å; V290-I294 WeakPolarHBondContact O-CG1 3.42Å; V290-I294 PolarHBondContact O-N 3.22Å; V290-L324 HydrophobicContact CG1-CD2 4.15Å; V290-L327 HydrophobicContact CG2-CD1 3.99Å; V290-L335 HydrophobicContact CG2-CD1 4.08Å; V290-L335 HydrophobicContact CG2-CD2 3.95Å; V290-L335 HydrophobicContact CG2-CG 4.25Å
291	R	98.3	Very high	97.7	Very high	53 Å²	53	17.6 Å²	17.6	20%	0.2	8%	0.083	C	C	.	.	H	α-helix	trans	-64.7	-47.9	-176	-64.4	166.2	64.4	-135.4	-6.8	112.4	F159 Q163 G201 L202 A284 L293 I294 L295	F159-R291 HydrophobicContact CE2-CB 3.69Å; F159-R291 HydrophobicContact CZ-CB 3.94Å; Q163-R291 VanDerWaalsContact OE1-NH2 3.15Å; G201-R291 PolarHBondContact O-NE 3Å; L202-R291 HydrophobicContact CD2-CG 4.12Å; A284-R291 HydrophobicContact CB-CG 3.93Å; A284-R291 VanDerWaalsContact O-CD 3.28Å; A284-R291 WeakPolarHBondContact O-CD 3.43Å; A284-R291 WeakPolarHBondContact O-CG 3.37Å; R291-L293 PolarHBondContact O-N 3.05Å; R291-I294 PolarHBondContact O-N 3.15Å; R291-L295 WeakPolarHBondContact O-CB 3.27Å; R291-L295 PolarHBondContact O-N 3.35Å
292	P	98.3	Very high	97.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-43.8	175.4	-23.8	33.8	0	0	0	112.8	L143 F159 V288 R289 L295 V296 L373	L143-P292 HydrophobicContact CD1-CG 4.22Å; L143-P292 HydrophobicContact CD2-CG 4.05Å; F159-P292 HydrophobicContact CB-CB 4.03Å; F159-P292 HydrophobicContact CB-CG 4.38Å; F159-P292 HydrophobicContact CD1-CB 4.48Å; F159-P292 HydrophobicContact CD1-CG 3.91Å; F159-P292 HydrophobicContact CD2-CB 4.18Å; F159-P292 HydrophobicContact CD2-CG 4.08Å; F159-P292 HydrophobicContact CE1-CG 4.19Å; F159-P292 HydrophobicContact CE2-CG 4.38Å; F159-P292 HydrophobicContact CG-CB 3.97Å; F159-P292 HydrophobicContact CG-CG 3.85Å; F159-P292 HydrophobicContact CZ-CG 4.41Å; V288-P292 VanDerWaalsContact O-CD 3.23Å; V288-P292 WeakPolarHBondContact O-CD 3.39Å; R289-P292 WeakPolarHBondContact O-CD 3.25Å; P292-L295 PolarHBondContact O-N 3.49Å; P292-V296 VanDerWaalsContact O-CG2 3.3Å; P292-V296 WeakPolarHBondContact O-CG2 3.25Å; P292-V296 PolarHBondContact O-N 2.63Å; P292-L373 HydrophobicContact CB-CD1 4.09Å; P292-L373 HydrophobicContact CB-CD2 4Å; P292-L373 HydrophobicContact CG-CD1 4.5Å
293	L	98.8	Very high	97.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.6	-48.8	179.3	-178.8	62.7	0	0	0	111.7	M155 R289 V290 R291 L295 V296 V297 V323 L327 L376 L377	M155-L293 HydrophobicContact CE-CD1 4Å; R289-L293 VanDerWaalsContact O-CB 3.28Å; R289-L293 WeakPolarHBondContact O-CB 3.35Å; R289-L293 PolarHBondContact O-N 3.22Å; V290-L293 PolarHBondContact O-N 2.85Å; R291-L293 PolarHBondContact O-N 3.05Å; L293-L295 VanDerWaalsContact C-N 3.34Å; L293-L295 PolarHBondContact O-N 3.37Å; L293-V296 PolarHBondContact O-N 3.05Å; L293-V297 HydrophobicContact CD1-CG2 4.43Å; L293-V297 VanDerWaalsContact O-CG2 3.32Å; L293-V297 WeakPolarHBondContact O-CG2 3.29Å; L293-V297 PolarHBondContact O-N 3.39Å; L293-V323 HydrophobicContact CD2-CG1 3.76Å; L293-V323 HydrophobicContact CG-CG1 3.96Å; L293-L327 HydrophobicContact CD2-CD1 4.17Å; L293-L327 HydrophobicContact CD2-CD2 3.84Å; L293-L327 HydrophobicContact CD2-CG 4.21Å; L293-L376 HydrophobicContact CD2-CB 4.15Å; L293-L377 HydrophobicContact CD1-CB 3.89Å; L293-L377 HydrophobicContact CD1-CD1 4.12Å
294	I	98.7	Very high	97.6	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-43	177.6	-72.3	172.4	0	0	0	111.1	L202 V290 R291 V297 K298 V320 V323 L324	L202-I294 HydrophobicContact CD1-CD1 4.07Å; L202-I294 HydrophobicContact CD1-CG2 4.38Å; L202-I294 HydrophobicContact CD2-CB 4.26Å; L202-I294 HydrophobicContact CD2-CD1 3.71Å; L202-I294 HydrophobicContact CD2-CG2 4.03Å; V290-I294 HydrophobicContact CG1-CD1 3.62Å; V290-I294 HydrophobicContact CG1-CG1 4.43Å; V290-I294 WeakPolarHBondContact O-CB 3.47Å; V290-I294 WeakPolarHBondContact O-CG1 3.42Å; V290-I294 PolarHBondContact O-N 3.22Å; R291-I294 PolarHBondContact O-N 3.15Å; I294-V297 PolarHBondContact O-N 2.51Å; I294-K298 HydrophobicContact CG2-CD 3.88Å; I294-K298 HydrophobicContact CG2-CG 4.33Å; I294-K298 WeakPolarHBondContact O-CB 3.44Å; I294-K298 WeakPolarHBondContact O-CG 3.21Å; I294-K298 PolarHBondContact O-N 3.49Å; I294-V320 HydrophobicContact CD1-CG1 4.21Å; I294-V320 HydrophobicContact CG2-CG2 3.78Å; I294-V323 HydrophobicContact CD1-CG1 4.49Å; I294-V323 HydrophobicContact CG1-CB 3.98Å; I294-V323 HydrophobicContact CG1-CG1 3.63Å; I294-V323 HydrophobicContact CG1-CG2 4.42Å; I294-L324 HydrophobicContact CD1-CD2 4.16Å
295	L	98.1	Very high	97.6	Very high	9 Å²	9	38.1 Å²	38.1	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-61.2	-48.8	-179.5	-173.6	148.4	0	0	0	111	L158 F159 C162 R291 P292 L293 V297 K298 K299	L158-L295 HydrophobicContact CD2-CD2 4.02Å; L158-L295 HydrophobicContact CG-CD2 3.85Å; F159-L295 HydrophobicContact CD2-CB 4.14Å; F159-L295 HydrophobicContact CD2-CD1 3.77Å; F159-L295 HydrophobicContact CD2-CG 4.46Å; F159-L295 HydrophobicContact CE2-CD1 4.37Å; C162-L295 HydrophobicContact CB-CD1 3.75Å; C162-L295 HydrophobicContact CB-CD2 3.95Å; C162-L295 HydrophobicContact CB-CG 4.38Å; R291-L295 WeakPolarHBondContact O-CB 3.27Å; R291-L295 PolarHBondContact O-N 3.35Å; P292-L295 PolarHBondContact O-N 3.49Å; L293-L295 VanDerWaalsContact C-N 3.34Å; L293-L295 PolarHBondContact O-N 3.37Å; L295-V297 PolarHBondContact O-N 3.23Å; L295-K298 PolarHBondContact O-N 3.44Å; L295-K299 HydrophobicContact CD2-CG 4.07Å; L295-K299 WeakPolarHBondContact O-CG 3.28Å; L295-K299 PolarHBondContact O-N 3.35Å
296	V	98.4	Very high	97.7	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.8	-46.3	178	171.4	0	0	0	0	110.6	M155 L158 P292 L293 K298 K299 W300 L377 L457	M155-V296 HydrophobicContact CB-CG2 3.9Å; M155-V296 HydrophobicContact CE-CB 4.29Å; M155-V296 HydrophobicContact CE-CG2 4.04Å; M155-V296 HydrophobicContact CG-CG1 4.42Å; M155-V296 HydrophobicContact CG-CG2 3.79Å; L158-V296 HydrophobicContact CD2-CG2 3.88Å; P292-V296 VanDerWaalsContact O-CG2 3.3Å; P292-V296 WeakPolarHBondContact O-CG2 3.25Å; P292-V296 PolarHBondContact O-N 2.63Å; L293-V296 PolarHBondContact O-N 3.05Å; V296-K298 VanDerWaalsContact C-N 3.35Å; V296-K298 PolarHBondContact O-N 3.3Å; V296-K299 PolarHBondContact O-N 3.07Å; V296-W300 VanDerWaalsContact O-CB 3.26Å; V296-W300 WeakPolarHBondContact O-CB 3.31Å; V296-W300 PolarHBondContact O-N 3.46Å; V296-L377 HydrophobicContact CG1-CD1 4.11Å; V296-L377 HydrophobicContact CG1-CD2 3.76Å; V296-L457 HydrophobicContact CG1-CD1 3.75Å; V296-L457 HydrophobicContact CG1-CD2 4.41Å; V296-L457 HydrophobicContact CG2-CD2 4.47Å
297	V	98.8	Very high	97.9	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-41.9	177.7	169.5	0	0	0	0	111.5	L293 I294 L295 W300 A301 L319 V323 L377 F380	L293-V297 HydrophobicContact CD1-CG2 4.43Å; L293-V297 VanDerWaalsContact O-CG2 3.32Å; L293-V297 WeakPolarHBondContact O-CG2 3.29Å; L293-V297 PolarHBondContact O-N 3.39Å; I294-V297 PolarHBondContact O-N 2.51Å; L295-V297 PolarHBondContact O-N 3.23Å; V297-W300 HydrophobicContact CG1-CE3 4.26Å; V297-A301 VanDerWaalsContact O-CB 3.27Å; V297-A301 WeakPolarHBondContact O-CB 3.27Å; V297-A301 PolarHBondContact O-N 2.9Å; V297-L319 HydrophobicContact CG1-CD2 4.22Å; V297-V323 HydrophobicContact CB-CG2 4.05Å; V297-V323 HydrophobicContact CG1-CG2 3.85Å; V297-V323 HydrophobicContact CG2-CG2 3.97Å; V297-L377 HydrophobicContact CG2-CD1 3.97Å; V297-F380 HydrophobicContact CB-CE1 4.38Å; V297-F380 HydrophobicContact CG1-CE1 3.74Å; V297-F380 HydrophobicContact CG1-CZ 3.73Å; V297-F380 HydrophobicContact CG2-CD1 3.84Å; V297-F380 HydrophobicContact CG2-CE1 3.64Å; V297-F380 HydrophobicContact CG2-CZ 4.17Å
298	K	97.8	Very high	97.8	Very high	28 Å²	28	34.6 Å²	34.6	12%	0.122	16%	0.157	C	C	.	.	H	α-helix	trans	-63.2	-43.6	176.5	-77.3	174.8	63.4	-178.7	0	112.1	L202 I294 L295 V296 R302 N307 V320	L202-K298 PolarHBondContact O-NZ 2.92Å; I294-K298 HydrophobicContact CG2-CD 3.88Å; I294-K298 HydrophobicContact CG2-CG 4.33Å; I294-K298 WeakPolarHBondContact O-CB 3.44Å; I294-K298 WeakPolarHBondContact O-CG 3.21Å; I294-K298 PolarHBondContact O-N 3.49Å; L295-K298 PolarHBondContact O-N 3.44Å; V296-K298 VanDerWaalsContact C-N 3.35Å; V296-K298 PolarHBondContact O-N 3.3Å; K298-R302 WeakPolarHBondContact O-CB 3.37Å; K298-R302 PolarHBondContact O-N 3.36Å; K298-N307 PolarHBondContact O-ND2 3.38Å; K298-V320 HydrophobicContact CD-CG2 4.47Å
299	K	97.2	Very high	97.8	Very high	21 Å²	21	34.3 Å²	34.3	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-67.5	-44.5	178.7	-70.4	-66	-169.8	173.9	0	111.5	L158 L295 V296 R302 H303 L461 I466 E470	L158-K299 HydrophobicContact CD2-CB 4.36Å; L158-K299 HydrophobicContact CD2-CG 4.4Å; L295-K299 HydrophobicContact CD2-CG 4.07Å; L295-K299 WeakPolarHBondContact O-CG 3.28Å; L295-K299 PolarHBondContact O-N 3.35Å; V296-K299 PolarHBondContact O-N 3.07Å; K299-R302 PolarHBondContact O-N 2.99Å; K299-H303 WeakPolarHBondContact O-CB 3.32Å; K299-H303 PolarHBondContact O-N 3.34Å; K299-L461 HydrophobicContact CB-CD1 4.22Å; K299-L461 HydrophobicContact CB-CD2 4.23Å; K299-I466 HydrophobicContact CD-CG2 3.98Å; K299-E470 IonicContact NZ-OE1 3.67Å; K299-E470 PolarHBondContact NZ-OE1 2.91Å
300	W	98.4	Very high	97.5	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-54.3	-56.2	171.6	164.9	77.1	0	0	0	111.6	V296 V297 R302 H303 H304 I306 F380 L381 C443 F444 S447	V296-W300 VanDerWaalsContact O-CB 3.26Å; V296-W300 WeakPolarHBondContact O-CB 3.31Å; V296-W300 PolarHBondContact O-N 3.46Å; V297-W300 HydrophobicContact CG1-CE3 4.26Å; W300-R302 VanDerWaalsContact C-N 3.27Å; W300-R302 PolarHBondContact O-N 2.84Å; W300-H303 WeakPolarHBondContact O-CB 3.45Å; W300-H303 PolarHBondContact O-N 2.67Å; W300-H303 VanDerWaalsContact O-N 3.12Å; W300-H304 AromaticContact CD1-CD2 3.32Å; W300-H304 AromaticContact CD1-NE2 3.57Å; W300-H304 AromaticContact NE1-CD2 3.28Å; W300-H304 PolarHBondContact NE1-CD2 3.1Å; W300-H304 VanDerWaalsContact NE1-CD2 3.28Å; W300-H304 AromaticContact NE1-NE2 3.55Å; W300-H304 PolarHBondContact O-CD2 3.47Å; W300-H304 VanDerWaalsContact O-CD2 3.23Å; W300-H304 PolarHBondContact O-N 2.8Å; W300-I306 HydrophobicContact CH2-CD1 3.76Å; W300-I306 HydrophobicContact CZ2-CD1 4.26Å; W300-I306 HydrophobicContact CZ3-CD1 4.06Å; W300-F380 HydrophobicContact CZ3-CE1 4.41Å; W300-L381 HydrophobicContact CD2-CD2 4.42Å; W300-L381 HydrophobicContact CH2-CD2 3.9Å; W300-L381 HydrophobicContact CZ2-CD2 3.7Å; W300-L381 HydrophobicContact CZ3-CD2 4.32Å; W300-C443 WeakPolarHBondContact CZ2-SG 3.24Å; W300-F444 AromaticContact CH2-CD1 3.69Å; W300-F444 HydrophobicContact CH2-CD1 3.69Å; W300-F444 HydrophobicContact CH2-CD2 4.09Å; W300-F444 AromaticContact CH2-CE1 3.58Å; W300-F444 HydrophobicContact CH2-CE1 3.58Å; W300-F444 AromaticContact CH2-CE2 3.98Å; W300-F444 HydrophobicContact CH2-CE2 3.98Å; W300-F444 AromaticContact CH2-CG 3.95Å; W300-F444 HydrophobicContact CH2-CG 3.95Å; W300-F444 AromaticContact CH2-CZ 3.72Å; W300-F444 HydrophobicContact CH2-CZ 3.72Å; W300-F444 HydrophobicContact CZ2-CD1 4.41Å; W300-F444 HydrophobicContact CZ3-CD1 4.45Å; W300-F444 AromaticContact CZ3-CE1 3.9Å; W300-F444 HydrophobicContact CZ3-CE1 3.9Å; W300-F444 HydrophobicContact CZ3-CE2 4.45Å; W300-F444 AromaticContact CZ3-CZ 3.89Å; W300-F444 HydrophobicContact CZ3-CZ 3.89Å; W300-S447 PolarHBondContact NE1-OG 3.15Å
301	A	98.3	Very high	97.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-34.3	-177.4	0	0	0	0	0	112.6	V297 Q305 I306 N307 L319	V297-A301 VanDerWaalsContact O-CB 3.27Å; V297-A301 WeakPolarHBondContact O-CB 3.27Å; V297-A301 PolarHBondContact O-N 2.9Å; A301-Q305 PolarHBondContact O-N 2.74Å; A301-I306 HydrophobicContact CB-CD1 4.26Å; A301-I306 HydrophobicContact CB-CG1 3.92Å; A301-I306 VanDerWaalsContact O-CG1 3.29Å; A301-I306 WeakPolarHBondContact O-CG1 3.36Å; A301-I306 PolarHBondContact O-N 3.25Å; A301-N307 HydrophobicContact CB-CB 3.79Å; A301-N307 PolarHBondContact O-N 2.98Å; A301-L319 HydrophobicContact CB-CD1 3.42Å; A301-L319 VanDerWaalsContact CB-CD1 3.42Å; A301-L319 HydrophobicContact CB-CD2 4.2Å; A301-L319 HydrophobicContact CB-CG 4.48Å
302	R	96.6	Very high	97.3	Very high	166 Å²	166	43.6 Å²	43.6	63%	0.626	22%	0.217	S	C	*	.	H	α-helix	trans	-68.8	-43.4	174.4	-174.3	174.5	-180	166	0.6	112	K298 K299 W300 H304 Q305 N307	K298-R302 WeakPolarHBondContact O-CB 3.37Å; K298-R302 PolarHBondContact O-N 3.36Å; K299-R302 PolarHBondContact O-N 2.99Å; W300-R302 VanDerWaalsContact C-N 3.27Å; W300-R302 PolarHBondContact O-N 2.84Å; R302-H304 VanDerWaalsContact C-N 3.28Å; R302-H304 PolarHBondContact O-N 2.94Å; R302-Q305 PolarHBondContact O-N 3.42Å; R302-N307 HydrophobicContact CB-CB 4.37Å
303	H	96.8	Very high	97.2	Very high	87 Å²	87	43.9 Å²	43.9	40%	0.403	22%	0.218	S	C	.	.	H	α-helix	trans	-59.4	-40.5	177.1	177	68.6	0	0	0	111.8	K299 W300 Q305 L461	K299-H303 WeakPolarHBondContact O-CB 3.32Å; K299-H303 PolarHBondContact O-N 3.34Å; W300-H303 WeakPolarHBondContact O-CB 3.45Å; W300-H303 PolarHBondContact O-N 2.67Å; W300-H303 VanDerWaalsContact O-N 3.12Å; H303-Q305 VanDerWaalsContact C-N 3.26Å; H303-Q305 PolarHBondContact O-N 2.98Å; H303-L461 HydrophobicContact CB-CD1 3.65Å
304	H	98	Very high	97.2	Very high	64 Å²	64	43.9 Å²	43.9	30%	0.296	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	8.3	176.3	-69.2	-74.8	0	0	0	114.5	W300 R302 I306 C443 I460	W300-H304 AromaticContact CD1-CD2 3.32Å; W300-H304 AromaticContact CD1-NE2 3.57Å; W300-H304 AromaticContact NE1-CD2 3.28Å; W300-H304 PolarHBondContact NE1-CD2 3.1Å; W300-H304 VanDerWaalsContact NE1-CD2 3.28Å; W300-H304 AromaticContact NE1-NE2 3.55Å; W300-H304 PolarHBondContact O-CD2 3.47Å; W300-H304 VanDerWaalsContact O-CD2 3.23Å; W300-H304 PolarHBondContact O-N 2.8Å; R302-H304 VanDerWaalsContact C-N 3.28Å; R302-H304 PolarHBondContact O-N 2.94Å; H304-I306 HydrophobicContact CB-CG1 4.3Å; H304-I306 PolarHBondContact O-N 3.04Å; H304-C443 WeakPolarHBondContact CB-SG 3.48Å; H304-C443 VanDerWaalsContact CG-SG 3.5Å; H304-I460 PolarHBondContact NE2-O 3.38Å
305	Q	97.8	Very high	97.2	Very high	164 Å²	164	45 Å²	45	77%	0.766	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	31.3	175.6	-55.9	171.2	64.2	0	0	114.3	A301 R302 H303	A301-Q305 PolarHBondContact O-N 2.74Å; R302-Q305 PolarHBondContact O-N 3.42Å; H303-Q305 VanDerWaalsContact C-N 3.26Å; H303-Q305 PolarHBondContact O-N 2.98Å
306	I	98.3	Very high	97.1	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.031	24%	0.24	C	C	.	.			trans	-111.8	12.9	176.7	59.5	163	0	0	0	113.2	W300 A301 H304 T313 L314 I440 C443	W300-I306 HydrophobicContact CH2-CD1 3.76Å; W300-I306 HydrophobicContact CZ2-CD1 4.26Å; W300-I306 HydrophobicContact CZ3-CD1 4.06Å; A301-I306 HydrophobicContact CB-CD1 4.26Å; A301-I306 HydrophobicContact CB-CG1 3.92Å; A301-I306 VanDerWaalsContact O-CG1 3.29Å; A301-I306 WeakPolarHBondContact O-CG1 3.36Å; A301-I306 PolarHBondContact O-N 3.25Å; H304-I306 HydrophobicContact CB-CG1 4.3Å; H304-I306 PolarHBondContact O-N 3.04Å; I306-T313 PolarHBondContact O-OG1 3.34Å; I306-L314 WeakPolarHBondContact O-CB 3.25Å; I306-L314 PolarHBondContact O-N 3.33Å; I306-L314 VanDerWaalsContact O-N 3.11Å; I306-I440 HydrophobicContact CB-CG1 4.07Å; I306-I440 HydrophobicContact CG2-CG1 3.95Å; I306-C443 HydrophobicContact CD1-CB 4.08Å
307	N	97.8	Very high	97.1	Very high	26 Å²	26	49.5 Å²	49.5	14%	0.139	25%	0.251	C	S	.	.			trans	-122.8	63.6	178.9	-174.4	10.6	0	0	0	111.9	K298 A301 R302 L314 S316 L319	K298-N307 PolarHBondContact O-ND2 3.38Å; A301-N307 HydrophobicContact CB-CB 3.79Å; A301-N307 PolarHBondContact O-N 2.98Å; R302-N307 HydrophobicContact CB-CB 4.37Å; N307-L314 CarbonylContact C-O 3.54Å; N307-L314 VanDerWaalsContact CA-O 3.26Å; N307-L314 WeakPolarHBondContact CA-O 3.41Å; N307-S316 PolarHBondContact ND2-OG 3.46Å; N307-S316 VanDerWaalsContact ND2-OG 3.14Å; N307-S316 WeakPolarHBondContact OD1-CA 3.27Å; N307-S316 PolarHBondContact OD1-N 3.28Å; N307-S316 VanDerWaalsContact OD1-N 3.13Å; N307-S316 PolarHBondContact OD1-OG 3.13Å; N307-L319 HydrophobicContact CB-CD1 3.89Å
308	D	96.3	Very high	97.1	Very high	50 Å²	50	49.5 Å²	49.5	27%	0.267	25%	0.25	S	S	.	.			trans	-155.7	100.2	174.7	-171.3	-19.4	0	0	0	110.2	S310 K311 T313 L314	D308-S310 PolarHBondContact O-N 3.49Å; D308-S310 WeakPolarHBondContact OD1-CB 3.47Å; D308-S310 PolarHBondContact OD1-N 3.44Å; D308-S310 PolarHBondContact OD1-OG 2.85Å; D308-K311 HydrophobicContact CB-CB 4.2Å; D308-K311 HydrophobicContact CB-CD 4.25Å; D308-K311 HydrophobicContact CB-CG 4.33Å; D308-K311 PolarHBondContact O-N 2.93Å; D308-K311 VanDerWaalsContact O-N 3.12Å; D308-K311 PolarHBondContact OD1-N 3.48Å; D308-K311 WeakPolarHBondContact OD2-CD 3.28Å; D308-K311 WeakPolarHBondContact OD2-CE 3.32Å; D308-K311 WeakPolarHBondContact OD2-CG 3.41Å; D308-K311 IonicContact OD2-NZ 2.69Å; D308-K311 PolarHBondContact OD2-NZ 3.39Å; D308-T313 VanDerWaalsContact C-OG1 3.22Å; D308-T313 WeakPolarHBondContact CA-OG1 3.34Å; D308-T313 PolarHBondContact N-OG1 3.29Å; D308-T313 PolarHBondContact O-N 2.99Å; D308-T313 VanDerWaalsContact O-N 3.08Å; D308-T313 PolarHBondContact O-OG1 3.03Å; D308-L314 PolarHBondContact N-O 3.43Å
309	A	94.7	Very high	97.1	Very high	42 Å²	42	48.2 Å²	48.2	35%	0.347	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-65.6	-27.1	-179.2	0	0	0	0	0	112.9	K311 G312 T313 A430	A309-K311 PolarHBondContact O-N 3.09Å; A309-G312 PolarHBondContact O-N 2.86Å; A309-T313 WeakPolarHBondContact CA-O 3.41Å; A309-A430 HydrophobicContact CB-CB 3.9Å; A309-A430 WeakPolarHBondContact O-CB 3.36Å
310	S	92.2	Very high	97.2	Very high	108 Å²	108	47.5 Å²	47.5	76%	0.755	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-68.2	-22.9	176.3	77.1	0	0	0	0	112.1	D308	D308-S310 PolarHBondContact O-N 3.49Å; D308-S310 WeakPolarHBondContact OD1-CB 3.47Å; D308-S310 PolarHBondContact OD1-N 3.44Å; D308-S310 PolarHBondContact OD1-OG 2.85Å
311	K	95.3	Very high	97.2	Very high	135 Å²	135	47.5 Å²	47.5	59%	0.587	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-99.8	16.1	176.4	-63.1	-178.9	-174.1	164.8	0	113.6	D308 A309 K436	D308-K311 HydrophobicContact CB-CB 4.2Å; D308-K311 HydrophobicContact CB-CD 4.25Å; D308-K311 HydrophobicContact CB-CG 4.33Å; D308-K311 PolarHBondContact O-N 2.93Å; D308-K311 VanDerWaalsContact O-N 3.12Å; D308-K311 PolarHBondContact OD1-N 3.48Å; D308-K311 WeakPolarHBondContact OD2-CD 3.28Å; D308-K311 WeakPolarHBondContact OD2-CE 3.32Å; D308-K311 WeakPolarHBondContact OD2-CG 3.41Å; D308-K311 IonicContact OD2-NZ 2.69Å; D308-K311 PolarHBondContact OD2-NZ 3.39Å; A309-K311 PolarHBondContact O-N 3.09Å; K311-K436 VanDerWaalsContact O-CE 3.26Å; K311-K436 WeakPolarHBondContact O-CE 3.42Å; K311-K436 PolarHBondContact O-NZ 3.33Å
312	G	96.2	Very high	97.3	Very high	5 Å²	5	47.5 Å²	47.5	5%	0.052	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	20.6	177.7	0	0	0	0	0	114.9	A309 A430 K436	A309-G312 PolarHBondContact O-N 2.86Å; G312-A430 CarbonylContact C-O 3.38Å; G312-A430 VanDerWaalsContact CA-O 3.26Å; G312-A430 WeakPolarHBondContact CA-O 3.38Å; G312-K436 WeakPolarHBondContact O-CB 3.31Å
313	T	98	Very high	97.4	Very high	6 Å²	6	39.7 Å²	39.7	4%	0.037	21%	0.213	C	C	.	.	S	Bend	trans	-110.3	-168.4	177.1	66.7	0	0	0	0	111.6	I306 D308 A309 K436	I306-T313 PolarHBondContact O-OG1 3.34Å; D308-T313 VanDerWaalsContact C-OG1 3.22Å; D308-T313 WeakPolarHBondContact CA-OG1 3.34Å; D308-T313 PolarHBondContact N-OG1 3.29Å; D308-T313 PolarHBondContact O-N 2.99Å; D308-T313 VanDerWaalsContact O-N 3.08Å; D308-T313 PolarHBondContact O-OG1 3.03Å; A309-T313 WeakPolarHBondContact CA-O 3.41Å; T313-K436 HydrophobicContact CG2-CD 4.04Å
314	L	98.4	Very high	97.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.			trans	-68.9	145.1	-177.1	-60.5	167.7	0	0	0	110.4	I306 N307 D308 T318 L319 M322 I416 V431 I440	I306-L314 WeakPolarHBondContact O-CB 3.25Å; I306-L314 PolarHBondContact O-N 3.33Å; I306-L314 VanDerWaalsContact O-N 3.11Å; N307-L314 CarbonylContact C-O 3.54Å; N307-L314 VanDerWaalsContact CA-O 3.26Å; N307-L314 WeakPolarHBondContact CA-O 3.41Å; D308-L314 PolarHBondContact N-O 3.43Å; L314-T318 HydrophobicContact CD2-CG2 3.77Å; L314-L319 HydrophobicContact CB-CD2 4.47Å; L314-L319 HydrophobicContact CB-CG 4.12Å; L314-L319 HydrophobicContact CD1-CD2 3.64Å; L314-L319 HydrophobicContact CD1-CG 4.21Å; L314-M322 HydrophobicContact CD1-SD 4.21Å; L314-M322 HydrophobicContact CD2-SD 4.32Å; L314-I416 HydrophobicContact CD2-CD1 3.78Å; L314-V431 HydrophobicContact CD2-CG2 4.04Å; L314-I440 HydrophobicContact CD1-CG2 4.06Å; L314-I440 HydrophobicContact CD2-CD1 4.45Å; L314-I440 HydrophobicContact CG-CD1 4.01Å
315	S	97.3	Very high	97.5	Very high	27 Å²	27	32.5 Å²	32.5	19%	0.189	18%	0.18	C	C	.	.			trans	-81.7	158.5	165.7	77.3	0	0	0	0	110.1	Y317 T318 L319	S315-Y317 PolarHBondContact O-N 2.9Å; S315-Y317 PolarHBondContact OG-N 3.48Å; S315-T318 WeakPolarHBondContact O-CB 3.37Å; S315-T318 PolarHBondContact O-N 3.04Å; S315-T318 VanDerWaalsContact O-N 3.14Å; S315-T318 PolarHBondContact OG-N 2.89Å; S315-T318 PolarHBondContact OG-OG1 3.43Å; S315-L319 PolarHBondContact O-N 2.93Å
316	S	96.8	Very high	97.6	Very high	46 Å²	46	25.4 Å²	25.4	32%	0.322	15%	0.146	S	C	.	.	H	α-helix	trans	-59.7	-34	171.9	-74.6	0	0	0	0	112.1	N307 L319 V320	N307-S316 PolarHBondContact ND2-OG 3.46Å; N307-S316 VanDerWaalsContact ND2-OG 3.14Å; N307-S316 WeakPolarHBondContact OD1-CA 3.27Å; N307-S316 PolarHBondContact OD1-N 3.28Å; N307-S316 VanDerWaalsContact OD1-N 3.13Å; N307-S316 PolarHBondContact OD1-OG 3.13Å; S316-L319 PolarHBondContact O-N 2.87Å; S316-V320 VanDerWaalsContact O-CG2 3.28Å; S316-V320 WeakPolarHBondContact O-CG2 3.32Å; S316-V320 PolarHBondContact O-N 3.49Å
317	Y	97.9	Very high	97.6	Very high	57 Å²	57	25.1 Å²	25.1	22%	0.224	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-43	174.7	-178.3	-134.5	0	0	0	112	N276 L280 S315 L319 V320 L321 E420 P421 V427	N276-Y317 HydrophobicContact CB-CE2 4.42Å; N276-Y317 PolarHBondContact ND2-OH 3.2Å; N276-Y317 VanDerWaalsContact ND2-OH 3.13Å; N276-Y317 PolarHBondContact OD1-OH 3.31Å; L280-Y317 HydrophobicContact CD1-CD2 3.88Å; L280-Y317 HydrophobicContact CD1-CE2 3.81Å; L280-Y317 HydrophobicContact CD2-CE2 4.48Å; L280-Y317 HydrophobicContact CG-CE2 4.37Å; S315-Y317 PolarHBondContact O-N 2.9Å; S315-Y317 PolarHBondContact OG-N 3.48Å; Y317-L319 VanDerWaalsContact C-N 3.35Å; Y317-L319 PolarHBondContact O-N 3.16Å; Y317-V320 PolarHBondContact O-N 3.4Å; Y317-L321 HydrophobicContact CD2-CG 4.28Å; Y317-L321 HydrophobicContact CE1-CD1 4.08Å; Y317-L321 HydrophobicContact CE2-CD1 4.04Å; Y317-L321 HydrophobicContact CE2-CD2 3.86Å; Y317-L321 HydrophobicContact CE2-CG 3.89Å; Y317-L321 PolarHBondContact O-N 3.39Å; Y317-E420 PolarHBondContact OH-OE1 2.82Å; Y317-P421 WeakPolarHBondContact OH-CD 3.49Å; Y317-V427 HydrophobicContact CD1-CB 4.2Å; Y317-V427 HydrophobicContact CD1-CG1 3.96Å; Y317-V427 HydrophobicContact CE1-CB 4.34Å; Y317-V427 HydrophobicContact CE1-CG1 3.62Å
318	T	98.6	Very high	97.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.6	-45.9	175.2	-49.8	0	0	0	0	111.5	L314 S315 V320 L321 M322 V418 V427 A428	L314-T318 HydrophobicContact CD2-CG2 3.77Å; S315-T318 WeakPolarHBondContact O-CB 3.37Å; S315-T318 PolarHBondContact O-N 3.04Å; S315-T318 VanDerWaalsContact O-N 3.14Å; S315-T318 PolarHBondContact OG-N 2.89Å; S315-T318 PolarHBondContact OG-OG1 3.43Å; T318-V320 PolarHBondContact O-N 3.08Å; T318-L321 PolarHBondContact O-N 3.07Å; T318-M322 HydrophobicContact CG2-SD 4.14Å; T318-M322 VanDerWaalsContact O-CG 3.27Å; T318-M322 WeakPolarHBondContact O-CG 3.47Å; T318-M322 PolarHBondContact O-N 3.41Å; T318-V418 HydrophobicContact CG2-CB 4.4Å; T318-V418 HydrophobicContact CG2-CG2 3.92Å; T318-V427 HydrophobicContact CG2-CG2 4.22Å; T318-V427 PolarHBondContact OG1-O 3.34Å; T318-A428 HydrophobicContact CG2-CB 3.76Å
319	L	98.7	Very high	97.7	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-62.1	-41.6	177.5	-75.5	167.1	0	0	0	112.3	V297 A301 N307 L314 S315 S316 Y317 M322 V323	V297-L319 HydrophobicContact CG1-CD2 4.22Å; A301-L319 HydrophobicContact CB-CD1 3.42Å; A301-L319 VanDerWaalsContact CB-CD1 3.42Å; A301-L319 HydrophobicContact CB-CD2 4.2Å; A301-L319 HydrophobicContact CB-CG 4.48Å; N307-L319 HydrophobicContact CB-CD1 3.89Å; L314-L319 HydrophobicContact CB-CD2 4.47Å; L314-L319 HydrophobicContact CB-CG 4.12Å; L314-L319 HydrophobicContact CD1-CD2 3.64Å; L314-L319 HydrophobicContact CD1-CG 4.21Å; S315-L319 PolarHBondContact O-N 2.93Å; S316-L319 PolarHBondContact O-N 2.87Å; Y317-L319 VanDerWaalsContact C-N 3.35Å; Y317-L319 PolarHBondContact O-N 3.16Å; L319-M322 WeakPolarHBondContact O-CB 3.39Å; L319-M322 PolarHBondContact O-N 2.91Å; L319-V323 WeakPolarHBondContact O-CG2 3.32Å; L319-V323 PolarHBondContact O-N 3.25Å
320	V	98.8	Very high	97.9	Very high	7 Å²	7	23.8 Å²	23.8	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-58.7	-50.9	175.7	168.9	0	0	0	0	110.3	L202 L280 I294 K298 S316 Y317 T318 M322 V323 L324	L202-V320 HydrophobicContact CD1-CG1 3.76Å; L202-V320 HydrophobicContact CD1-CG2 3.99Å; L280-V320 HydrophobicContact CD1-CG1 4.04Å; L280-V320 HydrophobicContact CD2-CG1 3.56Å; L280-V320 HydrophobicContact CG-CG1 4.41Å; I294-V320 HydrophobicContact CD1-CG1 4.21Å; I294-V320 HydrophobicContact CG2-CG2 3.78Å; K298-V320 HydrophobicContact CD-CG2 4.47Å; S316-V320 VanDerWaalsContact O-CG2 3.28Å; S316-V320 WeakPolarHBondContact O-CG2 3.32Å; S316-V320 PolarHBondContact O-N 3.49Å; Y317-V320 PolarHBondContact O-N 3.4Å; T318-V320 PolarHBondContact O-N 3.08Å; V320-M322 VanDerWaalsContact C-N 3.28Å; V320-M322 PolarHBondContact O-N 3.12Å; V320-V323 PolarHBondContact O-N 3.23Å; V320-V323 VanDerWaalsContact O-N 3.12Å; V320-L324 HydrophobicContact CG1-CD1 4.18Å; V320-L324 HydrophobicContact CG1-CG 4.32Å; V320-L324 WeakPolarHBondContact O-CG 3.49Å; V320-L324 PolarHBondContact O-N 3.41Å
321	L	98.9	Very high	98.1	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-35.4	179.1	-64	-173.6	0	0	0	112.7	L280 Y317 T318 L324 H325 V397 V418 P421 V427	L280-L321 HydrophobicContact CD2-CD2 4.15Å; Y317-L321 HydrophobicContact CD2-CG 4.28Å; Y317-L321 HydrophobicContact CE1-CD1 4.08Å; Y317-L321 HydrophobicContact CE2-CD1 4.04Å; Y317-L321 HydrophobicContact CE2-CD2 3.86Å; Y317-L321 HydrophobicContact CE2-CG 3.89Å; Y317-L321 PolarHBondContact O-N 3.39Å; T318-L321 PolarHBondContact O-N 3.07Å; L321-L324 HydrophobicContact CD2-CD1 4.41Å; L321-L324 PolarHBondContact O-N 2.8Å; L321-H325 VanDerWaalsContact O-CB 3.25Å; L321-H325 WeakPolarHBondContact O-CB 3.43Å; L321-H325 PolarHBondContact O-N 2.7Å; L321-V397 HydrophobicContact CB-CG2 4.01Å; L321-V397 HydrophobicContact CD2-CB 4.38Å; L321-V397 HydrophobicContact CD2-CG2 3.97Å; L321-V397 VanDerWaalsContact O-CG2 3.31Å; L321-V397 WeakPolarHBondContact O-CG2 3.4Å; L321-V418 HydrophobicContact CB-CG1 3.78Å; L321-V418 HydrophobicContact CD1-CG1 3.79Å; L321-V418 HydrophobicContact CG-CG1 4.46Å; L321-P421 HydrophobicContact CD1-CG 4.38Å; L321-P421 HydrophobicContact CD2-CG 4.15Å; L321-V427 HydrophobicContact CD1-CG1 4.42Å; L321-V427 HydrophobicContact CD1-CG2 3.98Å
322	M	98.9	Very high	98.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63	-42.6	173.4	-72.1	170.2	61.2	0	0	112.2	L314 T318 L319 V320 Y326 F380 Y384 W390 I395 V418 F444	L314-M322 HydrophobicContact CD1-SD 4.21Å; L314-M322 HydrophobicContact CD2-SD 4.32Å; T318-M322 HydrophobicContact CG2-SD 4.14Å; T318-M322 VanDerWaalsContact O-CG 3.27Å; T318-M322 WeakPolarHBondContact O-CG 3.47Å; T318-M322 PolarHBondContact O-N 3.41Å; L319-M322 WeakPolarHBondContact O-CB 3.39Å; L319-M322 PolarHBondContact O-N 2.91Å; V320-M322 VanDerWaalsContact C-N 3.28Å; V320-M322 PolarHBondContact O-N 3.12Å; M322-Y326 WeakPolarHBondContact O-CB 3.39Å; M322-Y326 PolarHBondContact O-N 3.12Å; M322-F380 HydrophobicContact CB-CE2 4.39Å; M322-Y384 WeakPolarHBondContact CA-OH 3.5Å; M322-Y384 HydrophobicContact CB-CE2 3.88Å; M322-Y384 HydrophobicContact CE-CD1 4.05Å; M322-Y384 HydrophobicContact CE-CD2 3.95Å; M322-Y384 HydrophobicContact CE-CE1 4.05Å; M322-Y384 HydrophobicContact CE-CE2 3.92Å; M322-Y384 HydrophobicContact CE-CG 4.01Å; M322-Y384 PolarHBondContact O-OH 3.37Å; M322-W390 HydrophobicContact CE-CH2 3.75Å; M322-W390 HydrophobicContact CE-CZ3 4.37Å; M322-I395 HydrophobicContact CG-CD1 3.88Å; M322-V418 HydrophobicContact CG-CG2 4.28Å; M322-F444 HydrophobicContact CE-CE2 4.1Å; M322-F444 HydrophobicContact CE-CZ 3.65Å
323	V	98.9	Very high	98.3	Very high	1 Å²	1	28 Å²	28	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-65.4	-46.3	176	174.9	0	0	0	0	110.8	L293 I294 V297 L319 V320 H325 Y326 L327 F380	L293-V323 HydrophobicContact CD2-CG1 3.76Å; L293-V323 HydrophobicContact CG-CG1 3.96Å; I294-V323 HydrophobicContact CD1-CG1 4.49Å; I294-V323 HydrophobicContact CG1-CB 3.98Å; I294-V323 HydrophobicContact CG1-CG1 3.63Å; I294-V323 HydrophobicContact CG1-CG2 4.42Å; V297-V323 HydrophobicContact CB-CG2 4.05Å; V297-V323 HydrophobicContact CG1-CG2 3.85Å; V297-V323 HydrophobicContact CG2-CG2 3.97Å; L319-V323 WeakPolarHBondContact O-CG2 3.32Å; L319-V323 PolarHBondContact O-N 3.25Å; V320-V323 PolarHBondContact O-N 3.23Å; V320-V323 VanDerWaalsContact O-N 3.12Å; V323-H325 VanDerWaalsContact C-N 3.35Å; V323-H325 PolarHBondContact O-N 2.81Å; V323-Y326 PolarHBondContact O-N 3.02Å; V323-L327 HydrophobicContact CG1-CD1 4.23Å; V323-L327 HydrophobicContact CG1-CG 4.48Å; V323-L327 WeakPolarHBondContact O-CG 3.41Å; V323-L327 PolarHBondContact O-N 3.46Å; V323-F380 HydrophobicContact CB-CE2 4.33Å; V323-F380 HydrophobicContact CG2-CD2 4.08Å; V323-F380 HydrophobicContact CG2-CE2 3.54Å; V323-F380 HydrophobicContact CG2-CZ 3.89Å
324	L	98.9	Very high	98.3	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-59.2	-46.5	178	-64.2	-175.9	0	0	0	111.5	L280 Y283 V290 I294 V320 L321 Y326 L327 Q328 L335 V397	L280-L324 HydrophobicContact CD2-CD1 3.56Å; Y283-L324 HydrophobicContact CD1-CD2 4.45Å; Y283-L324 HydrophobicContact CD2-CD1 3.74Å; Y283-L324 HydrophobicContact CE2-CD1 4.36Å; Y283-L324 HydrophobicContact CG-CD1 3.89Å; Y283-L324 HydrophobicContact CG-CD2 4.14Å; V290-L324 HydrophobicContact CG1-CD2 4.15Å; I294-L324 HydrophobicContact CD1-CD2 4.16Å; V320-L324 HydrophobicContact CG1-CD1 4.18Å; V320-L324 HydrophobicContact CG1-CG 4.32Å; V320-L324 WeakPolarHBondContact O-CG 3.49Å; V320-L324 PolarHBondContact O-N 3.41Å; L321-L324 HydrophobicContact CD2-CD1 4.41Å; L321-L324 PolarHBondContact O-N 2.8Å; L324-Y326 PolarHBondContact O-N 2.87Å; L324-L327 PolarHBondContact O-N 2.92Å; L324-Q328 WeakPolarHBondContact O-CB 3.36Å; L324-Q328 VanDerWaalsContact O-CG 3.27Å; L324-Q328 WeakPolarHBondContact O-CG 3.5Å; L324-Q328 PolarHBondContact O-N 3.47Å; L324-L335 HydrophobicContact CD2-CD1 3.53Å; L324-V397 HydrophobicContact CB-CG1 4.25Å; L324-V397 HydrophobicContact CB-CG2 4.01Å; L324-V397 HydrophobicContact CD1-CG1 4.24Å
325	H	98.9	Very high	98.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-57.9	-46	175.8	169.7	83.4	0	0	0	112.6	L321 V323 L327 Q328 T329 Y383 Y384 I395 V397	L321-H325 VanDerWaalsContact O-CB 3.25Å; L321-H325 WeakPolarHBondContact O-CB 3.43Å; L321-H325 PolarHBondContact O-N 2.7Å; V323-H325 VanDerWaalsContact C-N 3.35Å; V323-H325 PolarHBondContact O-N 2.81Å; H325-L327 VanDerWaalsContact C-N 3.32Å; H325-L327 PolarHBondContact O-N 2.83Å; H325-Q328 PolarHBondContact O-N 3.28Å; H325-T329 WeakPolarHBondContact O-CB 3.33Å; H325-T329 WeakPolarHBondContact O-CG2 3.3Å; H325-T329 PolarHBondContact O-N 2.72Å; H325-T329 PolarHBondContact O-OG1 3.07Å; H325-Y383 AromaticContact CD2-CE1 3.94Å; H325-Y383 AromaticContact NE2-CE1 3.94Å; H325-Y383 AromaticContact NE2-CZ 3.75Å; H325-Y383 PolarHBondContact NE2-OH 3.04Å; H325-Y384 PolarHBondContact CD2-OH 3.05Å; H325-I395 HydrophobicContact CB-CG2 3.47Å; H325-I395 VanDerWaalsContact CB-CG2 3.47Å; H325-V397 HydrophobicContact CB-CG2 4.25Å
326	Y	98.9	Very high	98.4	Very high	15 Å²	15	27.4 Å²	27.4	6%	0.059	14%	0.141	C	C	.	.	H	α-helix	trans	-57.2	-48.2	176.4	165.3	-106.7	0	0	0	110.7	M322 V323 L324 Q328 T329 L330 L376 G379 F380 Y383	M322-Y326 WeakPolarHBondContact O-CB 3.39Å; M322-Y326 PolarHBondContact O-N 3.12Å; V323-Y326 PolarHBondContact O-N 3.02Å; L324-Y326 PolarHBondContact O-N 2.87Å; Y326-Q328 VanDerWaalsContact C-N 3.3Å; Y326-Q328 PolarHBondContact O-N 3.29Å; Y326-T329 PolarHBondContact O-N 3.11Å; Y326-T329 PolarHBondContact O-OG1 3.27Å; Y326-L330 HydrophobicContact CD2-CD2 4.5Å; Y326-L330 HydrophobicContact CE1-CD2 4.43Å; Y326-L330 HydrophobicContact CE2-CD2 3.75Å; Y326-L330 WeakPolarHBondContact O-CG 3Å; Y326-L330 PolarHBondContact O-N 2.83Å; Y326-L376 HydrophobicContact CE1-CD2 4.34Å; Y326-L376 VanDerWaalsContact CE1-O 3.31Å; Y326-L376 WeakPolarHBondContact CE1-O 2.73Å; Y326-L376 PolarHBondContact OH-O 2.87Å; Y326-G379 VanDerWaalsContact CZ-C 3.41Å; Y326-G379 WeakPolarHBondContact OH-CA 3.31Å; Y326-F380 HydrophobicContact CD1-CB 3.77Å; Y326-F380 HydrophobicContact CD1-CD2 4.14Å; Y326-F380 HydrophobicContact CD1-CG 4.47Å; Y326-F380 HydrophobicContact CE1-CB 3.78Å; Y326-F380 HydrophobicContact CG-CB 4.2Å; Y326-F380 HydrophobicContact CG-CD2 4.12Å; Y326-F380 VanDerWaalsContact CZ-N 3.25Å; Y326-F380 PolarHBondContact OH-N 3.13Å; Y326-Y383 HydrophobicContact CD2-CD1 4.21Å; Y326-Y383 HydrophobicContact CD2-CD2 4.4Å; Y326-Y383 AromaticContact CD2-CG 3.9Å; Y326-Y383 HydrophobicContact CD2-CG 3.9Å; Y326-Y383 HydrophobicContact CE2-CG 4.45Å
327	L	98.9	Very high	98.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-31.9	178.9	-69	-178.9	0	0	0	113.7	V290 L293 V323 L324 H325 L330 V334 L335 L376	V290-L327 HydrophobicContact CG2-CD1 3.99Å; L293-L327 HydrophobicContact CD2-CD1 4.17Å; L293-L327 HydrophobicContact CD2-CD2 3.84Å; L293-L327 HydrophobicContact CD2-CG 4.21Å; V323-L327 HydrophobicContact CG1-CD1 4.23Å; V323-L327 HydrophobicContact CG1-CG 4.48Å; V323-L327 WeakPolarHBondContact O-CG 3.41Å; V323-L327 PolarHBondContact O-N 3.46Å; L324-L327 PolarHBondContact O-N 2.92Å; H325-L327 VanDerWaalsContact C-N 3.32Å; H325-L327 PolarHBondContact O-N 2.83Å; L327-L330 HydrophobicContact CD2-CD1 4.24Å; L327-V334 HydrophobicContact CB-CB 4.09Å; L327-V334 HydrophobicContact CD1-CG1 4.36Å; L327-V334 HydrophobicContact CD2-CB 3.99Å; L327-V334 HydrophobicContact CD2-CG1 4.2Å; L327-V334 HydrophobicContact CD2-CG2 4.12Å; L327-V334 HydrophobicContact CG-CB 4.48Å; L327-V334 PolarHBondContact O-N 2.75Å; L327-L335 HydrophobicContact CB-CB 4.48Å; L327-L335 HydrophobicContact CB-CD1 3.93Å; L327-L335 HydrophobicContact CB-CG 4.17Å; L327-L335 HydrophobicContact CD1-CD1 3.81Å; L327-L335 HydrophobicContact CD1-CG 4.36Å; L327-L376 HydrophobicContact CD2-CD1 4.21Å; L327-L376 HydrophobicContact CD2-CD2 4.05Å
328	Q	98.8	Very high	98.4	Very high	8 Å²	8	23.1 Å²	23.1	4%	0.037	12%	0.119	C	C	.	.	H	α-helix	trans	-75	-26.7	176.3	-74.9	173.5	-38.4	0	0	113.5	Y283 L324 H325 Y326 L335 P336 V397 A400	Y283-Q328 PolarHBondContact OH-NE2 3.49Å; L324-Q328 WeakPolarHBondContact O-CB 3.36Å; L324-Q328 VanDerWaalsContact O-CG 3.27Å; L324-Q328 WeakPolarHBondContact O-CG 3.5Å; L324-Q328 PolarHBondContact O-N 3.47Å; H325-Q328 PolarHBondContact O-N 3.28Å; Y326-Q328 VanDerWaalsContact C-N 3.3Å; Y326-Q328 PolarHBondContact O-N 3.29Å; Q328-L335 HydrophobicContact CG-CB 3.86Å; Q328-P336 PolarHBondContact NE2-O 3.04Å; Q328-V397 PolarHBondContact NE2-O 2.88Å; Q328-V397 PolarHBondContact OE1-O 3.3Å; Q328-A400 HydrophobicContact CB-CB 3.96Å; Q328-A400 HydrophobicContact CG-CB 4.09Å
329	T	98.3	Very high	98.3	Very high	47 Å²	47	24.2 Å²	24.2	29%	0.288	12%	0.124	S	C	.	.	S	Bend	trans	-106.1	10	-172.9	55.9	0	0	0	0	113.9	H325 Y326	H325-T329 WeakPolarHBondContact O-CB 3.33Å; H325-T329 WeakPolarHBondContact O-CG2 3.3Å; H325-T329 PolarHBondContact O-N 2.72Å; H325-T329 PolarHBondContact O-OG1 3.07Å; Y326-T329 PolarHBondContact O-N 3.11Å; Y326-T329 PolarHBondContact O-OG1 3.27Å
330	L	98.4	Very high	98.2	Very high	35 Å²	35	29.2 Å²	29.2	18%	0.183	15%	0.146	C	C	.	.	S	Bend	trans	-63	152.2	165.6	-69.8	171.7	0	0	0	110.5	Y326 L327 Q332 V334 L376	Y326-L330 HydrophobicContact CD2-CD2 4.5Å; Y326-L330 HydrophobicContact CE1-CD2 4.43Å; Y326-L330 HydrophobicContact CE2-CD2 3.75Å; Y326-L330 WeakPolarHBondContact O-CG 3Å; Y326-L330 PolarHBondContact O-N 2.83Å; L327-L330 HydrophobicContact CD2-CD1 4.24Å; L330-Q332 WeakPolarHBondContact CB-O 3.43Å; L330-Q332 PolarHBondContact O-N 3.5Å; L330-V334 HydrophobicContact CD1-CG2 3.75Å; L330-L376 HydrophobicContact CD1-CD2 3.71Å
331	E	96.6	Very high	98.1	Very high	197 Å²	197	32.6 Å²	32.6	92%	0.921	17%	0.166	S	C	*	.	S	Bend	trans	-55.3	-41.2	175.4	-178.3	177	-171.3	0	0	111.9
332	Q	97.8	Very high	97.9	Very high	92 Å²	92	33.6 Å²	33.6	43%	0.43	17%	0.171	S	C	.	.	S	Bend	trans	-107.8	102.7	163.1	-63.2	-174.4	25.5	0	0	108.2	L330 V334 T368 N369	L330-Q332 WeakPolarHBondContact CB-O 3.43Å; L330-Q332 PolarHBondContact O-N 3.5Å; Q332-V334 PolarHBondContact O-N 2.7Å; Q332-T368 PolarHBondContact OE1-O 3.43Å; Q332-T368 PolarHBondContact OE1-OG1 3.42Å; Q332-T368 VanDerWaalsContact OE1-OG1 3.08Å; Q332-N369 HydrophobicContact CB-CB 4Å; Q332-N369 WeakPolarHBondContact O-CB 3.26Å; Q332-N369 PolarHBondContact O-ND2 2.85Å
333	P	98.1	Very high	97.8	Very high	46 Å²	46	37.1 Å²	37.1	30%	0.299	19%	0.194	S	C	.	.			trans	-63.1	129.6	-175.9	-24.5	34.4	0	0	0	112.5	L335 Y365 S367	P333-L335 VanDerWaalsContact C-N 3.31Å; P333-Y365 PolarHBondContact O-OH 2.95Å; P333-S367 PolarHBondContact O-OG 2.9Å
334	V	98.4	Very high	97.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-76.2	-26.4	170.1	174.6	0	0	0	0	110.6	D287 L327 L330 Q332 Y365 S367 N369 L376	D287-V334 HydrophobicContact CB-CG1 4.03Å; L327-V334 HydrophobicContact CB-CB 4.09Å; L327-V334 HydrophobicContact CD1-CG1 4.36Å; L327-V334 HydrophobicContact CD2-CB 3.99Å; L327-V334 HydrophobicContact CD2-CG1 4.2Å; L327-V334 HydrophobicContact CD2-CG2 4.12Å; L327-V334 HydrophobicContact CG-CB 4.48Å; L327-V334 PolarHBondContact O-N 2.75Å; L330-V334 HydrophobicContact CD1-CG2 3.75Å; Q332-V334 PolarHBondContact O-N 2.7Å; V334-Y365 VanDerWaalsContact O-CE1 3.3Å; V334-Y365 WeakPolarHBondContact O-CE1 3.43Å; V334-S367 WeakPolarHBondContact CA-OG 3.49Å; V334-N369 HydrophobicContact CG2-CB 3.77Å; V334-L376 HydrophobicContact CG2-CD2 4.37Å
335	L	98.3	Very high	97.4	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	22%	0.221	C	C	.	.	S	Bend	trans	-133.2	144.8	-179.1	-67.9	175.6	0	0	0	111.3	Y283 A286 V290 L324 L327 Q328 P333	Y283-L335 HydrophobicContact CD1-CB 4.41Å; Y283-L335 HydrophobicContact CD1-CD1 3.92Å; Y283-L335 HydrophobicContact CD1-CD2 4.16Å; Y283-L335 HydrophobicContact CD1-CG 4.41Å; Y283-L335 HydrophobicContact CE1-CB 4.46Å; A286-L335 HydrophobicContact CB-CD2 3.67Å; V290-L335 HydrophobicContact CG2-CD1 4.08Å; V290-L335 HydrophobicContact CG2-CD2 3.95Å; V290-L335 HydrophobicContact CG2-CG 4.25Å; L324-L335 HydrophobicContact CD2-CD1 3.53Å; L327-L335 HydrophobicContact CB-CB 4.48Å; L327-L335 HydrophobicContact CB-CD1 3.93Å; L327-L335 HydrophobicContact CB-CG 4.17Å; L327-L335 HydrophobicContact CD1-CD1 3.81Å; L327-L335 HydrophobicContact CD1-CG 4.36Å; Q328-L335 HydrophobicContact CG-CB 3.86Å; P333-L335 VanDerWaalsContact C-N 3.31Å
336	P	97.8	Very high	97.3	Very high	21 Å²	21	43.5 Å²	43.5	14%	0.136	22%	0.224	C	C	.	.			trans	-85	-173.4	169.4	37.7	-34	0	0	0	110.4	Y283 Q328 F338 Y365	Y283-P336 WeakPolarHBondContact CE1-O 3.3Å; Q328-P336 PolarHBondContact NE2-O 3.04Å; P336-F338 HydrophobicContact CG-CD1 4.02Å; P336-F338 HydrophobicContact CG-CE1 3.65Å; P336-F338 HydrophobicContact CG-CE2 4.25Å; P336-F338 HydrophobicContact CG-CG 4.45Å; P336-F338 HydrophobicContact CG-CZ 3.77Å; P336-Y365 HydrophobicContact CB-CD2 3.94Å; P336-Y365 HydrophobicContact CB-CE2 3.99Å; P336-Y365 HydrophobicContact CB-CG 4.42Å; P336-Y365 HydrophobicContact CG-CD1 4.27Å; P336-Y365 HydrophobicContact CG-CD2 3.75Å; P336-Y365 HydrophobicContact CG-CE2 4.22Å; P336-Y365 HydrophobicContact CG-CG 3.76Å
337	S	98.1	Very high	97.1	Very high	7 Å²	7	46.1 Å²	46.1	5%	0.049	24%	0.239	C	C	.	.			trans	-95.5	110.5	156	167.2	0	0	0	0	109.6	Q339 K340 T341 R398	S337-Q339 VanDerWaalsContact C-N 3.34Å; S337-Q339 PolarHBondContact O-N 2.78Å; S337-K340 PolarHBondContact O-N 2.82Å; S337-K340 PolarHBondContact OG-N 3.22Å; S337-T341 PolarHBondContact O-N 3.36Å; S337-T341 PolarHBondContact O-OG1 3Å; S337-T341 VanDerWaalsContact O-OG1 3.08Å; S337-R398 WeakPolarHBondContact CB-O 3.32Å; S337-R398 PolarHBondContact OG-O 2.96Å
338	F	97.6	Very high	96.9	Very high	5 Å²	5	49.4 Å²	49.4	2%	0.022	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-31.7	178	-72.3	-58.7	0	0	0	113.2	T282 Y283 A286 P336 K340 T341 H342 F346 V362	T282-F338 HydrophobicContact CG2-CD1 4.31Å; T282-F338 HydrophobicContact CG2-CD2 3.67Å; T282-F338 HydrophobicContact CG2-CE1 4.42Å; T282-F338 HydrophobicContact CG2-CE2 3.81Å; T282-F338 HydrophobicContact CG2-CG 3.96Å; T282-F338 HydrophobicContact CG2-CZ 4.2Å; Y283-F338 AromaticContact CD1-CD2 3.51Å; Y283-F338 HydrophobicContact CD1-CD2 3.51Å; Y283-F338 AromaticContact CD1-CE2 3.55Å; Y283-F338 HydrophobicContact CD1-CE2 3.55Å; Y283-F338 HydrophobicContact CD2-CD2 4.36Å; Y283-F338 AromaticContact CE1-CD2 3.29Å; Y283-F338 HydrophobicContact CE1-CD2 3.29Å; Y283-F338 AromaticContact CE1-CE2 3.71Å; Y283-F338 HydrophobicContact CE1-CE2 3.71Å; Y283-F338 HydrophobicContact CE1-CG 4.27Å; Y283-F338 HydrophobicContact CE2-CD2 4.21Å; Y283-F338 HydrophobicContact CG-CD2 4.04Å; Y283-F338 HydrophobicContact CG-CE2 4.24Å; Y283-F338 AromaticContact CZ-CD2 3.67Å; Y283-F338 PolarHBondContact OH-N 3.12Å; Y283-F338 VanDerWaalsContact OH-N 3.1Å; A286-F338 HydrophobicContact CB-CE2 3.69Å; A286-F338 HydrophobicContact CB-CZ 3.63Å; P336-F338 HydrophobicContact CG-CD1 4.02Å; P336-F338 HydrophobicContact CG-CE1 3.65Å; P336-F338 HydrophobicContact CG-CE2 4.25Å; P336-F338 HydrophobicContact CG-CG 4.45Å; P336-F338 HydrophobicContact CG-CZ 3.77Å; F338-K340 PolarHBondContact O-N 2.81Å; F338-T341 WeakPolarHBondContact CA-OG1 3.12Å; F338-T341 PolarHBondContact O-N 3.36Å; F338-H342 CarbonylContact O-C 3.57Å; F338-H342 WeakPolarHBondContact O-CA 3.39Å; F338-H342 PolarHBondContact O-N 3.41Å; F338-F346 HydrophobicContact CB-CD2 4.26Å; F338-F346 HydrophobicContact CB-CE2 3.65Å; F338-F346 HydrophobicContact CB-CZ 4.27Å; F338-V362 HydrophobicContact CD1-CG1 3.47Å; F338-V362 VanDerWaalsContact CD1-CG1 3.47Å; F338-V362 HydrophobicContact CE1-CG1 3.52Å; F338-V362 HydrophobicContact CG-CG1 4.32Å; F338-V362 HydrophobicContact CZ-CG1 4.39Å
339	Q	96.9	Very high	96.7	Very high	23 Å²	23	56.2 Å²	56.2	11%	0.107	30%	0.297	C	S	.	.	H	α-helix	trans	-68.9	-22.8	174.3	-70.2	176	-81	0	0	112.8	L279 S337 F346 R398 P421	L279-Q339 HydrophobicContact CD1-CG 3.99Å; L279-Q339 HydrophobicContact CD2-CG 4.34Å; S337-Q339 VanDerWaalsContact C-N 3.34Å; S337-Q339 PolarHBondContact O-N 2.78Å; Q339-F346 HydrophobicContact CG-CB 3.78Å; Q339-F346 HydrophobicContact CG-CD2 4.38Å; Q339-F346 HydrophobicContact CG-CG 4.15Å; Q339-R398 HydrophobicContact CB-CG 4.27Å; Q339-P421 PolarHBondContact NE2-O 2.9Å; Q339-P421 VanDerWaalsContact OE1-CB 3.25Å
340	K	96.2	Very high	96.4	Very high	106 Å²	106	55.4 Å²	55.4	46%	0.461	29%	0.29	S	S	.	.	H	α-helix	trans	-82.6	-41.4	172.1	-79	-178.8	164.4	175.1	0	112.3	S337 F338 Q399	S337-K340 PolarHBondContact O-N 2.82Å; S337-K340 PolarHBondContact OG-N 3.22Å; F338-K340 PolarHBondContact O-N 2.81Å; K340-Q399 PolarHBondContact NZ-O 3.16Å
341	T	95.6	Very high	96.2	Very high	78 Å²	78	58 Å²	58	48%	0.479	30%	0.304	S	S	.	.	H	α-helix	trans	-85	-25.2	-173.8	54.6	0	0	0	0	113.6	S337 F338	S337-T341 PolarHBondContact O-N 3.36Å; S337-T341 PolarHBondContact O-OG1 3Å; S337-T341 VanDerWaalsContact O-OG1 3.08Å; F338-T341 WeakPolarHBondContact CA-OG1 3.12Å; F338-T341 PolarHBondContact O-N 3.36Å
342	H	96.6	Very high	96.1	Very high	23 Å²	23	49.6 Å²	49.6	11%	0.106	27%	0.265	C	S	.	.			trans	-138.2	59.4	-177.7	-58.1	81.5	0	0	0	110.5	F338 E344 C345 F346 R363	F338-H342 CarbonylContact O-C 3.57Å; F338-H342 WeakPolarHBondContact O-CA 3.39Å; F338-H342 PolarHBondContact O-N 3.41Å; H342-E344 VanDerWaalsContact C-OE2 3.27Å; H342-E344 WeakPolarHBondContact CA-OE1 3.32Å; H342-E344 WeakPolarHBondContact CA-OE2 3.43Å; H342-E344 WeakPolarHBondContact CB-OE1 3.35Å; H342-E344 IonicContact CD2-OE1 2.83Å; H342-E344 IonicContact CG-OE1 3.5Å; H342-E344 PolarHBondContact O-N 3.17Å; H342-C345 HydrophobicContact CB-CB 4.12Å; H342-C345 PolarHBondContact O-N 2.67Å; H342-F346 HydrophobicContact CB-CE2 4.44Å; H342-F346 WeakPolarHBondContact O-CD2 3.31Å; H342-R363 PolarHBondContact NE2-N 2.82Å; H342-R363 VanDerWaalsContact NE2-N 3.17Å
343	P	95.8	Very high	95.9	Very high	73 Å²	73	48.7 Å²	48.7	47%	0.474	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-57.3	-32.6	-177.3	25.3	-35.1	0	0	0	113	C345 F346 D347	P343-C345 VanDerWaalsContact C-N 3.26Å; P343-C345 PolarHBondContact O-N 2.66Å; P343-F346 CarbonylContact O-C 3.6Å; P343-F346 PolarHBondContact O-N 3.08Å; P343-F346 VanDerWaalsContact O-N 3.15Å; P343-D347 PolarHBondContact O-N 3Å
344	E	94.6	Very high	95.7	Very high	114 Å²	114	52.1 Å²	52.1	53%	0.533	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-62.1	-30.6	176.7	71.2	-65.7	155.1	0	0	113.2	H342 F346 M350	H342-E344 VanDerWaalsContact C-OE2 3.27Å; H342-E344 WeakPolarHBondContact CA-OE1 3.32Å; H342-E344 WeakPolarHBondContact CA-OE2 3.43Å; H342-E344 WeakPolarHBondContact CB-OE1 3.35Å; H342-E344 IonicContact CD2-OE1 2.83Å; H342-E344 IonicContact CG-OE1 3.5Å; H342-E344 PolarHBondContact O-N 3.17Å; E344-F346 VanDerWaalsContact C-N 3.31Å; E344-M350 WeakPolarHBondContact O-CE 3.36Å
345	C	94.9	Very high	95.6	Very high	9 Å²	9	52.6 Å²	52.6	6%	0.061	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-79.5	-16.1	178.5	-63.8	0	0	0	0	112.8	H342 P343 V362	H342-C345 HydrophobicContact CB-CB 4.12Å; H342-C345 PolarHBondContact O-N 2.67Å; P343-C345 VanDerWaalsContact C-N 3.26Å; P343-C345 PolarHBondContact O-N 2.66Å; C345-V362 HydrophobicContact CB-CG2 4.01Å
346	F	96	Very high	95.4	Very high	14 Å²	14	53.4 Å²	53.4	6%	0.061	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-135.4	31.5	-172	-55.7	-71.3	0	0	0	112.5	L279 T282 F338 Q339 H342 P343 E344 P348 V362 F422	L279-F346 HydrophobicContact CB-CD1 4.21Å; L279-F346 HydrophobicContact CB-CE1 4.24Å; L279-F346 HydrophobicContact CD1-CD1 3.78Å; L279-F346 HydrophobicContact CD1-CD2 4.45Å; L279-F346 HydrophobicContact CD1-CE1 3.8Å; L279-F346 HydrophobicContact CD1-CE2 4.49Å; L279-F346 HydrophobicContact CD1-CG 4.12Å; L279-F346 HydrophobicContact CD1-CZ 4.17Å; T282-F346 HydrophobicContact CG2-CZ 3.94Å; T282-F346 WeakPolarHBondContact OG1-CZ 3.39Å; F338-F346 HydrophobicContact CB-CD2 4.26Å; F338-F346 HydrophobicContact CB-CE2 3.65Å; F338-F346 HydrophobicContact CB-CZ 4.27Å; Q339-F346 HydrophobicContact CG-CB 3.78Å; Q339-F346 HydrophobicContact CG-CD2 4.38Å; Q339-F346 HydrophobicContact CG-CG 4.15Å; H342-F346 HydrophobicContact CB-CE2 4.44Å; H342-F346 WeakPolarHBondContact O-CD2 3.31Å; P343-F346 CarbonylContact O-C 3.6Å; P343-F346 PolarHBondContact O-N 3.08Å; P343-F346 VanDerWaalsContact O-N 3.15Å; E344-F346 VanDerWaalsContact C-N 3.31Å; F346-P348 WeakPolarHBondContact O-CD 3.36Å; F346-V362 HydrophobicContact CE2-CG2 3.73Å; F346-V362 HydrophobicContact CZ-CG2 3.74Å; F346-F422 HydrophobicContact CB-CE1 4.4Å; F346-F422 HydrophobicContact CB-CZ 4.45Å; F346-F422 WeakPolarHBondContact O-CE1 3.19Å
347	D	94.8	Very high	95	Very high	70 Å²	70	55.6 Å²	55.6	37%	0.374	29%	0.294	S	S	.	.			trans	-63	123.7	176.2	-173.7	-15	0	0	0	109.9	R275 P343 L349 M350	R275-D347 PolarHBondContact NH1-O 3.13Å; P343-D347 PolarHBondContact O-N 3Å; D347-L349 PolarHBondContact O-N 2.83Å; D347-L349 VanDerWaalsContact O-N 3.07Å; D347-L349 WeakPolarHBondContact OD1-CB 3.32Å; D347-L349 PolarHBondContact OD1-N 2.92Å; D347-M350 HydrophobicContact CB-CB 4.23Å; D347-M350 WeakPolarHBondContact O-CB 3.45Å; D347-M350 PolarHBondContact O-N 3.14Å; D347-M350 VanDerWaalsContact O-N 3.11Å
348	P	94.5	Very high	94.4	Very high	68 Å²	68	55.4 Å²	55.4	44%	0.442	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-18.9	173.1	-23.2	32.7	0	0	0	114.6	R275 F346 F422	R275-P348 PolarHBondContact NE-O 2.9Å; R275-P348 VanDerWaalsContact NE-O 3.16Å; R275-P348 PolarHBondContact NH2-O 2.81Å; F346-P348 WeakPolarHBondContact O-CD 3.36Å; P348-F422 HydrophobicContact CB-CD1 4.33Å; P348-F422 HydrophobicContact CG-CD1 4.11Å
349	L	94.4	Very high	94	Very high	152 Å²	152	56.3 Å²	56.3	80%	0.796	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-8.5	179.7	-56.7	-178.4	0	0	0	114.1	D347	D347-L349 PolarHBondContact O-N 2.83Å; D347-L349 VanDerWaalsContact O-N 3.07Å; D347-L349 WeakPolarHBondContact OD1-CB 3.32Å; D347-L349 PolarHBondContact OD1-N 2.92Å
350	M	93.7	Very high	93.6	Very high	30 Å²	30	60.3 Å²	60.3	15%	0.148	31%	0.314	C	S	.	.	S	Bend	trans	-54	141.5	177.4	176.1	-174.7	-73.6	0	0	111.4	R275 E344 D347 I352 E354 V355	R275-M350 VanDerWaalsContact CZ-O 3.25Å; R275-M350 PolarHBondContact NH1-O 2.97Å; R275-M350 PolarHBondContact NH2-O 2.95Å; E344-M350 WeakPolarHBondContact O-CE 3.36Å; D347-M350 HydrophobicContact CB-CB 4.23Å; D347-M350 WeakPolarHBondContact O-CB 3.45Å; D347-M350 PolarHBondContact O-N 3.14Å; D347-M350 VanDerWaalsContact O-N 3.11Å; M350-I352 PolarHBondContact O-N 2.89Å; M350-E354 HydrophobicContact CG-CB 3.93Å; M350-E354 HydrophobicContact SD-CB 4.2Å; M350-V355 HydrophobicContact CG-CG2 4.25Å; M350-V355 HydrophobicContact SD-CB 4.47Å; M350-V355 HydrophobicContact SD-CG2 3.97Å
351	D	94.5	Very high	93.3	Very high	90 Å²	90	61.2 Å²	61.2	48%	0.481	32%	0.319	S	S	.	.			trans	-57.7	139.7	175.8	-167.4	-76.4	0	0	0	110.7	D353 E354 V355	D351-D353 PolarHBondContact O-N 2.96Å; D351-D353 WeakPolarHBondContact OD1-CB 3.47Å; D351-D353 PolarHBondContact OD1-N 3.42Å; D351-E354 HydrophobicContact CB-CG 4.19Å; D351-E354 PolarHBondContact O-N 3.47Å; D351-V355 WeakPolarHBondContact O-CG2 3.38Å; D351-V355 PolarHBondContact O-N 3.38Å
352	I	94.3	Very high	93.1	Very high	20 Å²	20	58.3 Å²	58.3	10%	0.103	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-28.3	-174.8	-62.5	-59.3	0	0	0	112	Y193 V214 T271 I274 R275 M350 E354 V355	Y193-I352 HydrophobicContact CE1-CG2 4.2Å; Y193-I352 HydrophobicContact CE2-CG2 4.12Å; V214-I352 HydrophobicContact CG2-CG2 4.31Å; T271-I352 HydrophobicContact CG2-CD1 4.09Å; T271-I352 HydrophobicContact CG2-CG1 3.9Å; I274-I352 HydrophobicContact CB-CG2 4.43Å; I274-I352 HydrophobicContact CD1-CG2 3.44Å; I274-I352 VanDerWaalsContact CD1-CG2 3.44Å; I274-I352 HydrophobicContact CG2-CG2 4.16Å; R275-I352 HydrophobicContact CG-CD1 4.36Å; M350-I352 PolarHBondContact O-N 2.89Å; I352-E354 VanDerWaalsContact C-N 3.26Å; I352-E354 PolarHBondContact O-N 2.8Å; I352-V355 HydrophobicContact CD1-CG2 4.41Å
353	D	93.3	Very high	92.8	Very high	73 Å²	73	66.6 Å²	66.6	39%	0.39	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.1	175	-77.1	-49.5	0	0	0	112.5	R191 Y193 D351 P356	R191-D353 WeakPolarHBondContact CD-OD1 3.34Å; R191-D353 IonicContact CZ-OD1 2.67Å; R191-D353 IonicContact NE-OD1 3.54Å; R191-D353 PolarHBondContact NE-OD1 2.86Å; R191-D353 IonicContact NH1-OD1 3.67Å; R191-D353 PolarHBondContact NH1-OD1 3.26Å; R191-D353 IonicContact NH1-OD2 2.94Å; R191-D353 IonicContact NH2-OD1 2.8Å; Y193-D353 PolarHBondContact OH-OD1 3.31Å; D351-D353 PolarHBondContact O-N 2.96Å; D351-D353 WeakPolarHBondContact OD1-CB 3.47Å; D351-D353 PolarHBondContact OD1-N 3.42Å; D353-P356 WeakPolarHBondContact O-CD 3.43Å
354	E	94.1	Very high	92.5	Very high	118 Å²	118	67.9 Å²	67.9	55%	0.551	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-23.1	-179.4	-63.8	-179.2	168.9	0	0	113.2	M350 D351 I352 P356 D357 G358	M350-E354 HydrophobicContact CG-CB 3.93Å; M350-E354 HydrophobicContact SD-CB 4.2Å; D351-E354 HydrophobicContact CB-CG 4.19Å; D351-E354 PolarHBondContact O-N 3.47Å; I352-E354 VanDerWaalsContact C-N 3.26Å; I352-E354 PolarHBondContact O-N 2.8Å; E354-P356 VanDerWaalsContact C-N 3.32Å; E354-D357 PolarHBondContact O-N 2.91Å; E354-G358 PolarHBondContact O-N 2.85Å
355	V	95.1	Very high	92.3	Very high	9 Å²	9	66 Å²	66	6%	0.055	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-50.6	-41.6	179.7	171.5	0	0	0	0	113.9	I274 R275 F278 M350 D351 I352 D357 G358	I274-V355 HydrophobicContact CG2-CG1 4.22Å; R275-V355 HydrophobicContact CG-CG1 4.48Å; R275-V355 HydrophobicContact CG-CG2 4.18Å; R275-V355 VanDerWaalsContact NH1-CG2 3.31Å; F278-V355 HydrophobicContact CB-CG1 4.06Å; F278-V355 HydrophobicContact CD2-CG1 3.75Å; F278-V355 HydrophobicContact CG-CG1 4.24Å; M350-V355 HydrophobicContact CG-CG2 4.25Å; M350-V355 HydrophobicContact SD-CB 4.47Å; M350-V355 HydrophobicContact SD-CG2 3.97Å; D351-V355 WeakPolarHBondContact O-CG2 3.38Å; D351-V355 PolarHBondContact O-N 3.38Å; I352-V355 HydrophobicContact CD1-CG2 4.41Å; V355-D357 PolarHBondContact O-N 3.02Å; V355-G358 PolarHBondContact O-N 3.24Å
356	P	93.7	Very high	92.2	Very high	18 Å²	18	71.5 Å²	71.5	12%	0.117	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-59.5	-26.1	178.2	-26.3	36.5	0	0	0	115.2	F278 D353 E354 P359	F278-P356 HydrophobicContact CD1-CB 4.35Å; F278-P356 HydrophobicContact CD2-CG 4.41Å; F278-P356 HydrophobicContact CE1-CB 3.74Å; F278-P356 HydrophobicContact CE1-CG 4.43Å; F278-P356 HydrophobicContact CE2-CB 3.95Å; F278-P356 HydrophobicContact CE2-CG 3.73Å; F278-P356 HydrophobicContact CZ-CB 3.52Å; F278-P356 HydrophobicContact CZ-CG 3.74Å; D353-P356 WeakPolarHBondContact O-CD 3.43Å; E354-P356 VanDerWaalsContact C-N 3.32Å; P356-P359 WeakPolarHBondContact O-CD 3.37Å
357	D	90.1	Very high	92.2	Very high	67 Å²	67	71.6 Å²	71.6	36%	0.358	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-91.2	-13.6	-179.1	-73.2	-38.5	0	0	0	113.2	E354 V355 P359 R360 H361	E354-D357 PolarHBondContact O-N 2.91Å; V355-D357 PolarHBondContact O-N 3.02Å; D357-P359 VanDerWaalsContact C-CD 3.48Å; D357-R360 VanDerWaalsContact O-CB 3.29Å; D357-R360 WeakPolarHBondContact O-CB 3.33Å; D357-R360 PolarHBondContact O-N 2.71Å; D357-R360 IonicContact OD1-CZ 2.94Å; D357-R360 IonicContact OD1-NE 3.49Å; D357-R360 PolarHBondContact OD1-NE 3.05Å; D357-H361 PolarHBondContact O-CE1 3.48Å; D357-H361 PolarHBondContact O-ND1 3.46Å
358	G	86.8	Confident	92.3	Very high	3 Å²	3	72.8 Å²	72.8	3%	0.031	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-46	-49.8	174.6	0	0	0	0	0	114.1	E354 V355 R360 H361	E354-G358 PolarHBondContact O-N 2.85Å; V355-G358 PolarHBondContact O-N 3.24Å; G358-R360 PolarHBondContact O-N 3.43Å; G358-R360 VanDerWaalsContact O-N 3.07Å; G358-H361 PolarHBondContact O-N 3.31Å; G358-H361 VanDerWaalsContact O-N 3.1Å
359	P	88.4	Confident	92.5	Very high	25 Å²	25	70 Å²	70	16%	0.162	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-58.1	-23.1	179.2	-26	35	0	0	0	115.6	F278 P356 D357 H361	F278-P359 HydrophobicContact CB-CG 3.99Å; F278-P359 HydrophobicContact CD1-CG 4.19Å; P356-P359 WeakPolarHBondContact O-CD 3.37Å; D357-P359 VanDerWaalsContact C-CD 3.48Å; P359-H361 VanDerWaalsContact C-N 3.26Å; P359-H361 PolarHBondContact O-N 3.06Å
360	R	88.8	Confident	92.6	Very high	107 Å²	107	68 Å²	68	40%	0.404	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-68.3	-27.6	178.7	-65.8	179.8	-174.4	-89.4	-7.5	112.8	L49 D357 G358	L49-R360 HydrophobicContact CD1-CG 3.31Å; L49-R360 VanDerWaalsContact CD1-NH1 3.29Å; D357-R360 VanDerWaalsContact O-CB 3.29Å; D357-R360 WeakPolarHBondContact O-CB 3.33Å; D357-R360 PolarHBondContact O-N 2.71Å; D357-R360 IonicContact OD1-CZ 2.94Å; D357-R360 IonicContact OD1-NE 3.49Å; D357-R360 PolarHBondContact OD1-NE 3.05Å; G358-R360 PolarHBondContact O-N 3.43Å; G358-R360 VanDerWaalsContact O-N 3.07Å
361	H	89.2	Confident	92.8	Very high	125 Å²	125	68.3 Å²	68.3	58%	0.579	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-96.3	-3.4	-172.2	-55.3	100.3	0	0	0	112.5	D357 G358 P359	D357-H361 PolarHBondContact O-CE1 3.48Å; D357-H361 PolarHBondContact O-ND1 3.46Å; G358-H361 PolarHBondContact O-N 3.31Å; G358-H361 VanDerWaalsContact O-N 3.1Å; P359-H361 VanDerWaalsContact C-N 3.26Å; P359-H361 PolarHBondContact O-N 3.06Å
362	V	92.5	Very high	92.9	Very high	16 Å²	16	64 Å²	64	10%	0.097	33%	0.325	C	S	.	.	S	Bend	trans	-79.9	125.9	178.1	179.9	0	0	0	0	109.8	T282 F338 C345 F346	T282-V362 HydrophobicContact CG2-CB 4.08Å; T282-V362 HydrophobicContact CG2-CG1 3.84Å; T282-V362 HydrophobicContact CG2-CG2 3.94Å; F338-V362 HydrophobicContact CD1-CG1 3.47Å; F338-V362 VanDerWaalsContact CD1-CG1 3.47Å; F338-V362 HydrophobicContact CE1-CG1 3.52Å; F338-V362 HydrophobicContact CG-CG1 4.32Å; F338-V362 HydrophobicContact CZ-CG1 4.39Å; C345-V362 HydrophobicContact CB-CG2 4.01Å; F346-V362 HydrophobicContact CE2-CG2 3.73Å; F346-V362 HydrophobicContact CZ-CG2 3.74Å
363	R	90.1	Very high	93.1	Very high	197 Å²	197	63.1 Å²	63.1	74%	0.743	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-68.2	141.2	176.1	-66.1	-178.3	-179.4	160.3	1.6	110.7	H342 Y365	H342-R363 PolarHBondContact NE2-N 2.82Å; H342-R363 VanDerWaalsContact NE2-N 3.17Å; R363-Y365 PolarHBondContact O-N 3.24Å
364	P	88.8	Confident	93.4	Very high	101 Å²	101	59.8 Å²	59.8	66%	0.656	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-54.5	138.2	173.8	-26.2	34.8	0	0	0	111.8	I46	I46-P364 HydrophobicContact CD1-CG 4.1Å; I46-P364 HydrophobicContact CG1-CG 4.39Å
365	Y	90.5	Very high	93.6	Very high	74 Å²	74	59 Å²	59	29%	0.29	30%	0.299	S	S	.	.			trans	-104.1	131.2	171.9	174.1	-97.4	0	0	0	109.2	P333 V334 P336 R363	P333-Y365 PolarHBondContact O-OH 2.95Å; V334-Y365 VanDerWaalsContact O-CE1 3.3Å; V334-Y365 WeakPolarHBondContact O-CE1 3.43Å; P336-Y365 HydrophobicContact CB-CD2 3.94Å; P336-Y365 HydrophobicContact CB-CE2 3.99Å; P336-Y365 HydrophobicContact CB-CG 4.42Å; P336-Y365 HydrophobicContact CG-CD1 4.27Å; P336-Y365 HydrophobicContact CG-CD2 3.75Å; P336-Y365 HydrophobicContact CG-CE2 4.22Å; P336-Y365 HydrophobicContact CG-CG 3.76Å; R363-Y365 PolarHBondContact O-N 3.24Å
366	T	93.2	Very high	93.8	Very high	124 Å²	124	58.6 Å²	58.6	76%	0.761	30%	0.297	S	S	*	.			trans	-109.8	112.2	175.3	-53.4	0	0	0	0	109.4
367	S	95.3	Very high	94	Very high	16 Å²	16	57.8 Å²	57.8	11%	0.112	29%	0.291	C	S	.	.			trans	-75.9	140.9	173.9	-174	0	0	0	0	111.1	P333 V334 N369	P333-S367 PolarHBondContact O-OG 2.9Å; V334-S367 WeakPolarHBondContact CA-OG 3.49Å; S367-N369 VanDerWaalsContact C-N 3.29Å; S367-N369 WeakPolarHBondContact OG-CB 3.48Å; S367-N369 PolarHBondContact OG-N 2.96Å
368	T	96.9	Very high	94.4	Very high	95 Å²	95	55.9 Å²	55.9	58%	0.583	28%	0.281	S	S	*	.			trans	-81	-12.1	168	62.9	0	0	0	0	112.5	Q332 Q370	Q332-T368 PolarHBondContact OE1-O 3.43Å; Q332-T368 PolarHBondContact OE1-OG1 3.42Å; Q332-T368 VanDerWaalsContact OE1-OG1 3.08Å; T368-Q370 WeakPolarHBondContact O-CG 3.49Å; T368-Q370 PolarHBondContact O-N 3.12Å; T368-Q370 PolarHBondContact O-NE2 3.06Å; T368-Q370 VanDerWaalsContact O-NE2 3.14Å
369	N	97.9	Very high	95	Very high	11 Å²	11	56.1 Å²	56.1	6%	0.059	28%	0.283	C	S	.	.			trans	-67.2	125.3	-175	-177.9	-66.8	0	0	0	111.7	R289 Q332 V334 S367 S371	R289-N369 PolarHBondContact NH1-O 2.99Å; R289-N369 PolarHBondContact NH1-OD1 3.41Å; R289-N369 PolarHBondContact NH2-O 3.14Å; R289-N369 VanDerWaalsContact NH2-O 3.11Å; Q332-N369 HydrophobicContact CB-CB 4Å; Q332-N369 WeakPolarHBondContact O-CB 3.26Å; Q332-N369 PolarHBondContact O-ND2 2.85Å; V334-N369 HydrophobicContact CG2-CB 3.77Å; S367-N369 VanDerWaalsContact C-N 3.29Å; S367-N369 WeakPolarHBondContact OG-CB 3.48Å; S367-N369 PolarHBondContact OG-N 2.96Å; N369-S371 VanDerWaalsContact OD1-CB 3.24Å; N369-S371 WeakPolarHBondContact OD1-CB 3.42Å; N369-S371 PolarHBondContact OD1-N 2.88Å; N369-S371 PolarHBondContact OD1-OG 3.3Å
370	Q	96.6	Very high	95.5	Very high	108 Å²	108	54.9 Å²	54.9	51%	0.505	28%	0.276	S	S	.	.			trans	-104.8	9.7	-177.1	-59.1	-55.6	-36.2	0	0	114.9	K148 T368 S372	K148-Q370 PolarHBondContact NZ-O 3.13Å; T368-Q370 WeakPolarHBondContact O-CG 3.49Å; T368-Q370 PolarHBondContact O-N 3.12Å; T368-Q370 PolarHBondContact O-NE2 3.06Å; T368-Q370 VanDerWaalsContact O-NE2 3.14Å; Q370-S372 PolarHBondContact O-N 2.76Å
371	S	98	Very high	96	Very high	37 Å²	37	49.8 Å²	49.8	26%	0.259	26%	0.256	S	S	.	.			trans	-62.3	134.6	178.4	-60.5	0	0	0	0	111	R289 N369 E375	R289-S371 PolarHBondContact NH1-O 2.95Å; N369-S371 VanDerWaalsContact OD1-CB 3.24Å; N369-S371 WeakPolarHBondContact OD1-CB 3.42Å; N369-S371 PolarHBondContact OD1-N 2.88Å; N369-S371 PolarHBondContact OD1-OG 3.3Å; S371-E375 WeakPolarHBondContact CA-OE2 3.35Å
372	S	98.2	Very high	96.4	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	25%	0.251	C	S	.	.			trans	-65.2	165.9	170.8	61.4	0	0	0	0	112.1	F146 D149 Q370 G374 E375 L376	F146-S372 WeakPolarHBondContact O-CA 3.36Å; F146-S372 WeakPolarHBondContact O-CB 3.26Å; D149-S372 PolarHBondContact OD2-OG 3.11Å; Q370-S372 PolarHBondContact O-N 2.76Å; S372-G374 VanDerWaalsContact C-N 3.31Å; S372-G374 PolarHBondContact O-N 3.14Å; S372-E375 WeakPolarHBondContact CB-OE2 3.29Å; S372-E375 PolarHBondContact N-OE2 2.92Å; S372-E375 PolarHBondContact O-N 3.02Å; S372-E375 WeakPolarHBondContact OG-CB 3.28Å; S372-E375 VanDerWaalsContact OG-CD 3.3Å; S372-E375 WeakPolarHBondContact OG-CG 3.5Å; S372-E375 PolarHBondContact OG-N 3.49Å; S372-E375 PolarHBondContact OG-OE2 3.27Å; S372-L376 WeakPolarHBondContact O-CG 3.11Å; S372-L376 PolarHBondContact O-N 3.35Å
373	L	98.3	Very high	96.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.6	-42.8	175	-81.2	171.9	0	0	0	112.4	L143 F146 M155 V156 R289 P292 L376 L377	L143-L373 HydrophobicContact CD1-CD1 4.12Å; F146-L373 PolarHBondContact O-N 2.93Å; M155-L373 HydrophobicContact CE-CB 3.89Å; M155-L373 HydrophobicContact CE-CD2 4.11Å; M155-L373 HydrophobicContact SD-CB 3.92Å; V156-L373 HydrophobicContact CG2-CD1 3.63Å; R289-L373 HydrophobicContact CB-CD2 3.82Å; R289-L373 HydrophobicContact CG-CD2 4.21Å; R289-L373 HydrophobicContact CG-CG 4.5Å; R289-L373 WeakPolarHBondContact O-CD2 3.3Å; P292-L373 HydrophobicContact CB-CD1 4.09Å; P292-L373 HydrophobicContact CB-CD2 4Å; P292-L373 HydrophobicContact CG-CD1 4.5Å; L373-L376 PolarHBondContact O-N 3.41Å; L373-L377 PolarHBondContact O-N 3.45Å
374	G	98.4	Very high	97.1	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-42.3	179.2	0	0	0	0	0	112.7	S152 S372 L377 L378	S152-G374 PolarHBondContact OG-N 2.68Å; S372-G374 VanDerWaalsContact C-N 3.31Å; S372-G374 PolarHBondContact O-N 3.14Å; G374-L377 PolarHBondContact O-N 3.33Å; G374-L378 WeakPolarHBondContact O-CB 3.45Å; G374-L378 PolarHBondContact O-N 2.99Å
375	E	98.6	Very high	97.6	Very high	102 Å²	102	37.7 Å²	37.7	48%	0.477	20%	0.197	S	C	.	.	H	α-helix	trans	-62.5	-42	173.7	-73.1	168.3	130.6	0	0	111.8	S371 S372 G379	S371-E375 WeakPolarHBondContact CA-OE2 3.35Å; S372-E375 WeakPolarHBondContact CB-OE2 3.29Å; S372-E375 PolarHBondContact N-OE2 2.92Å; S372-E375 PolarHBondContact O-N 3.02Å; S372-E375 WeakPolarHBondContact OG-CB 3.28Å; S372-E375 VanDerWaalsContact OG-CD 3.3Å; S372-E375 WeakPolarHBondContact OG-CG 3.5Å; S372-E375 PolarHBondContact OG-N 3.49Å; S372-E375 PolarHBondContact OG-OE2 3.27Å; E375-G379 PolarHBondContact O-N 3.5Å
376	L	98.8	Very high	97.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-42.9	178	-70.9	176.8	0	0	0	112.2	R289 L293 Y326 L327 L330 V334 S372 L373 G379 F380	R289-L376 HydrophobicContact CB-CD1 4.14Å; L293-L376 HydrophobicContact CD2-CB 4.15Å; Y326-L376 HydrophobicContact CE1-CD2 4.34Å; Y326-L376 VanDerWaalsContact CE1-O 3.31Å; Y326-L376 WeakPolarHBondContact CE1-O 2.73Å; Y326-L376 PolarHBondContact OH-O 2.87Å; L327-L376 HydrophobicContact CD2-CD1 4.21Å; L327-L376 HydrophobicContact CD2-CD2 4.05Å; L330-L376 HydrophobicContact CD1-CD2 3.71Å; V334-L376 HydrophobicContact CG2-CD2 4.37Å; S372-L376 WeakPolarHBondContact O-CG 3.11Å; S372-L376 PolarHBondContact O-N 3.35Å; L373-L376 PolarHBondContact O-N 3.41Å; L376-G379 PolarHBondContact O-N 3.01Å; L376-F380 WeakPolarHBondContact O-CB 3.37Å; L376-F380 PolarHBondContact O-N 3.21Å
377	L	98.8	Very high	98.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-47	176.4	177.6	63.1	0	0	0	111.6	L151 M155 L293 V296 V297 L373 G374 G379 F380 L381 L451 L457	L151-L377 HydrophobicContact CD1-CD2 4.26Å; M155-L377 HydrophobicContact CE-CB 3.92Å; M155-L377 HydrophobicContact CE-CD2 4.18Å; M155-L377 HydrophobicContact CG-CD2 4.32Å; M155-L377 HydrophobicContact SD-CB 3.88Å; M155-L377 HydrophobicContact SD-CD2 3.69Å; M155-L377 HydrophobicContact SD-CG 4.43Å; L293-L377 HydrophobicContact CD1-CB 3.89Å; L293-L377 HydrophobicContact CD1-CD1 4.12Å; V296-L377 HydrophobicContact CG1-CD1 4.11Å; V296-L377 HydrophobicContact CG1-CD2 3.76Å; V297-L377 HydrophobicContact CG2-CD1 3.97Å; L373-L377 PolarHBondContact O-N 3.45Å; G374-L377 PolarHBondContact O-N 3.33Å; L377-G379 VanDerWaalsContact C-N 3.33Å; L377-G379 PolarHBondContact O-N 3.25Å; L377-F380 PolarHBondContact O-N 2.66Å; L377-L381 WeakPolarHBondContact O-CG 2.73Å; L377-L381 PolarHBondContact O-N 3.23Å; L377-L381 VanDerWaalsContact O-N 3.07Å; L377-L451 HydrophobicContact CD2-CD2 3.86Å; L377-L451 HydrophobicContact CG-CD2 3.91Å; L377-L457 HydrophobicContact CD2-CD1 4.01Å
378	L	98.7	Very high	98.3	Very high	27 Å²	27	40.6 Å²	40.6	14%	0.141	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-44	177.6	-177.5	69.2	0	0	0	111.3	G374 L381 R382 Y448 L451 N452	G374-L378 WeakPolarHBondContact O-CB 3.45Å; G374-L378 PolarHBondContact O-N 2.99Å; L378-L381 PolarHBondContact O-N 2.9Å; L378-R382 WeakPolarHBondContact O-CB 3.47Å; L378-R382 PolarHBondContact O-N 3.23Å; L378-Y448 HydrophobicContact CD1-CD2 3.8Å; L378-Y448 HydrophobicContact CD1-CE2 3.84Å; L378-Y448 HydrophobicContact CG-CD2 4.45Å; L378-Y448 HydrophobicContact CG-CE2 4.21Å; L378-L451 HydrophobicContact CD1-CB 4.36Å; L378-L451 HydrophobicContact CD1-CD2 4.36Å; L378-L451 HydrophobicContact CD1-CG 4.42Å; L378-N452 HydrophobicContact CD1-CB 3.88Å
379	G	98.8	Very high	98.3	Very high	8 Å²	8	37.7 Å²	37.7	8%	0.082	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-37.2	177.9	0	0	0	0	0	113	Y326 E375 L376 L377 R382 Y383	Y326-G379 VanDerWaalsContact CZ-C 3.41Å; Y326-G379 WeakPolarHBondContact OH-CA 3.31Å; E375-G379 PolarHBondContact O-N 3.5Å; L376-G379 PolarHBondContact O-N 3.01Å; L377-G379 VanDerWaalsContact C-N 3.33Å; L377-G379 PolarHBondContact O-N 3.25Å; G379-R382 PolarHBondContact O-N 3.48Å; G379-Y383 VanDerWaalsContact O-CB 3.25Å; G379-Y383 WeakPolarHBondContact O-CB 3.47Å; G379-Y383 PolarHBondContact O-N 3.41Å
380	F	98.9	Very high	98.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-49.5	173.4	166.7	-96.3	0	0	0	111.4	V297 W300 M322 V323 Y326 L376 L377 R382 Y383 Y384 F444	V297-F380 HydrophobicContact CB-CE1 4.38Å; V297-F380 HydrophobicContact CG1-CE1 3.74Å; V297-F380 HydrophobicContact CG1-CZ 3.73Å; V297-F380 HydrophobicContact CG2-CD1 3.84Å; V297-F380 HydrophobicContact CG2-CE1 3.64Å; V297-F380 HydrophobicContact CG2-CZ 4.17Å; W300-F380 HydrophobicContact CZ3-CE1 4.41Å; M322-F380 HydrophobicContact CB-CE2 4.39Å; V323-F380 HydrophobicContact CB-CE2 4.33Å; V323-F380 HydrophobicContact CG2-CD2 4.08Å; V323-F380 HydrophobicContact CG2-CE2 3.54Å; V323-F380 HydrophobicContact CG2-CZ 3.89Å; Y326-F380 HydrophobicContact CD1-CB 3.77Å; Y326-F380 HydrophobicContact CD1-CD2 4.14Å; Y326-F380 HydrophobicContact CD1-CG 4.47Å; Y326-F380 HydrophobicContact CE1-CB 3.78Å; Y326-F380 HydrophobicContact CG-CB 4.2Å; Y326-F380 HydrophobicContact CG-CD2 4.12Å; Y326-F380 VanDerWaalsContact CZ-N 3.25Å; Y326-F380 PolarHBondContact OH-N 3.13Å; L376-F380 WeakPolarHBondContact O-CB 3.37Å; L376-F380 PolarHBondContact O-N 3.21Å; L377-F380 PolarHBondContact O-N 2.66Å; F380-R382 PolarHBondContact O-N 3.36Å; F380-Y383 PolarHBondContact O-N 3.45Å; F380-Y384 AromaticContact CD2-CD2 3.83Å; F380-Y384 HydrophobicContact CD2-CD2 3.83Å; F380-Y384 AromaticContact CD2-CE2 3.77Å; F380-Y384 HydrophobicContact CD2-CE2 3.77Å; F380-Y384 AromaticContact CE2-CD2 3.53Å; F380-Y384 HydrophobicContact CE2-CD2 3.53Å; F380-Y384 AromaticContact CE2-CE2 3.38Å; F380-Y384 HydrophobicContact CE2-CE2 3.38Å; F380-Y384 AromaticContact CZ-CD2 3.96Å; F380-Y384 HydrophobicContact CZ-CD2 3.96Å; F380-Y384 HydrophobicContact CZ-CE2 4.17Å; F380-Y384 PolarHBondContact O-N 3.06Å; F380-F444 HydrophobicContact CD1-CE1 4.4Å; F380-F444 AromaticContact CE1-CE1 3.62Å; F380-F444 HydrophobicContact CE1-CE1 3.62Å; F380-F444 HydrophobicContact CE1-CZ 4.29Å; F380-F444 AromaticContact CZ-CE1 3.84Å; F380-F444 HydrophobicContact CZ-CE1 3.84Å; F380-F444 HydrophobicContact CZ-CZ 4.16Å
381	L	98.9	Very high	98.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-45.1	177.4	-67.3	174.3	0	0	0	110.9	W300 L377 L378 Y383 Y384 A385 F444 L451 I460	W300-L381 HydrophobicContact CD2-CD2 4.42Å; W300-L381 HydrophobicContact CH2-CD2 3.9Å; W300-L381 HydrophobicContact CZ2-CD2 3.7Å; W300-L381 HydrophobicContact CZ3-CD2 4.32Å; L377-L381 WeakPolarHBondContact O-CG 2.73Å; L377-L381 PolarHBondContact O-N 3.23Å; L377-L381 VanDerWaalsContact O-N 3.07Å; L378-L381 PolarHBondContact O-N 2.9Å; L381-Y383 PolarHBondContact O-N 3.16Å; L381-Y384 PolarHBondContact O-N 3.07Å; L381-A385 WeakPolarHBondContact O-CB 3.41Å; L381-A385 PolarHBondContact O-N 2.75Å; L381-F444 HydrophobicContact CD2-CD1 3.96Å; L381-F444 HydrophobicContact CD2-CE1 4.29Å; L381-L451 HydrophobicContact CD1-CB 4.42Å; L381-L451 HydrophobicContact CD1-CD2 3.73Å; L381-I460 HydrophobicContact CD1-CD1 4.04Å
382	R	98.8	Very high	98.3	Very high	121 Å²	121	42.2 Å²	42.2	46%	0.457	20%	0.202	S	C	.	.	H	α-helix	trans	-59	-45	176.7	-170.7	174.5	67.6	172.8	-0.6	112.3	L378 G379 F380 A385 T386 Y448	L378-R382 WeakPolarHBondContact O-CB 3.47Å; L378-R382 PolarHBondContact O-N 3.23Å; G379-R382 PolarHBondContact O-N 3.48Å; F380-R382 PolarHBondContact O-N 3.36Å; R382-A385 PolarHBondContact O-N 3.39Å; R382-T386 PolarHBondContact O-N 2.88Å; R382-T386 PolarHBondContact O-OG1 2.79Å; R382-Y448 HydrophobicContact CB-CD2 3.64Å; R382-Y448 HydrophobicContact CB-CE2 3.46Å; R382-Y448 VanDerWaalsContact CB-CE2 3.46Å; R382-Y448 HydrophobicContact CB-CG 4.32Å; R382-Y448 WeakPolarHBondContact CD-OH 3.27Å; R382-Y448 HydrophobicContact CG-CD2 4.24Å; R382-Y448 HydrophobicContact CG-CE1 4.2Å; R382-Y448 HydrophobicContact CG-CE2 3.67Å
383	Y	98.8	Very high	98.3	Very high	33 Å²	33	44.5 Å²	44.5	13%	0.129	21%	0.213	C	C	.	.	I	π-helix	trans	-58.4	-51	-177.1	177.1	-99.5	0	0	0	110.8	H325 Y326 G379 F380 L381 R387 F388 I402	H325-Y383 AromaticContact CD2-CE1 3.94Å; H325-Y383 AromaticContact NE2-CE1 3.94Å; H325-Y383 AromaticContact NE2-CZ 3.75Å; H325-Y383 PolarHBondContact NE2-OH 3.04Å; Y326-Y383 HydrophobicContact CD2-CD1 4.21Å; Y326-Y383 HydrophobicContact CD2-CD2 4.4Å; Y326-Y383 AromaticContact CD2-CG 3.9Å; Y326-Y383 HydrophobicContact CD2-CG 3.9Å; Y326-Y383 HydrophobicContact CE2-CG 4.45Å; G379-Y383 VanDerWaalsContact O-CB 3.25Å; G379-Y383 WeakPolarHBondContact O-CB 3.47Å; G379-Y383 PolarHBondContact O-N 3.41Å; F380-Y383 PolarHBondContact O-N 3.45Å; L381-Y383 PolarHBondContact O-N 3.16Å; Y383-R387 HydrophobicContact CD2-CB 4.07Å; Y383-R387 WeakPolarHBondContact O-CA 3.46Å; Y383-R387 WeakPolarHBondContact O-CB 3.16Å; Y383-R387 PolarHBondContact O-N 3.2Å; Y383-F388 HydrophobicContact CD1-CB 4.29Å; Y383-F388 HydrophobicContact CE1-CB 3.89Å; Y383-F388 AromaticContact CE1-CD2 3.96Å; Y383-F388 HydrophobicContact CE1-CD2 3.96Å; Y383-F388 HydrophobicContact CE1-CG 4.23Å; Y383-F388 PolarHBondContact O-N 2.99Å; Y383-I402 WeakPolarHBondContact OH-CD1 3.28Å
384	Y	98.8	Very high	98.3	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	21%	0.213	C	C	.	.	I	π-helix	trans	-78.6	-23	-179.2	-75.7	-58	0	0	0	114.4	M322 H325 F380 L381 F388 W390 I395 F444	M322-Y384 WeakPolarHBondContact CA-OH 3.5Å; M322-Y384 HydrophobicContact CB-CE2 3.88Å; M322-Y384 HydrophobicContact CE-CD1 4.05Å; M322-Y384 HydrophobicContact CE-CD2 3.95Å; M322-Y384 HydrophobicContact CE-CE1 4.05Å; M322-Y384 HydrophobicContact CE-CE2 3.92Å; M322-Y384 HydrophobicContact CE-CG 4.01Å; M322-Y384 PolarHBondContact O-OH 3.37Å; H325-Y384 PolarHBondContact CD2-OH 3.05Å; F380-Y384 AromaticContact CD2-CD2 3.83Å; F380-Y384 HydrophobicContact CD2-CD2 3.83Å; F380-Y384 AromaticContact CD2-CE2 3.77Å; F380-Y384 HydrophobicContact CD2-CE2 3.77Å; F380-Y384 AromaticContact CE2-CD2 3.53Å; F380-Y384 HydrophobicContact CE2-CD2 3.53Å; F380-Y384 AromaticContact CE2-CE2 3.38Å; F380-Y384 HydrophobicContact CE2-CE2 3.38Å; F380-Y384 AromaticContact CZ-CD2 3.96Å; F380-Y384 HydrophobicContact CZ-CD2 3.96Å; F380-Y384 HydrophobicContact CZ-CE2 4.17Å; F380-Y384 PolarHBondContact O-N 3.06Å; L381-Y384 PolarHBondContact O-N 3.07Å; Y384-F388 HydrophobicContact CD1-CB 3.86Å; Y384-F388 HydrophobicContact CD1-CD1 4.12Å; Y384-F388 HydrophobicContact CD1-CG 4.01Å; Y384-F388 HydrophobicContact CE1-CB 4.15Å; Y384-F388 HydrophobicContact CE1-CD1 4.11Å; Y384-F388 HydrophobicContact CE1-CD2 4.29Å; Y384-F388 AromaticContact CE1-CG 3.91Å; Y384-F388 HydrophobicContact CE1-CG 3.91Å; Y384-W390 AromaticContact CD1-CH2 3.44Å; Y384-W390 HydrophobicContact CD1-CH2 3.44Å; Y384-W390 VanDerWaalsContact CD1-CH2 3.44Å; Y384-W390 AromaticContact CD1-CZ2 3.63Å; Y384-W390 HydrophobicContact CD1-CZ2 3.63Å; Y384-W390 HydrophobicContact CD1-CZ3 4.29Å; Y384-W390 HydrophobicContact CE1-CH2 4.05Å; Y384-W390 HydrophobicContact CG-CH2 4.12Å; Y384-W390 HydrophobicContact CG-CZ2 4.16Å; Y384-W390 PolarHBondContact O-NE1 3.24Å; Y384-I395 HydrophobicContact CE1-CD1 3.81Å; Y384-I395 WeakPolarHBondContact OH-CD1 3.38Å; Y384-F444 HydrophobicContact CD2-CE1 4.09Å; Y384-F444 HydrophobicContact CD2-CZ 4.44Å; Y384-F444 HydrophobicContact CG-CE1 4.17Å; Y384-F444 HydrophobicContact CG-CZ 4.42Å
385	A	98.5	Very high	98.3	Very high	29 Å²	29	44.4 Å²	44.4	24%	0.24	21%	0.211	C	C	.	.	I	π-helix	trans	-74	-38.1	173.1	0	0	0	0	0	113	L381 R382 F444	L381-A385 WeakPolarHBondContact O-CB 3.41Å; L381-A385 PolarHBondContact O-N 2.75Å; R382-A385 PolarHBondContact O-N 3.39Å; A385-F444 HydrophobicContact CB-CB 4.29Å
386	T	97.6	Very high	98.3	Very high	83 Å²	83	39.6 Å²	39.6	51%	0.509	19%	0.189	S	C	.	.	I	π-helix	trans	-132.6	-21.9	-163.3	64.9	0	0	0	0	116.3	R382	R382-T386 PolarHBondContact O-N 2.88Å; R382-T386 PolarHBondContact O-OG1 2.79Å
387	R	97.2	Very high	98.3	Very high	182 Å²	182	39.6 Å²	39.6	69%	0.687	19%	0.189	S	C	*	.	I	π-helix	trans	-108.1	-40.2	-171.4	-59.1	-60.9	-173.4	164.3	1.3	113.2	Y383	Y383-R387 HydrophobicContact CD2-CB 4.07Å; Y383-R387 WeakPolarHBondContact O-CA 3.46Å; Y383-R387 WeakPolarHBondContact O-CB 3.16Å; Y383-R387 PolarHBondContact O-N 3.2Å
388	F	98.3	Very high	98.3	Very high	10 Å²	10	43.5 Å²	43.5	4%	0.044	20%	0.203	C	C	.	.			trans	-76.2	127.5	-177.9	-172.9	-98.8	0	0	0	112.1	Y383 Y384 W390 Q393 I395 I402	Y383-F388 HydrophobicContact CD1-CB 4.29Å; Y383-F388 HydrophobicContact CE1-CB 3.89Å; Y383-F388 AromaticContact CE1-CD2 3.96Å; Y383-F388 HydrophobicContact CE1-CD2 3.96Å; Y383-F388 HydrophobicContact CE1-CG 4.23Å; Y383-F388 PolarHBondContact O-N 2.99Å; Y384-F388 HydrophobicContact CD1-CB 3.86Å; Y384-F388 HydrophobicContact CD1-CD1 4.12Å; Y384-F388 HydrophobicContact CD1-CG 4.01Å; Y384-F388 HydrophobicContact CE1-CB 4.15Å; Y384-F388 HydrophobicContact CE1-CD1 4.11Å; Y384-F388 HydrophobicContact CE1-CD2 4.29Å; Y384-F388 AromaticContact CE1-CG 3.91Å; Y384-F388 HydrophobicContact CE1-CG 3.91Å; F388-W390 AromaticContact CD1-CD2 3.64Å; F388-W390 HydrophobicContact CD1-CD2 3.64Å; F388-W390 AromaticContact CD1-CE2 3.92Å; F388-W390 AromaticContact CD1-CE3 3.66Å; F388-W390 HydrophobicContact CD1-CE3 3.66Å; F388-W390 HydrophobicContact CD1-CG 4.11Å; F388-W390 HydrophobicContact CD1-CH2 4.28Å; F388-W390 HydrophobicContact CD1-CZ2 4.26Å; F388-W390 AromaticContact CD1-CZ3 3.98Å; F388-W390 HydrophobicContact CD1-CZ3 3.98Å; F388-W390 AromaticContact CE1-CD2 3.92Å; F388-W390 HydrophobicContact CE1-CD2 3.92Å; F388-W390 AromaticContact CE1-CE3 3.54Å; F388-W390 HydrophobicContact CE1-CE3 3.54Å; F388-W390 HydrophobicContact CE1-CG 4.41Å; F388-W390 AromaticContact CE1-CZ3 3.94Å; F388-W390 HydrophobicContact CE1-CZ3 3.94Å; F388-W390 PolarHBondContact O-N 3.42Å; F388-Q393 HydrophobicContact CD2-CB 4.42Å; F388-Q393 HydrophobicContact CE1-CB 4.43Å; F388-Q393 HydrophobicContact CE2-CB 3.67Å; F388-Q393 HydrophobicContact CZ-CB 3.67Å; F388-I395 HydrophobicContact CE1-CD1 4.27Å; F388-I395 HydrophobicContact CE1-CG1 4.45Å; F388-I395 HydrophobicContact CE2-CD1 4.25Å; F388-I395 HydrophobicContact CE2-CG1 3.68Å; F388-I395 HydrophobicContact CZ-CD1 3.91Å; F388-I395 HydrophobicContact CZ-CG1 3.61Å; F388-I402 HydrophobicContact CE2-CG2 4.45Å
389	S	98.1	Very high	98.2	Very high	34 Å²	34	44.7 Å²	44.7	24%	0.238	21%	0.208	C	C	.	.			trans	-96	87.5	-178.5	-162	0	0	0	0	110.8	D391 K392 Q393	S389-D391 PolarHBondContact O-N 2.87Å; S389-D391 PolarHBondContact OG-OD1 2.79Å; S389-K392 PolarHBondContact O-N 2.82Å; S389-Q393 VanDerWaalsContact O-CB 3.31Å; S389-Q393 WeakPolarHBondContact O-CB 3.18Å; S389-Q393 PolarHBondContact O-N 3.16Å
390	W	97.9	Very high	98.2	Very high	12 Å²	12	45.6 Å²	45.6	5%	0.045	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-31	-178.3	-55.5	96.8	0	0	0	115.2	M322 Y384 F388 I416 F437	M322-W390 HydrophobicContact CE-CH2 3.75Å; M322-W390 HydrophobicContact CE-CZ3 4.37Å; Y384-W390 AromaticContact CD1-CH2 3.44Å; Y384-W390 HydrophobicContact CD1-CH2 3.44Å; Y384-W390 VanDerWaalsContact CD1-CH2 3.44Å; Y384-W390 AromaticContact CD1-CZ2 3.63Å; Y384-W390 HydrophobicContact CD1-CZ2 3.63Å; Y384-W390 HydrophobicContact CD1-CZ3 4.29Å; Y384-W390 HydrophobicContact CE1-CH2 4.05Å; Y384-W390 HydrophobicContact CG-CH2 4.12Å; Y384-W390 HydrophobicContact CG-CZ2 4.16Å; Y384-W390 PolarHBondContact O-NE1 3.24Å; F388-W390 AromaticContact CD1-CD2 3.64Å; F388-W390 HydrophobicContact CD1-CD2 3.64Å; F388-W390 AromaticContact CD1-CE2 3.92Å; F388-W390 AromaticContact CD1-CE3 3.66Å; F388-W390 HydrophobicContact CD1-CE3 3.66Å; F388-W390 HydrophobicContact CD1-CG 4.11Å; F388-W390 HydrophobicContact CD1-CH2 4.28Å; F388-W390 HydrophobicContact CD1-CZ2 4.26Å; F388-W390 AromaticContact CD1-CZ3 3.98Å; F388-W390 HydrophobicContact CD1-CZ3 3.98Å; F388-W390 AromaticContact CE1-CD2 3.92Å; F388-W390 HydrophobicContact CE1-CD2 3.92Å; F388-W390 AromaticContact CE1-CE3 3.54Å; F388-W390 HydrophobicContact CE1-CE3 3.54Å; F388-W390 HydrophobicContact CE1-CG 4.41Å; F388-W390 AromaticContact CE1-CZ3 3.94Å; F388-W390 HydrophobicContact CE1-CZ3 3.94Å; F388-W390 PolarHBondContact O-N 3.42Å; W390-I416 HydrophobicContact CE3-CB 4.3Å; W390-I416 HydrophobicContact CE3-CD1 4.34Å; W390-I416 HydrophobicContact CE3-CG1 3.81Å; W390-I416 HydrophobicContact CE3-CG2 4.02Å; W390-I416 HydrophobicContact CZ3-CB 4.42Å; W390-I416 HydrophobicContact CZ3-CD1 4.13Å; W390-I416 HydrophobicContact CZ3-CG1 4.03Å; W390-I416 HydrophobicContact CZ3-CG2 3.74Å; W390-F437 HydrophobicContact CB-CE2 3.94Å; W390-F437 HydrophobicContact CB-CZ 3.72Å; W390-F437 HydrophobicContact CD2-CE2 4.2Å; W390-F437 AromaticContact CG-CE2 3.92Å; W390-F437 HydrophobicContact CG-CE2 3.92Å; W390-F437 AromaticContact CG-CZ 3.97Å; W390-F437 HydrophobicContact CG-CZ 3.97Å
391	D	96.4	Very high	98.2	Very high	101 Å²	101	48.4 Å²	48.4	54%	0.54	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-22.1	-179.6	62.9	-46.8	0	0	0	113.6	S389 K405	S389-D391 PolarHBondContact O-N 2.87Å; S389-D391 PolarHBondContact OG-OD1 2.79Å; D391-K405 WeakPolarHBondContact O-CD 3.26Å
392	K	97.1	Very high	98.1	Very high	138 Å²	138	51 Å²	51	60%	0.6	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.8	-15.1	-172.5	-63.4	176.4	-171	175.8	0	114.4	S389 K405	S389-K392 PolarHBondContact O-N 2.82Å; K392-K405 VanDerWaalsContact C-CB 3.45Å; K392-K405 WeakPolarHBondContact O-CB 3.13Å; K392-K405 PolarHBondContact O-N 2.85Å
393	Q	98.3	Very high	98.1	Very high	50 Å²	50	47.6 Å²	47.6	23%	0.234	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	147.8	-165.2	-68.2	-179.7	-33.4	0	0	112.5	F388 S389 I402	F388-Q393 HydrophobicContact CD2-CB 4.42Å; F388-Q393 HydrophobicContact CE1-CB 4.43Å; F388-Q393 HydrophobicContact CE2-CB 3.67Å; F388-Q393 HydrophobicContact CZ-CB 3.67Å; S389-Q393 VanDerWaalsContact O-CB 3.31Å; S389-Q393 WeakPolarHBondContact O-CB 3.18Å; S389-Q393 PolarHBondContact O-N 3.16Å; Q393-I402 HydrophobicContact CB-CG2 3.47Å; Q393-I402 VanDerWaalsContact CB-CG2 3.47Å; Q393-I402 HydrophobicContact CG-CG2 3.49Å; Q393-I402 VanDerWaalsContact CG-CG2 3.49Å
394	V	98.6	Very high	98	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130	173.7	-178.8	0	0	0	0	108.1	L403 K405 W411 C417 E419	V394-L403 HydrophobicContact CB-CB 4.21Å; V394-L403 PolarHBondContact N-O 3.4Å; V394-L403 PolarHBondContact O-N 2.96Å; V394-K405 HydrophobicContact CG2-CB 4.03Å; V394-K405 HydrophobicContact CG2-CG 4.24Å; V394-W411 HydrophobicContact CG1-CD2 4.45Å; V394-W411 HydrophobicContact CG1-CE3 4.16Å; V394-W411 HydrophobicContact CG1-CH2 3.83Å; V394-W411 HydrophobicContact CG1-CZ2 4.12Å; V394-W411 HydrophobicContact CG1-CZ3 3.83Å; V394-W411 HydrophobicContact CG2-CD2 4.09Å; V394-W411 HydrophobicContact CG2-CE3 4.21Å; V394-W411 HydrophobicContact CG2-CG 4.35Å; V394-C417 HydrophobicContact CB-CB 4.12Å; V394-C417 HydrophobicContact CG1-CB 4.06Å; V394-C417 HydrophobicContact CG2-CB 3.72Å; V394-E419 HydrophobicContact CG1-CB 4.33Å
395	I	98.8	Very high	97.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.1	174.7	-72.5	157.8	0	0	0	109.1	M322 H325 Y384 F388 C417 V418 E419	M322-I395 HydrophobicContact CG-CD1 3.88Å; H325-I395 HydrophobicContact CB-CG2 3.47Å; H325-I395 VanDerWaalsContact CB-CG2 3.47Å; Y384-I395 HydrophobicContact CE1-CD1 3.81Å; Y384-I395 WeakPolarHBondContact OH-CD1 3.38Å; F388-I395 HydrophobicContact CE1-CD1 4.27Å; F388-I395 HydrophobicContact CE1-CG1 4.45Å; F388-I395 HydrophobicContact CE2-CD1 4.25Å; F388-I395 HydrophobicContact CE2-CG1 3.68Å; F388-I395 HydrophobicContact CZ-CD1 3.91Å; F388-I395 HydrophobicContact CZ-CG1 3.61Å; I395-C417 PolarHBondContact N-O 2.68Å; I395-V418 HydrophobicContact CB-CB 4.41Å; I395-V418 HydrophobicContact CB-CG1 4.29Å; I395-V418 HydrophobicContact CB-CG2 4.12Å; I395-V418 HydrophobicContact CD1-CG2 3.78Å; I395-V418 HydrophobicContact CG2-CG1 4.05Å; I395-E419 WeakPolarHBondContact O-CB 3.46Å; I395-E419 PolarHBondContact O-N 3Å
396	S	98.6	Very high	97.6	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	103.6	174	177.1	0	0	0	0	111.2	R398 Q399 A400 T401 E419	S396-R398 VanDerWaalsContact C-N 3.33Å; S396-Q399 PolarHBondContact O-N 2.76Å; S396-Q399 VanDerWaalsContact OG-CB 3.27Å; S396-Q399 WeakPolarHBondContact OG-CB 3.47Å; S396-Q399 WeakPolarHBondContact OG-CG 3.27Å; S396-Q399 PolarHBondContact OG-N 3.02Å; S396-A400 PolarHBondContact O-N 3.2Å; S396-T401 PolarHBondContact N-O 3.41Å; S396-T401 PolarHBondContact O-N 3.23Å; S396-E419 VanDerWaalsContact CB-OE2 3.25Å; S396-E419 WeakPolarHBondContact CB-OE2 3.45Å; S396-E419 PolarHBondContact OG-OE2 2.87Å
397	V	98.8	Very high	97.3	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-36.7	173.9	172.7	0	0	0	0	111.1	Y283 L321 L324 H325 Q328 Q399 A400	Y283-V397 HydrophobicContact CE2-CG1 3.88Å; L321-V397 HydrophobicContact CB-CG2 4.01Å; L321-V397 HydrophobicContact CD2-CB 4.38Å; L321-V397 HydrophobicContact CD2-CG2 3.97Å; L321-V397 VanDerWaalsContact O-CG2 3.31Å; L321-V397 WeakPolarHBondContact O-CG2 3.4Å; L324-V397 HydrophobicContact CB-CG1 4.25Å; L324-V397 HydrophobicContact CB-CG2 4.01Å; L324-V397 HydrophobicContact CD1-CG1 4.24Å; H325-V397 HydrophobicContact CB-CG2 4.25Å; Q328-V397 PolarHBondContact NE2-O 2.88Å; Q328-V397 PolarHBondContact OE1-O 3.3Å; V397-Q399 VanDerWaalsContact C-N 3.28Å; V397-Q399 PolarHBondContact O-N 3.35Å; V397-A400 PolarHBondContact O-N 3.46Å; V397-A400 VanDerWaalsContact O-N 3.13Å
398	R	98.2	Very high	97.1	Very high	82 Å²	82	51.6 Å²	51.6	31%	0.309	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-41	175	-179.2	-177.3	62	97.5	-1.3	111.6	S337 Q339 S396 E419 P421	S337-R398 WeakPolarHBondContact CB-O 3.32Å; S337-R398 PolarHBondContact OG-O 2.96Å; Q339-R398 HydrophobicContact CB-CG 4.27Å; S396-R398 VanDerWaalsContact C-N 3.33Å; R398-E419 IonicContact CZ-OE1 3.91Å; R398-E419 IonicContact CZ-OE2 3.72Å; R398-E419 IonicContact NE-OE1 3.15Å; R398-E419 IonicContact NE-OE2 2.63Å; R398-E419 PolarHBondContact NE-OE2 3.18Å; R398-E419 IonicContact NH2-OE1 3.84Å; R398-E419 PolarHBondContact NH2-OE1 2.99Å; R398-E419 IonicContact NH2-OE2 2.97Å; R398-P421 HydrophobicContact CB-CB 4.24Å; R398-P421 VanDerWaalsContact CD-O 3.3Å; R398-P421 WeakPolarHBondContact CD-O 3.49Å
399	Q	97.8	Very high	96.7	Very high	53 Å²	53	59.3 Å²	59.3	25%	0.248	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-6.6	178.9	-64.5	-68.3	-34.4	0	0	113.6	K340 S396 V397 T401 L403	K340-Q399 PolarHBondContact NZ-O 3.16Å; S396-Q399 PolarHBondContact O-N 2.76Å; S396-Q399 VanDerWaalsContact OG-CB 3.27Å; S396-Q399 WeakPolarHBondContact OG-CB 3.47Å; S396-Q399 WeakPolarHBondContact OG-CG 3.27Å; S396-Q399 PolarHBondContact OG-N 3.02Å; V397-Q399 VanDerWaalsContact C-N 3.28Å; V397-Q399 PolarHBondContact O-N 3.35Å; Q399-T401 HydrophobicContact CB-CG2 3.66Å; Q399-T401 PolarHBondContact O-N 3.26Å; Q399-L403 HydrophobicContact CG-CD2 4.43Å
400	A	98.3	Very high	96.4	Very high	26 Å²	26	61.2 Å²	61.2	22%	0.215	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	41	-170	0	0	0	0	0	112	Q328 S396 V397	Q328-A400 HydrophobicContact CB-CB 3.96Å; Q328-A400 HydrophobicContact CG-CB 4.09Å; S396-A400 PolarHBondContact O-N 3.2Å; V397-A400 PolarHBondContact O-N 3.46Å; V397-A400 VanDerWaalsContact O-N 3.13Å
401	T	97.9	Very high	96.3	Very high	60 Å²	60	62.1 Å²	62.1	37%	0.368	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	176.2	-174.6	-159.3	0	0	0	0	112.1	S396 Q399 L403	S396-T401 PolarHBondContact N-O 3.41Å; S396-T401 PolarHBondContact O-N 3.23Å; Q399-T401 HydrophobicContact CB-CG2 3.66Å; Q399-T401 PolarHBondContact O-N 3.26Å; T401-L403 HydrophobicContact CG2-CD2 3.97Å
402	I	97.9	Very high	96.1	Very high	53 Å²	53	63.2 Å²	63.2	27%	0.272	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	126.5	172.8	-56.8	171.1	0	0	0	108.9	Y383 F388 Q393	Y383-I402 WeakPolarHBondContact OH-CD1 3.28Å; F388-I402 HydrophobicContact CE2-CG2 4.45Å; Q393-I402 HydrophobicContact CB-CG2 3.47Å; Q393-I402 VanDerWaalsContact CB-CG2 3.47Å; Q393-I402 HydrophobicContact CG-CG2 3.49Å; Q393-I402 VanDerWaalsContact CG-CG2 3.49Å
403	L	97.4	Very high	95.9	Very high	51 Å²	51	63.8 Å²	63.8	27%	0.267	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	148.6	171.9	-55.9	177.7	0	0	0	110.3	V394 Q399 T401	V394-L403 HydrophobicContact CB-CB 4.21Å; V394-L403 PolarHBondContact N-O 3.4Å; V394-L403 PolarHBondContact O-N 2.96Å; Q399-L403 HydrophobicContact CG-CD2 4.43Å; T401-L403 HydrophobicContact CG2-CD2 3.97Å
404	P	97	Very high	95.8	Very high	100 Å²	100	64.6 Å²	64.6	65%	0.649	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	137.3	172.7	28.7	-33.8	0	0	0	110.3	T406	P404-T406 PolarHBondContact O-N 3.42Å
405	K	96.1	Very high	95.8	Very high	51 Å²	51	67.5 Å²	67.5	22%	0.222	34%	0.339	C	S	.	.			trans	-72.7	111.9	173.8	-169.4	-171.5	-171.5	169	0	109.7	D391 K392 V394 W411 K414 C417	D391-K405 WeakPolarHBondContact O-CD 3.26Å; K392-K405 VanDerWaalsContact C-CB 3.45Å; K392-K405 WeakPolarHBondContact O-CB 3.13Å; K392-K405 PolarHBondContact O-N 2.85Å; V394-K405 HydrophobicContact CG2-CB 4.03Å; V394-K405 HydrophobicContact CG2-CG 4.24Å; K405-W411 WeakPolarHBondContact CE-O 3.48Å; K405-W411 HydrophobicContact CG-CB 3.95Å; K405-K414 PolarHBondContact NZ-O 2.89Å; K405-C417 VanDerWaalsContact CE-SG 3.58Å
406	T	94.1	Very high	95.8	Very high	73 Å²	73	67.6 Å²	67.6	45%	0.448	34%	0.339	S	S	.	.			trans	-89.5	164.3	179	66.7	0	0	0	0	111.4	P404 S408	P404-T406 PolarHBondContact O-N 3.42Å; T406-S408 PolarHBondContact O-N 2.88Å
407	N	91.5	Very high	95.8	Very high	145 Å²	145	67.6 Å²	67.6	78%	0.775	34%	0.34	S	S	*	.	S	Bend	trans	-78.9	26.4	174.3	-163.7	25.8	0	0	0	113.1
408	S	92.1	Very high	95.8	Very high	43 Å²	43	67.6 Å²	67.6	30%	0.301	34%	0.339	S	S	.	.	S	Bend	trans	-70.1	160.1	178.7	83	0	0	0	0	110.9	T406 E410 W411 R412	T406-S408 PolarHBondContact O-N 2.88Å; S408-E410 PolarHBondContact O-N 3.48Å; S408-E410 VanDerWaalsContact O-N 3.14Å; S408-E410 PolarHBondContact OG-N 2.96Å; S408-W411 PolarHBondContact O-N 2.93Å; S408-R412 WeakPolarHBondContact O-CB 3.38Å; S408-R412 VanDerWaalsContact O-CG 3.23Å; S408-R412 WeakPolarHBondContact O-CG 3.43Å; S408-R412 PolarHBondContact O-N 3.09Å
409	K	90.4	Very high	95.8	Very high	172 Å²	172	64.4 Å²	64.4	75%	0.748	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-31	176.2	-174.6	-178.3	175.4	-175.4	0	112.9
410	E	91.3	Very high	95.8	Very high	74 Å²	74	62.2 Å²	62.2	35%	0.346	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-41.7	-177.4	-164.6	59.2	-140.1	0	0	112.2	S408 K414 S425 N426	S408-E410 PolarHBondContact O-N 3.48Å; S408-E410 VanDerWaalsContact O-N 3.14Å; S408-E410 PolarHBondContact OG-N 2.96Å; E410-K414 WeakPolarHBondContact O-CG 3.42Å; E410-S425 WeakPolarHBondContact OE1-CA 3.35Å; E410-N426 PolarHBondContact OE1-N 2.73Å
411	W	95.4	Very high	95.8	Very high	30 Å²	30	61 Å²	61	11%	0.114	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-25.3	-170.7	-47.4	121.5	0	0	0	114.1	V394 K405 S408 N413 K414 C417 E419 G424 N426	V394-W411 HydrophobicContact CG1-CD2 4.45Å; V394-W411 HydrophobicContact CG1-CE3 4.16Å; V394-W411 HydrophobicContact CG1-CH2 3.83Å; V394-W411 HydrophobicContact CG1-CZ2 4.12Å; V394-W411 HydrophobicContact CG1-CZ3 3.83Å; V394-W411 HydrophobicContact CG2-CD2 4.09Å; V394-W411 HydrophobicContact CG2-CE3 4.21Å; V394-W411 HydrophobicContact CG2-CG 4.35Å; K405-W411 WeakPolarHBondContact CE-O 3.48Å; K405-W411 HydrophobicContact CG-CB 3.95Å; S408-W411 PolarHBondContact O-N 2.93Å; W411-N413 PolarHBondContact O-N 3.43Å; W411-K414 WeakPolarHBondContact O-CB 3.44Å; W411-K414 PolarHBondContact O-N 3.24Å; W411-C417 HydrophobicContact CE3-CB 3.73Å; W411-C417 HydrophobicContact CZ3-CB 4.09Å; W411-E419 HydrophobicContact CH2-CB 4.15Å; W411-E419 HydrophobicContact CH2-CG 4.42Å; W411-G424 WeakPolarHBondContact CZ2-O 3.4Å; W411-N426 HydrophobicContact CE3-CB 4.14Å; W411-N426 HydrophobicContact CH2-CB 4.44Å; W411-N426 HydrophobicContact CZ3-CB 3.62Å
412	R	92.2	Very high	95.7	Very high	125 Å²	125	59.7 Å²	59.7	47%	0.472	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	138.5	-179.4	73.1	-173.9	-175	175.9	2.5	110.5	S408 K414	S408-R412 WeakPolarHBondContact O-CB 3.38Å; S408-R412 VanDerWaalsContact O-CG 3.23Å; S408-R412 WeakPolarHBondContact O-CG 3.43Å; S408-R412 PolarHBondContact O-N 3.09Å; R412-K414 PolarHBondContact O-N 3.5Å; R412-K414 VanDerWaalsContact O-N 3.11Å
413	N	93.1	Very high	95.6	Very high	149 Å²	149	62.9 Å²	62.9	80%	0.797	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	17.3	178.7	-50.5	-26.9	0	0	0	115.1	W411	W411-N413 PolarHBondContact O-N 3.43Å
414	K	96.7	Very high	95.4	Very high	68 Å²	68	61.6 Å²	61.6	30%	0.296	31%	0.31	S	S	.	.			trans	-95.6	135.2	173.2	-55.6	-53.6	-179.7	-177.2	0	110.4	K405 E410 W411 R412	K405-K414 PolarHBondContact NZ-O 2.89Å; E410-K414 WeakPolarHBondContact O-CG 3.42Å; W411-K414 WeakPolarHBondContact O-CB 3.44Å; W411-K414 PolarHBondContact O-N 3.24Å; R412-K414 PolarHBondContact O-N 3.5Å; R412-K414 VanDerWaalsContact O-N 3.11Å
415	F	97.9	Very high	95.3	Very high	62 Å²	62	57.6 Å²	57.6	27%	0.272	29%	0.285	S	S	.	.	S	Bend	trans	-76	-41.3	178.6	-67.9	-65	0	0	0	112.4	H432 K434 F437	F415-H432 WeakPolarHBondContact CE2-O 3.46Å; F415-K434 HydrophobicContact CE1-CB 4.5Å; F415-K434 HydrophobicContact CE2-CB 4.43Å; F415-K434 HydrophobicContact CZ-CB 3.9Å; F415-K434 HydrophobicContact CZ-CG 4.42Å; F415-F437 HydrophobicContact CB-CB 3.91Å; F415-F437 HydrophobicContact CB-CD1 4.01Å; F415-F437 HydrophobicContact CB-CD2 3.62Å; F415-F437 HydrophobicContact CB-CE1 4.39Å; F415-F437 HydrophobicContact CB-CE2 4.03Å; F415-F437 HydrophobicContact CB-CG 3.58Å; F415-F437 HydrophobicContact CB-CZ 4.37Å; F415-F437 HydrophobicContact CD1-CB 4.31Å; F415-F437 AromaticContact CD1-CD1 3.59Å; F415-F437 HydrophobicContact CD1-CD1 3.59Å; F415-F437 AromaticContact CD1-CE1 3.97Å; F415-F437 HydrophobicContact CD1-CE1 3.97Å; F415-F437 AromaticContact CD1-CG 3.97Å; F415-F437 HydrophobicContact CD1-CG 3.97Å; F415-F437 HydrophobicContact CD2-CB 4.15Å; F415-F437 HydrophobicContact CE1-CD1 4.29Å; F415-F437 HydrophobicContact CG-CB 3.87Å; F415-F437 AromaticContact CG-CD1 3.93Å; F415-F437 HydrophobicContact CG-CD1 3.93Å; F415-F437 HydrophobicContact CG-CD2 4.36Å; F415-F437 AromaticContact CG-CG 3.81Å; F415-F437 HydrophobicContact CG-CG 3.81Å
416	I	98.4	Very high	95.4	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	27%	0.274	C	S	.	.	S	Bend	trans	-120.8	132.3	178.9	-58.7	-178	0	0	0	108.2	L314 W390 V418 N426 A428 V431 F437 I440	L314-I416 HydrophobicContact CD2-CD1 3.78Å; W390-I416 HydrophobicContact CE3-CB 4.3Å; W390-I416 HydrophobicContact CE3-CD1 4.34Å; W390-I416 HydrophobicContact CE3-CG1 3.81Å; W390-I416 HydrophobicContact CE3-CG2 4.02Å; W390-I416 HydrophobicContact CZ3-CB 4.42Å; W390-I416 HydrophobicContact CZ3-CD1 4.13Å; W390-I416 HydrophobicContact CZ3-CG1 4.03Å; W390-I416 HydrophobicContact CZ3-CG2 3.74Å; I416-V418 HydrophobicContact CG2-CG2 4.1Å; I416-N426 PolarHBondContact O-ND2 3.08Å; I416-N426 PolarHBondContact O-OD1 3.12Å; I416-A428 HydrophobicContact CB-CB 3.87Å; I416-A428 HydrophobicContact CG2-CB 3.56Å; I416-V431 HydrophobicContact CD1-CB 4.36Å; I416-V431 HydrophobicContact CD1-CG1 4.06Å; I416-V431 HydrophobicContact CD1-CG2 4.29Å; I416-V431 HydrophobicContact CG1-CG1 4.39Å; I416-F437 HydrophobicContact CD1-CD2 4.09Å; I416-F437 HydrophobicContact CD1-CE2 4.43Å; I416-F437 HydrophobicContact CG1-CD2 3.81Å; I416-F437 HydrophobicContact CG1-CE2 3.87Å; I416-I440 HydrophobicContact CD1-CD1 4.15Å; I416-I440 HydrophobicContact CD1-CG2 4.31Å
417	C	98.5	Very high	95.6	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.007	26%	0.259	C	S	.	.			trans	-124.4	110.7	-177.8	-58.8	0	0	0	0	110	V394 I395 K405 W411	V394-C417 HydrophobicContact CB-CB 4.12Å; V394-C417 HydrophobicContact CG1-CB 4.06Å; V394-C417 HydrophobicContact CG2-CB 3.72Å; I395-C417 PolarHBondContact N-O 2.68Å; K405-C417 VanDerWaalsContact CE-SG 3.58Å; W411-C417 HydrophobicContact CE3-CB 3.73Å; W411-C417 HydrophobicContact CZ3-CB 4.09Å
418	V	98.7	Very high	95.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-130.1	116.6	177.1	-179.6	0	0	0	0	107.4	T318 L321 M322 I395 I416 N426 V427 A428	T318-V418 HydrophobicContact CG2-CB 4.4Å; T318-V418 HydrophobicContact CG2-CG2 3.92Å; L321-V418 HydrophobicContact CB-CG1 3.78Å; L321-V418 HydrophobicContact CD1-CG1 3.79Å; L321-V418 HydrophobicContact CG-CG1 4.46Å; M322-V418 HydrophobicContact CG-CG2 4.28Å; I395-V418 HydrophobicContact CB-CB 4.41Å; I395-V418 HydrophobicContact CB-CG1 4.29Å; I395-V418 HydrophobicContact CB-CG2 4.12Å; I395-V418 HydrophobicContact CD1-CG2 3.78Å; I395-V418 HydrophobicContact CG2-CG1 4.05Å; I416-V418 HydrophobicContact CG2-CG2 4.1Å; V418-N426 PolarHBondContact N-OD1 2.97Å; V418-N426 VanDerWaalsContact N-OD1 3.14Å; V418-N426 WeakPolarHBondContact O-CA 3.23Å; V418-N426 PolarHBondContact O-OD1 2.96Å; V418-V427 HydrophobicContact CB-CG2 3.57Å; V418-V427 HydrophobicContact CG1-CG2 3.47Å; V418-V427 VanDerWaalsContact CG1-CG2 3.47Å; V418-V427 PolarHBondContact O-N 2.82Å; V418-A428 HydrophobicContact CG2-CB 4.32Å
419	E	98.5	Very high	96	Very high	16 Å²	16	48.8 Å²	48.8	8%	0.075	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-69.8	128.2	-179.9	-170	-166.4	-139.7	0	0	110.8	V394 I395 S396 R398 W411	V394-E419 HydrophobicContact CG1-CB 4.33Å; I395-E419 WeakPolarHBondContact O-CB 3.46Å; I395-E419 PolarHBondContact O-N 3Å; S396-E419 VanDerWaalsContact CB-OE2 3.25Å; S396-E419 WeakPolarHBondContact CB-OE2 3.45Å; S396-E419 PolarHBondContact OG-OE2 2.87Å; R398-E419 IonicContact CZ-OE1 3.91Å; R398-E419 IonicContact CZ-OE2 3.72Å; R398-E419 IonicContact NE-OE1 3.15Å; R398-E419 IonicContact NE-OE2 2.63Å; R398-E419 PolarHBondContact NE-OE2 3.18Å; R398-E419 IonicContact NH2-OE1 3.84Å; R398-E419 PolarHBondContact NH2-OE1 2.99Å; R398-E419 IonicContact NH2-OE2 2.97Å; W411-E419 HydrophobicContact CH2-CB 4.15Å; W411-E419 HydrophobicContact CH2-CG 4.42Å
420	E	97.9	Very high	96.2	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.028	20%	0.2	C	C	.	.			trans	-67.9	120.7	167.3	-153.8	-56.5	121.4	0	0	108.9	N276 Y317 F422 E423 G424 S425 V427	N276-E420 VanDerWaalsContact CG-OE1 3.26Å; N276-E420 PolarHBondContact ND2-OE1 3.08Å; N276-E420 PolarHBondContact OD1-OE1 3.36Å; N276-E420 VanDerWaalsContact OD1-OE1 3.08Å; Y317-E420 PolarHBondContact OH-OE1 2.82Å; E420-F422 VanDerWaalsContact C-N 3.25Å; E420-F422 PolarHBondContact O-N 3.46Å; E420-F422 VanDerWaalsContact O-N 3.12Å; E420-F422 WeakPolarHBondContact OE2-CA 2.97Å; E420-F422 PolarHBondContact OE2-N 2.58Å; E420-E423 HydrophobicContact CG-CB 4.46Å; E420-E423 PolarHBondContact OE2-N 3.03Å; E420-G424 WeakPolarHBondContact O-CA 3.45Å; E420-G424 PolarHBondContact O-N 2.94Å; E420-S425 VanDerWaalsContact CB-O 3.28Å; E420-S425 WeakPolarHBondContact CB-O 3.39Å; E420-S425 PolarHBondContact N-O 3.02Å; E420-V427 HydrophobicContact CB-CG1 3.74Å; E420-V427 HydrophobicContact CG-CG1 3.71Å
421	P	98.1	Very high	96.5	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.6	-169	-22.8	34.6	0	0	0	116.8	L279 Y317 L321 Q339 R398	L279-P421 HydrophobicContact CD2-CB 3.78Å; L279-P421 HydrophobicContact CD2-CG 4.18Å; Y317-P421 WeakPolarHBondContact OH-CD 3.49Å; L321-P421 HydrophobicContact CD1-CG 4.38Å; L321-P421 HydrophobicContact CD2-CG 4.15Å; Q339-P421 PolarHBondContact NE2-O 2.9Å; Q339-P421 VanDerWaalsContact OE1-CB 3.25Å; R398-P421 HydrophobicContact CB-CB 4.24Å; R398-P421 VanDerWaalsContact CD-O 3.3Å; R398-P421 WeakPolarHBondContact CD-O 3.49Å
422	F	97.3	Very high	96.5	Very high	33 Å²	33	42.4 Å²	42.4	15%	0.145	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-38.9	176.9	-67.7	-89.9	0	0	0	112.7	V272 R275 N276 L279 F346 P348 E420	V272-F422 HydrophobicContact CG1-CB 4.46Å; R275-F422 HydrophobicContact CB-CD1 4.26Å; R275-F422 HydrophobicContact CB-CD2 4.11Å; R275-F422 HydrophobicContact CB-CE1 3.96Å; R275-F422 HydrophobicContact CB-CE2 3.79Å; R275-F422 HydrophobicContact CB-CG 4.33Å; R275-F422 HydrophobicContact CB-CZ 3.73Å; N276-F422 WeakPolarHBondContact OD1-CD2 3.13Å; N276-F422 VanDerWaalsContact OD1-CE2 3.3Å; N276-F422 WeakPolarHBondContact OD1-CE2 3.17Å; L279-F422 HydrophobicContact CB-CE2 4.07Å; L279-F422 HydrophobicContact CB-CZ 4.2Å; L279-F422 HydrophobicContact CD2-CE2 3.64Å; L279-F422 HydrophobicContact CD2-CZ 4.1Å; L279-F422 HydrophobicContact CG-CE2 4.48Å; F346-F422 HydrophobicContact CB-CE1 4.4Å; F346-F422 HydrophobicContact CB-CZ 4.45Å; F346-F422 WeakPolarHBondContact O-CE1 3.19Å; P348-F422 HydrophobicContact CB-CD1 4.33Å; P348-F422 HydrophobicContact CG-CD1 4.11Å; E420-F422 VanDerWaalsContact C-N 3.25Å; E420-F422 PolarHBondContact O-N 3.46Å; E420-F422 VanDerWaalsContact O-N 3.12Å; E420-F422 WeakPolarHBondContact OE2-CA 2.97Å; E420-F422 PolarHBondContact OE2-N 2.58Å
423	E	94.7	Very high	96.8	Very high	119 Å²	119	40.4 Å²	40.4	56%	0.556	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-16.3	-174.4	-64.4	-174.2	153	0	0	114.1	V272 E420 S425	V272-E423 HydrophobicContact CG1-CG 4.12Å; V272-E423 HydrophobicContact CG2-CG 3.8Å; V272-E423 VanDerWaalsContact CG2-OE1 3.31Å; V272-E423 WeakPolarHBondContact CG2-OE1 3.22Å; E420-E423 HydrophobicContact CG-CB 4.46Å; E420-E423 PolarHBondContact OE2-N 3.03Å; E423-S425 PolarHBondContact O-N 2.83Å
424	G	94.3	Very high	97.1	Very high	25 Å²	25	39.4 Å²	39.4	26%	0.258	19%	0.19	S	C	.	.			trans	71.8	6.6	-177.3	0	0	0	0	0	115.2	W411 E420	W411-G424 WeakPolarHBondContact CZ2-O 3.4Å; E420-G424 WeakPolarHBondContact O-CA 3.45Å; E420-G424 PolarHBondContact O-N 2.94Å
425	S	95.2	Very high	97.1	Very high	16 Å²	16	42.5 Å²	42.5	11%	0.112	21%	0.208	C	C	.	.			trans	-75.8	166.5	177.7	74	0	0	0	0	112.6	E410 E420 E423	E410-S425 WeakPolarHBondContact OE1-CA 3.35Å; E420-S425 VanDerWaalsContact CB-O 3.28Å; E420-S425 WeakPolarHBondContact CB-O 3.39Å; E420-S425 PolarHBondContact N-O 3.02Å; E423-S425 PolarHBondContact O-N 2.83Å
426	N	97.4	Very high	97.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-86.7	112.1	176.1	-172.1	3.5	0	0	0	111.7	E410 W411 I416 V418 A428	E410-N426 PolarHBondContact OE1-N 2.73Å; W411-N426 HydrophobicContact CE3-CB 4.14Å; W411-N426 HydrophobicContact CH2-CB 4.44Å; W411-N426 HydrophobicContact CZ3-CB 3.62Å; I416-N426 PolarHBondContact O-ND2 3.08Å; I416-N426 PolarHBondContact O-OD1 3.12Å; V418-N426 PolarHBondContact N-OD1 2.97Å; V418-N426 VanDerWaalsContact N-OD1 3.14Å; V418-N426 WeakPolarHBondContact O-CA 3.23Å; V418-N426 PolarHBondContact O-OD1 2.96Å; N426-A428 VanDerWaalsContact C-N 3.28Å; N426-A428 PolarHBondContact O-N 3.38Å; N426-A428 WeakPolarHBondContact OD1-CB 3.21Å; N426-A428 PolarHBondContact OD1-N 2.85Å
427	V	97.3	Very high	97.2	Very high	21 Å²	21	43.6 Å²	43.6	13%	0.127	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.9	177.7	-55.8	0	0	0	0	113	Y317 T318 L321 V418 E420 R429	Y317-V427 HydrophobicContact CD1-CB 4.2Å; Y317-V427 HydrophobicContact CD1-CG1 3.96Å; Y317-V427 HydrophobicContact CE1-CB 4.34Å; Y317-V427 HydrophobicContact CE1-CG1 3.62Å; T318-V427 HydrophobicContact CG2-CG2 4.22Å; T318-V427 PolarHBondContact OG1-O 3.34Å; L321-V427 HydrophobicContact CD1-CG1 4.42Å; L321-V427 HydrophobicContact CD1-CG2 3.98Å; V418-V427 HydrophobicContact CB-CG2 3.57Å; V418-V427 HydrophobicContact CG1-CG2 3.47Å; V418-V427 VanDerWaalsContact CG1-CG2 3.47Å; V418-V427 PolarHBondContact O-N 2.82Å; E420-V427 HydrophobicContact CB-CG1 3.74Å; E420-V427 HydrophobicContact CG-CG1 3.71Å; V427-R429 VanDerWaalsContact C-N 3.31Å; V427-R429 PolarHBondContact O-N 3.42Å
428	A	97.4	Very high	97.2	Very high	2 Å²	2	46.6 Å²	46.6	2%	0.017	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	14.4	179.8	0	0	0	0	0	113.4	T318 I416 V418 N426 A430 V431	T318-A428 HydrophobicContact CG2-CB 3.76Å; I416-A428 HydrophobicContact CB-CB 3.87Å; I416-A428 HydrophobicContact CG2-CB 3.56Å; V418-A428 HydrophobicContact CG2-CB 4.32Å; N426-A428 VanDerWaalsContact C-N 3.28Å; N426-A428 PolarHBondContact O-N 3.38Å; N426-A428 WeakPolarHBondContact OD1-CB 3.21Å; N426-A428 PolarHBondContact OD1-N 2.85Å; A428-A430 PolarHBondContact O-N 3.25Å; A428-V431 PolarHBondContact O-N 3.03Å
429	R	94.6	Very high	97.2	Very high	103 Å²	103	48.9 Å²	48.9	39%	0.389	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.8	-175.7	62.7	-177.9	168.6	-135.5	-3.6	115.8	V427 V431	V427-R429 VanDerWaalsContact C-N 3.31Å; V427-R429 PolarHBondContact O-N 3.42Å; R429-V431 VanDerWaalsContact C-N 3.25Å; R429-V431 PolarHBondContact O-N 2.66Å
430	A	95.8	Very high	97.2	Very high	23 Å²	23	48.1 Å²	48.1	19%	0.19	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-25.4	176.9	0	0	0	0	0	112.5	A309 G312 A428 H432	A309-A430 HydrophobicContact CB-CB 3.9Å; A309-A430 WeakPolarHBondContact O-CB 3.36Å; G312-A430 CarbonylContact C-O 3.38Å; G312-A430 VanDerWaalsContact CA-O 3.26Å; G312-A430 WeakPolarHBondContact CA-O 3.38Å; A428-A430 PolarHBondContact O-N 3.25Å; A430-H432 VanDerWaalsContact C-N 3.3Å; A430-H432 PolarHBondContact O-CD2 3.09Å; A430-H432 PolarHBondContact O-N 3.18Å
431	V	97.8	Very high	97.2	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.018	26%	0.262	C	S	.	.			trans	-83	79.1	176.3	-170.3	0	0	0	0	109.2	L314 I416 A428 R429 F437 I440	L314-V431 HydrophobicContact CD2-CG2 4.04Å; I416-V431 HydrophobicContact CD1-CB 4.36Å; I416-V431 HydrophobicContact CD1-CG1 4.06Å; I416-V431 HydrophobicContact CD1-CG2 4.29Å; I416-V431 HydrophobicContact CG1-CG1 4.39Å; A428-V431 PolarHBondContact O-N 3.03Å; R429-V431 VanDerWaalsContact C-N 3.25Å; R429-V431 PolarHBondContact O-N 2.66Å; V431-F437 HydrophobicContact CG1-CB 4.08Å; V431-I440 HydrophobicContact CG1-CD1 3.79Å; V431-I440 HydrophobicContact CG2-CD1 3.86Å
432	H	95.8	Very high	97.3	Very high	117 Å²	117	57.9 Å²	57.9	54%	0.542	29%	0.286	S	S	.	.			trans	-113.4	-5.4	-178	63.6	71.8	0	0	0	113.7	F415 A430	F415-H432 WeakPolarHBondContact CE2-O 3.46Å; A430-H432 VanDerWaalsContact C-N 3.3Å; A430-H432 PolarHBondContact O-CD2 3.09Å; A430-H432 PolarHBondContact O-N 3.18Å
433	E	97.9	Very high	97.3	Very high	82 Å²	82	56.8 Å²	56.8	38%	0.383	28%	0.283	S	S	.	.			trans	-101	133.2	175.9	-72	173.3	-119.2	0	0	110.8	I435 K436 F437	E433-I435 VanDerWaalsContact C-N 3.27Å; E433-I435 PolarHBondContact O-N 2.8Å; E433-K436 HydrophobicContact CB-CB 4.22Å; E433-K436 HydrophobicContact CB-CG 3.82Å; E433-K436 PolarHBondContact O-N 3.05Å; E433-F437 PolarHBondContact O-N 2.84Å
434	K	98.2	Very high	97.5	Very high	128 Å²	128	51.1 Å²	51.1	56%	0.557	26%	0.256	S	S	*	.	H	α-helix	trans	-58.4	-40.4	178.7	-173.1	179.6	-177.8	-63.4	0	111.9	F415 K436 F437 D438	F415-K434 HydrophobicContact CE1-CB 4.5Å; F415-K434 HydrophobicContact CE2-CB 4.43Å; F415-K434 HydrophobicContact CZ-CB 3.9Å; F415-K434 HydrophobicContact CZ-CG 4.42Å; K434-K436 VanDerWaalsContact C-N 3.33Å; K434-K436 PolarHBondContact O-N 3.39Å; K434-F437 PolarHBondContact O-N 2.9Å; K434-D438 IonicContact NZ-OD1 2.76Å; K434-D438 IonicContact NZ-OD2 3.76Å; K434-D438 PolarHBondContact NZ-OD2 2.97Å; K434-D438 WeakPolarHBondContact O-CB 3.47Å; K434-D438 VanDerWaalsContact O-CG 3.28Å; K434-D438 PolarHBondContact O-N 3.46Å
435	I	98.4	Very high	97.7	Very high	133 Å²	133	51.9 Å²	51.9	68%	0.682	26%	0.258	S	S	*	.	H	α-helix	trans	-60.8	-43	179.5	-62.1	172.6	0	0	0	110.9	E433 A439	E433-I435 VanDerWaalsContact C-N 3.27Å; E433-I435 PolarHBondContact O-N 2.8Å; I435-A439 WeakPolarHBondContact O-CB 3.45Å; I435-A439 PolarHBondContact O-N 3.25Å
436	K	98.4	Very high	97.9	Very high	66 Å²	66	55.2 Å²	55.2	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-66.6	-43.1	177.4	-59.8	-65.7	-176.5	169.4	0	111.4	K311 G312 T313 E433 K434 A439 I440	K311-K436 VanDerWaalsContact O-CE 3.26Å; K311-K436 WeakPolarHBondContact O-CE 3.42Å; K311-K436 PolarHBondContact O-NZ 3.33Å; G312-K436 WeakPolarHBondContact O-CB 3.31Å; T313-K436 HydrophobicContact CG2-CD 4.04Å; E433-K436 HydrophobicContact CB-CB 4.22Å; E433-K436 HydrophobicContact CB-CG 3.82Å; E433-K436 PolarHBondContact O-N 3.05Å; K434-K436 VanDerWaalsContact C-N 3.33Å; K434-K436 PolarHBondContact O-N 3.39Å; K436-A439 PolarHBondContact O-N 3.42Å; K436-I440 WeakPolarHBondContact O-CD1 3.39Å; K436-I440 VanDerWaalsContact O-CG1 3.28Å; K436-I440 WeakPolarHBondContact O-CG1 3.21Å; K436-I440 PolarHBondContact O-N 2.71Å
437	F	98.7	Very high	98	Very high	21 Å²	21	55.3 Å²	55.3	9%	0.092	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-46.6	175.7	173.6	-121.9	0	0	0	112.5	W390 F415 I416 V431 E433 K434 A439 I440 K441	W390-F437 HydrophobicContact CB-CE2 3.94Å; W390-F437 HydrophobicContact CB-CZ 3.72Å; W390-F437 HydrophobicContact CD2-CE2 4.2Å; W390-F437 AromaticContact CG-CE2 3.92Å; W390-F437 HydrophobicContact CG-CE2 3.92Å; W390-F437 AromaticContact CG-CZ 3.97Å; W390-F437 HydrophobicContact CG-CZ 3.97Å; F415-F437 HydrophobicContact CB-CB 3.91Å; F415-F437 HydrophobicContact CB-CD1 4.01Å; F415-F437 HydrophobicContact CB-CD2 3.62Å; F415-F437 HydrophobicContact CB-CE1 4.39Å; F415-F437 HydrophobicContact CB-CE2 4.03Å; F415-F437 HydrophobicContact CB-CG 3.58Å; F415-F437 HydrophobicContact CB-CZ 4.37Å; F415-F437 HydrophobicContact CD1-CB 4.31Å; F415-F437 AromaticContact CD1-CD1 3.59Å; F415-F437 HydrophobicContact CD1-CD1 3.59Å; F415-F437 AromaticContact CD1-CE1 3.97Å; F415-F437 HydrophobicContact CD1-CE1 3.97Å; F415-F437 AromaticContact CD1-CG 3.97Å; F415-F437 HydrophobicContact CD1-CG 3.97Å; F415-F437 HydrophobicContact CD2-CB 4.15Å; F415-F437 HydrophobicContact CE1-CD1 4.29Å; F415-F437 HydrophobicContact CG-CB 3.87Å; F415-F437 AromaticContact CG-CD1 3.93Å; F415-F437 HydrophobicContact CG-CD1 3.93Å; F415-F437 HydrophobicContact CG-CD2 4.36Å; F415-F437 AromaticContact CG-CG 3.81Å; F415-F437 HydrophobicContact CG-CG 3.81Å; I416-F437 HydrophobicContact CD1-CD2 4.09Å; I416-F437 HydrophobicContact CD1-CE2 4.43Å; I416-F437 HydrophobicContact CG1-CD2 3.81Å; I416-F437 HydrophobicContact CG1-CE2 3.87Å; V431-F437 HydrophobicContact CG1-CB 4.08Å; E433-F437 PolarHBondContact O-N 2.84Å; K434-F437 PolarHBondContact O-N 2.9Å; F437-A439 VanDerWaalsContact C-N 3.34Å; F437-A439 PolarHBondContact O-N 2.76Å; F437-I440 PolarHBondContact O-N 3.11Å; F437-K441 HydrophobicContact CD1-CD 4.36Å; F437-K441 HydrophobicContact CD2-CD 4.44Å; F437-K441 HydrophobicContact CD2-CG 4.42Å; F437-K441 HydrophobicContact CE1-CD 3.74Å; F437-K441 HydrophobicContact CE2-CD 3.83Å; F437-K441 HydrophobicContact CE2-CG 4.03Å; F437-K441 HydrophobicContact CZ-CD 3.46Å; F437-K441 VanDerWaalsContact CZ-CD 3.46Å; F437-K441 HydrophobicContact CZ-CG 4.19Å; F437-K441 PolarHBondContact O-N 3.14Å
438	D	98.6	Very high	98	Very high	63 Å²	63	56.6 Å²	56.6	34%	0.337	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-40.3	178.2	-69.2	-23.5	0	0	0	111.2	K434 I440 K441 K442	K434-D438 IonicContact NZ-OD1 2.76Å; K434-D438 IonicContact NZ-OD2 3.76Å; K434-D438 PolarHBondContact NZ-OD2 2.97Å; K434-D438 WeakPolarHBondContact O-CB 3.47Å; K434-D438 VanDerWaalsContact O-CG 3.28Å; K434-D438 PolarHBondContact O-N 3.46Å; D438-I440 PolarHBondContact O-N 3.27Å; D438-K441 PolarHBondContact O-N 2.9Å; D438-K442 VanDerWaalsContact O-CB 3.3Å; D438-K442 WeakPolarHBondContact O-CB 3.26Å; D438-K442 PolarHBondContact O-N 3.26Å
439	A	98.6	Very high	98.1	Very high	49 Å²	49	61.4 Å²	61.4	41%	0.405	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-41.9	174.8	0	0	0	0	0	112.4	I435 K436 F437 K442 C443	I435-A439 WeakPolarHBondContact O-CB 3.45Å; I435-A439 PolarHBondContact O-N 3.25Å; K436-A439 PolarHBondContact O-N 3.42Å; F437-A439 VanDerWaalsContact C-N 3.34Å; F437-A439 PolarHBondContact O-N 2.76Å; A439-K442 PolarHBondContact O-N 3.06Å; A439-C443 WeakPolarHBondContact O-CB 3.34Å; A439-C443 PolarHBondContact O-N 3.33Å
440	I	98.8	Very high	98.3	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-51.2	174.6	-69.6	159.8	0	0	0	110.1	I306 L314 I416 V431 K436 F437 D438 K442 C443 F444	I306-I440 HydrophobicContact CB-CG1 4.07Å; I306-I440 HydrophobicContact CG2-CG1 3.95Å; L314-I440 HydrophobicContact CD1-CG2 4.06Å; L314-I440 HydrophobicContact CD2-CD1 4.45Å; L314-I440 HydrophobicContact CG-CD1 4.01Å; I416-I440 HydrophobicContact CD1-CD1 4.15Å; I416-I440 HydrophobicContact CD1-CG2 4.31Å; V431-I440 HydrophobicContact CG1-CD1 3.79Å; V431-I440 HydrophobicContact CG2-CD1 3.86Å; K436-I440 WeakPolarHBondContact O-CD1 3.39Å; K436-I440 VanDerWaalsContact O-CG1 3.28Å; K436-I440 WeakPolarHBondContact O-CG1 3.21Å; K436-I440 PolarHBondContact O-N 2.71Å; F437-I440 PolarHBondContact O-N 3.11Å; D438-I440 PolarHBondContact O-N 3.27Å; I440-K442 VanDerWaalsContact C-N 3.34Å; I440-K442 PolarHBondContact O-N 3.33Å; I440-C443 PolarHBondContact O-N 3.37Å; I440-F444 HydrophobicContact CG2-CD2 3.87Å; I440-F444 HydrophobicContact CG2-CE2 3.78Å; I440-F444 VanDerWaalsContact O-CD2 3.32Å; I440-F444 WeakPolarHBondContact O-CD2 3.18Å; I440-F444 PolarHBondContact O-N 2.64Å
441	K	98.7	Very high	98.4	Very high	90 Å²	90	58.8 Å²	58.8	39%	0.391	29%	0.286	S	S	.	.	H	α-helix	trans	-58.9	-44.6	178.9	-75.5	-176.9	61.8	-178.1	0	112.4	F437 D438 F444 S445	F437-K441 HydrophobicContact CD1-CD 4.36Å; F437-K441 HydrophobicContact CD2-CD 4.44Å; F437-K441 HydrophobicContact CD2-CG 4.42Å; F437-K441 HydrophobicContact CE1-CD 3.74Å; F437-K441 HydrophobicContact CE2-CD 3.83Å; F437-K441 HydrophobicContact CE2-CG 4.03Å; F437-K441 HydrophobicContact CZ-CD 3.46Å; F437-K441 VanDerWaalsContact CZ-CD 3.46Å; F437-K441 HydrophobicContact CZ-CG 4.19Å; F437-K441 PolarHBondContact O-N 3.14Å; D438-K441 PolarHBondContact O-N 2.9Å; K441-F444 PolarHBondContact O-N 3.13Å; K441-S445 PolarHBondContact O-N 3.13Å; K441-S445 VanDerWaalsContact O-N 3.08Å
442	K	98.7	Very high	98.4	Very high	121 Å²	121	61.8 Å²	61.8	53%	0.526	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-47.4	177.4	-177.6	176.9	173.5	-179.2	0	110.9	D438 A439 I440 F444 S445 E446	D438-K442 VanDerWaalsContact O-CB 3.3Å; D438-K442 WeakPolarHBondContact O-CB 3.26Å; D438-K442 PolarHBondContact O-N 3.26Å; A439-K442 PolarHBondContact O-N 3.06Å; I440-K442 VanDerWaalsContact C-N 3.34Å; I440-K442 PolarHBondContact O-N 3.33Å; K442-F444 PolarHBondContact O-N 2.96Å; K442-S445 PolarHBondContact O-N 3.11Å; K442-S445 VanDerWaalsContact O-N 3.12Å; K442-E446 WeakPolarHBondContact CE-OE1 3.24Å; K442-E446 WeakPolarHBondContact CE-OE2 3.36Å; K442-E446 HydrophobicContact CG-CG 4.21Å; K442-E446 IonicContact NZ-OE1 3.04Å; K442-E446 WeakPolarHBondContact O-CG 3.32Å; K442-E446 PolarHBondContact O-N 3.45Å
443	C	98.7	Very high	98.4	Very high	10 Å²	10	63.3 Å²	63.3	7%	0.068	31%	0.31	C	S	.	.	H	α-helix	trans	-58.8	-44.2	178.2	-178.9	0	0	0	0	112.6	W300 H304 I306 A439 I440 S445 S447	W300-C443 WeakPolarHBondContact CZ2-SG 3.24Å; H304-C443 WeakPolarHBondContact CB-SG 3.48Å; H304-C443 VanDerWaalsContact CG-SG 3.5Å; I306-C443 HydrophobicContact CD1-CB 4.08Å; A439-C443 WeakPolarHBondContact O-CB 3.34Å; A439-C443 PolarHBondContact O-N 3.33Å; I440-C443 PolarHBondContact O-N 3.37Å; C443-S445 PolarHBondContact O-N 3.24Å; C443-S447 WeakPolarHBondContact O-CB 3.47Å; C443-S447 PolarHBondContact O-N 3.46Å; C443-S447 PolarHBondContact O-OG 3.49Å
444	F	98.8	Very high	98.4	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59	-45.7	173.5	-87.3	-77.6	0	0	0	112.1	W300 M322 F380 L381 Y384 A385 I440 K441 K442 Y448	W300-F444 AromaticContact CH2-CD1 3.69Å; W300-F444 HydrophobicContact CH2-CD1 3.69Å; W300-F444 HydrophobicContact CH2-CD2 4.09Å; W300-F444 AromaticContact CH2-CE1 3.58Å; W300-F444 HydrophobicContact CH2-CE1 3.58Å; W300-F444 AromaticContact CH2-CE2 3.98Å; W300-F444 HydrophobicContact CH2-CE2 3.98Å; W300-F444 AromaticContact CH2-CG 3.95Å; W300-F444 HydrophobicContact CH2-CG 3.95Å; W300-F444 AromaticContact CH2-CZ 3.72Å; W300-F444 HydrophobicContact CH2-CZ 3.72Å; W300-F444 HydrophobicContact CZ2-CD1 4.41Å; W300-F444 HydrophobicContact CZ3-CD1 4.45Å; W300-F444 AromaticContact CZ3-CE1 3.9Å; W300-F444 HydrophobicContact CZ3-CE1 3.9Å; W300-F444 HydrophobicContact CZ3-CE2 4.45Å; W300-F444 AromaticContact CZ3-CZ 3.89Å; W300-F444 HydrophobicContact CZ3-CZ 3.89Å; M322-F444 HydrophobicContact CE-CE2 4.1Å; M322-F444 HydrophobicContact CE-CZ 3.65Å; F380-F444 HydrophobicContact CD1-CE1 4.4Å; F380-F444 AromaticContact CE1-CE1 3.62Å; F380-F444 HydrophobicContact CE1-CE1 3.62Å; F380-F444 HydrophobicContact CE1-CZ 4.29Å; F380-F444 AromaticContact CZ-CE1 3.84Å; F380-F444 HydrophobicContact CZ-CE1 3.84Å; F380-F444 HydrophobicContact CZ-CZ 4.16Å; L381-F444 HydrophobicContact CD2-CD1 3.96Å; L381-F444 HydrophobicContact CD2-CE1 4.29Å; Y384-F444 HydrophobicContact CD2-CE1 4.09Å; Y384-F444 HydrophobicContact CD2-CZ 4.44Å; Y384-F444 HydrophobicContact CG-CE1 4.17Å; Y384-F444 HydrophobicContact CG-CZ 4.42Å; A385-F444 HydrophobicContact CB-CB 4.29Å; I440-F444 HydrophobicContact CG2-CD2 3.87Å; I440-F444 HydrophobicContact CG2-CE2 3.78Å; I440-F444 VanDerWaalsContact O-CD2 3.32Å; I440-F444 WeakPolarHBondContact O-CD2 3.18Å; I440-F444 PolarHBondContact O-N 2.64Å; K441-F444 PolarHBondContact O-N 3.13Å; K442-F444 PolarHBondContact O-N 2.96Å; F444-Y448 VanDerWaalsContact O-CB 3.31Å; F444-Y448 WeakPolarHBondContact O-CB 3.26Å; F444-Y448 PolarHBondContact O-N 2.81Å
445	S	98.7	Very high	98.4	Very high	42 Å²	42	65.5 Å²	65.5	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-50	-178.9	-171.6	0	0	0	0	112.7	K441 K442 C443 Y448 Q449	K441-S445 PolarHBondContact O-N 3.13Å; K441-S445 VanDerWaalsContact O-N 3.08Å; K442-S445 PolarHBondContact O-N 3.11Å; K442-S445 VanDerWaalsContact O-N 3.12Å; C443-S445 PolarHBondContact O-N 3.24Å; S445-Y448 PolarHBondContact O-N 3.01Å; S445-Q449 WeakPolarHBondContact O-CG 3.41Å; S445-Q449 PolarHBondContact O-N 2.8Å
446	E	98.6	Very high	98.3	Very high	86 Å²	86	60.7 Å²	60.7	40%	0.402	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-43.5	-179.9	-70.3	178.3	152.7	0	0	110.9	K442 Y448 Q449 M450	K442-E446 WeakPolarHBondContact CE-OE1 3.24Å; K442-E446 WeakPolarHBondContact CE-OE2 3.36Å; K442-E446 HydrophobicContact CG-CG 4.21Å; K442-E446 IonicContact NZ-OE1 3.04Å; K442-E446 WeakPolarHBondContact O-CG 3.32Å; K442-E446 PolarHBondContact O-N 3.45Å; E446-Y448 VanDerWaalsContact C-N 3.34Å; E446-Y448 PolarHBondContact O-N 2.69Å; E446-Q449 PolarHBondContact O-N 3.1Å; E446-M450 WeakPolarHBondContact O-CB 3.48Å; E446-M450 VanDerWaalsContact O-CG 3.27Å; E446-M450 WeakPolarHBondContact O-CG 3.44Å; E446-M450 PolarHBondContact O-N 3.48Å
447	S	98.7	Very high	98.3	Very high	2 Å²	2	57.5 Å²	57.5	1%	0.014	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-39.2	177.7	-58.1	0	0	0	0	111.9	W300 C443 L451	W300-S447 PolarHBondContact NE1-OG 3.15Å; C443-S447 WeakPolarHBondContact O-CB 3.47Å; C443-S447 PolarHBondContact O-N 3.46Å; C443-S447 PolarHBondContact O-OG 3.49Å; S447-L451 WeakPolarHBondContact O-CB 3.4Å; S447-L451 PolarHBondContact O-N 2.99Å
448	Y	98.7	Very high	98.2	Very high	47 Å²	47	59.1 Å²	59.1	18%	0.184	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-48.5	173.6	168.7	-115.1	0	0	0	111.4	L378 R382 F444 S445 E446 N452	L378-Y448 HydrophobicContact CD1-CD2 3.8Å; L378-Y448 HydrophobicContact CD1-CE2 3.84Å; L378-Y448 HydrophobicContact CG-CD2 4.45Å; L378-Y448 HydrophobicContact CG-CE2 4.21Å; R382-Y448 HydrophobicContact CB-CD2 3.64Å; R382-Y448 HydrophobicContact CB-CE2 3.46Å; R382-Y448 VanDerWaalsContact CB-CE2 3.46Å; R382-Y448 HydrophobicContact CB-CG 4.32Å; R382-Y448 WeakPolarHBondContact CD-OH 3.27Å; R382-Y448 HydrophobicContact CG-CD2 4.24Å; R382-Y448 HydrophobicContact CG-CE1 4.2Å; R382-Y448 HydrophobicContact CG-CE2 3.67Å; F444-Y448 VanDerWaalsContact O-CB 3.31Å; F444-Y448 WeakPolarHBondContact O-CB 3.26Å; F444-Y448 PolarHBondContact O-N 2.81Å; S445-Y448 PolarHBondContact O-N 3.01Å; E446-Y448 VanDerWaalsContact C-N 3.34Å; E446-Y448 PolarHBondContact O-N 2.69Å; Y448-N452 HydrophobicContact CE2-CB 4.24Å; Y448-N452 WeakPolarHBondContact O-CB 3.23Å; Y448-N452 PolarHBondContact O-N 3.28Å
449	Q	98.5	Very high	98.1	Very high	103 Å²	103	57 Å²	57	48%	0.481	28%	0.282	S	S	.	.	H	α-helix	trans	-60.2	-53	180	-73	172.1	-13.8	0	0	111.3	S445 E446 L451 N452 E453	S445-Q449 WeakPolarHBondContact O-CG 3.41Å; S445-Q449 PolarHBondContact O-N 2.8Å; E446-Q449 PolarHBondContact O-N 3.1Å; Q449-L451 PolarHBondContact O-N 3.07Å; Q449-N452 PolarHBondContact O-N 2.77Å; Q449-E453 WeakPolarHBondContact O-CG 3.46Å; Q449-E453 PolarHBondContact O-N 2.8Å
450	M	98.3	Very high	98	Very high	71 Å²	71	54.8 Å²	54.8	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-59.8	-46	-179.4	-67.9	175.5	75.6	0	0	112.3	E446 N452 E453 R454 S459 I460	E446-M450 WeakPolarHBondContact O-CB 3.48Å; E446-M450 VanDerWaalsContact O-CG 3.27Å; E446-M450 WeakPolarHBondContact O-CG 3.44Å; E446-M450 PolarHBondContact O-N 3.48Å; M450-N452 VanDerWaalsContact C-N 3.34Å; M450-E453 PolarHBondContact O-N 3.33Å; M450-R454 WeakPolarHBondContact O-CB 3.4Å; M450-R454 PolarHBondContact O-N 3.22Å; M450-S459 WeakPolarHBondContact CE-O 3.49Å; M450-I460 HydrophobicContact CB-CG2 4.06Å
451	L	98	Very high	97.9	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70.2	-33.8	179.8	-165.9	71.4	0	0	0	111.5	L151 L377 L378 L381 S447 Q449 K455 D456 I460	L151-L451 HydrophobicContact CD1-CD1 3.82Å; L151-L451 HydrophobicContact CD2-CD1 4.05Å; L151-L451 HydrophobicContact CD2-CD2 3.99Å; L151-L451 HydrophobicContact CD2-CG 4.05Å; L377-L451 HydrophobicContact CD2-CD2 3.86Å; L377-L451 HydrophobicContact CG-CD2 3.91Å; L378-L451 HydrophobicContact CD1-CB 4.36Å; L378-L451 HydrophobicContact CD1-CD2 4.36Å; L378-L451 HydrophobicContact CD1-CG 4.42Å; L381-L451 HydrophobicContact CD1-CB 4.42Å; L381-L451 HydrophobicContact CD1-CD2 3.73Å; S447-L451 WeakPolarHBondContact O-CB 3.4Å; S447-L451 PolarHBondContact O-N 2.99Å; Q449-L451 PolarHBondContact O-N 3.07Å; L451-K455 WeakPolarHBondContact O-CA 3.46Å; L451-K455 PolarHBondContact O-N 3.32Å; L451-D456 WeakPolarHBondContact CD1-O 3.45Å; L451-I460 HydrophobicContact CB-CD1 4.45Å; L451-I460 HydrophobicContact CB-CG2 4.17Å; L451-I460 HydrophobicContact CD1-CD1 4.01Å; L451-I460 HydrophobicContact CD1-CG1 4.19Å; L451-I460 HydrophobicContact CD2-CD1 3.98Å; L451-I460 HydrophobicContact CG-CD1 4.38Å
452	N	97.6	Very high	97.7	Very high	66 Å²	66	52.5 Å²	52.5	35%	0.353	26%	0.261	S	S	.	.	H	α-helix	trans	-65.3	-40.3	176.5	-171.1	54.1	0	0	0	112.1	L378 Y448 Q449 M450 K455	L378-N452 HydrophobicContact CD1-CB 3.88Å; Y448-N452 HydrophobicContact CE2-CB 4.24Å; Y448-N452 WeakPolarHBondContact O-CB 3.23Å; Y448-N452 PolarHBondContact O-N 3.28Å; Q449-N452 PolarHBondContact O-N 2.77Å; M450-N452 VanDerWaalsContact C-N 3.34Å; N452-K455 WeakPolarHBondContact O-CE 3.26Å; N452-K455 PolarHBondContact O-NZ 2.75Å; N452-K455 PolarHBondContact OD1-NZ 3.31Å
453	E	97.6	Very high	97.4	Very high	149 Å²	149	47.5 Å²	47.5	70%	0.696	24%	0.24	S	C	*	.	H	α-helix	trans	-73.7	-47.3	178.9	-71.4	170.1	-170.8	0	0	112.2	Q449 M450	Q449-E453 WeakPolarHBondContact O-CG 3.46Å; Q449-E453 PolarHBondContact O-N 2.8Å; M450-E453 PolarHBondContact O-N 3.33Å
454	R	97.3	Very high	97.2	Very high	170 Å²	170	57.2 Å²	57.2	64%	0.642	28%	0.275	S	S	*	.	H	α-helix	trans	-93	-24.2	-168.8	-61.8	-171.9	-179.7	-149.7	2.1	114.5	M450 D456	M450-R454 WeakPolarHBondContact O-CB 3.4Å; M450-R454 PolarHBondContact O-N 3.22Å; R454-D456 HydrophobicContact CB-CB 4.36Å; R454-D456 PolarHBondContact O-N 3.25Å; R454-D456 VanDerWaalsContact O-N 3.12Å
455	K	96.9	Very high	96.9	Very high	87 Å²	87	60 Å²	60	38%	0.378	30%	0.299	S	S	.	.			trans	47.2	39.2	-174	-52.8	-63.5	-177.8	-165.5	0	112.8	L451 N452	L451-K455 WeakPolarHBondContact O-CA 3.46Å; L451-K455 PolarHBondContact O-N 3.32Å; N452-K455 WeakPolarHBondContact O-CE 3.26Å; N452-K455 PolarHBondContact O-NZ 2.75Å; N452-K455 PolarHBondContact OD1-NZ 3.31Å
456	D	97.3	Very high	96.6	Very high	31 Å²	31	58.9 Å²	58.9	17%	0.166	29%	0.289	C	S	.	.			trans	-135.1	123.1	-175.9	-169.5	-35	0	0	0	108.9	K150 Q154 L451 R454 A458 S459	K150-D456 IonicContact NZ-OD2 3.71Å; K150-D456 PolarHBondContact NZ-OD2 2.85Å; Q154-D456 PolarHBondContact NE2-OD1 3.15Å; Q154-D456 PolarHBondContact OE1-OD1 2.9Å; L451-D456 WeakPolarHBondContact CD1-O 3.45Å; R454-D456 HydrophobicContact CB-CB 4.36Å; R454-D456 PolarHBondContact O-N 3.25Å; R454-D456 VanDerWaalsContact O-N 3.12Å; D456-A458 PolarHBondContact O-N 3.47Å; D456-A458 VanDerWaalsContact OD1-CB 3.25Å; D456-A458 WeakPolarHBondContact OD1-CB 3.1Å; D456-A458 PolarHBondContact OD1-N 3.14Å; D456-S459 VanDerWaalsContact O-CB 3.26Å; D456-S459 WeakPolarHBondContact O-CB 3.25Å; D456-S459 PolarHBondContact O-N 3.41Å; D456-S459 PolarHBondContact O-OG 3.48Å
457	L	97.6	Very high	96.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61.6	-30.5	-178.5	-171.9	56.6	0	0	0	112.1	L151 Q154 M155 L158 V296 L377 S459 I460 L461 L463	L151-L457 HydrophobicContact CD1-CB 3.76Å; L151-L457 HydrophobicContact CD1-CD1 4.25Å; Q154-L457 HydrophobicContact CB-CB 3.86Å; Q154-L457 HydrophobicContact CB-CD2 4.15Å; M155-L457 HydrophobicContact CG-CD2 4.05Å; L158-L457 HydrophobicContact CD2-CD2 4.21Å; V296-L457 HydrophobicContact CG1-CD1 3.75Å; V296-L457 HydrophobicContact CG1-CD2 4.41Å; V296-L457 HydrophobicContact CG2-CD2 4.47Å; L377-L457 HydrophobicContact CD2-CD1 4.01Å; L457-S459 PolarHBondContact O-N 2.85Å; L457-S459 VanDerWaalsContact O-N 3.14Å; L457-I460 HydrophobicContact CD1-CD1 4.29Å; L457-I460 HydrophobicContact CD1-CG1 4.2Å; L457-I460 PolarHBondContact O-N 3.4Å; L457-L461 HydrophobicContact CG-CD2 4.42Å; L457-L461 PolarHBondContact O-N 2.99Å; L457-L463 HydrophobicContact CB-CD2 4.4Å; L457-L463 HydrophobicContact CD2-CD1 4.03Å
458	A	96.8	Very high	96.1	Very high	55 Å²	55	61.2 Å²	61.2	46%	0.455	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-65	-15.5	177.3	0	0	0	0	0	112.9	D456 I460 L461 L463	D456-A458 PolarHBondContact O-N 3.47Å; D456-A458 VanDerWaalsContact OD1-CB 3.25Å; D456-A458 WeakPolarHBondContact OD1-CB 3.1Å; D456-A458 PolarHBondContact OD1-N 3.14Å; A458-I460 VanDerWaalsContact C-N 3.32Å; A458-L461 CarbonylContact C-O 3.58Å; A458-L461 WeakPolarHBondContact CA-O 3.33Å; A458-L463 HydrophobicContact CB-CB 4.37Å
459	S	97.1	Very high	95.7	Very high	18 Å²	18	63.8 Å²	63.8	13%	0.126	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-69.8	-26.9	175.3	67.5	0	0	0	0	113.7	M450 D456 L457	M450-S459 WeakPolarHBondContact CE-O 3.49Å; D456-S459 VanDerWaalsContact O-CB 3.26Å; D456-S459 WeakPolarHBondContact O-CB 3.25Å; D456-S459 PolarHBondContact O-N 3.41Å; D456-S459 PolarHBondContact O-OG 3.48Å; L457-S459 PolarHBondContact O-N 2.85Å; L457-S459 VanDerWaalsContact O-N 3.14Å
460	I	97.2	Very high	95.1	Very high	2 Å²	2	59 Å²	59	1%	0.01	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	1.3	-175.8	63.7	167.6	0	0	0	112.7	H304 L381 M450 L451 L457 A458	H304-I460 PolarHBondContact NE2-O 3.38Å; L381-I460 HydrophobicContact CD1-CD1 4.04Å; M450-I460 HydrophobicContact CB-CG2 4.06Å; L451-I460 HydrophobicContact CB-CD1 4.45Å; L451-I460 HydrophobicContact CB-CG2 4.17Å; L451-I460 HydrophobicContact CD1-CD1 4.01Å; L451-I460 HydrophobicContact CD1-CG1 4.19Å; L451-I460 HydrophobicContact CD2-CD1 3.98Å; L451-I460 HydrophobicContact CG-CD1 4.38Å; L457-I460 HydrophobicContact CD1-CD1 4.29Å; L457-I460 HydrophobicContact CD1-CG1 4.2Å; L457-I460 PolarHBondContact O-N 3.4Å; A458-I460 VanDerWaalsContact C-N 3.32Å
461	L	95.5	Very high	94.5	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.026	29%	0.294	C	S	.	.	S	Bend	trans	-151	141.5	-175.2	-173	68.3	0	0	0	110.5	L158 K299 H303 L457 A458 L463 I466	L158-L461 HydrophobicContact CD2-CD2 3.6Å; K299-L461 HydrophobicContact CB-CD1 4.22Å; K299-L461 HydrophobicContact CB-CD2 4.23Å; H303-L461 HydrophobicContact CB-CD1 3.65Å; L457-L461 HydrophobicContact CG-CD2 4.42Å; L457-L461 PolarHBondContact O-N 2.99Å; A458-L461 CarbonylContact C-O 3.58Å; A458-L461 WeakPolarHBondContact CA-O 3.33Å; L461-L463 PolarHBondContact O-N 3.03Å; L461-I466 HydrophobicContact CD1-CD1 3.35Å; L461-I466 HydrophobicContact CD2-CD1 3.96Å; L461-I466 HydrophobicContact CG-CD1 3.59Å
462	A	94.1	Very high	93.8	Very high	38 Å²	38	62.7 Å²	62.7	31%	0.314	33%	0.328	S	S	.	.			trans	-72.7	62.4	169.5	0	0	0	0	0	112.4	R464 A465 I466	A462-R464 PolarHBondContact O-N 3.28Å; A462-A465 HydrophobicContact CB-CB 4.22Å; A462-A465 PolarHBondContact O-N 3.33Å; A462-I466 WeakPolarHBondContact O-CG1 3.31Å; A462-I466 PolarHBondContact O-N 3.25Å; A462-I466 VanDerWaalsContact O-N 3.08Å
463	L	93.7	Very high	92.6	Very high	15 Å²	15	64.5 Å²	64.5	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-50.6	-54.9	-167.5	179.1	59.6	0	0	0	113.5	Q154 L158 L457 A458 L461 A465 I466 I467	Q154-L463 HydrophobicContact CB-CD2 3.94Å; Q154-L463 HydrophobicContact CG-CD2 4Å; L158-L463 HydrophobicContact CB-CD1 3.88Å; L158-L463 HydrophobicContact CD1-CD1 3.94Å; L158-L463 HydrophobicContact CD2-CD1 4.42Å; L158-L463 HydrophobicContact CG-CD1 4.28Å; L457-L463 HydrophobicContact CB-CD2 4.4Å; L457-L463 HydrophobicContact CD2-CD1 4.03Å; A458-L463 HydrophobicContact CB-CB 4.37Å; L461-L463 PolarHBondContact O-N 3.03Å; L463-A465 PolarHBondContact O-N 3.03Å; L463-I466 PolarHBondContact O-N 3.29Å; L463-I467 HydrophobicContact CD1-CD1 3.74Å; L463-I467 HydrophobicContact CD1-CG1 4.3Å; L463-I467 HydrophobicContact CG-CD1 4.1Å; L463-I467 WeakPolarHBondContact O-CG1 3.27Å; L463-I467 PolarHBondContact O-N 2.96Å
464	R	93.1	Very high	90.7	Very high	214 Å²	214	67.5 Å²	67.5	81%	0.808	34%	0.335	S	S	*	.	H	α-helix	trans	-62.2	-42	-178	-69.5	-176.9	177.5	176.8	-1.3	112.5	A462 I466 I467 N468	A462-R464 PolarHBondContact O-N 3.28Å; R464-I466 VanDerWaalsContact C-N 3.34Å; R464-I466 PolarHBondContact O-N 2.89Å; R464-I467 PolarHBondContact O-N 2.8Å; R464-N468 WeakPolarHBondContact O-CB 3.4Å; R464-N468 PolarHBondContact O-N 3.34Å; R464-N468 PolarHBondContact O-ND2 3.2Å
465	A	93.8	Very high	90.4	Very high	60 Å²	60	62.4 Å²	62.4	50%	0.496	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-43	-179.9	0	0	0	0	0	111.1	A462 L463 N468 E469	A462-A465 HydrophobicContact CB-CB 4.22Å; A462-A465 PolarHBondContact O-N 3.33Å; L463-A465 PolarHBondContact O-N 3.03Å; A465-N468 PolarHBondContact O-N 3Å; A465-E469 WeakPolarHBondContact O-CB 3.24Å; A465-E469 PolarHBondContact O-N 3.26Å
466	I	93.2	Very high	90.1	Very high	18 Å²	18	61.1 Å²	61.1	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-45.2	179.6	-66	170.5	0	0	0	111.3	L158 K299 L461 A462 L463 R464 E469 E470	L158-I466 HydrophobicContact CD1-CB 4.44Å; L158-I466 HydrophobicContact CD1-CG2 3.81Å; K299-I466 HydrophobicContact CD-CG2 3.98Å; L461-I466 HydrophobicContact CD1-CD1 3.35Å; L461-I466 HydrophobicContact CD2-CD1 3.96Å; L461-I466 HydrophobicContact CG-CD1 3.59Å; A462-I466 WeakPolarHBondContact O-CG1 3.31Å; A462-I466 PolarHBondContact O-N 3.25Å; A462-I466 VanDerWaalsContact O-N 3.08Å; L463-I466 PolarHBondContact O-N 3.29Å; R464-I466 VanDerWaalsContact C-N 3.34Å; R464-I466 PolarHBondContact O-N 2.89Å; I466-E469 PolarHBondContact O-N 3.35Å; I466-E470 WeakPolarHBondContact O-CG 3.49Å; I466-E470 PolarHBondContact O-N 3.47Å
467	I	93	Very high	89.7	Confident	30 Å²	30	62.7 Å²	62.7	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-48.2	177.5	-71.4	174.8	0	0	0	110.2	L158 A161 L463 R464 E469 E470 L471	L158-I467 HydrophobicContact CD1-CG1 3.95Å; A161-I467 HydrophobicContact CB-CB 4.38Å; A161-I467 HydrophobicContact CB-CG1 4.05Å; A161-I467 HydrophobicContact CB-CG2 3.93Å; L463-I467 HydrophobicContact CD1-CD1 3.74Å; L463-I467 HydrophobicContact CD1-CG1 4.3Å; L463-I467 HydrophobicContact CG-CD1 4.1Å; L463-I467 WeakPolarHBondContact O-CG1 3.27Å; L463-I467 PolarHBondContact O-N 2.96Å; R464-I467 PolarHBondContact O-N 2.8Å; I467-E469 VanDerWaalsContact C-N 3.33Å; I467-E469 PolarHBondContact O-N 2.8Å; I467-E470 PolarHBondContact O-N 3.14Å; I467-L471 HydrophobicContact CG2-CD1 3.7Å; I467-L471 HydrophobicContact CG2-CG 4.25Å; I467-L471 WeakPolarHBondContact O-CB 3.47Å; I467-L471 VanDerWaalsContact O-CG 3.28Å; I467-L471 WeakPolarHBondContact O-CG 3.49Å; I467-L471 PolarHBondContact O-N 2.64Å
468	N	92.5	Very high	89.2	Confident	106 Å²	106	66.4 Å²	66.4	57%	0.567	34%	0.344	S	S	*	.	H	α-helix	trans	-61.3	-41.5	179.4	-69.8	-10.2	0	0	0	112.1	R464 A465 L471 A472	R464-N468 WeakPolarHBondContact O-CB 3.4Å; R464-N468 PolarHBondContact O-N 3.34Å; R464-N468 PolarHBondContact O-ND2 3.2Å; A465-N468 PolarHBondContact O-N 3Å; N468-L471 PolarHBondContact O-N 3.36Å; N468-A472 WeakPolarHBondContact O-CB 3.47Å; N468-A472 PolarHBondContact O-N 3.1Å
469	E	89.8	Confident	88.7	Confident	102 Å²	102	67.1 Å²	67.1	48%	0.477	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-42	177.6	-170.2	-171.9	167.8	0	0	112.2	A465 I466 I467 R473	A465-E469 WeakPolarHBondContact O-CB 3.24Å; A465-E469 PolarHBondContact O-N 3.26Å; I466-E469 PolarHBondContact O-N 3.35Å; I467-E469 VanDerWaalsContact C-N 3.33Å; I467-E469 PolarHBondContact O-N 2.8Å; E469-R473 WeakPolarHBondContact O-CG 3.34Å; E469-R473 IonicContact OE1-CZ 3.82Å; E469-R473 IonicContact OE1-NE 3.94Å; E469-R473 IonicContact OE1-NH2 3.83Å; E469-R473 PolarHBondContact OE1-NH2 3.4Å
470	E	87.6	Confident	88.2	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.009	35%	0.351	C	S	.	.	H	α-helix	trans	-72.6	-36.2	179.8	-67.5	-72.9	177.7	0	0	112.2	C162 S206 K299 I466 I467 A472 R473	C162-E470 HydrophobicContact CB-CG 4.47Å; S206-E470 VanDerWaalsContact CB-OE1 3.32Å; S206-E470 WeakPolarHBondContact CB-OE1 3.43Å; S206-E470 WeakPolarHBondContact CB-OE2 3.34Å; S206-E470 PolarHBondContact N-OE2 3.08Å; S206-E470 PolarHBondContact OG-OE1 3.36Å; S206-E470 PolarHBondContact OG-OE2 3.39Å; K299-E470 IonicContact NZ-OE1 3.67Å; K299-E470 PolarHBondContact NZ-OE1 2.91Å; I466-E470 WeakPolarHBondContact O-CG 3.49Å; I466-E470 PolarHBondContact O-N 3.47Å; I467-E470 PolarHBondContact O-N 3.14Å; E470-A472 VanDerWaalsContact C-N 3.34Å; E470-R473 PolarHBondContact O-N 2.88Å
471	L	84	Confident	87.5	Confident	62 Å²	62	75.3 Å²	75.3	33%	0.325	38%	0.375	S	S	.	.	H	α-helix	trans	-68.7	-32.8	175.3	-68.8	177.1	0	0	0	112.4	I467 N468 R473 R474	I467-L471 HydrophobicContact CG2-CD1 3.7Å; I467-L471 HydrophobicContact CG2-CG 4.25Å; I467-L471 WeakPolarHBondContact O-CB 3.47Å; I467-L471 VanDerWaalsContact O-CG 3.28Å; I467-L471 WeakPolarHBondContact O-CG 3.49Å; I467-L471 PolarHBondContact O-N 2.64Å; N468-L471 PolarHBondContact O-N 3.36Å; L471-R473 PolarHBondContact O-N 2.98Å; L471-R474 WeakPolarHBondContact O-CB 3.49Å; L471-R474 VanDerWaalsContact O-CG 3.29Å; L471-R474 WeakPolarHBondContact O-CG 3.36Å; L471-R474 PolarHBondContact O-N 3.36Å
472	A	84.4	Confident	86.9	Confident	86 Å²	86	80.7 Å²	80.7	71%	0.711	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-14.7	176.5	0	0	0	0	0	113.7	N468 E470 R474	N468-A472 WeakPolarHBondContact O-CB 3.47Å; N468-A472 PolarHBondContact O-N 3.1Å; E470-A472 VanDerWaalsContact C-N 3.34Å; A472-R474 VanDerWaalsContact C-N 3.29Å
473	R	73.1	Confident	86.3	Confident	105 Å²	105	84.3 Å²	84.3	40%	0.396	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	5.6	177	-67.4	170.8	-175.6	-136.3	7.4	113.4	E469 E470 L471	E469-R473 WeakPolarHBondContact O-CG 3.34Å; E469-R473 IonicContact OE1-CZ 3.82Å; E469-R473 IonicContact OE1-NE 3.94Å; E469-R473 IonicContact OE1-NH2 3.83Å; E469-R473 PolarHBondContact OE1-NH2 3.4Å; E470-R473 PolarHBondContact O-N 2.88Å; L471-R473 PolarHBondContact O-N 2.98Å
474	R	57.6	Low	85.6	Confident	211 Å²	211	90.5 Å²	90.5	80%	0.796	44%	0.439	S	S	*	.			trans	-63.2	0	178.4	-79.7	-179	177.8	-159.4	1.5	112.7	L471 A472	L471-R474 WeakPolarHBondContact O-CB 3.49Å; L471-R474 VanDerWaalsContact O-CG 3.29Å; L471-R474 WeakPolarHBondContact O-CG 3.36Å; L471-R474 PolarHBondContact O-N 3.36Å; A472-R474 VanDerWaalsContact C-N 3.29Å

Retrieved 474 of 474 residues in 305.3 ms (Link to these results)

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