A0A096NDN3_PAPAN Loading...

CCAAT/enhancer-binding protein zeta

Stimulates transcription from the HSP70 promoter.

AlphaFold DB , UniProt , Accession A0A096NDN3, Species PAPAN (Papio anubis, Olive baboon), Gene CEBPZ, Length 1,053 aa.

						>A0A096NDN3_PAPAN|A0A096NDN3|CEBPZ
MAAAKEPLEFHAKRPWRPEEAVEDPDEDDEDDANETENGFSLEEVLRLGGTKQDYLMLATLDENEEVIDGGKKGVIDDLQQGELEAFIQNLNLAKYTKACLIEEDEPAKKENSSKKEVKIPKINNKNTAESQRTSVNKVKNKNKPKPHSDENGSTTPKVKKDKQNIFEFFERQTLLLKPGGKWYDLEYSNEYSLKPQPQDVVSNYKTLAQKLYEHEINLFKSKTNSQKGASSTWMKAIVSSGTLGDRMAAMILLIQDDAVHTLQFVETLVNLVKKKGSKQQCLMALDTFKELLITDLLPDSRKLRIFSQHPFDKLEQLSSGNKDSRDRRLILWYFEHQLKHLVAEFVQVLETLSHDTLVTTKTRALAVAHELLCNKPEEEKALLVQVVNKLGDPQNRIATKASHLLETLLCKHPNMKGVVCGEVERLLFRSNISSKAQYYAICFLNQMALSHEESELANKLITIYFCFFRTCIKKKDIESKMLSALLTGVNRAYPYSQTGDDKVREQIDTLFKVLHMVNFNTSVQALMLLFQVMNSQQTISDRYYTALYRKMLDPGLMMCSKQAMFLNLVYKSLKADIVLRRVKAFVKRLLQVTCQQMPPFICGALYLVSEILKAKPGLRSQLDDHPESDDEEHFIDANDDEDMEKFTDADKETEMVKKLETEETVPESDIETKKPEIASWVHFDNLKGGKQLNKYDPFSRNPLFCGAENTSLWELKKLSVHFHPSVALFAKTILQGNYIQYSGDPLQDFTLMRFLDRFVYRNPKPHKGKENTDSVVMQPKRKHFIKDIRHLPVNSKEFLAKEESQIPVDEVFFHRYYKKVAVKEKQKRDADEESIEDVDDEEFEKLIDTFEDDNCFSSGKDDMDFAGNVKKRTKGAKDNTLDEDSEGSDGELGNLDDDEVSLGSMDDEEFAEIDEDGGTFMDVLDDENESVPELEVHSKVNTKRSKRKGTNDFDFAGSFQGPRKKKRNFNDSSLFVSAEEFGHLLDENMGSKFDNIGMNAMANKDNASLKQLRWEAERDDWLHNRDVKSIIKKKKHFKKRIKTTQKTKKQRK
					

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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	36	Very low	35	Very low	242 Å²	242	157.4 Å²	157.4	100%	1.192	85%	0.853	S	S	*	*				0	156.5	0	-75.2	-176	171.7	0	0	108.2
2	A	34.8	Very low	34.8	Very low	102 Å²	102	151.3 Å²	151.3	84%	0.843	84%	0.84	S	S	*	*			trans	59.1	94.7	-170.3	0	0	0	0	0	112.8
3	A	33.2	Very low	34.9	Very low	102 Å²	102	154.5 Å²	154.5	84%	0.843	84%	0.84	S	S	*	*			cis	82.8	132.7	36	0	0	0	0	0	114.3
4	A	40.1	Very low	34.6	Very low	94 Å²	94	159.9 Å²	159.9	78%	0.777	84%	0.842	S	S	*	*			cis	-166.9	164.5	-15.6	0	0	0	0	0	111.3
5	K	36.5	Very low	35.1	Very low	190 Å²	190	157.6 Å²	157.6	83%	0.826	84%	0.84	S	S	*	*			trans	84.7	92.2	168.1	-57.5	-173	173.7	-171.3	0	119.8
6	E	38	Very low	34.6	Very low	190 Å²	190	163.3 Å²	163.3	89%	0.888	85%	0.846	S	S	*	*				54.1	152.7	109	-71.3	174.3	164	0	0	122.8
7	P	43.3	Very low	34.5	Very low	107 Å²	107	164.1 Å²	164.1	70%	0.695	84%	0.836	S	S	*	*			trans	-135	173.9	-135.3	44.3	-27.9	0	0	0	118.6
8	L	32.6	Very low	34.7	Very low	156 Å²	156	161.3 Å²	161.3	82%	0.817	83%	0.831	S	S	*	*			trans	33.7	131.6	141.1	-63.4	166.1	0	0	0	121.8
9	E	31.8	Very low	34.5	Very low	172 Å²	172	158.3 Å²	158.3	80%	0.804	81%	0.813	S	S	*	*				178.5	-176.2	99.8	-92.7	-137.6	153.4	0	0	115.6
10	F	28.4	Very low	34.2	Very low	184 Å²	184	158.4 Å²	158.4	81%	0.807	81%	0.809	S	S	*	*			trans	-63.6	167.7	-163	-84.7	-103.6	0	0	0	120.2
11	H	30	Very low	33.8	Very low	192 Å²	192	155.9 Å²	155.9	89%	0.889	81%	0.812	S	S	*	*			trans	-120.3	150.7	159.9	-93.4	-72.7	0	0	0	111.9
12	A	33.2	Very low	33.7	Very low	85 Å²	85	150.6 Å²	150.6	70%	0.702	79%	0.794	S	S	*	*			trans	-159.4	149.7	178.7	0	0	0	0	0	116.5
13	K	36	Very low	33.4	Very low	192 Å²	192	154.9 Å²	154.9	84%	0.835	80%	0.796	S	S	*	*			trans	75.9	133.2	149.3	-72.6	169.7	-179.8	174.5	0	123.8
14	R	30.6	Very low	33.3	Very low	231 Å²	231	157 Å²	157	87%	0.872	79%	0.793	S	S	*	*			trans	75.3	167.7	141.9	-76.3	-178.2	174.3	-154.4	-2.2	119.6
15	P	42.3	Very low	33.5	Very low	125 Å²	125	158.6 Å²	158.6	81%	0.812	80%	0.795	S	S	*	*			cis	-125.4	-127	3.1	36.4	-14.6	0	0	0	117.3
16	W	26.9	Very low	33.3	Very low	249 Å²	249	156.6 Å²	156.6	94%	0.943	79%	0.794	S	S	*	*			trans	-135.3	-175.5	-145	-106.5	40.3	0	0	0	116.8
17	R	32.4	Very low	33.1	Very low	176 Å²	176	155.8 Å²	155.8	66%	0.664	79%	0.79	S	S	*	*			trans	-61.1	169.4	178.3	-60.5	-165.8	-177.1	-175.2	-4.1	116.4	E19 E20	R17-E19 WeakPolarHBondContact CD-OE1 3.25Å; R17-E19 IonicContact CZ-OE1 3.65Å; R17-E19 IonicContact NE-OE1 2.75Å; R17-E19 IonicContact NH1-OE1 2.76Å; R17-E19 PolarHBondContact NH1-OE1 2.72Å; R17-E20 IonicContact NH1-OE1 2.72Å; R17-E20 PolarHBondContact NH1-OE1 2.79Å
18	P	38.9	Very low	32.4	Very low	115 Å²	115	157.3 Å²	157.3	75%	0.747	79%	0.792	S	S	*	*				-129.2	165.4	91.4	12.9	10.6	0	0	0	113.7
19	E	29.8	Very low	32.3	Very low	104 Å²	104	157.6 Å²	157.6	49%	0.486	80%	0.795	S	S	.	*			cis	78.3	133.4	40.8	-73.6	69.2	-84.4	0	0	115.1	R17	R17-E19 WeakPolarHBondContact CD-OE1 3.25Å; R17-E19 IonicContact CZ-OE1 3.65Å; R17-E19 IonicContact NE-OE1 2.75Å; R17-E19 IonicContact NH1-OE1 2.76Å; R17-E19 PolarHBondContact NH1-OE1 2.72Å
20	E	28.2	Very low	32.4	Very low	160 Å²	160	157.9 Å²	157.9	75%	0.748	80%	0.796	S	S	*	*			cis	-174.1	149.5	-31.2	-110.8	156.2	-148.4	0	0	108.9	R17	R17-E20 IonicContact NH1-OE1 2.72Å; R17-E20 PolarHBondContact NH1-OE1 2.79Å
21	A	27	Very low	32.4	Very low	105 Å²	105	157.2 Å²	157.2	87%	0.868	80%	0.801	S	S	*	*			trans	-160.1	162.7	-177.2	0	0	0	0	0	115.8
22	V	33.1	Very low	32.6	Very low	132 Å²	132	155.4 Å²	155.4	80%	0.8	80%	0.798	S	S	*	*			trans	-140.7	144.9	-172.7	173.7	0	0	0	0	111.8
23	E	29.3	Very low	32.3	Very low	192 Å²	192	156 Å²	156	90%	0.897	80%	0.802	S	S	*	*			trans	-164.2	129.7	157.1	-118.1	165.1	-144.1	0	0	112
24	D	31.4	Very low	32.3	Very low	146 Å²	146	154.3 Å²	154.3	78%	0.781	80%	0.803	S	S	*	*			trans	-114.3	156.2	168.1	-70.8	-56.9	0	0	0	109.3
25	P	43.2	Very low	32.3	Very low	127 Å²	127	152.6 Å²	152.6	83%	0.825	80%	0.804	S	S	*	*			trans	-142.4	164.4	131.9	37.8	-24.4	0	0	0	115.5
26	D	32.5	Very low	31.9	Very low	148 Å²	148	153.2 Å²	153.2	79%	0.791	81%	0.806	S	S	*	*			trans	-88.5	174.3	-158.9	-43.2	-95.9	0	0	0	118.6
27	E	33.2	Very low	32.5	Very low	173 Å²	173	150.5 Å²	150.5	81%	0.808	80%	0.804	S	S	*	*			trans	81.6	117.2	148.2	-77	169.7	-173.7	0	0	122.7
28	D	30.3	Very low	33.2	Very low	139 Å²	139	149.9 Å²	149.9	74%	0.743	81%	0.814	S	S	*	*			trans	57.3	118.3	136.9	-56.2	-6.8	0	0	0	123.5
29	D	29.5	Very low	33.7	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	81%	0.812	S	S	*	*				-172.8	173.4	98	-110	-26.2	0	0	0	113.3
30	E	33.6	Very low	35.4	Very low	178 Å²	178	150 Å²	150	83%	0.832	82%	0.821	S	S	*	*			trans	-82.7	147.1	-170.8	-52.3	176.8	126.6	0	0	115.5
31	D	28.3	Very low	37.6	Very low	171 Å²	171	144.6 Å²	144.6	91%	0.914	80%	0.801	S	S	*	*				179.2	163	120.3	-112.3	-29.4	0	0	0	115.3
32	D	34.5	Very low	39.6	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	77%	0.771	S	S	*	*			trans	-86.9	128.8	-174.3	-126.8	-26.7	0	0	0	113.9
33	A	28.5	Very low	41.2	Very low	96 Å²	96	143 Å²	143	79%	0.793	77%	0.768	S	S	*	*			trans	-157.8	129.6	162.1	0	0	0	0	0	113.6
34	N	34.2	Very low	43.5	Very low	157 Å²	157	138.5 Å²	138.5	84%	0.84	75%	0.747	S	S	*	*			trans	-98.8	128.9	163.7	-73	-92.4	0	0	0	109
35	E	31.8	Very low	45.7	Very low	195 Å²	195	132.2 Å²	132.2	91%	0.911	71%	0.714	S	S	*	*			trans	-151.1	143.2	158.5	-128.2	162.4	-140.8	0	0	111.1
36	T	34	Very low	47.2	Very low	139 Å²	139	130.5 Å²	130.5	85%	0.853	70%	0.697	S	S	*	*			trans	-109.3	96.4	-169.3	50.2	0	0	0	0	111.6
37	E	39.8	Very low	49.1	Very low	191 Å²	191	134 Å²	134	89%	0.893	70%	0.699	S	S	*	*			trans	-90.8	100.8	170	-68.6	-159.8	136.3	0	0	111.1
38	N	46.2	Very low	51.2	Low	164 Å²	164	133.2 Å²	133.2	88%	0.877	70%	0.7	S	S	*	*			trans	-145.9	57.6	170.9	-103.7	-28	0	0	0	110.5
39	G	50	Low	53.1	Low	68 Å²	68	129.8 Å²	129.8	70%	0.701	70%	0.697	S	S	*	*			trans	-116.2	124.3	177	0	0	0	0	0	111.9
40	F	64.3	Low	55.6	Low	152 Å²	152	123.3 Å²	123.3	67%	0.667	67%	0.668	S	S	*	*			trans	-61.3	141.1	179.5	-70	-78.5	0	0	0	112.6	Y55	F40-Y55 WeakPolarHBondContact O-CE2 3.36Å
41	S	75.4	Confident	58	Low	47 Å²	47	118.1 Å²	118.1	33%	0.329	65%	0.649	S	S	.	*			trans	-83	149.8	176.4	76.9	0	0	0	0	113.1	E43 E44 V45	S41-E43 PolarHBondContact O-N 3.25Å; S41-E44 VanDerWaalsContact CB-OE2 3.31Å; S41-E44 WeakPolarHBondContact CB-OE2 3.23Å; S41-E44 PolarHBondContact N-OE2 3.42Å; S41-E44 PolarHBondContact O-N 3.46Å; S41-E44 VanDerWaalsContact OG-CD 3.31Å; S41-E44 VanDerWaalsContact OG-CG 3.28Å; S41-E44 WeakPolarHBondContact OG-CG 3.38Å; S41-E44 PolarHBondContact OG-N 3.47Å; S41-E44 PolarHBondContact OG-OE2 2.92Å; S41-V45 PolarHBondContact O-N 3.3Å
42	L	67.8	Low	60.1	Low	48 Å²	48	116.5 Å²	116.5	25%	0.251	63%	0.634	S	S	.	*	H	α-helix	trans	-62.2	-29.2	176.3	176.8	60.9	0	0	0	112.5	L46 K52 Y55	L42-L46 HydrophobicContact CD1-CD1 4.23Å; L42-L46 HydrophobicContact CD1-CG 4.35Å; L42-L46 HydrophobicContact CG-CD1 4.09Å; L42-L46 WeakPolarHBondContact O-CB 3.47Å; L42-L46 WeakPolarHBondContact O-CD1 3.34Å; L42-L46 VanDerWaalsContact O-CG 3.23Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.3Å; L42-L46 VanDerWaalsContact O-N 3.17Å; L42-K52 HydrophobicContact CD1-CB 4.43Å; L42-K52 HydrophobicContact CD1-CG 4.19Å; L42-K52 HydrophobicContact CD2-CD 4.44Å; L42-Y55 VanDerWaalsContact CA-CD2 3.49Å; L42-Y55 HydrophobicContact CB-CD2 3.83Å; L42-Y55 HydrophobicContact CB-CE1 4.48Å; L42-Y55 HydrophobicContact CB-CE2 3.74Å; L42-Y55 HydrophobicContact CB-CG 4.23Å; L42-Y55 HydrophobicContact CD1-CD1 3.93Å; L42-Y55 HydrophobicContact CD1-CD2 3.94Å; L42-Y55 HydrophobicContact CD1-CG 3.55Å; L42-Y55 HydrophobicContact CG-CD2 4.49Å; L42-Y55 HydrophobicContact CG-CG 4.44Å; L42-Y55 VanDerWaalsContact N-CE2 3.35Å
43	E	68	Low	61.9	Low	156 Å²	156	116.9 Å²	116.9	73%	0.729	63%	0.631	S	S	*	*	H	α-helix	trans	-75.2	-29.5	178.4	-63.6	-161.6	128.8	0	0	112.7	S41 R47	S41-E43 PolarHBondContact O-N 3.25Å; E43-R47 WeakPolarHBondContact O-CB 3.49Å; E43-R47 WeakPolarHBondContact O-CG 3.37Å; E43-R47 PolarHBondContact O-N 3.21Å
44	E	76.3	Confident	64.2	Low	98 Å²	98	115.4 Å²	115.4	46%	0.458	61%	0.609	S	S	.	*	H	α-helix	trans	-71.5	-44.7	172.5	-73.9	165.3	121.6	0	0	112.1	S41 L46 R47 L48	S41-E44 VanDerWaalsContact CB-OE2 3.31Å; S41-E44 WeakPolarHBondContact CB-OE2 3.23Å; S41-E44 PolarHBondContact N-OE2 3.42Å; S41-E44 PolarHBondContact O-N 3.46Å; S41-E44 VanDerWaalsContact OG-CD 3.31Å; S41-E44 VanDerWaalsContact OG-CG 3.28Å; S41-E44 WeakPolarHBondContact OG-CG 3.38Å; S41-E44 PolarHBondContact OG-N 3.47Å; S41-E44 PolarHBondContact OG-OE2 2.92Å; E44-L46 VanDerWaalsContact C-N 3.26Å; E44-L46 PolarHBondContact O-N 2.98Å; E44-R47 WeakPolarHBondContact O-CB 3.45Å; E44-R47 PolarHBondContact O-N 3.14Å; E44-R47 VanDerWaalsContact O-N 3.07Å; E44-L48 WeakPolarHBondContact O-CG 3.38Å; E44-L48 PolarHBondContact O-N 3.11Å
45	V	77.7	Confident	66.4	Low	13 Å²	13	111.5 Å²	111.5	8%	0.079	58%	0.583	C	S	.	*	H	α-helix	trans	-58.9	-40.7	175.5	177.9	0	0	0	0	110.9	S41 L48 G49 G50 Y55 L58	S41-V45 PolarHBondContact O-N 3.3Å; V45-L48 PolarHBondContact O-N 3.3Å; V45-G49 PolarHBondContact O-N 2.78Å; V45-G50 WeakPolarHBondContact O-CA 3.23Å; V45-G50 PolarHBondContact O-N 2.77Å; V45-Y55 HydrophobicContact CG2-CD2 4.04Å; V45-L58 HydrophobicContact CG2-CD1 4.07Å
46	L	75.1	Confident	68.3	Low	91 Å²	91	107.4 Å²	107.4	48%	0.476	57%	0.567	S	S	.	*	H	α-helix	trans	-68.1	-37.5	174.1	-71.1	168.1	0	0	0	112.9	L42 E44 L48 G49	L42-L46 HydrophobicContact CD1-CD1 4.23Å; L42-L46 HydrophobicContact CD1-CG 4.35Å; L42-L46 HydrophobicContact CG-CD1 4.09Å; L42-L46 WeakPolarHBondContact O-CB 3.47Å; L42-L46 WeakPolarHBondContact O-CD1 3.34Å; L42-L46 VanDerWaalsContact O-CG 3.23Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.3Å; L42-L46 VanDerWaalsContact O-N 3.17Å; E44-L46 VanDerWaalsContact C-N 3.26Å; E44-L46 PolarHBondContact O-N 2.98Å; L46-L48 VanDerWaalsContact C-N 3.34Å; L46-G49 PolarHBondContact O-N 3.22Å
47	R	73.1	Confident	70.2	Confident	223 Å²	223	105.8 Å²	105.8	84%	0.842	55%	0.551	S	S	*	*	H	α-helix	trans	-65.3	-34.9	175.3	-88.1	176.6	148.6	-164.8	-5.3	113.2	E43 E44 G49	E43-R47 WeakPolarHBondContact O-CB 3.49Å; E43-R47 WeakPolarHBondContact O-CG 3.37Å; E43-R47 PolarHBondContact O-N 3.21Å; E44-R47 WeakPolarHBondContact O-CB 3.45Å; E44-R47 PolarHBondContact O-N 3.14Å; E44-R47 VanDerWaalsContact O-N 3.07Å; R47-G49 PolarHBondContact O-N 3.12Å
48	L	76.8	Confident	71.6	Confident	156 Å²	156	99.9 Å²	99.9	82%	0.817	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	2.6	175.5	-65.3	172.3	0	0	0	113	E44 V45 L46	E44-L48 WeakPolarHBondContact O-CG 3.38Å; E44-L48 PolarHBondContact O-N 3.11Å; V45-L48 PolarHBondContact O-N 3.3Å; L46-L48 VanDerWaalsContact C-N 3.34Å
49	G	70.9	Confident	72.4	Confident	67 Å²	67	94.8 Å²	94.8	69%	0.691	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	5.6	176.7	0	0	0	0	0	114.9	V45 L46 R47	V45-G49 PolarHBondContact O-N 2.78Å; L46-G49 PolarHBondContact O-N 3.22Å; R47-G49 PolarHBondContact O-N 3.12Å
50	G	81.8	Confident	72.7	Confident	25 Å²	25	95.2 Å²	95.2	26%	0.258	50%	0.495	S	S	.	.			trans	-71.4	160.3	170	0	0	0	0	0	112.2	V45	V45-G50 WeakPolarHBondContact O-CA 3.23Å; V45-G50 PolarHBondContact O-N 2.77Å
51	T	83.6	Confident	72.3	Confident	69 Å²	69	92.7 Å²	92.7	42%	0.423	49%	0.488	S	S	.	.			trans	-96	168.2	177	78.2	0	0	0	0	111.7	Q53 D54 Y55	T51-Q53 PolarHBondContact O-N 3.38Å; T51-Q53 VanDerWaalsContact O-N 3.16Å; T51-Q53 PolarHBondContact OG1-N 2.97Å; T51-D54 WeakPolarHBondContact CA-OD2 3.37Å; T51-D54 VanDerWaalsContact CB-OD2 3.23Å; T51-D54 WeakPolarHBondContact CB-OD2 3.33Å; T51-D54 WeakPolarHBondContact CG2-OD2 3.16Å; T51-D54 PolarHBondContact N-OD2 3.39Å; T51-D54 PolarHBondContact O-N 3.49Å; T51-D54 PolarHBondContact OG1-N 2.95Å; T51-D54 PolarHBondContact OG1-OD2 3.46Å; T51-Y55 PolarHBondContact O-N 3.01Å
52	K	73.1	Confident	70.9	Confident	138 Å²	138	97.3 Å²	97.3	60%	0.6	51%	0.509	S	S	*	.	H	α-helix	trans	-62.1	-18.8	172.7	-174.4	165.6	-178.7	170.7	0	113.5	L42 L56	L42-K52 HydrophobicContact CD1-CB 4.43Å; L42-K52 HydrophobicContact CD1-CG 4.19Å; L42-K52 HydrophobicContact CD2-CD 4.44Å; K52-L56 PolarHBondContact O-N 3.15Å
53	Q	71.1	Confident	70	Confident	162 Å²	162	102.8 Å²	102.8	76%	0.757	53%	0.533	S	S	*	.	H	α-helix	trans	-78.9	-32.6	173.4	-64.5	-176.1	-97.3	0	0	111.7	T51 L56 M57	T51-Q53 PolarHBondContact O-N 3.38Å; T51-Q53 VanDerWaalsContact O-N 3.16Å; T51-Q53 PolarHBondContact OG1-N 2.97Å; Q53-L56 PolarHBondContact O-N 2.74Å; Q53-M57 PolarHBondContact O-N 3.37Å
54	D	76.5	Confident	68.6	Low	64 Å²	64	100.7 Å²	100.7	34%	0.342	53%	0.527	S	S	.	.	H	α-helix	trans	-71.5	-39.4	177.4	-50.5	-60.4	0	0	0	110.9	T51 L56 M57 L58	T51-D54 WeakPolarHBondContact CA-OD2 3.37Å; T51-D54 VanDerWaalsContact CB-OD2 3.23Å; T51-D54 WeakPolarHBondContact CB-OD2 3.33Å; T51-D54 WeakPolarHBondContact CG2-OD2 3.16Å; T51-D54 PolarHBondContact N-OD2 3.39Å; T51-D54 PolarHBondContact O-N 3.49Å; T51-D54 PolarHBondContact OG1-N 2.95Å; T51-D54 PolarHBondContact OG1-OD2 3.46Å; D54-L56 VanDerWaalsContact C-N 3.3Å; D54-L56 PolarHBondContact O-N 2.88Å; D54-M57 WeakPolarHBondContact O-CB 3.19Å; D54-M57 PolarHBondContact O-N 3.24Å; D54-L58 WeakPolarHBondContact O-CG 3.26Å; D54-L58 PolarHBondContact O-N 3.08Å
55	Y	81.3	Confident	66.9	Low	75 Å²	75	102.9 Å²	102.9	29%	0.294	54%	0.537	S	S	.	.	H	α-helix	trans	-56.1	-44.5	167.3	173.3	-90.3	0	0	0	112	F40 L42 V45 T51 M57 L58 A59	F40-Y55 WeakPolarHBondContact O-CE2 3.36Å; L42-Y55 VanDerWaalsContact CA-CD2 3.49Å; L42-Y55 HydrophobicContact CB-CD2 3.83Å; L42-Y55 HydrophobicContact CB-CE1 4.48Å; L42-Y55 HydrophobicContact CB-CE2 3.74Å; L42-Y55 HydrophobicContact CB-CG 4.23Å; L42-Y55 HydrophobicContact CD1-CD1 3.93Å; L42-Y55 HydrophobicContact CD1-CD2 3.94Å; L42-Y55 HydrophobicContact CD1-CG 3.55Å; L42-Y55 HydrophobicContact CG-CD2 4.49Å; L42-Y55 HydrophobicContact CG-CG 4.44Å; L42-Y55 VanDerWaalsContact N-CE2 3.35Å; V45-Y55 HydrophobicContact CG2-CD2 4.04Å; T51-Y55 PolarHBondContact O-N 3.01Å; Y55-M57 VanDerWaalsContact C-N 3.3Å; Y55-M57 PolarHBondContact O-N 2.89Å; Y55-L58 PolarHBondContact O-N 2.94Å; Y55-A59 WeakPolarHBondContact O-CB 3.23Å; Y55-A59 PolarHBondContact O-N 3.45Å
56	L	72.4	Confident	65	Low	110 Å²	110	110.6 Å²	110.6	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-67.7	-32.4	-179.7	-146.1	94.1	0	0	0	112	K52 Q53 D54 T60	K52-L56 PolarHBondContact O-N 3.15Å; Q53-L56 PolarHBondContact O-N 2.74Å; D54-L56 VanDerWaalsContact C-N 3.3Å; D54-L56 PolarHBondContact O-N 2.88Å; L56-T60 WeakPolarHBondContact O-CG2 3.44Å; L56-T60 PolarHBondContact O-N 3.29Å; L56-T60 PolarHBondContact O-OG1 3.43Å
57	M	73.3	Confident	63.2	Low	105 Å²	105	113 Å²	113	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-67.9	-48.5	173.5	-177.3	-171.3	72.2	0	0	111	Q53 D54 Y55 A59 T60 L61	Q53-M57 PolarHBondContact O-N 3.37Å; D54-M57 WeakPolarHBondContact O-CB 3.19Å; D54-M57 PolarHBondContact O-N 3.24Å; Y55-M57 VanDerWaalsContact C-N 3.3Å; Y55-M57 PolarHBondContact O-N 2.89Å; M57-A59 VanDerWaalsContact C-N 3.34Å; M57-A59 PolarHBondContact O-N 3.27Å; M57-T60 PolarHBondContact O-N 3.21Å; M57-T60 PolarHBondContact O-OG1 2.75Å; M57-L61 PolarHBondContact O-N 3.38Å
58	L	68.9	Low	61.4	Low	67 Å²	67	109.1 Å²	109.1	35%	0.351	59%	0.585	S	S	.	*	H	α-helix	trans	-56.9	-47.2	177.4	-70.5	166.5	0	0	0	111.2	V45 D54 Y55 T60 L61	V45-L58 HydrophobicContact CG2-CD1 4.07Å; D54-L58 WeakPolarHBondContact O-CG 3.26Å; D54-L58 PolarHBondContact O-N 3.08Å; Y55-L58 PolarHBondContact O-N 2.94Å; L58-T60 PolarHBondContact O-N 3.02Å; L58-L61 HydrophobicContact CD2-CD1 4.32Å; L58-L61 WeakPolarHBondContact O-CB 3.24Å; L58-L61 PolarHBondContact O-N 2.93Å
59	A	63.8	Low	59.2	Low	56 Å²	56	109.4 Å²	109.4	46%	0.463	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.8	-7.7	175.8	0	0	0	0	0	114.9	Y55 M57	Y55-A59 WeakPolarHBondContact O-CB 3.23Å; Y55-A59 PolarHBondContact O-N 3.45Å; M57-A59 VanDerWaalsContact C-N 3.34Å; M57-A59 PolarHBondContact O-N 3.27Å
60	T	56.3	Low	57.6	Low	78 Å²	78	109.8 Å²	109.8	48%	0.479	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.4	3.6	171.8	56	0	0	0	0	113.6	L56 M57 L58 N64	L56-T60 WeakPolarHBondContact O-CG2 3.44Å; L56-T60 PolarHBondContact O-N 3.29Å; L56-T60 PolarHBondContact O-OG1 3.43Å; M57-T60 PolarHBondContact O-N 3.21Å; M57-T60 PolarHBondContact O-OG1 2.75Å; L58-T60 PolarHBondContact O-N 3.02Å; T60-N64 PolarHBondContact O-ND2 2.77Å
61	L	54.5	Low	55.3	Low	99 Å²	99	111.8 Å²	111.8	52%	0.518	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	-30.5	175.4	-71	173.7	0	0	0	112.6	M57 L58 E63 N64	M57-L61 PolarHBondContact O-N 3.38Å; L58-L61 HydrophobicContact CD2-CD1 4.32Å; L58-L61 WeakPolarHBondContact O-CB 3.24Å; L58-L61 PolarHBondContact O-N 2.93Å; L61-E63 PolarHBondContact O-N 3.14Å; L61-N64 WeakPolarHBondContact CA-ND2 3.29Å; L61-N64 PolarHBondContact O-N 3.26Å; L61-N64 PolarHBondContact O-ND2 3.06Å
62	D	46.6	Very low	53	Low	143 Å²	143	116.7 Å²	116.7	77%	0.765	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-12.7	179.7	-62.1	-40.2	0	0	0	114.4	N64	D62-N64 VanDerWaalsContact C-N 3.34Å; D62-N64 PolarHBondContact O-N 2.98Å
63	E	48.5	Very low	51.6	Low	164 Å²	164	120.2 Å²	120.2	77%	0.766	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	6.3	176.9	-66.2	-163.7	150.2	0	0	114.4	L61 E65	L61-E63 PolarHBondContact O-N 3.14Å; E63-E65 PolarHBondContact O-N 2.84Å; E63-E65 VanDerWaalsContact O-N 3.14Å
64	N	39.7	Very low	50.7	Low	112 Å²	112	116 Å²	116	60%	0.599	64%	0.643	S	S	*	*			trans	-90.1	71.5	-172.2	-68	-83.5	0	0	0	114.2	T60 L61 D62	T60-N64 PolarHBondContact O-ND2 2.77Å; L61-N64 WeakPolarHBondContact CA-ND2 3.29Å; L61-N64 PolarHBondContact O-N 3.26Å; L61-N64 PolarHBondContact O-ND2 3.06Å; D62-N64 VanDerWaalsContact C-N 3.34Å; D62-N64 PolarHBondContact O-N 2.98Å
65	E	40.1	Very low	49.1	Very low	144 Å²	144	119.6 Å²	119.6	67%	0.673	67%	0.667	S	S	*	*			trans	-57.8	148.5	153.1	-72.6	-175.8	126.6	0	0	111	E63 V67 K72	E63-E65 PolarHBondContact O-N 2.84Å; E63-E65 VanDerWaalsContact O-N 3.14Å; E65-V67 PolarHBondContact O-N 3.41Å; E65-K72 IonicContact OE2-NZ 2.82Å; E65-K72 PolarHBondContact OE2-NZ 2.31Å
66	E	38.5	Very low	47.3	Very low	175 Å²	175	123.2 Å²	123.2	82%	0.818	69%	0.69	S	S	*	*			trans	-57	120.7	-175.8	-61.6	-176.5	114.1	0	0	113.8	I68	E66-I68 PolarHBondContact O-N 2.79Å
67	V	37.3	Very low	45.9	Very low	142 Å²	142	125.3 Å²	125.3	86%	0.861	70%	0.702	S	S	*	*			trans	-88.1	78.2	170.4	-173.9	0	0	0	0	110.1	E65	E65-V67 PolarHBondContact O-N 3.41Å
68	I	34.3	Very low	44.9	Very low	140 Å²	140	128.3 Å²	128.3	72%	0.718	72%	0.72	S	S	*	*			trans	-118.7	115.2	168	-57.7	-178.5	0	0	0	110	E66	E66-I68 PolarHBondContact O-N 2.79Å
69	D	31.6	Very low	44.2	Very low	163 Å²	163	129.8 Å²	129.8	87%	0.872	73%	0.727	S	S	*	*	S	Bend	trans	65.4	170.5	177.6	-142.5	-10.5	0	0	0	117	G71	D69-G71 PolarHBondContact O-N 2.95Å
70	G	36.9	Very low	44.1	Very low	74 Å²	74	134.7 Å²	134.7	76%	0.763	74%	0.741	S	S	*	*	S	Bend	trans	-82.2	112.1	-151.9	0	0	0	0	0	117.8
71	G	32.4	Very low	43.7	Very low	68 Å²	68	141.1 Å²	141.1	70%	0.701	77%	0.765	S	S	*	*			trans	107.3	108.1	140.5	0	0	0	0	0	117	D69 K73	D69-G71 PolarHBondContact O-N 2.95Å; G71-K73 PolarHBondContact O-N 2.97Å
72	K	36	Very low	44	Very low	171 Å²	171	138.5 Å²	138.5	74%	0.743	76%	0.763	S	S	*	*			trans	-63.9	102.4	169.4	-68.7	-156.9	177.4	-154.8	0	110.8	E65 G74	E65-K72 IonicContact OE2-NZ 2.82Å; E65-K72 PolarHBondContact OE2-NZ 2.31Å; K72-G74 PolarHBondContact O-N 3.24Å
73	K	43.9	Very low	45	Very low	213 Å²	213	137 Å²	137	93%	0.926	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	120.8	157.6	-78.4	179.3	175.7	173.8	0	108.1	G71	G71-K73 PolarHBondContact O-N 2.97Å
74	G	51.6	Low	45.2	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	161.9	-23.6	169.1	0	0	0	0	0	117.8	K72	K72-G74 PolarHBondContact O-N 3.24Å
75	V	42.9	Very low	46.3	Very low	138 Å²	138	135.6 Å²	135.6	84%	0.836	74%	0.744	S	S	*	*	S	Bend	trans	-124.1	39.9	-165.6	-154.9	0	0	0	0	113.8
76	I	42.9	Very low	47.5	Very low	151 Å²	151	131.2 Å²	131.2	77%	0.774	73%	0.732	S	S	*	*			trans	-145.8	83.1	164.3	-47.5	176.7	0	0	0	109.5
77	D	44.8	Very low	48.4	Very low	155 Å²	155	129 Å²	129	83%	0.829	72%	0.72	S	S	*	*			trans	-148.7	29.8	162.3	-147.7	13	0	0	0	113.6
78	D	50.7	Low	49.7	Very low	167 Å²	167	126.8 Å²	126.8	89%	0.893	70%	0.703	S	S	*	*			trans	-96.4	23.3	173	-78.1	-39.7	0	0	0	112.7
79	L	55.4	Low	51.1	Low	98 Å²	98	126.8 Å²	126.8	51%	0.513	70%	0.699	S	S	.	*	S	Bend	trans	-104.2	119.5	177.6	-70	177	0	0	0	110.7
80	Q	61.4	Low	52.7	Low	160 Å²	160	125.7 Å²	125.7	75%	0.748	69%	0.694	S	S	*	*			trans	-68.6	141	-176.5	-62.4	-171.6	9.3	0	0	111.3	G82 E83	Q80-G82 PolarHBondContact O-N 2.88Å; Q80-E83 PolarHBondContact O-N 3.44Å
81	Q	48.1	Very low	54	Low	212 Å²	212	126.7 Å²	126.7	99%	0.991	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	102.9	-173.3	-71.1	-174.4	-9.9	0	0	112.1
82	G	59.8	Low	54.6	Low	45 Å²	45	129.1 Å²	129.1	46%	0.464	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	139.1	-28.2	177.9	0	0	0	0	0	114	Q80 L84 E85 A86	Q80-G82 PolarHBondContact O-N 2.88Å; G82-L84 PolarHBondContact O-N 3.47Å; G82-E85 PolarHBondContact O-N 3.4Å; G82-A86 PolarHBondContact O-N 2.93Å; G82-A86 VanDerWaalsContact O-N 3.1Å
83	E	67.5	Low	55.3	Low	112 Å²	112	126.2 Å²	126.2	52%	0.523	67%	0.67	S	S	.	*	H	α-helix	trans	-65	-43	-174	-64.6	-167.5	127.5	0	0	112.8	Q80 E85 A86 F87	Q80-E83 PolarHBondContact O-N 3.44Å; E83-E85 VanDerWaalsContact C-N 3.3Å; E83-E85 PolarHBondContact O-N 3.25Å; E83-A86 PolarHBondContact O-N 2.85Å; E83-F87 WeakPolarHBondContact O-CB 3.36Å; E83-F87 PolarHBondContact O-N 3.46Å
84	L	54.1	Low	55.2	Low	108 Å²	108	120.2 Å²	120.2	57%	0.565	66%	0.66	S	S	*	*	H	α-helix	trans	-62.3	-36.5	178	-175.3	62.6	0	0	0	112.3	G82 F87 I88	G82-L84 PolarHBondContact O-N 3.47Å; L84-F87 PolarHBondContact O-N 2.84Å; L84-I88 HydrophobicContact CD1-CD1 4.21Å; L84-I88 HydrophobicContact CG-CD1 3.98Å; L84-I88 WeakPolarHBondContact O-CB 3.5Å; L84-I88 WeakPolarHBondContact O-CD1 3.48Å; L84-I88 VanDerWaalsContact O-CG1 3.24Å; L84-I88 WeakPolarHBondContact O-CG1 3.38Å; L84-I88 PolarHBondContact O-N 2.88Å
85	E	61.1	Low	55	Low	137 Å²	137	125.1 Å²	125.1	64%	0.64	66%	0.66	S	S	*	*	H	α-helix	trans	-73.8	-39.4	-179.9	-164.2	169.6	-143.5	0	0	111.4	G82 E83 F87 I88 Q89	G82-E85 PolarHBondContact O-N 3.4Å; E83-E85 VanDerWaalsContact C-N 3.3Å; E83-E85 PolarHBondContact O-N 3.25Å; E85-F87 VanDerWaalsContact C-N 3.35Å; E85-I88 PolarHBondContact O-N 3.23Å; E85-Q89 WeakPolarHBondContact O-CG 3.47Å; E85-Q89 PolarHBondContact O-N 3.3Å
86	A	66.3	Low	55.3	Low	53 Å²	53	128.2 Å²	128.2	44%	0.438	66%	0.659	S	S	.	*	H	α-helix	trans	-62.9	-39.6	170.8	0	0	0	0	0	112.2	G82 E83 Q89 N90	G82-A86 PolarHBondContact O-N 2.93Å; G82-A86 VanDerWaalsContact O-N 3.1Å; E83-A86 PolarHBondContact O-N 2.85Å; A86-Q89 PolarHBondContact O-N 3.49Å; A86-N90 WeakPolarHBondContact O-CB 3.48Å; A86-N90 PolarHBondContact O-N 3.32Å
87	F	56.4	Low	55.1	Low	128 Å²	128	127 Å²	127	56%	0.561	66%	0.658	S	S	*	*	H	α-helix	trans	-66	-43.9	177.3	-171	-110.2	0	0	0	112.2	E83 L84 E85 Q89 N90 L91	E83-F87 WeakPolarHBondContact O-CB 3.36Å; E83-F87 PolarHBondContact O-N 3.46Å; L84-F87 PolarHBondContact O-N 2.84Å; E85-F87 VanDerWaalsContact C-N 3.35Å; F87-Q89 PolarHBondContact O-N 3.27Å; F87-N90 PolarHBondContact O-N 3.18Å; F87-L91 HydrophobicContact CD1-CD1 3.84Å; F87-L91 HydrophobicContact CE1-CD1 3.48Å; F87-L91 VanDerWaalsContact CE1-CD1 3.48Å; F87-L91 HydrophobicContact CE1-CG 4.5Å; F87-L91 HydrophobicContact CZ-CD1 3.87Å; F87-L91 PolarHBondContact O-N 2.97Å
88	I	64.6	Low	54.7	Low	96 Å²	96	129.4 Å²	129.4	49%	0.492	66%	0.661	S	S	.	*	H	α-helix	trans	-63.7	-39.2	176.2	-71.9	167	0	0	0	111.5	L84 E85 L91	L84-I88 HydrophobicContact CD1-CD1 4.21Å; L84-I88 HydrophobicContact CG-CD1 3.98Å; L84-I88 WeakPolarHBondContact O-CB 3.5Å; L84-I88 WeakPolarHBondContact O-CD1 3.48Å; L84-I88 VanDerWaalsContact O-CG1 3.24Å; L84-I88 WeakPolarHBondContact O-CG1 3.38Å; L84-I88 PolarHBondContact O-N 2.88Å; E85-I88 PolarHBondContact O-N 3.23Å; I88-L91 PolarHBondContact O-N 3.28Å
89	Q	64.8	Low	53.9	Low	139 Å²	139	125.4 Å²	125.4	65%	0.65	65%	0.651	S	S	*	*	H	α-helix	trans	-66.2	-42.9	174.8	-71.3	-177.4	34.9	0	0	112	E85 A86 F87 L91 N92	E85-Q89 WeakPolarHBondContact O-CG 3.47Å; E85-Q89 PolarHBondContact O-N 3.3Å; A86-Q89 PolarHBondContact O-N 3.49Å; F87-Q89 PolarHBondContact O-N 3.27Å; Q89-L91 VanDerWaalsContact C-N 3.29Å; Q89-L91 PolarHBondContact O-N 3.43Å; Q89-N92 PolarHBondContact O-N 2.99Å
90	N	64.3	Low	52.5	Low	141 Å²	141	126.6 Å²	126.6	75%	0.754	67%	0.667	S	S	*	*	H	α-helix	trans	-62.5	-32	176.3	-81.1	-20.6	0	0	0	113.4	A86 F87 N92	A86-N90 WeakPolarHBondContact O-CB 3.48Å; A86-N90 PolarHBondContact O-N 3.32Å; F87-N90 PolarHBondContact O-N 3.18Å; N90-N92 VanDerWaalsContact C-N 3.32Å; N90-N92 PolarHBondContact O-N 3.08Å
91	L	64.4	Low	51	Low	94 Å²	94	126.3 Å²	126.3	49%	0.492	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.8	-10	178.3	-75.4	172.7	0	0	0	114.7	F87 I88 Q89 L93	F87-L91 HydrophobicContact CD1-CD1 3.84Å; F87-L91 HydrophobicContact CE1-CD1 3.48Å; F87-L91 VanDerWaalsContact CE1-CD1 3.48Å; F87-L91 HydrophobicContact CE1-CG 4.5Å; F87-L91 HydrophobicContact CZ-CD1 3.87Å; F87-L91 PolarHBondContact O-N 2.97Å; I88-L91 PolarHBondContact O-N 3.28Å; Q89-L91 VanDerWaalsContact C-N 3.29Å; Q89-L91 PolarHBondContact O-N 3.43Å; L91-L93 HydrophobicContact CB-CD1 4.03Å; L91-L93 HydrophobicContact CB-CG 4.27Å; L91-L93 PolarHBondContact O-N 3.04Å
92	N	45.3	Very low	50.2	Low	119 Å²	119	122 Å²	122	64%	0.636	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.2	31.6	166.2	-148.7	-22.7	0	0	0	115	Q89 N90 A94	Q89-N92 PolarHBondContact O-N 2.99Å; N90-N92 VanDerWaalsContact C-N 3.32Å; N90-N92 PolarHBondContact O-N 3.08Å; N92-A94 PolarHBondContact O-N 3.14Å; N92-A94 VanDerWaalsContact O-N 3.14Å
93	L	51.3	Low	48.8	Very low	110 Å²	110	128.1 Å²	128.1	58%	0.576	67%	0.668	S	S	*	*			trans	-71.7	-4.1	-171	-79.5	160.5	0	0	0	115.3	L91 K95 Y96	L91-L93 HydrophobicContact CB-CD1 4.03Å; L91-L93 HydrophobicContact CB-CG 4.27Å; L91-L93 PolarHBondContact O-N 3.04Å; L93-K95 PolarHBondContact O-N 2.88Å; L93-Y96 PolarHBondContact O-N 2.85Å
94	A	41.9	Very low	46.7	Very low	87 Å²	87	131.5 Å²	131.5	72%	0.719	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	6.9	-173.4	0	0	0	0	0	116.3	N92	N92-A94 PolarHBondContact O-N 3.14Å; N92-A94 VanDerWaalsContact O-N 3.14Å
95	K	47.4	Very low	45.6	Very low	178 Å²	178	133.6 Å²	133.6	77%	0.774	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-13	179.4	-73.8	-179.7	178.4	171.8	0	115.3	L93	L93-K95 PolarHBondContact O-N 2.88Å
96	Y	49.6	Very low	44.3	Very low	203 Å²	203	134.7 Å²	134.7	80%	0.796	70%	0.701	S	S	*	*	S	Bend	trans	-111.4	-7.1	-171.1	-80.2	-80.4	0	0	0	115.9	L93 K98	L93-Y96 PolarHBondContact O-N 2.85Å; Y96-K98 PolarHBondContact O-N 2.68Å
97	T	37.4	Very low	42.6	Very low	125 Å²	125	138 Å²	138	77%	0.767	72%	0.718	S	S	*	*			trans	-76.6	42	-177.3	48	0	0	0	0	114.7
98	K	37.1	Very low	41.2	Very low	205 Å²	205	135 Å²	135	89%	0.891	72%	0.717	S	S	*	*	S	Bend	trans	-135.7	38.4	176.3	-80.3	-166.5	173.1	-179.8	0	114.3	Y96	Y96-K98 PolarHBondContact O-N 2.68Å
99	A	32.9	Very low	39.3	Very low	83 Å²	83	139.6 Å²	139.6	69%	0.686	73%	0.734	S	S	*	*	S	Bend	trans	-154.2	132.7	162.2	0	0	0	0	0	110.9
100	C	26.4	Very low	37.3	Very low	124 Å²	124	142.1 Å²	142.1	84%	0.838	74%	0.742	S	S	*	*			trans	66.4	154	173.8	-62.7	0	0	0	0	116
101	L	31.4	Very low	35.3	Very low	153 Å²	153	142.8 Å²	142.8	80%	0.801	74%	0.741	S	S	*	*			cis	-145.3	-147.6	-6.9	-121.7	166.8	0	0	0	111.5
102	I	29.9	Very low	33.3	Very low	122 Å²	122	145.6 Å²	145.6	63%	0.626	76%	0.757	S	S	*	*			trans	-127.2	145.2	-155.7	-70.3	163.1	0	0	0	113.3
103	E	30.2	Very low	32.1	Very low	173 Å²	173	144.5 Å²	144.5	81%	0.808	76%	0.758	S	S	*	*			trans	56.4	158.5	162.5	-72.9	142.8	-159.2	0	0	118.5
104	E	25	Very low	30.8	Very low	183 Å²	183	144.6 Å²	144.6	86%	0.855	77%	0.768	S	S	*	*			cis	-144.4	-170.2	6.1	-142.8	168.3	-157.8	0	0	111.9
105	D	30.2	Very low	29.9	Very low	152 Å²	152	149.8 Å²	149.8	81%	0.813	78%	0.775	S	S	*	*			trans	-100.7	154.2	-161.1	-80.8	-43.1	0	0	0	119
106	E	33.3	Very low	28.8	Very low	161 Å²	161	151.2 Å²	151.2	75%	0.752	78%	0.781	S	S	*	*			trans	60.6	146.1	149.1	-80.3	-78.9	156.5	0	0	120.2	A108	E106-A108 PolarHBondContact OE2-N 3.09Å
107	P	31.8	Very low	27.5	Very low	121 Å²	121	149.9 Å²	149.9	79%	0.786	78%	0.782	S	S	*	*				-153.7	134.6	68.6	38.4	-15.5	0	0	0	120.5
108	A	25.7	Very low	26.9	Very low	67 Å²	67	150 Å²	150	55%	0.554	78%	0.782	S	S	*	*				50	123.1	123.8	0	0	0	0	0	125.4	E106	E106-A108 PolarHBondContact OE2-N 3.09Å
109	K	25.5	Very low	26.2	Very low	191 Å²	191	150 Å²	150	83%	0.83	78%	0.782	S	S	*	*			trans	71.7	125.5	134.9	-65.3	173.1	-178.3	177.8	0	123.7
110	K	22.9	Very low	25.9	Very low	192 Å²	192	153.4 Å²	153.4	84%	0.835	79%	0.787	S	S	*	*				-168.8	121.8	106.2	-97.2	169.5	-178.1	177.1	0	108.3
111	E	22.1	Very low	26.4	Very low	156 Å²	156	152.6 Å²	152.6	73%	0.729	78%	0.78	S	S	*	*				73.8	95.2	77.4	-73.8	-167.2	153.7	0	0	116.1
112	N	21.3	Very low	26.1	Very low	153 Å²	153	154.1 Å²	154.1	82%	0.818	78%	0.781	S	S	*	*				156.2	155.7	126.9	-87.6	-57.6	0	0	0	112.1
113	S	21.8	Very low	25.8	Very low	95 Å²	95	155.4 Å²	155.4	66%	0.664	79%	0.787	S	S	*	*			cis	-171.7	130.4	-46.4	47.1	0	0	0	0	108.9
114	S	22.3	Very low	25.5	Very low	113 Å²	113	153.7 Å²	153.7	79%	0.79	78%	0.784	S	S	*	*			trans	174.3	121	147.1	40.1	0	0	0	0	116.2
115	K	23.6	Very low	25.3	Very low	196 Å²	196	151 Å²	151	85%	0.852	78%	0.775	S	S	*	*			trans	31	112.2	131.2	-54.1	170.6	-176.8	172	0	119.2
116	K	23.8	Very low	25.1	Very low	207 Å²	207	151.9 Å²	151.9	90%	0.9	77%	0.772	S	S	*	*				-173.7	169.7	101	-104.3	171.6	-178.2	174	0	114.7
117	E	22.1	Very low	24.7	Very low	175 Å²	175	150.9 Å²	150.9	82%	0.818	77%	0.771	S	S	*	*			trans	-99.9	148.9	-164.9	-61.4	161.9	108.7	0	0	114.4
118	V	26.5	Very low	24.4	Very low	127 Å²	127	151.7 Å²	151.7	77%	0.77	77%	0.774	S	S	*	*			trans	39.5	115.9	138.8	-176.4	0	0	0	0	119.1
119	K	22.5	Very low	24.5	Very low	206 Å²	206	152.6 Å²	152.6	90%	0.896	78%	0.782	S	S	*	*				-166.1	142.4	128.6	-103.3	143.9	-168.7	171.1	0	114.7
120	I	25	Very low	24.4	Very low	154 Å²	154	151.5 Å²	151.5	79%	0.79	78%	0.779	S	S	*	*			trans	-123	134.5	167.2	-58	169.5	0	0	0	102.8
121	P	36.5	Very low	24.5	Very low	108 Å²	108	145.8 Å²	145.8	70%	0.701	76%	0.764	S	S	*	*				-158.8	156.9	68	40.9	-18.6	0	0	0	121.3
122	K	25.1	Very low	24.7	Very low	185 Å²	185	146.4 Å²	146.4	80%	0.804	77%	0.767	S	S	*	*			trans	38.9	130.2	135.5	-52.5	171.4	176.1	176.8	0	121.8
123	I	24.4	Very low	24.9	Very low	149 Å²	149	150.4 Å²	150.4	76%	0.764	77%	0.77	S	S	*	*				171.5	131.5	107.6	-92.5	158.8	0	0	0	112.9
124	N	23.4	Very low	24.8	Very low	137 Å²	137	152.4 Å²	152.4	73%	0.733	78%	0.779	S	S	*	*			trans	32.7	158.9	149.6	-49.3	-16.1	0	0	0	122
125	N	22.2	Very low	25	Very low	125 Å²	125	151.7 Å²	151.7	67%	0.668	77%	0.773	S	S	*	*			cis	-166.5	150.3	27.3	-140.3	-6.6	0	0	0	113.3
126	K	24.9	Very low	25.1	Very low	172 Å²	172	148.4 Å²	148.4	75%	0.748	77%	0.77	S	S	*	*			trans	24.9	156.4	139.1	-73.4	177.2	-173.8	-179	0	123.5
127	N	25.8	Very low	25.2	Very low	140 Å²	140	144.8 Å²	144.8	75%	0.749	76%	0.76	S	S	*	*			cis	177.6	-173.1	-24.9	-116.9	28.2	0	0	0	111.1
128	T	24.9	Very low	25.3	Very low	137 Å²	137	145.2 Å²	145.2	84%	0.84	76%	0.759	S	S	*	*			trans	74.8	148.7	160.7	48	0	0	0	0	119.5
129	A	27.1	Very low	25.3	Very low	87 Å²	87	145.8 Å²	145.8	72%	0.719	76%	0.763	S	S	*	*			cis	-160.5	-177.5	-16.3	0	0	0	0	0	108.5
130	E	23.5	Very low	25.4	Very low	167 Å²	167	145.1 Å²	145.1	78%	0.78	76%	0.76	S	S	*	*			cis	-165.4	-164.2	25.1	-134.4	-45.4	63.1	0	0	106.4
131	S	25.7	Very low	25.3	Very low	72 Å²	72	143.8 Å²	143.8	50%	0.503	76%	0.755	S	S	.	*			cis	-166.3	-178.1	-4.5	-163.8	0	0	0	0	112
132	Q	26.2	Very low	24.7	Very low	169 Å²	169	146.7 Å²	146.7	79%	0.79	76%	0.756	S	S	*	*			trans	57.1	117.5	160.4	-44.4	-160.3	17.9	0	0	120.6
133	R	24.6	Very low	24.6	Very low	238 Å²	238	144.9 Å²	144.9	90%	0.898	76%	0.755	S	S	*	*				81.3	134.5	51.7	-68.5	-175.8	174	-172.4	-0.1	113.8
134	T	21.1	Very low	24.5	Very low	137 Å²	137	145.8 Å²	145.8	84%	0.84	75%	0.753	S	S	*	*				-145.3	-153.1	56.6	50.6	0	0	0	0	115.2
135	S	25.1	Very low	25	Very low	97 Å²	97	144.9 Å²	144.9	68%	0.678	76%	0.755	S	S	*	*				-164.8	162.6	-124.2	59.1	0	0	0	0	120.2
136	V	26.6	Very low	25.2	Very low	128 Å²	128	145.5 Å²	145.5	78%	0.776	75%	0.752	S	S	*	*			trans	74.5	149.4	145	154.2	0	0	0	0	116.2
137	N	24.9	Very low	26	Very low	130 Å²	130	142.9 Å²	142.9	70%	0.695	75%	0.753	S	S	*	*			cis	-135.1	-139.3	24	-145.2	-41	0	0	0	110.9
138	K	24.9	Very low	25.9	Very low	184 Å²	184	141.9 Å²	141.9	80%	0.8	74%	0.743	S	S	*	*			cis	-162.2	146.6	1.6	-130.8	154.1	-165.9	171.5	0	109.3
139	V	26.3	Very low	25.8	Very low	140 Å²	140	140.2 Å²	140.2	85%	0.848	74%	0.737	S	S	*	*			trans	-145	146.8	-171.7	-175.2	0	0	0	0	114.5
140	K	25	Very low	25.6	Very low	192 Å²	192	141.6 Å²	141.6	84%	0.835	73%	0.732	S	S	*	*			trans	-158.5	144.5	170.4	-94.4	-177.7	-177.9	174.7	0	112.1
141	N	24	Very low	25.6	Very low	126 Å²	126	142.1 Å²	142.1	67%	0.674	74%	0.735	S	S	*	*			cis	-168.7	163.1	-12.5	-150.5	-4.8	0	0	0	115
142	K	23.8	Very low	25.6	Very low	168 Å²	168	146.3 Å²	146.3	73%	0.73	75%	0.751	S	S	*	*			trans	72.2	148.3	160.5	-63.7	-172	178.4	-178.8	0	118.8
143	N	22.5	Very low	25.6	Very low	147 Å²	147	141.3 Å²	141.3	79%	0.786	75%	0.746	S	S	*	*			cis	-149.8	176.1	1.4	-127.2	12.4	0	0	0	114.7
144	K	21.1	Very low	25.7	Very low	168 Å²	168	134.9 Å²	134.9	73%	0.73	74%	0.737	S	S	*	*			trans	-109.5	-178.3	-177.2	-115.8	-178.5	179.3	165.6	0	111.4
145	P	34.4	Very low	25.9	Very low	118 Å²	118	134.5 Å²	134.5	77%	0.766	74%	0.735	S	S	*	*			cis	-139.8	157.2	27.2	41.1	-21.2	0	0	0	120.5
146	K	26.4	Very low	26.3	Very low	139 Å²	139	135.9 Å²	135.9	60%	0.604	74%	0.739	S	S	*	*			trans	14.2	143	142.3	-79.7	-157.1	176.5	-158	0	120.4	H148	K146-H148 VanDerWaalsContact CE-NE2 3.25Å; K146-H148 WeakPolarHBondContact CE-NE2 3.18Å; K146-H148 PolarHBondContact NZ-NE2 2.68Å
147	P	41	Very low	26.3	Very low	117 Å²	117	135 Å²	135	76%	0.76	74%	0.736	S	S	*	*			cis	-102.5	-112.5	48.6	36.9	-36.9	0	0	0	118
148	H	24.6	Very low	26.7	Very low	118 Å²	118	138.8 Å²	138.8	55%	0.546	75%	0.747	S	S	.	*			trans	-167	172.9	-148.4	-90.7	-85.9	0	0	0	108.1	K146 D150	K146-H148 VanDerWaalsContact CE-NE2 3.25Å; K146-H148 WeakPolarHBondContact CE-NE2 3.18Å; K146-H148 PolarHBondContact NZ-NE2 2.68Å; H148-D150 IonicContact CE1-OD1 2.66Å; H148-D150 IonicContact CG-OD1 3.81Å; H148-D150 IonicContact ND1-OD1 2.68Å; H148-D150 PolarHBondContact ND1-OD1 2.81Å; H148-D150 IonicContact ND1-OD2 2.94Å
149	S	23	Very low	26.7	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	75%	0.748	S	S	*	*			cis	-153.7	156.9	4.1	21.9	0	0	0	0	110.1
150	D	22.4	Very low	27	Very low	115 Å²	115	137.8 Å²	137.8	62%	0.615	74%	0.742	S	S	*	*			cis	-141.3	141.5	-18.8	-94.3	-31.5	0	0	0	110.5	H148	H148-D150 IonicContact CE1-OD1 2.66Å; H148-D150 IonicContact CG-OD1 3.81Å; H148-D150 IonicContact ND1-OD1 2.68Å; H148-D150 PolarHBondContact ND1-OD1 2.81Å; H148-D150 IonicContact ND1-OD2 2.94Å
151	E	24.7	Very low	27.2	Very low	178 Å²	178	138.5 Å²	138.5	83%	0.832	75%	0.745	S	S	*	*			trans	51.9	65.2	160	-48.9	-150.4	137.7	0	0	119.5
152	N	25	Very low	27.5	Very low	160 Å²	160	138.1 Å²	138.1	86%	0.856	74%	0.743	S	S	*	*				18	142.2	122.7	-56.2	-34.2	0	0	0	119.1
153	G	26.9	Very low	28.1	Very low	65 Å²	65	139.4 Å²	139.4	67%	0.67	75%	0.748	S	S	*	*			cis	175.7	151.3	8.6	0	0	0	0	0	110.7
154	S	26.7	Very low	28.9	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	74%	0.741	S	S	*	*				75.8	128.2	66.5	78.1	0	0	0	0	113.7
155	T	24.1	Very low	29.9	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	73%	0.731	S	S	*	*			cis	-162.5	163.5	-4.7	3.7	0	0	0	0	110.6
156	T	33.5	Very low	30.8	Very low	126 Å²	126	133.7 Å²	133.7	77%	0.773	72%	0.715	S	S	*	*			trans	-30.1	149.4	163.5	45.5	0	0	0	0	116.8
157	P	26.9	Very low	32.2	Very low	110 Å²	110	131 Å²	131	71%	0.714	70%	0.703	S	S	*	*			cis	-144.2	161.9	48	40.9	-22.7	0	0	0	119.6	V159	P157-V159 PolarHBondContact O-N 3.09Å
158	K	33.6	Very low	32.5	Very low	210 Å²	210	129.1 Å²	129.1	91%	0.913	68%	0.684	S	S	*	*			trans	21.4	89.2	151.8	-62.8	178.9	180	175.8	0	117.5
159	V	25.8	Very low	33.9	Very low	137 Å²	137	126.4 Å²	126.4	83%	0.83	67%	0.671	S	S	*	*			trans	-102.4	119.9	149.9	177.7	0	0	0	0	108	P157 K161	P157-V159 PolarHBondContact O-N 3.09Å; V159-K161 PolarHBondContact O-N 3.14Å
160	K	32.6	Very low	35.3	Very low	166 Å²	166	125.9 Å²	125.9	72%	0.722	66%	0.656	S	S	*	*			trans	-68.2	128	170.2	-58.3	174.9	-175.6	175	0	107.9	D162	K160-D162 WeakPolarHBondContact CB-OD1 3.46Å; K160-D162 WeakPolarHBondContact CD-OD1 3.39Å; K160-D162 PolarHBondContact O-N 2.9Å
161	K	28.2	Very low	36.7	Very low	206 Å²	206	128 Å²	128	90%	0.896	66%	0.662	S	S	*	*			trans	-84.7	98.5	150	-79.7	-170.3	174	-175.1	0	105.7	V159 K163	V159-K161 PolarHBondContact O-N 3.14Å; K161-K163 PolarHBondContact O-N 3.28Å
162	D	31	Very low	38.3	Very low	118 Å²	118	122.1 Å²	122.1	63%	0.631	63%	0.632	S	S	*	*			trans	-62.2	127	-176.8	-66.7	-51.4	0	0	0	110	K160 Q164	K160-D162 WeakPolarHBondContact CB-OD1 3.46Å; K160-D162 WeakPolarHBondContact CD-OD1 3.39Å; K160-D162 PolarHBondContact O-N 2.9Å; D162-Q164 VanDerWaalsContact C-N 3.27Å; D162-Q164 PolarHBondContact O-N 3.17Å
163	K	35.6	Very low	39.3	Very low	195 Å²	195	123.6 Å²	123.6	85%	0.848	63%	0.634	S	S	*	*			trans	-69.1	92.6	162.5	-66.5	-177.7	178.8	-175.5	0	106.1	K161 N165	K161-K163 PolarHBondContact O-N 3.28Å; K163-N165 PolarHBondContact O-N 2.94Å
164	Q	39.3	Very low	40.4	Very low	136 Å²	136	125 Å²	125	64%	0.636	63%	0.629	S	S	*	*			trans	-52.6	128.3	169.9	-70.2	-171.2	-2.7	0	0	107.9	D162 I166	D162-Q164 VanDerWaalsContact C-N 3.27Å; D162-Q164 PolarHBondContact O-N 3.17Å; Q164-I166 PolarHBondContact O-N 3.17Å
165	N	41.3	Very low	41.9	Very low	97 Å²	97	121.4 Å²	121.4	52%	0.519	60%	0.602	S	S	.	*			trans	-71.7	127.1	-174	-65.6	-67.5	0	0	0	108.4	K163 F167 E168	K163-N165 PolarHBondContact O-N 2.94Å; N165-F167 PolarHBondContact O-N 3.12Å; N165-F167 VanDerWaalsContact O-N 3.15Å; N165-E168 HydrophobicContact CB-CB 3.98Å; N165-E168 HydrophobicContact CB-CG 4.38Å; N165-E168 PolarHBondContact N-OE2 3.26Å; N165-E168 PolarHBondContact ND2-OE1 2.65Å; N165-E168 VanDerWaalsContact O-CB 3.23Å; N165-E168 WeakPolarHBondContact O-CB 3.33Å; N165-E168 PolarHBondContact O-N 3.22Å
166	I	53.7	Low	43.5	Very low	81 Å²	81	115.9 Å²	115.9	42%	0.415	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.5	-29.3	176.5	-64.7	168.5	0	0	0	110	Q164 E316 R326	Q164-I166 PolarHBondContact O-N 3.17Å; I166-E316 WeakPolarHBondContact CG2-OE1 3.44Å; I166-R326 PolarHBondContact O-NH1 3.04Å
167	F	55.3	Low	44.9	Very low	83 Å²	83	110.7 Å²	110.7	36%	0.364	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	10.4	178	-50.8	-76.1	0	0	0	114.7	N165 N204 Y205	N165-F167 PolarHBondContact O-N 3.12Å; N165-F167 VanDerWaalsContact O-N 3.15Å; F167-N204 HydrophobicContact CD1-CB 3.78Å; F167-N204 HydrophobicContact CE1-CB 3.75Å; F167-N204 HydrophobicContact CG-CB 4.34Å; F167-N204 HydrophobicContact CZ-CB 4.3Å; F167-Y205 HydrophobicContact CD1-CD1 4.19Å; F167-Y205 HydrophobicContact CD1-CE1 4.07Å; F167-Y205 HydrophobicContact CE1-CD1 4.12Å; F167-Y205 HydrophobicContact CE1-CD2 4.01Å; F167-Y205 AromaticContact CE1-CE1 3.88Å; F167-Y205 HydrophobicContact CE1-CE1 3.88Å; F167-Y205 AromaticContact CE1-CE2 3.79Å; F167-Y205 HydrophobicContact CE1-CE2 3.79Å; F167-Y205 HydrophobicContact CE1-CG 4.16Å; F167-Y205 AromaticContact CE1-CZ 3.7Å; F167-Y205 HydrophobicContact CZ-CE2 4.46Å
168	E	49.3	Very low	46.3	Very low	76 Å²	76	114.6 Å²	114.6	36%	0.355	54%	0.541	S	S	.	.			trans	-74.1	129.6	-178.6	-142.5	138.5	-120	0	0	111.2	N165 F170	N165-E168 HydrophobicContact CB-CB 3.98Å; N165-E168 HydrophobicContact CB-CG 4.38Å; N165-E168 PolarHBondContact N-OE2 3.26Å; N165-E168 PolarHBondContact ND2-OE1 2.65Å; N165-E168 VanDerWaalsContact O-CB 3.23Å; N165-E168 WeakPolarHBondContact O-CB 3.33Å; N165-E168 PolarHBondContact O-N 3.22Å; E168-F170 HydrophobicContact CB-CE2 3.84Å; E168-F170 HydrophobicContact CB-CZ 4.27Å; E168-F170 HydrophobicContact CG-CE2 4.32Å; E168-F170 HydrophobicContact CG-CZ 4.3Å; E168-F170 WeakPolarHBondContact O-CD2 3.48Å
169	F	52.5	Low	47.4	Very low	61 Å²	61	108 Å²	108	27%	0.268	52%	0.519	S	S	.	.			trans	-86.6	133.7	177.5	166.4	-98.1	0	0	0	110	E171 L208 K211 L212 H215	F169-E171 HydrophobicContact CD1-CG 4.44Å; F169-E171 HydrophobicContact CE1-CG 3.5Å; F169-E171 VanDerWaalsContact CE1-CG 3.5Å; F169-E171 HydrophobicContact CZ-CG 3.93Å; F169-L208 HydrophobicContact CB-CD1 3.97Å; F169-K211 HydrophobicContact CD2-CB 3.85Å; F169-K211 HydrophobicContact CE2-CB 4.05Å; F169-K211 HydrophobicContact CG-CB 4.39Å; F169-L212 HydrophobicContact CD2-CD2 3.93Å; F169-L212 HydrophobicContact CD2-CG 4.25Å; F169-L212 HydrophobicContact CE2-CD2 4.11Å; F169-H215 HydrophobicContact CE2-CB 3.93Å; F169-H215 HydrophobicContact CZ-CB 3.8Å; F169-H215 AromaticContact CZ-CD2 3.8Å; F169-H215 AromaticContact CZ-CG 3.87Å
170	F	52.6	Low	48.9	Very low	93 Å²	93	104 Å²	104	41%	0.408	51%	0.506	S	S	.	.			trans	-122.1	122.2	177.5	-69.7	-86.5	0	0	0	110	E168	E168-F170 HydrophobicContact CB-CE2 3.84Å; E168-F170 HydrophobicContact CB-CZ 4.27Å; E168-F170 HydrophobicContact CG-CE2 4.32Å; E168-F170 HydrophobicContact CG-CZ 4.3Å; E168-F170 WeakPolarHBondContact O-CD2 3.48Å
171	E	52.8	Low	50.4	Low	159 Å²	159	99.4 Å²	99.4	74%	0.743	51%	0.506	S	S	*	.			trans	-68	143.3	170.8	-63.5	-177.2	173.6	0	0	110.3	F169	F169-E171 HydrophobicContact CD1-CG 4.44Å; F169-E171 HydrophobicContact CE1-CG 3.5Å; F169-E171 VanDerWaalsContact CE1-CG 3.5Å; F169-E171 HydrophobicContact CZ-CG 3.93Å
172	R	58.2	Low	52.3	Low	55 Å²	55	93.4 Å²	93.4	21%	0.208	48%	0.48	C	S	.	.			trans	-139	152.9	-172.6	-64.8	173.8	-178	-103.2	17.9	109.2	H215 L219 D324 D327	R172-H215 PolarHBondContact N-CE1 3.23Å; R172-H215 VanDerWaalsContact N-CE1 3.3Å; R172-H215 PolarHBondContact N-NE2 2.91Å; R172-H215 PolarHBondContact O-CE1 3.24Å; R172-H215 VanDerWaalsContact O-CE1 3.23Å; R172-H215 PolarHBondContact O-NE2 3.37Å; R172-L219 WeakPolarHBondContact O-CD1 3.43Å; R172-L219 WeakPolarHBondContact O-CD2 3.48Å; R172-D324 IonicContact CZ-OD1 2.63Å; R172-D324 IonicContact CZ-OD2 2.62Å; R172-D324 IonicContact NH1-OD1 3.37Å; R172-D324 PolarHBondContact NH1-OD1 3.45Å; R172-D324 IonicContact NH1-OD2 3.2Å; R172-D324 PolarHBondContact NH1-OD2 3.09Å; R172-D324 IonicContact NH2-OD1 3.23Å; R172-D324 PolarHBondContact NH2-OD1 3.09Å; R172-D327 IonicContact CZ-OD2 3.35Å; R172-D327 IonicContact NE-OD2 2.67Å; R172-D327 IonicContact NH2-OD2 3.48Å; R172-D327 PolarHBondContact NH2-OD2 3.06Å
173	Q	46	Very low	54.4	Low	190 Å²	190	88.1 Å²	88.1	89%	0.888	45%	0.451	S	S	*	.	S	Bend	trans	-99.6	1.8	-176.7	-64.5	-175.6	-6.5	0	0	114.3
174	T	49.9	Very low	56	Low	95 Å²	95	80 Å²	80	58%	0.583	42%	0.415	S	S	*	.	S	Bend	trans	-130.1	137	-175.6	52.3	0	0	0	0	110.5	L176	T174-L176 PolarHBondContact O-N 3.22Å
175	L	58.1	Low	57.2	Low	27 Å²	27	79 Å²	79	14%	0.141	41%	0.414	C	S	.	.			trans	-55.5	133.7	165.5	-61.6	175.9	0	0	0	109.3	L177 E216 L219 F220 K223	L175-L177 WeakPolarHBondContact CB-O 3.38Å; L175-E216 HydrophobicContact CD2-CG 3.66Å; L175-L219 HydrophobicContact CD2-CB 3.64Å; L175-F220 HydrophobicContact CD1-CD2 4.02Å; L175-F220 HydrophobicContact CD2-CB 4.1Å; L175-K223 HydrophobicContact CD1-CD 3.74Å; L175-K223 HydrophobicContact CG-CD 4.22Å
176	L	58.1	Low	58.2	Low	13 Å²	13	77.8 Å²	77.8	7%	0.068	41%	0.407	C	S	.	.	S	Bend	trans	-81.6	-40.1	174.1	-69.4	174.9	0	0	0	110	T174 E216 D324 D327 R328 I331	T174-L176 PolarHBondContact O-N 3.22Å; L176-E216 WeakPolarHBondContact CA-OE1 3.43Å; L176-E216 PolarHBondContact N-OE1 2.95Å; L176-D324 HydrophobicContact CD2-CB 4.34Å; L176-D327 HydrophobicContact CD1-CB 3.79Å; L176-R328 HydrophobicContact CB-CG 3.78Å; L176-R328 VanDerWaalsContact O-CZ 3.25Å; L176-R328 PolarHBondContact O-NE 3.05Å; L176-R328 PolarHBondContact O-NH2 2.78Å; L176-I331 HydrophobicContact CD1-CD1 4.25Å
177	L	61.6	Low	58.2	Low	17 Å²	17	81 Å²	81	9%	0.089	42%	0.42	C	S	.	.	S	Bend	trans	-85.4	147.6	171.6	-62.9	176	0	0	0	110.9	L175 L186 E216 V260 R328 I331 L332	L175-L177 WeakPolarHBondContact CB-O 3.38Å; L177-L186 HydrophobicContact CD2-CD1 4.41Å; L177-E216 PolarHBondContact N-OE1 3.46Å; L177-V260 HydrophobicContact CD1-CB 4.42Å; L177-V260 HydrophobicContact CD1-CG1 3.79Å; L177-R328 HydrophobicContact CD2-CB 4.43Å; L177-R328 HydrophobicContact CD2-CG 4.22Å; L177-I331 HydrophobicContact CD1-CG2 3.92Å; L177-L332 HydrophobicContact CD1-CD2 3.83Å; L177-L332 HydrophobicContact CD1-CG 4.28Å; L177-L332 HydrophobicContact CD2-CD1 4.22Å; L177-L332 HydrophobicContact CD2-CD2 4.22Å; L177-L332 HydrophobicContact CD2-CG 4.24Å
178	K	57.8	Low	58.2	Low	192 Å²	192	79.6 Å²	79.6	84%	0.835	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-93.1	134.9	171.5	-69.4	179.4	-178	172.4	0	108.6
179	P	56.1	Low	58.6	Low	70 Å²	70	76.3 Å²	76.3	46%	0.455	40%	0.399	S	S	.	.	S	Bend	trans	-67.2	146.2	169.8	28.5	-34.3	0	0	0	110.9	F220 D258	P179-F220 HydrophobicContact CB-CE2 4.36Å; P179-D258 WeakPolarHBondContact CA-OD2 3.17Å; P179-D258 HydrophobicContact CB-CB 4.33Å; P179-D258 VanDerWaalsContact CB-OD2 3.32Å; P179-D258 WeakPolarHBondContact CB-OD2 3.45Å
180	G	56.2	Low	58.7	Low	55 Å²	55	78.5 Å²	78.5	57%	0.567	41%	0.413	S	S	*	.	S	Bend	trans	93.3	129.2	-178.1	0	0	0	0	0	114.3	D257	G180-D257 PolarHBondContact N-O 3.03Å; G180-D257 VanDerWaalsContact N-O 3.14Å
181	G	64.3	Low	59.1	Low	68 Å²	68	75.9 Å²	75.9	70%	0.701	40%	0.402	S	S	*	.	S	Bend	trans	112.8	153.3	-175.7	0	0	0	0	0	112.1
182	K	68.8	Low	59.2	Low	81 Å²	81	73.8 Å²	73.8	35%	0.352	39%	0.388	S	S	.	.			trans	-71.7	131.9	176	-68.7	170.4	154.6	-153	0	109.1	Y184 D185	K182-Y184 HydrophobicContact CB-CD2 4.26Å; K182-Y184 HydrophobicContact CB-CE1 4.37Å; K182-Y184 HydrophobicContact CB-CE2 3.94Å; K182-Y184 HydrophobicContact CD-CE2 3.76Å; K182-Y184 WeakPolarHBondContact CD-OH 3.46Å; K182-Y184 VanDerWaalsContact CE-OH 3.29Å; K182-Y184 WeakPolarHBondContact CE-OH 3.32Å; K182-Y184 HydrophobicContact CG-CE2 4.37Å; K182-Y184 PolarHBondContact NZ-OH 3.18Å; K182-Y184 PolarHBondContact O-N 2.83Å; K182-Y184 VanDerWaalsContact O-N 3.16Å; K182-D185 WeakPolarHBondContact CB-OD2 3.34Å; K182-D185 PolarHBondContact O-N 3.28Å
183	W	75.3	Confident	59	Low	7 Å²	7	72.1 Å²	72.1	3%	0.027	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-64.1	-24.8	-171.8	71.3	-91.7	0	0	0	113.8	V260 L297 P299 L304 F335 E336 L339	W183-V260 HydrophobicContact CB-CG2 3.73Å; W183-L297 PolarHBondContact NE1-O 3.13Å; W183-P299 HydrophobicContact CZ2-CG 4.34Å; W183-L304 HydrophobicContact CH2-CD2 3.66Å; W183-L304 HydrophobicContact CZ2-CD2 3.71Å; W183-F335 HydrophobicContact CB-CE1 4.37Å; W183-F335 AromaticContact CD1-CE1 3.92Å; W183-F335 HydrophobicContact CD2-CD1 4.15Å; W183-F335 AromaticContact CD2-CE1 3.73Å; W183-F335 HydrophobicContact CD2-CE1 3.73Å; W183-F335 AromaticContact CE2-CE1 3.93Å; W183-F335 HydrophobicContact CE3-CD1 4.22Å; W183-F335 HydrophobicContact CE3-CE1 4.26Å; W183-F335 HydrophobicContact CG-CD1 4.42Å; W183-F335 AromaticContact CG-CE1 3.75Å; W183-F335 HydrophobicContact CG-CE1 3.75Å; W183-E336 HydrophobicContact CH2-CB 4.13Å; W183-E336 HydrophobicContact CH2-CG 3.83Å; W183-E336 HydrophobicContact CZ3-CB 4.03Å; W183-E336 HydrophobicContact CZ3-CG 4.13Å; W183-L339 HydrophobicContact CZ2-CD2 3.72Å
184	Y	69.3	Low	59.4	Low	24 Å²	24	70.1 Å²	70.1	9%	0.094	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-83.2	-17.7	-179.7	46.2	-105.8	0	0	0	114.3	K182 L186 S189 D296 P299	K182-Y184 HydrophobicContact CB-CD2 4.26Å; K182-Y184 HydrophobicContact CB-CE1 4.37Å; K182-Y184 HydrophobicContact CB-CE2 3.94Å; K182-Y184 HydrophobicContact CD-CE2 3.76Å; K182-Y184 WeakPolarHBondContact CD-OH 3.46Å; K182-Y184 VanDerWaalsContact CE-OH 3.29Å; K182-Y184 WeakPolarHBondContact CE-OH 3.32Å; K182-Y184 HydrophobicContact CG-CE2 4.37Å; K182-Y184 PolarHBondContact NZ-OH 3.18Å; K182-Y184 PolarHBondContact O-N 2.83Å; K182-Y184 VanDerWaalsContact O-N 3.16Å; Y184-L186 PolarHBondContact O-N 3.38Å; Y184-S189 WeakPolarHBondContact O-CB 3.47Å; Y184-S189 PolarHBondContact O-OG 2.76Å; Y184-D296 WeakPolarHBondContact CE1-O 3.49Å; Y184-P299 HydrophobicContact CD1-CB 4.35Å; Y184-P299 HydrophobicContact CD1-CG 3.86Å; Y184-P299 HydrophobicContact CG-CB 4.24Å; Y184-P299 HydrophobicContact CG-CG 3.95Å
185	D	63.6	Low	59.6	Low	114 Å²	114	73.4 Å²	73.4	61%	0.61	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-73.4	-6.3	175.1	-59.7	-8.2	0	0	0	112	K182	K182-D185 WeakPolarHBondContact CB-OD2 3.34Å; K182-D185 PolarHBondContact O-N 3.28Å
186	L	63.8	Low	59.6	Low	73 Å²	73	78.2 Å²	78.2	38%	0.382	42%	0.418	S	S	.	.	S	Bend	trans	-76.7	122.3	175	-64.5	171.4	0	0	0	110.6	L177 Y184 Y188 S189 L332	L177-L186 HydrophobicContact CD2-CD1 4.41Å; Y184-L186 PolarHBondContact O-N 3.38Å; L186-Y188 PolarHBondContact O-N 2.84Å; L186-S189 WeakPolarHBondContact O-CB 3.42Å; L186-S189 PolarHBondContact O-N 3.14Å; L186-S189 PolarHBondContact O-OG 2.77Å; L186-L332 HydrophobicContact CB-CD1 4.28Å; L186-L332 HydrophobicContact CD1-CD1 3.9Å; L186-L332 HydrophobicContact CD1-CD2 3.79Å
187	E	52.2	Low	59.7	Low	148 Å²	148	78.4 Å²	78.4	69%	0.692	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-31.1	-42.6	-179.1	-62.9	160.2	-165.9	0	0	115.8	S189	E187-S189 VanDerWaalsContact C-N 3.26Å; E187-S189 PolarHBondContact O-N 3Å
188	Y	55.9	Low	60	Low	54 Å²	54	80.6 Å²	80.6	21%	0.212	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-77.3	-4.1	-173.1	-44.1	-42.1	0	0	0	114.7	L186 N190 R329 L332 W333	L186-Y188 PolarHBondContact O-N 2.84Å; Y188-N190 VanDerWaalsContact C-N 3.34Å; Y188-R329 HydrophobicContact CD1-CG 4.24Å; Y188-R329 HydrophobicContact CD2-CG 3.9Å; Y188-R329 HydrophobicContact CG-CG 3.7Å; Y188-L332 HydrophobicContact CD2-CD1 4.25Å; Y188-W333 PolarHBondContact O-NE1 2.93Å
189	S	57.6	Low	60.5	Low	7 Å²	7	78.1 Å²	78.1	5%	0.049	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-64.9	-38.4	177.4	69.5	0	0	0	0	111.5	Y184 L186 E187 E191 R302 R305	Y184-S189 WeakPolarHBondContact O-CB 3.47Å; Y184-S189 PolarHBondContact O-OG 2.76Å; L186-S189 WeakPolarHBondContact O-CB 3.42Å; L186-S189 PolarHBondContact O-N 3.14Å; L186-S189 PolarHBondContact O-OG 2.77Å; E187-S189 VanDerWaalsContact C-N 3.26Å; E187-S189 PolarHBondContact O-N 3Å; S189-E191 PolarHBondContact O-N 2.8Å; S189-R302 VanDerWaalsContact C-NH1 3.32Å; S189-R302 PolarHBondContact O-NH1 3Å; S189-R305 PolarHBondContact O-NH1 3.48Å
190	N	55.1	Low	61.2	Low	106 Å²	106	80.5 Å²	80.5	57%	0.567	44%	0.435	S	S	*	.	S	Bend	trans	-78.3	-8.4	-166.8	-77.3	-33	0	0	0	116	Y188 R305	Y188-N190 VanDerWaalsContact C-N 3.34Å; N190-R305 PolarHBondContact O-NH1 3.09Å; N190-R305 PolarHBondContact O-NH2 3.15Å
191	E	59.7	Low	61.8	Low	38 Å²	38	80 Å²	80	18%	0.178	42%	0.42	C	S	.	.			trans	-74.7	126.6	-177.5	-62.7	-178.5	178.5	0	0	114.3	S189 R305 H310 P311 L318 R329 W333	S189-E191 PolarHBondContact O-N 2.8Å; E191-R305 PolarHBondContact O-NH1 3.4Å; E191-H310 PolarHBondContact O-ND1 3.43Å; E191-H310 VanDerWaalsContact O-ND1 3.15Å; E191-P311 HydrophobicContact CB-CG 4.38Å; E191-L318 WeakPolarHBondContact OE2-CD1 3.18Å; E191-R329 IonicContact OE1-CZ 2.68Å; E191-R329 VanDerWaalsContact OE1-CZ 3.24Å; E191-R329 IonicContact OE1-NH1 3.92Å; E191-R329 PolarHBondContact OE1-NH1 2.99Å; E191-R329 IonicContact OE1-NH2 2.71Å; E191-R329 PolarHBondContact OE1-NH2 3.35Å; E191-R329 IonicContact OE2-CZ 2.77Å; E191-R329 IonicContact OE2-NH1 3.58Å; E191-R329 PolarHBondContact OE2-NH1 3.4Å; E191-W333 HydrophobicContact CB-CZ2 4.4Å; E191-W333 WeakPolarHBondContact OE2-CZ2 3.37Å
192	Y	56.1	Low	62.4	Low	116 Å²	116	77 Å²	77	46%	0.455	39%	0.389	S	S	.	.			trans	-135.9	152.7	-171.4	-178.8	-127.7	0	0	0	112.6	L194 Q309	Y192-L194 HydrophobicContact CD1-CG 4.45Å; Y192-L194 HydrophobicContact CE1-CD2 3.72Å; Y192-L194 HydrophobicContact CE1-CG 3.65Å; Y192-L194 WeakPolarHBondContact OH-CD2 3.42Å; Y192-Q309 HydrophobicContact CD2-CB 4.29Å; Y192-Q309 WeakPolarHBondContact CD2-O 3.42Å; Y192-Q309 HydrophobicContact CE2-CB 4Å
193	S	54	Low	62.9	Low	20 Å²	20	76 Å²	76	14%	0.14	39%	0.391	C	S	.	.			trans	-133	123.6	168.9	-176.3	0	0	0	0	111.6	K195 Q309	S193-K195 VanDerWaalsContact C-N 3.26Å; S193-K195 PolarHBondContact OG-N 3.5Å; S193-K195 VanDerWaalsContact OG-N 3.09Å; S193-K195 PolarHBondContact OG-O 2.97Å; S193-K195 VanDerWaalsContact OG-O 3.14Å; S193-Q309 PolarHBondContact N-O 2.95Å
194	L	54.3	Low	63	Low	148 Å²	148	79 Å²	79	78%	0.775	41%	0.408	S	S	*	.	S	Bend	trans	-74.7	-14.9	165.3	-76	165	0	0	0	113	Y192	Y192-L194 HydrophobicContact CD1-CG 4.45Å; Y192-L194 HydrophobicContact CE1-CD2 3.72Å; Y192-L194 HydrophobicContact CE1-CG 3.65Å; Y192-L194 WeakPolarHBondContact OH-CD2 3.42Å
195	K	53.7	Low	63.5	Low	163 Å²	163	78.4 Å²	78.4	71%	0.709	41%	0.405	S	S	*	.	S	Bend	trans	-88.8	124.6	-175.6	-65.6	-172	177.9	-174.1	0	110.3	S193 Q197	S193-K195 VanDerWaalsContact C-N 3.26Å; S193-K195 PolarHBondContact OG-N 3.5Å; S193-K195 VanDerWaalsContact OG-N 3.09Å; S193-K195 PolarHBondContact OG-O 2.97Å; S193-K195 VanDerWaalsContact OG-O 3.14Å; K195-Q197 PolarHBondContact O-N 3.25Å
196	P	57.5	Low	64.4	Low	128 Å²	128	76.3 Å²	76.3	83%	0.831	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-53.2	126.2	171.9	-26.2	35	0	0	0	111.1
197	Q	61.8	Low	65.3	Low	18 Å²	18	76.3 Å²	76.3	8%	0.084	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-89.9	148	178.9	-63.2	-73.7	-97.1	0	0	110	K195 Q199 V202 F312 D313	K195-Q197 PolarHBondContact O-N 3.25Å; Q197-Q199 PolarHBondContact O-N 3.02Å; Q197-V202 HydrophobicContact CB-CG2 3.67Å; Q197-F312 HydrophobicContact CB-CD2 4.22Å; Q197-F312 HydrophobicContact CG-CD2 4.08Å; Q197-D313 PolarHBondContact NE2-OD2 3.23Å; Q197-D313 PolarHBondContact OE1-OD2 2.99Å
198	P	67.8	Low	66.7	Low	62 Å²	62	69.5 Å²	69.5	40%	0.403	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-60.5	122.3	-178.4	19.6	-29.1	0	0	0	111.7	D200 V201 V202	P198-D200 VanDerWaalsContact C-N 3.26Å; P198-D200 PolarHBondContact O-N 3.26Å; P198-D200 VanDerWaalsContact O-N 3.14Å; P198-V201 HydrophobicContact CB-CG2 4.26Å; P198-V201 HydrophobicContact CG-CB 4.03Å; P198-V201 HydrophobicContact CG-CG2 3.81Å; P198-V201 WeakPolarHBondContact O-CB 3.33Å; P198-V201 PolarHBondContact O-N 3.08Å; P198-V202 PolarHBondContact O-N 2.98Å; P198-V202 VanDerWaalsContact O-N 3.12Å
199	Q	68.3	Low	68	Low	141 Å²	141	66.9 Å²	66.9	66%	0.659	35%	0.352	S	S	*	.	H	α-helix	trans	-53.7	-39.3	-169	-170.8	72.5	-7.8	0	0	113.2	Q197 V201 V202 S203	Q197-Q199 PolarHBondContact O-N 3.02Å; Q199-V201 PolarHBondContact O-N 3.29Å; Q199-V202 PolarHBondContact O-N 3.41Å; Q199-S203 WeakPolarHBondContact O-CB 3.47Å; Q199-S203 PolarHBondContact O-N 3.43Å
200	D	69.5	Low	69.3	Low	120 Å²	120	70.2 Å²	70.2	64%	0.642	37%	0.367	S	S	*	.	H	α-helix	trans	-63.1	-42.3	178.9	-54	-44.6	0	0	0	111.7	P198 S203 N204	P198-D200 VanDerWaalsContact C-N 3.26Å; P198-D200 PolarHBondContact O-N 3.26Å; P198-D200 VanDerWaalsContact O-N 3.14Å; D200-S203 PolarHBondContact O-N 2.9Å; D200-S203 PolarHBondContact O-OG 3.38Å; D200-N204 WeakPolarHBondContact O-CB 3.26Å; D200-N204 VanDerWaalsContact O-CG 3.29Å; D200-N204 PolarHBondContact O-N 3.44Å; D200-N204 PolarHBondContact O-ND2 3.39Å; D200-N204 VanDerWaalsContact O-ND2 3.11Å
201	V	69.9	Low	70.6	Confident	43 Å²	43	70.5 Å²	70.5	26%	0.261	36%	0.363	S	S	.	.	H	α-helix	trans	-67.4	-42.8	178.6	178.2	0	0	0	0	110.5	P198 Q199 S203 N204 Y205 F312	P198-V201 HydrophobicContact CB-CG2 4.26Å; P198-V201 HydrophobicContact CG-CB 4.03Å; P198-V201 HydrophobicContact CG-CG2 3.81Å; P198-V201 WeakPolarHBondContact O-CB 3.33Å; P198-V201 PolarHBondContact O-N 3.08Å; Q199-V201 PolarHBondContact O-N 3.29Å; V201-S203 VanDerWaalsContact C-N 3.32Å; V201-S203 PolarHBondContact O-N 2.91Å; V201-N204 PolarHBondContact O-N 3.45Å; V201-Y205 HydrophobicContact CG1-CD2 3.63Å; V201-Y205 HydrophobicContact CG1-CE2 3.64Å; V201-Y205 WeakPolarHBondContact O-CD2 3.26Å; V201-Y205 PolarHBondContact O-N 3.32Å; V201-F312 HydrophobicContact CG1-CB 4.43Å
202	V	76.6	Confident	71.7	Confident	7 Å²	7	69 Å²	69	4%	0.042	36%	0.357	C	S	.	.	H	α-helix	trans	-60.7	-42.3	173.9	-177.9	0	0	0	0	110.7	Q197 P198 Q199 K206 F307 F312	Q197-V202 HydrophobicContact CB-CG2 3.67Å; P198-V202 PolarHBondContact O-N 2.98Å; P198-V202 VanDerWaalsContact O-N 3.12Å; Q199-V202 PolarHBondContact O-N 3.41Å; V202-K206 VanDerWaalsContact O-CB 3.23Å; V202-K206 WeakPolarHBondContact O-CB 3.5Å; V202-K206 PolarHBondContact O-N 3.5Å; V202-F307 HydrophobicContact CG1-CD1 3.9Å; V202-F307 HydrophobicContact CG1-CE1 4.36Å; V202-F312 HydrophobicContact CG1-CE2 4.19Å; V202-F312 HydrophobicContact CG2-CD2 3.94Å; V202-F312 HydrophobicContact CG2-CE2 4Å
203	S	78.4	Confident	72.9	Confident	58 Å²	58	64 Å²	64	41%	0.406	34%	0.337	S	S	.	.	H	α-helix	trans	-66.1	-43.7	178.7	80.6	0	0	0	0	112.4	Q199 D200 V201 K206 T207	Q199-S203 WeakPolarHBondContact O-CB 3.47Å; Q199-S203 PolarHBondContact O-N 3.43Å; D200-S203 PolarHBondContact O-N 2.9Å; D200-S203 PolarHBondContact O-OG 3.38Å; V201-S203 VanDerWaalsContact C-N 3.32Å; V201-S203 PolarHBondContact O-N 2.91Å; S203-K206 PolarHBondContact O-N 2.82Å; S203-T207 PolarHBondContact O-N 2.94Å
204	N	78.3	Confident	74.3	Confident	70 Å²	70	67.5 Å²	67.5	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-63.1	-49.3	177.2	-73	-36.3	0	0	0	111.2	F167 D200 V201 K206 T207 L208	F167-N204 HydrophobicContact CD1-CB 3.78Å; F167-N204 HydrophobicContact CE1-CB 3.75Å; F167-N204 HydrophobicContact CG-CB 4.34Å; F167-N204 HydrophobicContact CZ-CB 4.3Å; D200-N204 WeakPolarHBondContact O-CB 3.26Å; D200-N204 VanDerWaalsContact O-CG 3.29Å; D200-N204 PolarHBondContact O-N 3.44Å; D200-N204 PolarHBondContact O-ND2 3.39Å; D200-N204 VanDerWaalsContact O-ND2 3.11Å; V201-N204 PolarHBondContact O-N 3.45Å; N204-K206 VanDerWaalsContact C-N 3.29Å; N204-K206 PolarHBondContact O-N 3.1Å; N204-T207 PolarHBondContact O-N 3.14Å; N204-T207 PolarHBondContact O-OG1 3.47Å; N204-L208 PolarHBondContact O-N 3.21Å; N204-L208 VanDerWaalsContact O-N 3.08Å
205	Y	78.8	Confident	75.5	Confident	12 Å²	12	62.1 Å²	62.1	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-31.7	175	-80	-57.8	0	0	0	113	F167 V201 L208 A209 F312 L315 L330	F167-Y205 HydrophobicContact CD1-CD1 4.19Å; F167-Y205 HydrophobicContact CD1-CE1 4.07Å; F167-Y205 HydrophobicContact CE1-CD1 4.12Å; F167-Y205 HydrophobicContact CE1-CD2 4.01Å; F167-Y205 AromaticContact CE1-CE1 3.88Å; F167-Y205 HydrophobicContact CE1-CE1 3.88Å; F167-Y205 AromaticContact CE1-CE2 3.79Å; F167-Y205 HydrophobicContact CE1-CE2 3.79Å; F167-Y205 HydrophobicContact CE1-CG 4.16Å; F167-Y205 AromaticContact CE1-CZ 3.7Å; F167-Y205 HydrophobicContact CZ-CE2 4.46Å; V201-Y205 HydrophobicContact CG1-CD2 3.63Å; V201-Y205 HydrophobicContact CG1-CE2 3.64Å; V201-Y205 WeakPolarHBondContact O-CD2 3.26Å; V201-Y205 PolarHBondContact O-N 3.32Å; Y205-L208 HydrophobicContact CD1-CD2 4.26Å; Y205-L208 PolarHBondContact O-N 2.99Å; Y205-A209 VanDerWaalsContact O-CB 3.23Å; Y205-A209 WeakPolarHBondContact O-CB 3.19Å; Y205-A209 PolarHBondContact O-N 3.41Å; Y205-F312 HydrophobicContact CD2-CB 4.21Å; Y205-F312 AromaticContact CD2-CD1 3.65Å; Y205-F312 HydrophobicContact CD2-CD1 3.65Å; Y205-F312 HydrophobicContact CD2-CE1 4.44Å; Y205-F312 HydrophobicContact CD2-CG 4.16Å; Y205-F312 HydrophobicContact CE2-CB 4.36Å; Y205-F312 HydrophobicContact CE2-CD1 4.38Å; Y205-F312 AromaticContact CG-CD1 3.97Å; Y205-F312 HydrophobicContact CG-CD1 3.97Å; Y205-F312 HydrophobicContact CG-CE1 4.38Å; Y205-L315 HydrophobicContact CD1-CD2 4.4Å; Y205-L315 HydrophobicContact CE1-CD2 4.13Å; Y205-L330 HydrophobicContact CD1-CD1 4.01Å; Y205-L330 HydrophobicContact CD1-CD2 4.06Å; Y205-L330 HydrophobicContact CE1-CD1 4.44Å; Y205-L330 HydrophobicContact CG-CD2 4.32Å
206	K	83	Confident	76.7	Confident	71 Å²	71	54.6 Å²	54.6	31%	0.309	29%	0.289	S	S	.	.	H	α-helix	trans	-66	-42.1	174.7	-174.2	165.3	174.8	170.3	0	112.1	V202 S203 N204 A209 Q210 F307 Y334 H337	V202-K206 VanDerWaalsContact O-CB 3.23Å; V202-K206 WeakPolarHBondContact O-CB 3.5Å; V202-K206 PolarHBondContact O-N 3.5Å; S203-K206 PolarHBondContact O-N 2.82Å; N204-K206 VanDerWaalsContact C-N 3.29Å; N204-K206 PolarHBondContact O-N 3.1Å; K206-A209 PolarHBondContact O-N 2.95Å; K206-Q210 WeakPolarHBondContact O-CB 3.46Å; K206-Q210 PolarHBondContact O-N 3.4Å; K206-F307 HydrophobicContact CB-CD1 3.99Å; K206-F307 HydrophobicContact CB-CE1 3.6Å; K206-F307 HydrophobicContact CB-CZ 4.26Å; K206-F307 HydrophobicContact CD-CD1 4.4Å; K206-F307 HydrophobicContact CG-CD1 4.38Å; K206-F307 HydrophobicContact CG-CE1 4.33Å; K206-Y334 HydrophobicContact CG-CE2 4.3Å; K206-H337 PolarHBondContact NZ-CE1 2.81Å; K206-H337 PolarHBondContact NZ-NE2 2.93Å
207	T	83.3	Confident	77.7	Confident	73 Å²	73	49 Å²	49	45%	0.448	25%	0.252	S	S	.	.	H	α-helix	trans	-69.1	-32.3	175.7	66.7	0	0	0	0	113	S203 N204 K211	S203-T207 PolarHBondContact O-N 2.94Å; N204-T207 PolarHBondContact O-N 3.14Å; N204-T207 PolarHBondContact O-OG1 3.47Å; T207-K211 WeakPolarHBondContact O-CG 3.26Å; T207-K211 PolarHBondContact O-N 3.44Å
208	L	81.3	Confident	78.6	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-68.1	-48.6	172	177.5	61.8	0	0	0	111.2	F169 N204 Y205 Q210 K211 L212 L330	F169-L208 HydrophobicContact CB-CD1 3.97Å; N204-L208 PolarHBondContact O-N 3.21Å; N204-L208 VanDerWaalsContact O-N 3.08Å; Y205-L208 HydrophobicContact CD1-CD2 4.26Å; Y205-L208 PolarHBondContact O-N 2.99Å; L208-Q210 VanDerWaalsContact C-N 3.34Å; L208-Q210 PolarHBondContact O-N 3.21Å; L208-K211 PolarHBondContact O-N 3.4Å; L208-L212 HydrophobicContact CD1-CD1 4.21Å; L208-L212 HydrophobicContact CD1-CG 4.26Å; L208-L212 HydrophobicContact CG-CD1 3.96Å; L208-L212 HydrophobicContact CG-CG 4.44Å; L208-L212 WeakPolarHBondContact O-CG 3.38Å; L208-L212 PolarHBondContact O-N 3.28Å; L208-L330 HydrophobicContact CD2-CD1 4.13Å
209	A	82.6	Confident	79	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-39.5	179.9	0	0	0	0	0	112.2	Y205 K206 L212 Y213 F307 L330 Y334	Y205-A209 VanDerWaalsContact O-CB 3.23Å; Y205-A209 WeakPolarHBondContact O-CB 3.19Å; Y205-A209 PolarHBondContact O-N 3.41Å; K206-A209 PolarHBondContact O-N 2.95Å; A209-L212 PolarHBondContact O-N 2.84Å; A209-Y213 VanDerWaalsContact O-CB 3.29Å; A209-Y213 WeakPolarHBondContact O-CB 3.3Å; A209-Y213 PolarHBondContact O-N 3.38Å; A209-F307 HydrophobicContact CB-CE2 4.12Å; A209-F307 HydrophobicContact CB-CZ 4.02Å; A209-L330 HydrophobicContact CB-CB 4.07Å; A209-Y334 HydrophobicContact CB-CD2 4.12Å; A209-Y334 HydrophobicContact CB-CG 4.23Å
210	Q	85.2	Confident	79.2	Confident	76 Å²	76	46.2 Å²	46.2	36%	0.355	24%	0.237	S	C	.	.	H	α-helix	trans	-58.2	-49.7	172.4	177.7	174.7	-6.1	0	0	111.7	K206 L208 L212 Y213 E214 Y334	K206-Q210 WeakPolarHBondContact O-CB 3.46Å; K206-Q210 PolarHBondContact O-N 3.4Å; L208-Q210 VanDerWaalsContact C-N 3.34Å; L208-Q210 PolarHBondContact O-N 3.21Å; Q210-L212 PolarHBondContact O-N 2.93Å; Q210-Y213 PolarHBondContact O-N 2.84Å; Q210-E214 HydrophobicContact CG-CG 4.41Å; Q210-E214 WeakPolarHBondContact CG-OE1 3.47Å; Q210-E214 PolarHBondContact NE2-OE1 2.81Å; Q210-E214 WeakPolarHBondContact O-CB 3.41Å; Q210-E214 WeakPolarHBondContact O-CG 3.36Å; Q210-E214 PolarHBondContact O-N 2.87Å; Q210-Y334 HydrophobicContact CB-CE2 3.86Å
211	K	83.1	Confident	79.5	Confident	113 Å²	113	44.3 Å²	44.3	49%	0.491	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-41.1	178.7	-71.6	172	-178.6	176.1	0	112.4	F169 T207 L208 H215	F169-K211 HydrophobicContact CD2-CB 3.85Å; F169-K211 HydrophobicContact CE2-CB 4.05Å; F169-K211 HydrophobicContact CG-CB 4.39Å; T207-K211 WeakPolarHBondContact O-CG 3.26Å; T207-K211 PolarHBondContact O-N 3.44Å; L208-K211 PolarHBondContact O-N 3.4Å; K211-H215 WeakPolarHBondContact O-CB 3.41Å; K211-H215 PolarHBondContact O-N 3.04Å
212	L	81.6	Confident	79.8	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-44.4	174.3	-72.8	171.3	0	0	0	111.6	F169 L208 A209 Q210 H215 E216 D327 L330 I331	F169-L212 HydrophobicContact CD2-CD2 3.93Å; F169-L212 HydrophobicContact CD2-CG 4.25Å; F169-L212 HydrophobicContact CE2-CD2 4.11Å; L208-L212 HydrophobicContact CD1-CD1 4.21Å; L208-L212 HydrophobicContact CD1-CG 4.26Å; L208-L212 HydrophobicContact CG-CD1 3.96Å; L208-L212 HydrophobicContact CG-CG 4.44Å; L208-L212 WeakPolarHBondContact O-CG 3.38Å; L208-L212 PolarHBondContact O-N 3.28Å; A209-L212 PolarHBondContact O-N 2.84Å; Q210-L212 PolarHBondContact O-N 2.93Å; L212-H215 PolarHBondContact O-N 3Å; L212-E216 WeakPolarHBondContact O-CB 3.49Å; L212-E216 PolarHBondContact O-N 3.22Å; L212-D327 HydrophobicContact CD1-CB 4.01Å; L212-D327 HydrophobicContact CD2-CB 4.46Å; L212-L330 HydrophobicContact CD1-CD1 4.45Å; L212-I331 HydrophobicContact CB-CD1 3.95Å; L212-I331 HydrophobicContact CB-CG1 3.84Å
213	Y	82.6	Confident	79.4	Confident	10 Å²	10	49.3 Å²	49.3	4%	0.039	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-44.7	179.5	-175.4	-117.3	0	0	0	113	A209 Q210 H215 E216 I217 V260 L263 I331 Y334 F335	A209-Y213 VanDerWaalsContact O-CB 3.29Å; A209-Y213 WeakPolarHBondContact O-CB 3.3Å; A209-Y213 PolarHBondContact O-N 3.38Å; Q210-Y213 PolarHBondContact O-N 2.84Å; Y213-H215 VanDerWaalsContact C-N 3.31Å; Y213-H215 PolarHBondContact O-N 2.77Å; Y213-E216 PolarHBondContact O-N 3.22Å; Y213-I217 HydrophobicContact CD1-CD1 3.83Å; Y213-I217 HydrophobicContact CD2-CD1 4.44Å; Y213-I217 HydrophobicContact CE1-CD1 3.43Å; Y213-I217 VanDerWaalsContact CE1-CD1 3.43Å; Y213-I217 HydrophobicContact CE1-CG1 4.49Å; Y213-I217 HydrophobicContact CE2-CD1 4.08Å; Y213-I217 HydrophobicContact CE2-CG1 4.35Å; Y213-I217 HydrophobicContact CG-CD1 4.34Å; Y213-I217 WeakPolarHBondContact O-CB 3.24Å; Y213-I217 WeakPolarHBondContact O-CG1 3.41Å; Y213-I217 PolarHBondContact O-N 3.27Å; Y213-V260 HydrophobicContact CE2-CG1 4.17Å; Y213-V260 WeakPolarHBondContact CE2-O 3.37Å; Y213-V260 PolarHBondContact OH-O 3.07Å; Y213-L263 HydrophobicContact CE1-CD2 4.41Å; Y213-L263 WeakPolarHBondContact OH-CB 3.45Å; Y213-I331 HydrophobicContact CD2-CG2 4.08Å; Y213-Y334 AromaticContact CD1-CD1 3.7Å; Y213-Y334 HydrophobicContact CD1-CD1 3.7Å; Y213-Y334 AromaticContact CD1-CE1 3.54Å; Y213-Y334 HydrophobicContact CD1-CE1 3.54Å; Y213-Y334 HydrophobicContact CE1-CD1 4.36Å; Y213-Y334 HydrophobicContact CE1-CE1 4.21Å; Y213-Y334 AromaticContact CG-CD1 3.82Å; Y213-Y334 HydrophobicContact CG-CD1 3.82Å; Y213-Y334 HydrophobicContact CG-CE1 4.09Å; Y213-F335 HydrophobicContact CE2-CD2 4.47Å
214	E	83.8	Confident	78.8	Confident	93 Å²	93	48 Å²	48	44%	0.435	24%	0.238	S	C	.	.	H	α-helix	trans	-60	-42	173.9	-73.7	172.5	-167.3	0	0	111.5	Q210 N218	Q210-E214 HydrophobicContact CG-CG 4.41Å; Q210-E214 WeakPolarHBondContact CG-OE1 3.47Å; Q210-E214 PolarHBondContact NE2-OE1 2.81Å; Q210-E214 WeakPolarHBondContact O-CB 3.41Å; Q210-E214 WeakPolarHBondContact O-CG 3.36Å; Q210-E214 PolarHBondContact O-N 2.87Å; E214-N218 WeakPolarHBondContact O-CB 3.42Å; E214-N218 VanDerWaalsContact O-CG 3.22Å; E214-N218 PolarHBondContact O-N 3.47Å; E214-N218 PolarHBondContact O-ND2 2.94Å; E214-N218 VanDerWaalsContact O-ND2 3.08Å
215	H	78.9	Confident	78.2	Confident	36 Å²	36	49.2 Å²	49.2	17%	0.167	24%	0.244	C	C	.	.	H	α-helix	trans	-66	-43.2	175	173.7	-84.3	0	0	0	112.3	F169 R172 K211 L212 Y213 N218 L219	F169-H215 HydrophobicContact CE2-CB 3.93Å; F169-H215 HydrophobicContact CZ-CB 3.8Å; F169-H215 AromaticContact CZ-CD2 3.8Å; F169-H215 AromaticContact CZ-CG 3.87Å; R172-H215 PolarHBondContact N-CE1 3.23Å; R172-H215 VanDerWaalsContact N-CE1 3.3Å; R172-H215 PolarHBondContact N-NE2 2.91Å; R172-H215 PolarHBondContact O-CE1 3.24Å; R172-H215 VanDerWaalsContact O-CE1 3.23Å; R172-H215 PolarHBondContact O-NE2 3.37Å; K211-H215 WeakPolarHBondContact O-CB 3.41Å; K211-H215 PolarHBondContact O-N 3.04Å; L212-H215 PolarHBondContact O-N 3Å; Y213-H215 VanDerWaalsContact C-N 3.31Å; Y213-H215 PolarHBondContact O-N 2.77Å; H215-N218 CarbonylContact O-C 3.59Å; H215-N218 PolarHBondContact O-N 3.47Å; H215-N218 VanDerWaalsContact O-N 3.14Å; H215-L219 PolarHBondContact O-N 2.85Å
216	E	77.8	Confident	77.4	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.019	27%	0.274	C	S	.	.	H	α-helix	trans	-69.4	-35.9	178.3	-161.6	170.7	-155	0	0	112.3	L175 L176 L177 L212 Y213 N218 L219 F220 H261 I331	L175-E216 HydrophobicContact CD2-CG 3.66Å; L176-E216 WeakPolarHBondContact CA-OE1 3.43Å; L176-E216 PolarHBondContact N-OE1 2.95Å; L177-E216 PolarHBondContact N-OE1 3.46Å; L212-E216 WeakPolarHBondContact O-CB 3.49Å; L212-E216 PolarHBondContact O-N 3.22Å; Y213-E216 PolarHBondContact O-N 3.22Å; E216-N218 VanDerWaalsContact C-N 3.29Å; E216-N218 PolarHBondContact O-N 2.96Å; E216-L219 WeakPolarHBondContact O-CB 3.47Å; E216-L219 PolarHBondContact O-N 3.15Å; E216-F220 WeakPolarHBondContact O-CB 3.38Å; E216-F220 PolarHBondContact O-N 2.98Å; E216-H261 WeakPolarHBondContact CG-NE2 3.24Å; E216-H261 IonicContact OE1-NE2 2.67Å; E216-I331 VanDerWaalsContact OE2-CD1 3.24Å; E216-I331 WeakPolarHBondContact OE2-CD1 3.47Å
217	I	80.1	Confident	76.4	Confident	11 Å²	11	55.8 Å²	55.8	6%	0.056	29%	0.287	C	S	.	.	H	α-helix	trans	-58.1	-41.6	167.2	-76.4	172.8	0	0	0	111.2	Y213 F220 K221	Y213-I217 HydrophobicContact CD1-CD1 3.83Å; Y213-I217 HydrophobicContact CD2-CD1 4.44Å; Y213-I217 HydrophobicContact CE1-CD1 3.43Å; Y213-I217 VanDerWaalsContact CE1-CD1 3.43Å; Y213-I217 HydrophobicContact CE1-CG1 4.49Å; Y213-I217 HydrophobicContact CE2-CD1 4.08Å; Y213-I217 HydrophobicContact CE2-CG1 4.35Å; Y213-I217 HydrophobicContact CG-CD1 4.34Å; Y213-I217 WeakPolarHBondContact O-CB 3.24Å; Y213-I217 WeakPolarHBondContact O-CG1 3.41Å; Y213-I217 PolarHBondContact O-N 3.27Å; I217-F220 PolarHBondContact O-N 3.06Å; I217-K221 HydrophobicContact CG2-CD 3.94Å; I217-K221 HydrophobicContact CG2-CG 4.45Å; I217-K221 WeakPolarHBondContact O-CB 3.44Å; I217-K221 VanDerWaalsContact O-CG 3.31Å; I217-K221 WeakPolarHBondContact O-CG 3.33Å; I217-K221 PolarHBondContact O-N 3.42Å
218	N	79.3	Confident	74.7	Confident	96 Å²	96	61 Å²	61	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-72.2	-33.5	179.1	-72.1	-30.8	0	0	0	112.4	E214 H215 E216 S222	E214-N218 WeakPolarHBondContact O-CB 3.42Å; E214-N218 VanDerWaalsContact O-CG 3.22Å; E214-N218 PolarHBondContact O-N 3.47Å; E214-N218 PolarHBondContact O-ND2 2.94Å; E214-N218 VanDerWaalsContact O-ND2 3.08Å; H215-N218 CarbonylContact O-C 3.59Å; H215-N218 PolarHBondContact O-N 3.47Å; H215-N218 VanDerWaalsContact O-N 3.14Å; E216-N218 VanDerWaalsContact C-N 3.29Å; E216-N218 PolarHBondContact O-N 2.96Å; N218-S222 WeakPolarHBondContact O-CB 3.38Å; N218-S222 PolarHBondContact O-N 2.93Å; N218-S222 PolarHBondContact O-OG 3.19Å
219	L	76.7	Confident	73.7	Confident	30 Å²	30	62.3 Å²	62.3	16%	0.157	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-42.6	165.8	-75.2	178.7	0	0	0	111.8	R172 L175 H215 E216 S222 K223	R172-L219 WeakPolarHBondContact O-CD1 3.43Å; R172-L219 WeakPolarHBondContact O-CD2 3.48Å; L175-L219 HydrophobicContact CD2-CB 3.64Å; H215-L219 PolarHBondContact O-N 2.85Å; E216-L219 WeakPolarHBondContact O-CB 3.47Å; E216-L219 PolarHBondContact O-N 3.15Å; L219-S222 WeakPolarHBondContact CA-OG 3.41Å; L219-S222 PolarHBondContact O-N 2.83Å; L219-S222 PolarHBondContact O-OG 3.42Å; L219-K223 WeakPolarHBondContact O-CB 3.35Å; L219-K223 PolarHBondContact O-N 2.89Å
220	F	73.3	Confident	72.7	Confident	37 Å²	37	66.1 Å²	66.1	16%	0.162	35%	0.35	C	S	.	.	H	α-helix	trans	-67.1	-43.9	179.6	-173.8	-93	0	0	0	111.5	L175 P179 E216 I217 K223 T224 D258 H261	L175-F220 HydrophobicContact CD1-CD2 4.02Å; L175-F220 HydrophobicContact CD2-CB 4.1Å; P179-F220 HydrophobicContact CB-CE2 4.36Å; E216-F220 WeakPolarHBondContact O-CB 3.38Å; E216-F220 PolarHBondContact O-N 2.98Å; I217-F220 PolarHBondContact O-N 3.06Å; F220-K223 PolarHBondContact O-N 2.95Å; F220-T224 HydrophobicContact CD1-CG2 4.11Å; F220-T224 HydrophobicContact CE1-CG2 3.83Å; F220-T224 HydrophobicContact CE2-CG2 4.37Å; F220-T224 HydrophobicContact CG-CG2 4.5Å; F220-T224 HydrophobicContact CZ-CG2 3.97Å; F220-T224 WeakPolarHBondContact O-CB 3.31Å; F220-T224 VanDerWaalsContact O-CG2 3.3Å; F220-T224 WeakPolarHBondContact O-CG2 3.42Å; F220-T224 PolarHBondContact O-N 2.72Å; F220-T224 PolarHBondContact O-OG1 3.02Å; F220-D258 HydrophobicContact CE2-CB 4.13Å; F220-D258 WeakPolarHBondContact CE2-OD2 3.43Å; F220-D258 HydrophobicContact CZ-CB 3.96Å; F220-H261 HydrophobicContact CB-CB 4.02Å; F220-H261 HydrophobicContact CD1-CB 3.66Å; F220-H261 HydrophobicContact CD2-CB 3.76Å; F220-H261 AromaticContact CD2-CD2 3.95Å; F220-H261 AromaticContact CD2-CG 3.56Å; F220-H261 AromaticContact CD2-ND1 3.76Å; F220-H261 HydrophobicContact CE1-CB 3.98Å; F220-H261 HydrophobicContact CE2-CB 4.07Å; F220-H261 HydrophobicContact CG-CB 3.54Å; F220-H261 AromaticContact CG-CD2 3.97Å; F220-H261 AromaticContact CG-CG 3.7Å; F220-H261 HydrophobicContact CZ-CB 4.17Å
221	K	75.6	Confident	71.7	Confident	80 Å²	80	66.1 Å²	66.1	35%	0.348	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-46.3	173.7	-74.9	172.8	178.6	177.3	0	112.2	I217 T224 N225	I217-K221 HydrophobicContact CG2-CD 3.94Å; I217-K221 HydrophobicContact CG2-CG 4.45Å; I217-K221 WeakPolarHBondContact O-CB 3.44Å; I217-K221 VanDerWaalsContact O-CG 3.31Å; I217-K221 WeakPolarHBondContact O-CG 3.33Å; I217-K221 PolarHBondContact O-N 3.42Å; K221-T224 PolarHBondContact O-OG1 2.99Å; K221-N225 VanDerWaalsContact O-CB 3.26Å; K221-N225 WeakPolarHBondContact O-CB 3.41Å; K221-N225 PolarHBondContact O-N 3.25Å; K221-N225 PolarHBondContact O-ND2 3.46Å
222	S	74.8	Confident	71.2	Confident	61 Å²	61	61.9 Å²	61.9	43%	0.427	34%	0.343	S	S	.	.	H	α-helix	trans	-67.5	-42.9	177.7	54.5	0	0	0	0	111.8	N218 L219 N225 S226	N218-S222 WeakPolarHBondContact O-CB 3.38Å; N218-S222 PolarHBondContact O-N 2.93Å; N218-S222 PolarHBondContact O-OG 3.19Å; L219-S222 WeakPolarHBondContact CA-OG 3.41Å; L219-S222 PolarHBondContact O-N 2.83Å; L219-S222 PolarHBondContact O-OG 3.42Å; S222-N225 CarbonylContact O-C 3.59Å; S222-N225 PolarHBondContact O-N 3.2Å; S222-S226 WeakPolarHBondContact O-CB 3.11Å; S222-S226 PolarHBondContact O-N 3.24Å; S222-S226 PolarHBondContact O-OG 3.01Å
223	K	69.8	Low	70.8	Confident	93 Å²	93	65.9 Å²	65.9	40%	0.404	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-45.2	176.1	-169.2	-178.5	-179.8	-174.7	0	112.6	L175 L219 F220 N225 S226 Q227	L175-K223 HydrophobicContact CD1-CD 3.74Å; L175-K223 HydrophobicContact CG-CD 4.22Å; L219-K223 WeakPolarHBondContact O-CB 3.35Å; L219-K223 PolarHBondContact O-N 2.89Å; F220-K223 PolarHBondContact O-N 2.95Å; K223-N225 VanDerWaalsContact C-N 3.29Å; K223-N225 PolarHBondContact O-N 3.3Å; K223-S226 PolarHBondContact O-N 2.81Å; K223-Q227 WeakPolarHBondContact O-CB 3.35Å; K223-Q227 WeakPolarHBondContact O-CG 3.45Å; K223-Q227 PolarHBondContact O-N 3.23Å
224	T	65.4	Low	70.5	Confident	31 Å²	31	73.5 Å²	73.5	19%	0.19	40%	0.396	C	S	.	.	H	α-helix	trans	-71.2	-20.2	175.6	58.8	0	0	0	0	113.7	F220 K221	F220-T224 HydrophobicContact CD1-CG2 4.11Å; F220-T224 HydrophobicContact CE1-CG2 3.83Å; F220-T224 HydrophobicContact CE2-CG2 4.37Å; F220-T224 HydrophobicContact CG-CG2 4.5Å; F220-T224 HydrophobicContact CZ-CG2 3.97Å; F220-T224 WeakPolarHBondContact O-CB 3.31Å; F220-T224 VanDerWaalsContact O-CG2 3.3Å; F220-T224 WeakPolarHBondContact O-CG2 3.42Å; F220-T224 PolarHBondContact O-N 2.72Å; F220-T224 PolarHBondContact O-OG1 3.02Å; K221-T224 PolarHBondContact O-OG1 2.99Å
225	N	66	Low	70.2	Confident	95 Å²	95	70.6 Å²	70.6	51%	0.508	38%	0.383	S	S	.	.	H	α-helix	trans	-84.8	-24.7	170.1	-70.7	-17	0	0	0	112.6	K221 S222 K223 K228 K236	K221-N225 VanDerWaalsContact O-CB 3.26Å; K221-N225 WeakPolarHBondContact O-CB 3.41Å; K221-N225 PolarHBondContact O-N 3.25Å; K221-N225 PolarHBondContact O-ND2 3.46Å; S222-N225 CarbonylContact O-C 3.59Å; S222-N225 PolarHBondContact O-N 3.2Å; K223-N225 VanDerWaalsContact C-N 3.29Å; K223-N225 PolarHBondContact O-N 3.3Å; N225-K228 VanDerWaalsContact O-CG 3.25Å; N225-K228 WeakPolarHBondContact O-CG 3.24Å; N225-K236 PolarHBondContact OD1-NZ 3.14Å
226	S	61.4	Low	70.1	Confident	97 Å²	97	72.6 Å²	72.6	68%	0.678	39%	0.391	S	S	*	.	H	α-helix	trans	-82.9	-35	173.3	-71.9	0	0	0	0	112.6	S222 K223 K228	S222-S226 WeakPolarHBondContact O-CB 3.11Å; S222-S226 PolarHBondContact O-N 3.24Å; S222-S226 PolarHBondContact O-OG 3.01Å; K223-S226 PolarHBondContact O-N 2.81Å; S226-K228 PolarHBondContact O-N 3.18Å
227	Q	61.2	Low	70.3	Confident	124 Å²	124	74.4 Å²	74.4	58%	0.579	41%	0.407	S	S	*	.	S	Bend	trans	-74.1	71.5	167.4	-68.2	-177.1	-81.1	0	0	109.8	K223 G229	K223-Q227 WeakPolarHBondContact O-CB 3.35Å; K223-Q227 WeakPolarHBondContact O-CG 3.45Å; K223-Q227 PolarHBondContact O-N 3.23Å; Q227-G229 PolarHBondContact O-N 2.66Å
228	K	49.5	Very low	70.5	Confident	183 Å²	183	75.3 Å²	75.3	80%	0.796	41%	0.412	S	S	*	.			trans	-70.7	58.6	-177.9	-64.8	-176.8	179.8	178.6	0	113.4	N225 S226	N225-K228 VanDerWaalsContact O-CG 3.25Å; N225-K228 WeakPolarHBondContact O-CG 3.24Å; S226-K228 PolarHBondContact O-N 3.18Å
229	G	59.2	Low	70.6	Confident	32 Å²	32	72.2 Å²	72.2	33%	0.33	40%	0.396	S	S	.	.			trans	-75.6	133.4	163.7	0	0	0	0	0	110.2	Q227 S231 S232	Q227-G229 PolarHBondContact O-N 2.66Å; G229-S231 PolarHBondContact O-N 3.46Å; G229-S231 VanDerWaalsContact O-N 3.08Å; G229-S232 PolarHBondContact O-N 3.27Å
230	A	61.3	Low	70.8	Confident	79 Å²	79	75.1 Å²	75.1	65%	0.653	42%	0.419	S	S	*	.	H	α-helix	trans	-54.9	-30.1	-179.8	0	0	0	0	0	113	T233 W234	A230-T233 WeakPolarHBondContact CA-OG1 3.5Å; A230-T233 PolarHBondContact O-OG1 3.41Å; A230-W234 WeakPolarHBondContact O-CB 3.34Å; A230-W234 PolarHBondContact O-N 2.92Å
231	S	64.9	Low	71.2	Confident	77 Å²	77	78 Å²	78	54%	0.538	44%	0.444	S	S	.	.	H	α-helix	trans	-59.5	-45.6	173.4	49.3	0	0	0	0	113.8	G229 T233 W234 M235	G229-S231 PolarHBondContact O-N 3.46Å; G229-S231 VanDerWaalsContact O-N 3.08Å; S231-T233 PolarHBondContact O-N 2.97Å; S231-W234 PolarHBondContact O-N 3.41Å; S231-M235 WeakPolarHBondContact O-CG 3.49Å; S231-M235 PolarHBondContact O-N 2.9Å
232	S	71.4	Confident	71.5	Confident	23 Å²	23	75.3 Å²	75.3	16%	0.161	44%	0.439	C	S	.	.	H	α-helix	trans	-66.3	-41.1	179.8	-171	0	0	0	0	111.4	G229 K236	G229-S232 PolarHBondContact O-N 3.27Å; S232-K236 WeakPolarHBondContact O-CB 3.36Å; S232-K236 WeakPolarHBondContact O-CD 3.35Å; S232-K236 VanDerWaalsContact O-CG 3.29Å; S232-K236 WeakPolarHBondContact O-CG 3.36Å; S232-K236 PolarHBondContact O-N 2.94Å; S232-K236 PolarHBondContact OG-NZ 2.95Å
233	T	73.3	Confident	71.9	Confident	91 Å²	91	76.4 Å²	76.4	56%	0.558	44%	0.443	S	S	*	.	H	α-helix	trans	-65.7	-36.9	173.6	38.8	0	0	0	0	112.6	A230 S231 A237	A230-T233 WeakPolarHBondContact CA-OG1 3.5Å; A230-T233 PolarHBondContact O-OG1 3.41Å; S231-T233 PolarHBondContact O-N 2.97Å; T233-A237 WeakPolarHBondContact O-CB 3.43Å; T233-A237 PolarHBondContact O-N 3.29Å
234	W	77.8	Confident	72.4	Confident	170 Å²	170	73.4 Å²	73.4	64%	0.644	43%	0.431	S	S	*	.	H	α-helix	trans	-68.9	-44	177.1	178.1	79.2	0	0	0	112.1	A230 S231 A237 I238	A230-W234 WeakPolarHBondContact O-CB 3.34Å; A230-W234 PolarHBondContact O-N 2.92Å; S231-W234 PolarHBondContact O-N 3.41Å; W234-A237 WeakPolarHBondContact O-CB 3.26Å; W234-A237 PolarHBondContact O-N 3.4Å; W234-I238 HydrophobicContact CD2-CD1 3.69Å; W234-I238 VanDerWaalsContact CE2-CD1 3.46Å; W234-I238 HydrophobicContact CE3-CD1 3.9Å; W234-I238 HydrophobicContact CG-CD1 4.41Å; W234-I238 HydrophobicContact CH2-CD1 3.71Å; W234-I238 HydrophobicContact CZ2-CD1 3.49Å; W234-I238 VanDerWaalsContact CZ2-CD1 3.49Å; W234-I238 HydrophobicContact CZ3-CD1 3.9Å; W234-I238 WeakPolarHBondContact O-CG1 3.39Å; W234-I238 PolarHBondContact O-N 3.25Å
235	M	75.7	Confident	73.1	Confident	33 Å²	33	73.3 Å²	73.3	16%	0.163	44%	0.437	C	S	.	.	H	α-helix	trans	-62.6	-43.1	173.4	-68.9	-167.3	-69.8	0	0	111.9	S231 A237 I238 V239 L254	S231-M235 WeakPolarHBondContact O-CG 3.49Å; S231-M235 PolarHBondContact O-N 2.9Å; M235-A237 VanDerWaalsContact C-N 3.3Å; M235-A237 PolarHBondContact O-N 3.29Å; M235-I238 PolarHBondContact O-N 3.4Å; M235-I238 VanDerWaalsContact O-N 3.16Å; M235-V239 WeakPolarHBondContact O-CG2 3.39Å; M235-V239 PolarHBondContact O-N 3.17Å; M235-L254 HydrophobicContact CB-CD1 4.39Å; M235-L254 HydrophobicContact CE-CD2 3.79Å; M235-L254 HydrophobicContact SD-CD2 4.07Å; M235-L254 HydrophobicContact SD-CG 4.38Å
236	K	77.8	Confident	74.1	Confident	77 Å²	77	72.5 Å²	72.5	34%	0.335	43%	0.432	S	S	.	.	H	α-helix	trans	-61.2	-36.2	173.8	-73.6	165.2	179.3	164.4	0	112.2	N225 S232 S240	N225-K236 PolarHBondContact OD1-NZ 3.14Å; S232-K236 WeakPolarHBondContact O-CB 3.36Å; S232-K236 WeakPolarHBondContact O-CD 3.35Å; S232-K236 VanDerWaalsContact O-CG 3.29Å; S232-K236 WeakPolarHBondContact O-CG 3.36Å; S232-K236 PolarHBondContact O-N 2.94Å; S232-K236 PolarHBondContact OG-NZ 2.95Å; K236-S240 PolarHBondContact O-N 3.26Å; K236-S240 PolarHBondContact O-OG 3.43Å
237	A	82.2	Confident	75.2	Confident	43 Å²	43	71.1 Å²	71.1	36%	0.355	41%	0.412	S	S	.	.	H	α-helix	trans	-68.8	-39	172.9	0	0	0	0	0	112.6	T233 W234 M235 S240 S241	T233-A237 WeakPolarHBondContact O-CB 3.43Å; T233-A237 PolarHBondContact O-N 3.29Å; W234-A237 WeakPolarHBondContact O-CB 3.26Å; W234-A237 PolarHBondContact O-N 3.4Å; M235-A237 VanDerWaalsContact C-N 3.3Å; M235-A237 PolarHBondContact O-N 3.29Å; A237-S240 PolarHBondContact O-N 2.76Å; A237-S240 PolarHBondContact O-OG 2.89Å; A237-S241 PolarHBondContact O-N 3.35Å; A237-S241 PolarHBondContact O-OG 3.04Å
238	I	84.7	Confident	76.3	Confident	30 Å²	30	65.4 Å²	65.4	15%	0.154	39%	0.386	C	S	.	.	H	α-helix	trans	-65	-51.6	175.3	-71.2	169.8	0	0	0	110.6	W234 M235 S240 S241 G242 D246 R247 A250	W234-I238 HydrophobicContact CD2-CD1 3.69Å; W234-I238 VanDerWaalsContact CE2-CD1 3.46Å; W234-I238 HydrophobicContact CE3-CD1 3.9Å; W234-I238 HydrophobicContact CG-CD1 4.41Å; W234-I238 HydrophobicContact CH2-CD1 3.71Å; W234-I238 HydrophobicContact CZ2-CD1 3.49Å; W234-I238 VanDerWaalsContact CZ2-CD1 3.49Å; W234-I238 HydrophobicContact CZ3-CD1 3.9Å; W234-I238 WeakPolarHBondContact O-CG1 3.39Å; W234-I238 PolarHBondContact O-N 3.25Å; M235-I238 PolarHBondContact O-N 3.4Å; M235-I238 VanDerWaalsContact O-N 3.16Å; I238-S240 PolarHBondContact O-N 3.29Å; I238-S240 VanDerWaalsContact O-N 3.11Å; I238-S241 PolarHBondContact O-N 2.97Å; I238-G242 WeakPolarHBondContact O-CA 3.46Å; I238-G242 PolarHBondContact O-N 3.27Å; I238-D246 HydrophobicContact CG2-CB 3.66Å; I238-D246 VanDerWaalsContact CG2-O 3.31Å; I238-D246 WeakPolarHBondContact CG2-O 3.25Å; I238-R247 WeakPolarHBondContact O-CG 3.22Å; I238-A250 HydrophobicContact CB-CB 4.28Å; I238-A250 HydrophobicContact CG2-CB 3.68Å
239	V	80.6	Confident	77.9	Confident	30 Å²	30	59 Å²	59	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-56.1	-32.3	-179.8	173.6	0	0	0	0	112.2	M235 R247 A250 M251 L254 F265	M235-V239 WeakPolarHBondContact O-CG2 3.39Å; M235-V239 PolarHBondContact O-N 3.17Å; V239-R247 WeakPolarHBondContact O-CD 3.37Å; V239-R247 WeakPolarHBondContact O-CG 3.49Å; V239-A250 HydrophobicContact CG2-CB 3.63Å; V239-M251 HydrophobicContact CG1-CG 4.11Å; V239-M251 HydrophobicContact CG2-CG 4.17Å; V239-L254 HydrophobicContact CG2-CD1 3.87Å; V239-F265 HydrophobicContact CG1-CD1 4.46Å; V239-F265 HydrophobicContact CG1-CE1 4.05Å; V239-F265 HydrophobicContact CG1-CZ 4.48Å
240	S	80.9	Confident	79.2	Confident	92 Å²	92	57.9 Å²	57.9	64%	0.643	35%	0.354	S	S	*	.	H	α-helix	trans	-90.6	-32.8	-179.6	51.8	0	0	0	0	115.3	K236 A237 I238	K236-S240 PolarHBondContact O-N 3.26Å; K236-S240 PolarHBondContact O-OG 3.43Å; A237-S240 PolarHBondContact O-N 2.76Å; A237-S240 PolarHBondContact O-OG 2.89Å; I238-S240 PolarHBondContact O-N 3.29Å; I238-S240 VanDerWaalsContact O-N 3.11Å
241	S	81.3	Confident	80.2	Confident	97 Å²	97	54.3 Å²	54.3	68%	0.678	32%	0.324	S	S	*	.	H	α-helix	trans	-132.5	-7.1	-169.9	70.5	0	0	0	0	116.6	A237 I238	A237-S241 PolarHBondContact O-N 3.35Å; A237-S241 PolarHBondContact O-OG 3.04Å; I238-S241 PolarHBondContact O-N 2.97Å
242	G	81.3	Confident	81.1	Confident	23 Å²	23	52.1 Å²	52.1	24%	0.237	31%	0.306	C	S	.	.	S	Bend	trans	-70.8	176.4	178	0	0	0	0	0	113.7	I238 R247	I238-G242 WeakPolarHBondContact O-CA 3.46Å; I238-G242 PolarHBondContact O-N 3.27Å; G242-R247 WeakPolarHBondContact O-CD 3.39Å; G242-R247 PolarHBondContact O-NE 3.35Å; G242-R247 VanDerWaalsContact O-NE 3.09Å
243	T	84.9	Confident	81.8	Confident	85 Å²	85	55.4 Å²	55.4	52%	0.521	32%	0.321	S	S	.	.			trans	-66.1	174.5	175.6	77.9	0	0	0	0	111	G245 D246 R247	T243-G245 VanDerWaalsContact C-N 3.34Å; T243-G245 PolarHBondContact O-N 3Å; T243-G245 PolarHBondContact OG1-N 3.08Å; T243-D246 WeakPolarHBondContact CB-OD2 3.31Å; T243-D246 VanDerWaalsContact CG2-OD2 3.25Å; T243-D246 WeakPolarHBondContact CG2-OD2 3.5Å; T243-D246 PolarHBondContact N-OD2 2.85Å; T243-D246 PolarHBondContact OG1-N 3.15Å; T243-D246 PolarHBondContact OG1-OD2 2.66Å; T243-R247 VanDerWaalsContact O-CB 3.31Å; T243-R247 WeakPolarHBondContact O-CB 3.26Å; T243-R247 VanDerWaalsContact O-CG 3.25Å; T243-R247 WeakPolarHBondContact O-CG 3.4Å; T243-R247 PolarHBondContact O-N 2.82Å; T243-R247 PolarHBondContact O-NE 3.46Å
244	L	78.7	Confident	82.2	Confident	29 Å²	29	52.5 Å²	52.5	15%	0.152	30%	0.302	C	S	.	.	H	α-helix	trans	-59.3	-44.9	176.4	-179.3	68.2	0	0	0	111.9	M248 Q281 M284	L244-M248 HydrophobicContact CD1-CE 3.87Å; L244-M248 VanDerWaalsContact O-CG 3.24Å; L244-M248 WeakPolarHBondContact O-CG 3.19Å; L244-M248 PolarHBondContact O-N 2.99Å; L244-M248 VanDerWaalsContact O-N 3.11Å; L244-Q281 HydrophobicContact CD1-CB 4.24Å; L244-Q281 HydrophobicContact CD1-CG 3.92Å; L244-Q281 HydrophobicContact CD2-CB 4.34Å; L244-Q281 HydrophobicContact CD2-CG 3.83Å; L244-Q281 HydrophobicContact CG-CG 4.48Å; L244-M284 HydrophobicContact CD2-CB 4.21Å; L244-M284 HydrophobicContact CD2-CE 4.3Å; L244-M284 HydrophobicContact CD2-CG 4.38Å; L244-M284 HydrophobicContact CD2-SD 3.55Å; L244-M284 VanDerWaalsContact CD2-SD 3.55Å; L244-M284 HydrophobicContact CG-SD 4.4Å
245	G	81.2	Confident	82.4	Confident	30 Å²	30	44.5 Å²	44.5	31%	0.309	27%	0.272	S	S	.	.	H	α-helix	trans	-63.5	-49.5	179.4	0	0	0	0	0	111.9	T243 R247 M248 A249	T243-G245 VanDerWaalsContact C-N 3.34Å; T243-G245 PolarHBondContact O-N 3Å; T243-G245 PolarHBondContact OG1-N 3.08Å; G245-R247 VanDerWaalsContact C-N 3.31Å; G245-R247 PolarHBondContact O-N 2.77Å; G245-M248 PolarHBondContact O-N 3.18Å; G245-M248 VanDerWaalsContact O-N 3.12Å; G245-A249 PolarHBondContact O-N 2.78Å
246	D	86.8	Confident	82.7	Confident	77 Å²	77	46.9 Å²	46.9	41%	0.412	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-39.3	-179.2	-41.7	-44.5	0	0	0	111.8	I238 T243 A249 A250	I238-D246 HydrophobicContact CG2-CB 3.66Å; I238-D246 VanDerWaalsContact CG2-O 3.31Å; I238-D246 WeakPolarHBondContact CG2-O 3.25Å; T243-D246 WeakPolarHBondContact CB-OD2 3.31Å; T243-D246 VanDerWaalsContact CG2-OD2 3.25Å; T243-D246 WeakPolarHBondContact CG2-OD2 3.5Å; T243-D246 PolarHBondContact N-OD2 2.85Å; T243-D246 PolarHBondContact OG1-N 3.15Å; T243-D246 PolarHBondContact OG1-OD2 2.66Å; D246-A249 PolarHBondContact O-N 2.87Å; D246-A250 VanDerWaalsContact O-CB 3.26Å; D246-A250 WeakPolarHBondContact O-CB 3.46Å; D246-A250 PolarHBondContact O-N 2.81Å
247	R	84.4	Confident	82.6	Confident	69 Å²	69	47.8 Å²	47.8	26%	0.26	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-42	175.1	-77.6	-176	-65.5	151.5	4	112.1	I238 V239 G242 T243 G245 M251	I238-R247 WeakPolarHBondContact O-CG 3.22Å; V239-R247 WeakPolarHBondContact O-CD 3.37Å; V239-R247 WeakPolarHBondContact O-CG 3.49Å; G242-R247 WeakPolarHBondContact O-CD 3.39Å; G242-R247 PolarHBondContact O-NE 3.35Å; G242-R247 VanDerWaalsContact O-NE 3.09Å; T243-R247 VanDerWaalsContact O-CB 3.31Å; T243-R247 WeakPolarHBondContact O-CB 3.26Å; T243-R247 VanDerWaalsContact O-CG 3.25Å; T243-R247 WeakPolarHBondContact O-CG 3.4Å; T243-R247 PolarHBondContact O-N 2.82Å; T243-R247 PolarHBondContact O-NE 3.46Å; G245-R247 VanDerWaalsContact C-N 3.31Å; G245-R247 PolarHBondContact O-N 2.77Å; R247-M251 WeakPolarHBondContact O-CB 3.45Å; R247-M251 WeakPolarHBondContact O-CE 3.46Å; R247-M251 WeakPolarHBondContact O-CG 3.44Å; R247-M251 PolarHBondContact O-N 3.13Å
248	M	83.6	Confident	82.3	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.02	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-48.6	176.5	-66.7	-66.6	165	0	0	111.3	L244 G245 A250 M251 I252 L269 L272 A285 T288	L244-M248 HydrophobicContact CD1-CE 3.87Å; L244-M248 VanDerWaalsContact O-CG 3.24Å; L244-M248 WeakPolarHBondContact O-CG 3.19Å; L244-M248 PolarHBondContact O-N 2.99Å; L244-M248 VanDerWaalsContact O-N 3.11Å; G245-M248 PolarHBondContact O-N 3.18Å; G245-M248 VanDerWaalsContact O-N 3.12Å; M248-A250 VanDerWaalsContact C-N 3.33Å; M248-A250 PolarHBondContact O-N 3.22Å; M248-M251 HydrophobicContact CE-CE 4.15Å; M248-M251 PolarHBondContact O-N 2.98Å; M248-M251 VanDerWaalsContact O-N 3.16Å; M248-M251 HydrophobicContact SD-CE 3.71Å; M248-I252 WeakPolarHBondContact O-CG1 3.19Å; M248-I252 PolarHBondContact O-N 3.27Å; M248-L269 HydrophobicContact CE-CD2 4.07Å; M248-L269 HydrophobicContact SD-CD2 3.3Å; M248-L269 WeakPolarHBondContact SD-CD2 3.49Å; M248-L272 HydrophobicContact CE-CD1 3.77Å; M248-A285 HydrophobicContact CE-CB 3.63Å; M248-A285 HydrophobicContact SD-CB 4.36Å; M248-T288 HydrophobicContact CB-CG2 4.09Å; M248-T288 HydrophobicContact CG-CG2 4.46Å
249	A	84.8	Confident	82	Confident	48 Å²	48	45.4 Å²	45.4	40%	0.397	28%	0.275	S	S	.	.	H	α-helix	trans	-60	-41.2	177.8	0	0	0	0	0	112.4	G245 D246 I252 L253	G245-A249 PolarHBondContact O-N 2.78Å; D246-A249 PolarHBondContact O-N 2.87Å; A249-I252 PolarHBondContact O-N 2.81Å; A249-L253 WeakPolarHBondContact O-CG 3.44Å; A249-L253 PolarHBondContact O-N 2.69Å
250	A	85.6	Confident	81.8	Confident	8 Å²	8	44.3 Å²	44.3	7%	0.066	27%	0.268	C	S	.	.	H	α-helix	trans	-68.6	-35.3	175.5	0	0	0	0	0	112.8	I238 V239 D246 M248 L254	I238-A250 HydrophobicContact CB-CB 4.28Å; I238-A250 HydrophobicContact CG2-CB 3.68Å; V239-A250 HydrophobicContact CG2-CB 3.63Å; D246-A250 VanDerWaalsContact O-CB 3.26Å; D246-A250 WeakPolarHBondContact O-CB 3.46Å; D246-A250 PolarHBondContact O-N 2.81Å; M248-A250 VanDerWaalsContact C-N 3.33Å; M248-A250 PolarHBondContact O-N 3.22Å; A250-L254 WeakPolarHBondContact O-CB 3.36Å; A250-L254 VanDerWaalsContact O-CD1 3.32Å; A250-L254 WeakPolarHBondContact O-CD1 3.34Å; A250-L254 WeakPolarHBondContact O-CG 3.43Å; A250-L254 PolarHBondContact O-N 3.44Å; A250-L254 VanDerWaalsContact O-N 3.14Å
251	M	81.8	Confident	81.4	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.02	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-39.1	171.9	-75.1	-175.3	-66.6	0	0	112	V239 R247 M248 L254 I255 F265 T268 L269 L272	V239-M251 HydrophobicContact CG1-CG 4.11Å; V239-M251 HydrophobicContact CG2-CG 4.17Å; R247-M251 WeakPolarHBondContact O-CB 3.45Å; R247-M251 WeakPolarHBondContact O-CE 3.46Å; R247-M251 WeakPolarHBondContact O-CG 3.44Å; R247-M251 PolarHBondContact O-N 3.13Å; M248-M251 HydrophobicContact CE-CE 4.15Å; M248-M251 PolarHBondContact O-N 2.98Å; M248-M251 VanDerWaalsContact O-N 3.16Å; M248-M251 HydrophobicContact SD-CE 3.71Å; M251-L254 PolarHBondContact O-N 2.82Å; M251-I255 WeakPolarHBondContact O-CD1 3.3Å; M251-I255 VanDerWaalsContact O-CG1 3.25Å; M251-I255 WeakPolarHBondContact O-CG1 3.4Å; M251-I255 PolarHBondContact O-N 2.86Å; M251-I255 VanDerWaalsContact O-N 3.09Å; M251-F265 HydrophobicContact CB-CB 4.35Å; M251-F265 HydrophobicContact CG-CB 4.07Å; M251-F265 HydrophobicContact CG-CD1 4.4Å; M251-F265 HydrophobicContact CG-CG 4.08Å; M251-F265 HydrophobicContact SD-CB 4.23Å; M251-T268 HydrophobicContact SD-CG2 4.3Å; M251-L269 HydrophobicContact CE-CD2 3.7Å; M251-L269 HydrophobicContact CE-CG 4.33Å; M251-L269 HydrophobicContact SD-CD2 4.35Å; M251-L269 HydrophobicContact SD-CG 4.34Å; M251-L272 HydrophobicContact CE-CD1 4.44Å
252	I	84.8	Confident	81.2	Confident	32 Å²	32	36.2 Å²	36.2	16%	0.164	21%	0.21	C	C	.	.	H	α-helix	trans	-59	-54.3	175	-70.3	162.7	0	0	0	110.4	M248 A249 L254 I255 Q256 T288 L292	M248-I252 WeakPolarHBondContact O-CG1 3.19Å; M248-I252 PolarHBondContact O-N 3.27Å; A249-I252 PolarHBondContact O-N 2.81Å; I252-L254 VanDerWaalsContact C-N 3.31Å; I252-L254 PolarHBondContact O-N 3.04Å; I252-I255 PolarHBondContact O-N 2.95Å; I252-I255 VanDerWaalsContact O-N 3.09Å; I252-Q256 HydrophobicContact CG2-CG 4.41Å; I252-Q256 WeakPolarHBondContact O-CG 3.49Å; I252-Q256 PolarHBondContact O-N 3.45Å; I252-T288 HydrophobicContact CD1-CG2 4.07Å; I252-L292 HydrophobicContact CB-CD2 4.33Å; I252-L292 HydrophobicContact CG1-CD1 3.91Å; I252-L292 HydrophobicContact CG1-CD2 4.21Å; I252-L292 HydrophobicContact CG1-CG 4.03Å; I252-L292 HydrophobicContact CG2-CD2 4.07Å
253	L	84.8	Confident	81.3	Confident	91 Å²	91	35.6 Å²	35.6	48%	0.476	20%	0.201	S	C	.	.	H	α-helix	trans	-59.4	-40.3	-178.9	-70	171.1	0	0	0	112.5	A249 I255 Q256 D257	A249-L253 WeakPolarHBondContact O-CG 3.44Å; A249-L253 PolarHBondContact O-N 2.69Å; L253-I255 VanDerWaalsContact C-N 3.32Å; L253-I255 PolarHBondContact O-N 2.69Å; L253-Q256 PolarHBondContact O-N 3.37Å; L253-D257 PolarHBondContact O-N 3.37Å
254	L	82.3	Confident	81.1	Confident	30 Å²	30	34.7 Å²	34.7	16%	0.157	19%	0.191	C	C	.	.	H	α-helix	trans	-68.7	-29.2	178.2	-69.6	166.7	0	0	0	112.9	M235 V239 A250 M251 I252 D258 T262 F265	M235-L254 HydrophobicContact CB-CD1 4.39Å; M235-L254 HydrophobicContact CE-CD2 3.79Å; M235-L254 HydrophobicContact SD-CD2 4.07Å; M235-L254 HydrophobicContact SD-CG 4.38Å; V239-L254 HydrophobicContact CG2-CD1 3.87Å; A250-L254 WeakPolarHBondContact O-CB 3.36Å; A250-L254 VanDerWaalsContact O-CD1 3.32Å; A250-L254 WeakPolarHBondContact O-CD1 3.34Å; A250-L254 WeakPolarHBondContact O-CG 3.43Å; A250-L254 PolarHBondContact O-N 3.44Å; A250-L254 VanDerWaalsContact O-N 3.14Å; M251-L254 PolarHBondContact O-N 2.82Å; I252-L254 VanDerWaalsContact C-N 3.31Å; I252-L254 PolarHBondContact O-N 3.04Å; L254-D258 PolarHBondContact O-N 2.79Å; L254-T262 HydrophobicContact CB-CG2 4.26Å; L254-T262 PolarHBondContact O-OG1 3.38Å; L254-F265 HydrophobicContact CB-CD2 4.02Å; L254-F265 HydrophobicContact CB-CE2 3.93Å; L254-F265 HydrophobicContact CD1-CD2 4.23Å; L254-F265 HydrophobicContact CD1-CE2 3.56Å; L254-F265 HydrophobicContact CD1-CZ 4.21Å; L254-F265 HydrophobicContact CG-CE2 4.33Å
255	I	83.1	Confident	81.2	Confident	2 Å²	2	36 Å²	36	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-77	-33.2	173.2	-67.7	163.8	0	0	0	110.9	M251 I252 L253 D258 A259 T262 F265 V266 L269 L292 L297	M251-I255 WeakPolarHBondContact O-CD1 3.3Å; M251-I255 VanDerWaalsContact O-CG1 3.25Å; M251-I255 WeakPolarHBondContact O-CG1 3.4Å; M251-I255 PolarHBondContact O-N 2.86Å; M251-I255 VanDerWaalsContact O-N 3.09Å; I252-I255 PolarHBondContact O-N 2.95Å; I252-I255 VanDerWaalsContact O-N 3.09Å; L253-I255 VanDerWaalsContact C-N 3.32Å; L253-I255 PolarHBondContact O-N 2.69Å; I255-D258 CarbonylContact O-C 3.47Å; I255-D258 VanDerWaalsContact O-C 3.3Å; I255-A259 WeakPolarHBondContact O-CA 3.27Å; I255-A259 PolarHBondContact O-N 2.82Å; I255-A259 VanDerWaalsContact O-N 3.1Å; I255-T262 HydrophobicContact CG1-CG2 3.85Å; I255-F265 HydrophobicContact CD1-CB 4.14Å; I255-F265 HydrophobicContact CG1-CB 4.39Å; I255-V266 HydrophobicContact CD1-CG2 3.79Å; I255-V266 HydrophobicContact CG1-CG2 4.41Å; I255-L269 HydrophobicContact CD1-CD1 4.09Å; I255-L292 HydrophobicContact CB-CD2 4.18Å; I255-L292 HydrophobicContact CD1-CD1 3.78Å; I255-L292 HydrophobicContact CG2-CD2 3.94Å; I255-L297 HydrophobicContact CG2-CD2 3.85Å; I255-L297 HydrophobicContact CG2-CG 4.35Å
256	Q	80.8	Confident	81.3	Confident	83 Å²	83	34.8 Å²	34.8	39%	0.388	18%	0.182	S	C	.	.	H	α-helix	trans	-72	-37.6	175.8	-75	177.3	-21.6	0	0	113.1	I252 L253 D296	I252-Q256 HydrophobicContact CG2-CG 4.41Å; I252-Q256 WeakPolarHBondContact O-CG 3.49Å; I252-Q256 PolarHBondContact O-N 3.45Å; L253-Q256 PolarHBondContact O-N 3.37Å; Q256-D296 VanDerWaalsContact CG-OD2 3.29Å; Q256-D296 WeakPolarHBondContact CG-OD2 3.41Å; Q256-D296 PolarHBondContact NE2-OD2 3.32Å
257	D	76.3	Confident	81.2	Confident	96 Å²	96	34.8 Å²	34.8	51%	0.513	18%	0.18	S	C	.	.	H	α-helix	trans	-63.6	-39.9	174.2	-82.2	-17.5	0	0	0	111.9	G180 L253	G180-D257 PolarHBondContact N-O 3.03Å; G180-D257 VanDerWaalsContact N-O 3.14Å; L253-D257 PolarHBondContact O-N 3.37Å
258	D	76.7	Confident	81.4	Confident	10 Å²	10	34.5 Å²	34.5	5%	0.053	19%	0.186	C	C	.	.			trans	-158.7	103.1	176.8	-168	-47.3	0	0	0	111.9	P179 F220 L254 I255 V260 H261 T262	P179-D258 WeakPolarHBondContact CA-OD2 3.17Å; P179-D258 HydrophobicContact CB-CB 4.33Å; P179-D258 VanDerWaalsContact CB-OD2 3.32Å; P179-D258 WeakPolarHBondContact CB-OD2 3.45Å; F220-D258 HydrophobicContact CE2-CB 4.13Å; F220-D258 WeakPolarHBondContact CE2-OD2 3.43Å; F220-D258 HydrophobicContact CZ-CB 3.96Å; L254-D258 PolarHBondContact O-N 2.79Å; I255-D258 CarbonylContact O-C 3.47Å; I255-D258 VanDerWaalsContact O-C 3.3Å; D258-V260 PolarHBondContact OD1-N 2.72Å; D258-V260 VanDerWaalsContact OD1-N 3.07Å; D258-H261 IonicContact OD1-CE1 2.68Å; D258-H261 IonicContact OD1-CG 3.78Å; D258-H261 PolarHBondContact OD1-N 3.49Å; D258-H261 IonicContact OD1-ND1 2.76Å; D258-H261 PolarHBondContact OD1-ND1 2.77Å; D258-H261 IonicContact OD2-CE1 2.68Å; D258-H261 PolarHBondContact OD2-CE1 2.83Å; D258-H261 IonicContact OD2-CG 2.77Å; D258-H261 IonicContact OD2-ND1 3.2Å; D258-H261 PolarHBondContact OD2-ND1 2.84Å; D258-T262 WeakPolarHBondContact O-CB 3.25Å; D258-T262 PolarHBondContact O-OG1 3.12Å
259	A	76.4	Confident	81.4	Confident	13 Å²	13	34.3 Å²	34.3	11%	0.107	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-32.9	-179.1	0	0	0	0	0	113.4	I255 L297 F335	I255-A259 WeakPolarHBondContact O-CA 3.27Å; I255-A259 PolarHBondContact O-N 2.82Å; I255-A259 VanDerWaalsContact O-N 3.1Å; A259-L297 HydrophobicContact CB-CD2 4.11Å; A259-F335 HydrophobicContact CB-CZ 4.43Å; A259-F335 VanDerWaalsContact O-CE2 3.27Å; A259-F335 WeakPolarHBondContact O-CE2 3.2Å; A259-F335 WeakPolarHBondContact O-CZ 3.27Å
260	V	76.5	Confident	81.4	Confident	8 Å²	8	32.1 Å²	32.1	5%	0.048	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-42.6	-167.9	-178.9	0	0	0	0	111.5	L177 W183 Y213 D258 T262 L332 F335	L177-V260 HydrophobicContact CD1-CB 4.42Å; L177-V260 HydrophobicContact CD1-CG1 3.79Å; W183-V260 HydrophobicContact CB-CG2 3.73Å; Y213-V260 HydrophobicContact CE2-CG1 4.17Å; Y213-V260 WeakPolarHBondContact CE2-O 3.37Å; Y213-V260 PolarHBondContact OH-O 3.07Å; D258-V260 PolarHBondContact OD1-N 2.72Å; D258-V260 VanDerWaalsContact OD1-N 3.07Å; V260-T262 VanDerWaalsContact C-N 3.33Å; V260-L332 HydrophobicContact CG2-CD2 4.26Å; V260-F335 HydrophobicContact CB-CD2 4.49Å; V260-F335 HydrophobicContact CG1-CB 4.24Å; V260-F335 HydrophobicContact CG1-CD2 4.18Å; V260-F335 HydrophobicContact CG1-CG 4.08Å; V260-F335 HydrophobicContact CG2-CD1 4.24Å; V260-F335 HydrophobicContact CG2-CE1 4.29Å
261	H	73	Confident	81.5	Confident	8 Å²	8	35 Å²	35	4%	0.037	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-8.2	-177.8	-57.1	92.5	0	0	0	113.6	E216 F220 D258	E216-H261 WeakPolarHBondContact CG-NE2 3.24Å; E216-H261 IonicContact OE1-NE2 2.67Å; F220-H261 HydrophobicContact CB-CB 4.02Å; F220-H261 HydrophobicContact CD1-CB 3.66Å; F220-H261 HydrophobicContact CD2-CB 3.76Å; F220-H261 AromaticContact CD2-CD2 3.95Å; F220-H261 AromaticContact CD2-CG 3.56Å; F220-H261 AromaticContact CD2-ND1 3.76Å; F220-H261 HydrophobicContact CE1-CB 3.98Å; F220-H261 HydrophobicContact CE2-CB 4.07Å; F220-H261 HydrophobicContact CG-CB 3.54Å; F220-H261 AromaticContact CG-CD2 3.97Å; F220-H261 AromaticContact CG-CG 3.7Å; F220-H261 HydrophobicContact CZ-CB 4.17Å; D258-H261 IonicContact OD1-CE1 2.68Å; D258-H261 IonicContact OD1-CG 3.78Å; D258-H261 PolarHBondContact OD1-N 3.49Å; D258-H261 IonicContact OD1-ND1 2.76Å; D258-H261 PolarHBondContact OD1-ND1 2.77Å; D258-H261 IonicContact OD2-CE1 2.68Å; D258-H261 PolarHBondContact OD2-CE1 2.83Å; D258-H261 IonicContact OD2-CG 2.77Å; D258-H261 IonicContact OD2-ND1 3.2Å; D258-H261 PolarHBondContact OD2-ND1 2.84Å
262	T	78.3	Confident	81.6	Confident	11 Å²	11	36 Å²	36	7%	0.067	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	11.5	-164.2	-52	0	0	0	0	114.1	L254 I255 D258 V260 Q264 F265	L254-T262 HydrophobicContact CB-CG2 4.26Å; L254-T262 PolarHBondContact O-OG1 3.38Å; I255-T262 HydrophobicContact CG1-CG2 3.85Å; D258-T262 WeakPolarHBondContact O-CB 3.25Å; D258-T262 PolarHBondContact O-OG1 3.12Å; V260-T262 VanDerWaalsContact C-N 3.33Å; T262-Q264 PolarHBondContact O-N 3.27Å; T262-F265 HydrophobicContact CG2-CB 4.32Å; T262-F265 HydrophobicContact CG2-CD2 3.25Å; T262-F265 HydrophobicContact CG2-CE2 3.78Å; T262-F265 HydrophobicContact CG2-CG 4.12Å; T262-F265 PolarHBondContact O-N 3.21Å
263	L	81.7	Confident	81.6	Confident	9 Å²	9	34.5 Å²	34.5	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-45.3	-33	178.8	-164	94.9	0	0	0	114.6	Y213 F265 V266 E267 F335 Q338 L342	Y213-L263 HydrophobicContact CE1-CD2 4.41Å; Y213-L263 WeakPolarHBondContact OH-CB 3.45Å; L263-F265 VanDerWaalsContact C-N 3.27Å; L263-F265 PolarHBondContact O-N 3.26Å; L263-V266 WeakPolarHBondContact O-CA 3.29Å; L263-V266 WeakPolarHBondContact O-CB 3.34Å; L263-V266 PolarHBondContact O-N 3.4Å; L263-E267 PolarHBondContact O-N 2.97Å; L263-F335 HydrophobicContact CD1-CD2 3.97Å; L263-F335 HydrophobicContact CD1-CE2 3.7Å; L263-Q338 HydrophobicContact CD1-CB 4.4Å; L263-Q338 HydrophobicContact CD2-CB 4.27Å; L263-L342 HydrophobicContact CD1-CD1 3.68Å; L263-L342 HydrophobicContact CD2-CD1 4.19Å; L263-L342 HydrophobicContact CG-CD1 3.8Å
264	Q	82.1	Confident	81.5	Confident	67 Å²	67	33.2 Å²	33.2	31%	0.313	17%	0.169	S	C	.	.	H	α-helix	trans	-60.6	-27.8	177.7	-77.8	147.2	42.4	0	0	114.4	T262 T268	T262-Q264 PolarHBondContact O-N 3.27Å; Q264-T268 WeakPolarHBondContact O-CB 3.4Å; Q264-T268 PolarHBondContact O-N 3.22Å; Q264-T268 PolarHBondContact O-OG1 2.88Å
265	F	79.7	Confident	81.4	Confident	56 Å²	56	38 Å²	38	25%	0.246	19%	0.188	C	C	.	.	H	α-helix	trans	-78.7	-31.1	172.1	-60.7	-33.1	0	0	0	111.7	V239 M251 L254 I255 T262 L263 T268 L269	V239-F265 HydrophobicContact CG1-CD1 4.46Å; V239-F265 HydrophobicContact CG1-CE1 4.05Å; V239-F265 HydrophobicContact CG1-CZ 4.48Å; M251-F265 HydrophobicContact CB-CB 4.35Å; M251-F265 HydrophobicContact CG-CB 4.07Å; M251-F265 HydrophobicContact CG-CD1 4.4Å; M251-F265 HydrophobicContact CG-CG 4.08Å; M251-F265 HydrophobicContact SD-CB 4.23Å; L254-F265 HydrophobicContact CB-CD2 4.02Å; L254-F265 HydrophobicContact CB-CE2 3.93Å; L254-F265 HydrophobicContact CD1-CD2 4.23Å; L254-F265 HydrophobicContact CD1-CE2 3.56Å; L254-F265 HydrophobicContact CD1-CZ 4.21Å; L254-F265 HydrophobicContact CG-CE2 4.33Å; I255-F265 HydrophobicContact CD1-CB 4.14Å; I255-F265 HydrophobicContact CG1-CB 4.39Å; T262-F265 HydrophobicContact CG2-CB 4.32Å; T262-F265 HydrophobicContact CG2-CD2 3.25Å; T262-F265 HydrophobicContact CG2-CE2 3.78Å; T262-F265 HydrophobicContact CG2-CG 4.12Å; T262-F265 PolarHBondContact O-N 3.21Å; L263-F265 VanDerWaalsContact C-N 3.27Å; L263-F265 PolarHBondContact O-N 3.26Å; F265-T268 WeakPolarHBondContact O-CB 3.22Å; F265-T268 PolarHBondContact O-N 3.01Å; F265-L269 VanDerWaalsContact O-CG 3.29Å; F265-L269 WeakPolarHBondContact O-CG 3.47Å; F265-L269 PolarHBondContact O-N 3.43Å
266	V	83.4	Confident	80.4	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.024	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-47.8	169.6	176.7	0	0	0	0	110.9	I255 L263 T268 L269 V270 F289 L297 L342	I255-V266 HydrophobicContact CD1-CG2 3.79Å; I255-V266 HydrophobicContact CG1-CG2 4.41Å; L263-V266 WeakPolarHBondContact O-CA 3.29Å; L263-V266 WeakPolarHBondContact O-CB 3.34Å; L263-V266 PolarHBondContact O-N 3.4Å; V266-T268 PolarHBondContact O-N 3.02Å; V266-L269 WeakPolarHBondContact O-CB 3.47Å; V266-L269 PolarHBondContact O-N 3.11Å; V266-L269 VanDerWaalsContact O-N 3.17Å; V266-V270 WeakPolarHBondContact O-CG2 3.4Å; V266-V270 PolarHBondContact O-N 3.21Å; V266-F289 HydrophobicContact CG1-CD2 4.47Å; V266-F289 HydrophobicContact CG1-CE2 3.55Å; V266-F289 HydrophobicContact CG1-CZ 3.98Å; V266-L297 HydrophobicContact CG2-CD1 4.12Å; V266-L342 HydrophobicContact CG1-CD1 4.03Å
267	E	86.1	Confident	79.5	Confident	77 Å²	77	45.2 Å²	45.2	36%	0.36	24%	0.243	S	C	.	.	H	α-helix	trans	-56.1	-40.6	171.7	-69	173.1	168.8	0	0	111.6	L263 N271 L342	L263-E267 PolarHBondContact O-N 2.97Å; E267-N271 VanDerWaalsContact O-CB 3.25Å; E267-N271 WeakPolarHBondContact O-CB 3.34Å; E267-N271 VanDerWaalsContact O-CG 3.25Å; E267-N271 PolarHBondContact O-N 3.18Å; E267-N271 PolarHBondContact O-ND2 2.67Å; E267-L342 HydrophobicContact CG-CD1 4.26Å; E267-L342 HydrophobicContact CG-CD2 4.01Å
268	T	86.8	Confident	79.4	Confident	63 Å²	63	42.5 Å²	42.5	39%	0.387	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-41.3	177.6	-61.5	0	0	0	0	111.9	M251 Q264 F265 V266 N271 L272	M251-T268 HydrophobicContact SD-CG2 4.3Å; Q264-T268 WeakPolarHBondContact O-CB 3.4Å; Q264-T268 PolarHBondContact O-N 3.22Å; Q264-T268 PolarHBondContact O-OG1 2.88Å; F265-T268 WeakPolarHBondContact O-CB 3.22Å; F265-T268 PolarHBondContact O-N 3.01Å; V266-T268 PolarHBondContact O-N 3.02Å; T268-N271 CarbonylContact O-C 3.56Å; T268-N271 PolarHBondContact O-N 2.93Å; T268-L272 HydrophobicContact CG2-CD1 4.22Å; T268-L272 VanDerWaalsContact O-CG 3.31Å; T268-L272 WeakPolarHBondContact O-CG 3.31Å; T268-L272 PolarHBondContact O-N 3.47Å
269	L	83.8	Confident	79.3	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-52.5	175	-74	168.5	0	0	0	111.4	M248 M251 I255 F265 V266 N271 L272 V273 F289 L292	M248-L269 HydrophobicContact CE-CD2 4.07Å; M248-L269 HydrophobicContact SD-CD2 3.3Å; M248-L269 WeakPolarHBondContact SD-CD2 3.49Å; M251-L269 HydrophobicContact CE-CD2 3.7Å; M251-L269 HydrophobicContact CE-CG 4.33Å; M251-L269 HydrophobicContact SD-CD2 4.35Å; M251-L269 HydrophobicContact SD-CG 4.34Å; I255-L269 HydrophobicContact CD1-CD1 4.09Å; F265-L269 VanDerWaalsContact O-CG 3.29Å; F265-L269 WeakPolarHBondContact O-CG 3.47Å; F265-L269 PolarHBondContact O-N 3.43Å; V266-L269 WeakPolarHBondContact O-CB 3.47Å; V266-L269 PolarHBondContact O-N 3.11Å; V266-L269 VanDerWaalsContact O-N 3.17Å; L269-N271 VanDerWaalsContact C-N 3.26Å; L269-N271 PolarHBondContact O-N 2.92Å; L269-L272 WeakPolarHBondContact O-CA 3.25Å; L269-L272 WeakPolarHBondContact O-CB 3.43Å; L269-L272 PolarHBondContact O-N 2.99Å; L269-V273 WeakPolarHBondContact O-CG2 3.5Å; L269-V273 PolarHBondContact O-N 2.9Å; L269-F289 HydrophobicContact CD1-CD2 4.33Å; L269-L292 HydrophobicContact CD1-CD1 3.65Å
270	V	85.9	Confident	79.5	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-58.2	-40	177.1	173	0	0	0	0	110.9	V266 L272 V273 K274 F289 E345 F346	V266-V270 WeakPolarHBondContact O-CG2 3.4Å; V266-V270 PolarHBondContact O-N 3.21Å; V270-L272 VanDerWaalsContact C-N 3.31Å; V270-L272 PolarHBondContact O-N 2.85Å; V270-V273 PolarHBondContact O-N 2.87Å; V270-K274 WeakPolarHBondContact O-CG 3.08Å; V270-K274 PolarHBondContact O-N 2.8Å; V270-F289 HydrophobicContact CG2-CD1 4.36Å; V270-F289 HydrophobicContact CG2-CE1 3.94Å; V270-F289 HydrophobicContact CG2-CZ 4.08Å; V270-E345 WeakPolarHBondContact CG1-OE2 3.46Å; V270-F346 HydrophobicContact CG2-CB 4.5Å
271	N	87.3	Confident	79.8	Confident	69 Å²	69	54.8 Å²	54.8	37%	0.369	29%	0.285	S	S	.	.	H	α-helix	trans	-72.8	-15.6	174.6	-73.1	-48.9	0	0	0	114.7	E267 T268 L269 K274 K275	E267-N271 VanDerWaalsContact O-CB 3.25Å; E267-N271 WeakPolarHBondContact O-CB 3.34Å; E267-N271 VanDerWaalsContact O-CG 3.25Å; E267-N271 PolarHBondContact O-N 3.18Å; E267-N271 PolarHBondContact O-ND2 2.67Å; T268-N271 CarbonylContact O-C 3.56Å; T268-N271 PolarHBondContact O-N 2.93Å; L269-N271 VanDerWaalsContact C-N 3.26Å; L269-N271 PolarHBondContact O-N 2.92Å; N271-K274 WeakPolarHBondContact OD1-CD 3.3Å; N271-K274 PolarHBondContact OD1-NZ 3.2Å; N271-K274 VanDerWaalsContact OD1-NZ 3.09Å; N271-K275 VanDerWaalsContact O-CD 3.26Å; N271-K275 WeakPolarHBondContact O-CD 3.45Å; N271-K275 WeakPolarHBondContact O-CG 3.39Å
272	L	84.4	Confident	80.3	Confident	24 Å²	24	54.6 Å²	54.6	13%	0.126	28%	0.284	C	S	.	.	H	α-helix	trans	-82.6	-37.2	167.9	-73.6	166.6	0	0	0	111.4	M248 M251 T268 L269 V270 K274 K275 A285	M248-L272 HydrophobicContact CE-CD1 3.77Å; M251-L272 HydrophobicContact CE-CD1 4.44Å; T268-L272 HydrophobicContact CG2-CD1 4.22Å; T268-L272 VanDerWaalsContact O-CG 3.31Å; T268-L272 WeakPolarHBondContact O-CG 3.31Å; T268-L272 PolarHBondContact O-N 3.47Å; L269-L272 WeakPolarHBondContact O-CA 3.25Å; L269-L272 WeakPolarHBondContact O-CB 3.43Å; L269-L272 PolarHBondContact O-N 2.99Å; V270-L272 VanDerWaalsContact C-N 3.31Å; V270-L272 PolarHBondContact O-N 2.85Å; L272-K274 VanDerWaalsContact C-N 3.35Å; L272-K275 HydrophobicContact CD2-CD 4.43Å; L272-K275 PolarHBondContact O-N 3.48Å; L272-K275 VanDerWaalsContact O-N 3.17Å; L272-A285 HydrophobicContact CB-CB 4.05Å
273	V	83.8	Confident	80.7	Confident	1 Å²	1	56 Å²	56	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-39.6	171.4	-177.8	0	0	0	0	111.1	L269 V270 K275 C282 A285 L286 F346 V349 L353	L269-V273 WeakPolarHBondContact O-CG2 3.5Å; L269-V273 PolarHBondContact O-N 2.9Å; V270-V273 PolarHBondContact O-N 2.87Å; V273-K275 VanDerWaalsContact C-N 3.25Å; V273-K275 PolarHBondContact O-N 3.03Å; V273-C282 PolarHBondContact O-SG 2.85Å; V273-A285 HydrophobicContact CG2-CB 3.69Å; V273-L286 HydrophobicContact CG1-CB 4.29Å; V273-L286 HydrophobicContact CG1-CD1 4.3Å; V273-L286 HydrophobicContact CG2-CB 4.15Å; V273-F346 HydrophobicContact CG1-CE2 4.25Å; V273-V349 HydrophobicContact CB-CG1 4.42Å; V273-V349 HydrophobicContact CG1-CG1 3.7Å; V273-L353 HydrophobicContact CG1-CD1 3.61Å
274	K	83.4	Confident	80.8	Confident	65 Å²	65	58.9 Å²	58.9	28%	0.283	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.5	173.1	-72.2	173.3	-165.8	160.4	0	114.3	V270 N271 L272 K276 E345 V349	V270-K274 WeakPolarHBondContact O-CG 3.08Å; V270-K274 PolarHBondContact O-N 2.8Å; N271-K274 WeakPolarHBondContact OD1-CD 3.3Å; N271-K274 PolarHBondContact OD1-NZ 3.2Å; N271-K274 VanDerWaalsContact OD1-NZ 3.09Å; L272-K274 VanDerWaalsContact C-N 3.35Å; K274-K276 PolarHBondContact O-N 3.07Å; K274-E345 VanDerWaalsContact CE-CD 3.41Å; K274-E345 WeakPolarHBondContact CE-OE1 3.32Å; K274-E345 WeakPolarHBondContact CE-OE2 3.29Å; K274-E345 IonicContact NZ-OE1 2.67Å; K274-E345 PolarHBondContact NZ-OE1 3.43Å; K274-E345 IonicContact NZ-OE2 3.93Å; K274-E345 PolarHBondContact NZ-OE2 3.42Å; K274-V349 HydrophobicContact CD-CG2 4.3Å; K274-V349 HydrophobicContact CG-CG1 4.14Å; K274-V349 HydrophobicContact CG-CG2 3.57Å
275	K	79.3	Confident	81	Confident	129 Å²	129	55.7 Å²	55.7	56%	0.561	29%	0.29	S	S	*	.			trans	-80.7	84.3	-170.1	-83.5	168.8	-174.5	171.3	0	112.2	N271 L272 V273 G277 S278	N271-K275 VanDerWaalsContact O-CD 3.26Å; N271-K275 WeakPolarHBondContact O-CD 3.45Å; N271-K275 WeakPolarHBondContact O-CG 3.39Å; L272-K275 HydrophobicContact CD2-CD 4.43Å; L272-K275 PolarHBondContact O-N 3.48Å; L272-K275 VanDerWaalsContact O-N 3.17Å; V273-K275 VanDerWaalsContact C-N 3.25Å; V273-K275 PolarHBondContact O-N 3.03Å; K275-G277 PolarHBondContact O-N 3.46Å; K275-S278 PolarHBondContact O-N 3.35Å
276	K	62.8	Low	81.4	Confident	152 Å²	152	53 Å²	53	66%	0.661	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-20	176.7	-60.4	-172.1	179.3	-174.4	0	115.6	K274 S278	K274-K276 PolarHBondContact O-N 3.07Å; K276-S278 VanDerWaalsContact C-N 3.29Å; K276-S278 PolarHBondContact O-N 2.96Å
277	G	62.3	Low	81.5	Confident	85 Å²	85	54.4 Å²	54.4	88%	0.876	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-12.5	-176.5	0	0	0	0	0	116.5	K275	K275-G277 PolarHBondContact O-N 3.46Å
278	S	74.1	Confident	81.6	Confident	40 Å²	40	51.7 Å²	51.7	28%	0.28	27%	0.274	S	S	.	.			trans	-144.7	96.3	171.3	-170.3	0	0	0	0	111.1	K275 K276 Q280 Q281 C282	K275-S278 PolarHBondContact O-N 3.35Å; K276-S278 VanDerWaalsContact C-N 3.29Å; K276-S278 PolarHBondContact O-N 2.96Å; S278-Q280 VanDerWaalsContact C-N 3.27Å; S278-Q280 PolarHBondContact O-N 3.4Å; S278-Q281 WeakPolarHBondContact O-CB 3.44Å; S278-Q281 PolarHBondContact O-N 3.18Å; S278-Q281 WeakPolarHBondContact OG-CG 3.38Å; S278-C282 PolarHBondContact O-N 3.13Å
279	K	74.6	Confident	81.6	Confident	75 Å²	75	48.7 Å²	48.7	33%	0.326	26%	0.256	S	S	.	.	H	α-helix	trans	-61.5	-31	-173.1	-62.8	-164.6	174.3	-162.6	0	113.5	C282 L283 D356 L358 T361	K279-C282 PolarHBondContact O-N 2.92Å; K279-L283 WeakPolarHBondContact O-CG 3.49Å; K279-L283 PolarHBondContact O-N 2.99Å; K279-D356 IonicContact NZ-OD1 2.71Å; K279-D356 PolarHBondContact NZ-OD1 3.36Å; K279-D356 IonicContact NZ-OD2 3.84Å; K279-D356 PolarHBondContact NZ-OD2 2.75Å; K279-L358 HydrophobicContact CD-CD1 3.62Å; K279-T361 HydrophobicContact CD-CG2 4.34Å
280	Q	79.8	Confident	81.9	Confident	143 Å²	143	49.5 Å²	49.5	67%	0.668	26%	0.26	S	S	*	.	H	α-helix	trans	-68.2	-37.4	173.1	-170.2	177.5	10.2	0	0	112.5	S278 M284	S278-Q280 VanDerWaalsContact C-N 3.27Å; S278-Q280 PolarHBondContact O-N 3.4Å; Q280-M284 HydrophobicContact CG-SD 4.33Å; Q280-M284 WeakPolarHBondContact O-CG 3.35Å; Q280-M284 PolarHBondContact O-N 2.99Å
281	Q	82.8	Confident	82	Confident	71 Å²	71	54 Å²	54	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-67.3	-42.2	174.3	-63.3	177.8	12.7	0	0	111.2	L244 S278 A285	L244-Q281 HydrophobicContact CD1-CB 4.24Å; L244-Q281 HydrophobicContact CD1-CG 3.92Å; L244-Q281 HydrophobicContact CD2-CB 4.34Å; L244-Q281 HydrophobicContact CD2-CG 3.83Å; L244-Q281 HydrophobicContact CG-CG 4.48Å; S278-Q281 WeakPolarHBondContact O-CB 3.44Å; S278-Q281 PolarHBondContact O-N 3.18Å; S278-Q281 WeakPolarHBondContact OG-CG 3.38Å; Q281-A285 WeakPolarHBondContact O-CB 3.27Å; Q281-A285 PolarHBondContact O-N 2.77Å
282	C	84	Confident	81.9	Confident	4 Å²	4	50.8 Å²	50.8	3%	0.027	26%	0.263	C	S	.	.	H	α-helix	trans	-59.1	-47.8	174.6	176.7	0	0	0	0	112.2	V273 S278 K279 L286	V273-C282 PolarHBondContact O-SG 2.85Å; S278-C282 PolarHBondContact O-N 3.13Å; K279-C282 PolarHBondContact O-N 2.92Å; C282-L286 WeakPolarHBondContact O-CB 3.18Å; C282-L286 PolarHBondContact O-N 3.46Å
283	L	86.4	Confident	81.9	Confident	39 Å²	39	49.8 Å²	49.8	20%	0.204	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-48.1	-179.6	-74.7	174.4	0	0	0	111.9	K279 A285 L286 D287 T361 R364	K279-L283 WeakPolarHBondContact O-CG 3.49Å; K279-L283 PolarHBondContact O-N 2.99Å; L283-A285 VanDerWaalsContact C-N 3.34Å; L283-A285 PolarHBondContact O-N 3.49Å; L283-L286 PolarHBondContact O-N 2.78Å; L283-L286 VanDerWaalsContact O-N 3.13Å; L283-D287 PolarHBondContact O-N 3.17Å; L283-T361 HydrophobicContact CD1-CG2 4.37Å; L283-T361 HydrophobicContact CD2-CG2 4.28Å; L283-T361 HydrophobicContact CG-CG2 4.4Å; L283-R364 HydrophobicContact CD2-CB 3.7Å; L283-R364 HydrophobicContact CD2-CG 3.98Å
284	M	84.4	Confident	82	Confident	70 Å²	70	51.7 Å²	51.7	35%	0.345	27%	0.268	S	S	.	.	H	α-helix	trans	-64.8	-36.4	178.5	-69.5	-177.8	67.3	0	0	112.5	L244 Q280 L286 T288	L244-M284 HydrophobicContact CD2-CB 4.21Å; L244-M284 HydrophobicContact CD2-CE 4.3Å; L244-M284 HydrophobicContact CD2-CG 4.38Å; L244-M284 HydrophobicContact CD2-SD 3.55Å; L244-M284 VanDerWaalsContact CD2-SD 3.55Å; L244-M284 HydrophobicContact CG-SD 4.4Å; Q280-M284 HydrophobicContact CG-SD 4.33Å; Q280-M284 WeakPolarHBondContact O-CG 3.35Å; Q280-M284 PolarHBondContact O-N 2.99Å; M284-L286 VanDerWaalsContact C-N 3.3Å; M284-L286 PolarHBondContact O-N 2.93Å; M284-T288 VanDerWaalsContact O-CG2 3.32Å; M284-T288 WeakPolarHBondContact O-CG2 3.38Å; M284-T288 PolarHBondContact O-N 3.31Å; M284-T288 VanDerWaalsContact O-N 3.1Å; M284-T288 PolarHBondContact O-OG1 2.94Å
285	A	87.1	Confident	82	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-27.4	174.5	0	0	0	0	0	113.2	M248 L272 V273 Q281 L283 T288 F289	M248-A285 HydrophobicContact CE-CB 3.63Å; M248-A285 HydrophobicContact SD-CB 4.36Å; L272-A285 HydrophobicContact CB-CB 4.05Å; V273-A285 HydrophobicContact CG2-CB 3.69Å; Q281-A285 WeakPolarHBondContact O-CB 3.27Å; Q281-A285 PolarHBondContact O-N 2.77Å; L283-A285 VanDerWaalsContact C-N 3.34Å; L283-A285 PolarHBondContact O-N 3.49Å; A285-T288 PolarHBondContact O-OG1 3.35Å; A285-F289 WeakPolarHBondContact O-CB 3.47Å; A285-F289 PolarHBondContact O-N 2.88Å
286	L	86.8	Confident	81.7	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-78.8	-42.2	178.5	170.9	147	0	0	0	111.4	V273 C282 L283 M284 K290 F346 L350 L353 V368	V273-L286 HydrophobicContact CG1-CB 4.29Å; V273-L286 HydrophobicContact CG1-CD1 4.3Å; V273-L286 HydrophobicContact CG2-CB 4.15Å; C282-L286 WeakPolarHBondContact O-CB 3.18Å; C282-L286 PolarHBondContact O-N 3.46Å; L283-L286 PolarHBondContact O-N 2.78Å; L283-L286 VanDerWaalsContact O-N 3.13Å; M284-L286 VanDerWaalsContact C-N 3.3Å; M284-L286 PolarHBondContact O-N 2.93Å; L286-K290 VanDerWaalsContact O-CB 3.32Å; L286-K290 WeakPolarHBondContact O-CB 3.49Å; L286-K290 PolarHBondContact O-N 2.99Å; L286-K290 VanDerWaalsContact O-N 3.09Å; L286-F346 HydrophobicContact CG-CZ 4.47Å; L286-L350 HydrophobicContact CD1-CD1 3.76Å; L286-L353 HydrophobicContact CD1-CD1 3.63Å; L286-V368 HydrophobicContact CD2-CB 4.1Å; L286-V368 HydrophobicContact CD2-CG1 4.34Å; L286-V368 HydrophobicContact CD2-CG2 3.46Å; L286-V368 VanDerWaalsContact CD2-CG2 3.46Å; L286-V368 HydrophobicContact CG-CG2 4.47Å
287	D	86.6	Confident	82.5	Confident	32 Å²	32	40 Å²	40	17%	0.171	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-43.8	172.9	-77.8	-47.3	0	0	0	111	L283 K290 E291 R364	L283-D287 PolarHBondContact O-N 3.17Å; D287-K290 WeakPolarHBondContact O-CB 3.25Å; D287-K290 PolarHBondContact O-N 3.14Å; D287-K290 IonicContact OD1-NZ 2.77Å; D287-E291 WeakPolarHBondContact O-CG 3.44Å; D287-E291 PolarHBondContact O-N 3.03Å; D287-E291 VanDerWaalsContact O-N 3.07Å; D287-R364 IonicContact OD1-NH1 3.2Å; D287-R364 IonicContact OD2-NH1 3.13Å
288	T	87.3	Confident	83.3	Confident	20 Å²	20	36.1 Å²	36.1	12%	0.123	18%	0.183	C	C	.	.	H	α-helix	trans	-72.8	-35.1	179.8	57.9	0	0	0	0	114	M248 I252 M284 A285 E291 L292	M248-T288 HydrophobicContact CB-CG2 4.09Å; M248-T288 HydrophobicContact CG-CG2 4.46Å; I252-T288 HydrophobicContact CD1-CG2 4.07Å; M284-T288 VanDerWaalsContact O-CG2 3.32Å; M284-T288 WeakPolarHBondContact O-CG2 3.38Å; M284-T288 PolarHBondContact O-N 3.31Å; M284-T288 VanDerWaalsContact O-N 3.1Å; M284-T288 PolarHBondContact O-OG1 2.94Å; A285-T288 PolarHBondContact O-OG1 3.35Å; T288-E291 PolarHBondContact O-N 3.22Å; T288-L292 PolarHBondContact O-N 2.8Å; T288-L292 VanDerWaalsContact O-N 3.09Å
289	F	87.8	Confident	83.4	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-69.2	-36.2	174.5	-175.4	-122.2	0	0	0	111.8	V266 L269 V270 A285 L292 L293 L297 F346	V266-F289 HydrophobicContact CG1-CD2 4.47Å; V266-F289 HydrophobicContact CG1-CE2 3.55Å; V266-F289 HydrophobicContact CG1-CZ 3.98Å; L269-F289 HydrophobicContact CD1-CD2 4.33Å; V270-F289 HydrophobicContact CG2-CD1 4.36Å; V270-F289 HydrophobicContact CG2-CE1 3.94Å; V270-F289 HydrophobicContact CG2-CZ 4.08Å; A285-F289 WeakPolarHBondContact O-CB 3.47Å; A285-F289 PolarHBondContact O-N 2.88Å; F289-L292 PolarHBondContact O-N 3.35Å; F289-L293 HydrophobicContact CD1-CD1 4.03Å; F289-L293 HydrophobicContact CD1-CG 4.39Å; F289-L293 HydrophobicContact CD2-CG 4.5Å; F289-L293 HydrophobicContact CE1-CD1 3.63Å; F289-L293 HydrophobicContact CE1-CD2 4.29Å; F289-L293 HydrophobicContact CE1-CG 4.01Å; F289-L293 HydrophobicContact CE2-CD2 4.07Å; F289-L293 HydrophobicContact CE2-CG 4.07Å; F289-L293 HydrophobicContact CZ-CD1 3.94Å; F289-L293 HydrophobicContact CZ-CD2 3.73Å; F289-L293 HydrophobicContact CZ-CG 3.84Å; F289-L293 WeakPolarHBondContact O-CG 3.37Å; F289-L293 PolarHBondContact O-N 2.95Å; F289-L297 HydrophobicContact CE2-CD1 4.04Å; F289-F346 HydrophobicContact CD1-CB 4.47Å; F289-F346 HydrophobicContact CD1-CD1 4.19Å; F289-F346 AromaticContact CD1-CD2 3.54Å; F289-F346 HydrophobicContact CD1-CD2 3.54Å; F289-F346 HydrophobicContact CD1-CE1 4.33Å; F289-F346 AromaticContact CD1-CE2 3.7Å; F289-F346 HydrophobicContact CD1-CE2 3.7Å; F289-F346 AromaticContact CD1-CG 3.8Å; F289-F346 HydrophobicContact CD1-CG 3.8Å; F289-F346 HydrophobicContact CD1-CZ 4.09Å; F289-F346 HydrophobicContact CE1-CB 3.79Å; F289-F346 AromaticContact CE1-CD1 3.96Å; F289-F346 HydrophobicContact CE1-CD1 3.96Å; F289-F346 AromaticContact CE1-CD2 3.75Å; F289-F346 HydrophobicContact CE1-CD2 3.75Å; F289-F346 HydrophobicContact CE1-CE2 4.32Å; F289-F346 AromaticContact CE1-CG 3.54Å; F289-F346 HydrophobicContact CE1-CG 3.54Å
290	K	88.7	Confident	83.3	Confident	19 Å²	19	35.5 Å²	35.5	8%	0.083	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-47.5	169.7	175.5	-152.4	73.9	-179.4	0	111.7	L286 D287 L292 L293 I294 V368 E371 L372	L286-K290 VanDerWaalsContact O-CB 3.32Å; L286-K290 WeakPolarHBondContact O-CB 3.49Å; L286-K290 PolarHBondContact O-N 2.99Å; L286-K290 VanDerWaalsContact O-N 3.09Å; D287-K290 WeakPolarHBondContact O-CB 3.25Å; D287-K290 PolarHBondContact O-N 3.14Å; D287-K290 IonicContact OD1-NZ 2.77Å; K290-L292 VanDerWaalsContact C-N 3.31Å; K290-L292 PolarHBondContact O-N 2.88Å; K290-L293 PolarHBondContact O-N 2.84Å; K290-I294 HydrophobicContact CD-CD1 4.26Å; K290-I294 HydrophobicContact CG-CD1 3.79Å; K290-I294 WeakPolarHBondContact O-CG1 3.16Å; K290-I294 PolarHBondContact O-N 3.02Å; K290-V368 HydrophobicContact CB-CG1 3.91Å; K290-V368 HydrophobicContact CD-CB 4.28Å; K290-V368 HydrophobicContact CD-CG1 4Å; K290-V368 HydrophobicContact CD-CG2 3.79Å; K290-V368 HydrophobicContact CG-CG1 3.9Å; K290-E371 HydrophobicContact CD-CB 4.32Å; K290-E371 VanDerWaalsContact CD-OE2 3.29Å; K290-E371 WeakPolarHBondContact CD-OE2 3.38Å; K290-E371 WeakPolarHBondContact CE-OE2 3.42Å; K290-E371 IonicContact NZ-OE2 3.85Å; K290-E371 PolarHBondContact NZ-OE2 3.49Å; K290-L372 HydrophobicContact CG-CD2 4.23Å; K290-L372 HydrophobicContact CG-CG 4.34Å
291	E	87.8	Confident	82.6	Confident	96 Å²	96	34.2 Å²	34.2	45%	0.449	19%	0.188	S	C	.	.	H	α-helix	trans	-60.1	-40	178.7	-74.7	168.5	-175.7	0	0	112.1	D287 T288 I294 T295	D287-E291 WeakPolarHBondContact O-CG 3.44Å; D287-E291 PolarHBondContact O-N 3.03Å; D287-E291 VanDerWaalsContact O-N 3.07Å; T288-E291 PolarHBondContact O-N 3.22Å; E291-I294 PolarHBondContact O-N 2.74Å; E291-T295 VanDerWaalsContact O-CB 3.31Å; E291-T295 WeakPolarHBondContact O-CB 3.45Å; E291-T295 PolarHBondContact O-N 2.94Å; E291-T295 PolarHBondContact O-OG1 3.46Å
292	L	85.8	Confident	82.3	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-65.5	-41.2	173.2	-77.6	166.6	0	0	0	113.5	I252 I255 L269 T288 F289 K290 I294 D296 L297	I252-L292 HydrophobicContact CB-CD2 4.33Å; I252-L292 HydrophobicContact CG1-CD1 3.91Å; I252-L292 HydrophobicContact CG1-CD2 4.21Å; I252-L292 HydrophobicContact CG1-CG 4.03Å; I252-L292 HydrophobicContact CG2-CD2 4.07Å; I255-L292 HydrophobicContact CB-CD2 4.18Å; I255-L292 HydrophobicContact CD1-CD1 3.78Å; I255-L292 HydrophobicContact CG2-CD2 3.94Å; L269-L292 HydrophobicContact CD1-CD1 3.65Å; T288-L292 PolarHBondContact O-N 2.8Å; T288-L292 VanDerWaalsContact O-N 3.09Å; F289-L292 PolarHBondContact O-N 3.35Å; K290-L292 VanDerWaalsContact C-N 3.31Å; K290-L292 PolarHBondContact O-N 2.88Å; L292-I294 VanDerWaalsContact C-N 3.35Å; L292-D296 PolarHBondContact O-N 2.88Å; L292-D296 VanDerWaalsContact O-N 3.09Å; L292-L297 HydrophobicContact CB-CD1 4.06Å; L292-L297 PolarHBondContact O-N 3.12Å
293	L	85.5	Confident	82.1	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	20%	0.196	C	C	.	.	I	π-helix	trans	-62.2	-41.6	174.7	-73.4	178.9	0	0	0	111.9	F289 K290 L297 L298 V343 F346 L372	F289-L293 HydrophobicContact CD1-CD1 4.03Å; F289-L293 HydrophobicContact CD1-CG 4.39Å; F289-L293 HydrophobicContact CD2-CG 4.5Å; F289-L293 HydrophobicContact CE1-CD1 3.63Å; F289-L293 HydrophobicContact CE1-CD2 4.29Å; F289-L293 HydrophobicContact CE1-CG 4.01Å; F289-L293 HydrophobicContact CE2-CD2 4.07Å; F289-L293 HydrophobicContact CE2-CG 4.07Å; F289-L293 HydrophobicContact CZ-CD1 3.94Å; F289-L293 HydrophobicContact CZ-CD2 3.73Å; F289-L293 HydrophobicContact CZ-CG 3.84Å; F289-L293 WeakPolarHBondContact O-CG 3.37Å; F289-L293 PolarHBondContact O-N 2.95Å; K290-L293 PolarHBondContact O-N 2.84Å; L293-L297 HydrophobicContact CD2-CB 4.27Å; L293-L297 HydrophobicContact CD2-CD1 4.21Å; L293-L298 HydrophobicContact CB-CD1 4.03Å; L293-L298 HydrophobicContact CB-CG 4.3Å; L293-L298 HydrophobicContact CD2-CD1 4.05Å; L293-L298 HydrophobicContact CD2-CD2 4.23Å; L293-L298 HydrophobicContact CD2-CG 3.93Å; L293-L298 HydrophobicContact CG-CD1 4.49Å; L293-L298 VanDerWaalsContact O-CB 3.27Å; L293-L298 WeakPolarHBondContact O-CB 3.43Å; L293-L298 WeakPolarHBondContact O-CG 3.3Å; L293-L298 PolarHBondContact O-N 3.46Å; L293-V343 HydrophobicContact CD2-CG2 3.85Å; L293-F346 HydrophobicContact CD1-CD1 4.32Å; L293-F346 HydrophobicContact CD1-CE1 4.39Å; L293-L372 HydrophobicContact CB-CD2 4.04Å; L293-L372 HydrophobicContact CD1-CD1 4.45Å; L293-L372 HydrophobicContact CD1-CD2 4.1Å
294	I	84.9	Confident	81.9	Confident	42 Å²	42	35 Å²	35	22%	0.215	19%	0.187	C	C	.	.	I	π-helix	trans	-72.2	-43.7	-179.6	-66.5	169	0	0	0	111.4	K290 E291 L292 L372 K376	K290-I294 HydrophobicContact CD-CD1 4.26Å; K290-I294 HydrophobicContact CG-CD1 3.79Å; K290-I294 WeakPolarHBondContact O-CG1 3.16Å; K290-I294 PolarHBondContact O-N 3.02Å; E291-I294 PolarHBondContact O-N 2.74Å; L292-I294 VanDerWaalsContact C-N 3.35Å; I294-L372 HydrophobicContact CG1-CD2 4.15Å; I294-K376 WeakPolarHBondContact O-CE 3.24Å; I294-K376 PolarHBondContact O-NZ 3.06Å
295	T	83.3	Confident	81.5	Confident	71 Å²	71	33.4 Å²	33.4	44%	0.436	18%	0.177	S	C	.	.	I	π-helix	trans	-85.1	-47.7	-168.5	-46.6	0	0	0	0	113.2	E291	E291-T295 VanDerWaalsContact O-CB 3.31Å; E291-T295 WeakPolarHBondContact O-CB 3.45Å; E291-T295 PolarHBondContact O-N 2.94Å; E291-T295 PolarHBondContact O-OG1 3.46Å
296	D	74	Confident	81.1	Confident	28 Å²	28	36.7 Å²	36.7	15%	0.15	19%	0.194	C	C	.	.	I	π-helix	trans	-125.6	-35.5	-158.5	-58.5	-61.2	0	0	0	114	Y184 Q256 L292	Y184-D296 WeakPolarHBondContact CE1-O 3.49Å; Q256-D296 VanDerWaalsContact CG-OD2 3.29Å; Q256-D296 WeakPolarHBondContact CG-OD2 3.41Å; Q256-D296 PolarHBondContact NE2-OD2 3.32Å; L292-D296 PolarHBondContact O-N 2.88Å; L292-D296 VanDerWaalsContact O-N 3.09Å
297	L	78.3	Confident	80.7	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.194	C	C	.	.	I	π-helix	trans	-89.6	-38	-170.8	-66.2	175.2	0	0	0	114.3	W183 I255 A259 V266 F289 L292 L293 L339	W183-L297 PolarHBondContact NE1-O 3.13Å; I255-L297 HydrophobicContact CG2-CD2 3.85Å; I255-L297 HydrophobicContact CG2-CG 4.35Å; A259-L297 HydrophobicContact CB-CD2 4.11Å; V266-L297 HydrophobicContact CG2-CD1 4.12Å; F289-L297 HydrophobicContact CE2-CD1 4.04Å; L292-L297 HydrophobicContact CB-CD1 4.06Å; L292-L297 PolarHBondContact O-N 3.12Å; L293-L297 HydrophobicContact CD2-CB 4.27Å; L293-L297 HydrophobicContact CD2-CD1 4.21Å; L297-L339 HydrophobicContact CB-CD1 4.45Å; L297-L339 HydrophobicContact CD1-CD1 4.47Å
298	L	80.4	Confident	80	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	20%	0.204	C	C	.	.	S	Bend	trans	-101.1	135.1	-176.8	-59.2	-179.8	0	0	0	112.2	L293 L304 V343 K376 E378	L293-L298 HydrophobicContact CB-CD1 4.03Å; L293-L298 HydrophobicContact CB-CG 4.3Å; L293-L298 HydrophobicContact CD2-CD1 4.05Å; L293-L298 HydrophobicContact CD2-CD2 4.23Å; L293-L298 HydrophobicContact CD2-CG 3.93Å; L293-L298 HydrophobicContact CG-CD1 4.49Å; L293-L298 VanDerWaalsContact O-CB 3.27Å; L293-L298 WeakPolarHBondContact O-CB 3.43Å; L293-L298 WeakPolarHBondContact O-CG 3.3Å; L293-L298 PolarHBondContact O-N 3.46Å; L298-L304 HydrophobicContact CD2-CD1 3.68Å; L298-L304 HydrophobicContact CD2-CD2 4.42Å; L298-L304 HydrophobicContact CD2-CG 4.14Å; L298-V343 HydrophobicContact CD2-CG2 4.19Å; L298-K376 HydrophobicContact CB-CD 3.77Å; L298-K376 HydrophobicContact CB-CG 4.14Å; L298-K376 HydrophobicContact CD1-CB 4.06Å; L298-K376 HydrophobicContact CD1-CG 3.98Å; L298-K376 PolarHBondContact O-NZ 3.37Å; L298-E378 HydrophobicContact CD1-CB 4.38Å; L298-E378 HydrophobicContact CD1-CG 3.87Å; L298-E378 HydrophobicContact CD2-CG 3.89Å; L298-E378 HydrophobicContact CG-CG 4.43Å
299	P	76.4	Confident	79.5	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.019	21%	0.212	C	C	.	.			trans	-61.5	150.1	166.7	-17.4	30.2	0	0	0	111.6	W183 Y184 R302	W183-P299 HydrophobicContact CZ2-CG 4.34Å; Y184-P299 HydrophobicContact CD1-CB 4.35Å; Y184-P299 HydrophobicContact CD1-CG 3.86Å; Y184-P299 HydrophobicContact CG-CB 4.24Å; Y184-P299 HydrophobicContact CG-CG 3.95Å; P299-R302 HydrophobicContact CB-CG 3.63Å; P299-R302 HydrophobicContact CG-CG 3.95Å
300	D	71.1	Confident	78.8	Confident	100 Å²	100	39.8 Å²	39.8	54%	0.535	21%	0.212	S	C	.	.	S	Bend	trans	-81.7	-37.2	174.3	-60	-72.3	0	0	0	112.5	K376	D300-K376 VanDerWaalsContact CG-NZ 3.33Å; D300-K376 IonicContact OD1-NZ 2.82Å; D300-K376 PolarHBondContact OD1-NZ 3.39Å; D300-K376 IonicContact OD2-NZ 3.24Å
301	S	65.7	Low	78	Confident	116 Å²	116	39.5 Å²	39.5	81%	0.811	21%	0.212	S	C	*	.	S	Bend	trans	-93.8	-7.5	-167.5	57.3	0	0	0	0	116
302	R	75.3	Confident	77	Confident	27 Å²	27	35.2 Å²	35.2	10%	0.102	19%	0.192	C	C	.	.	S	Bend	trans	-151.6	152.7	-169.7	67.3	178.5	-148.9	129.1	15.1	112.9	S189 P299 E336	S189-R302 VanDerWaalsContact C-NH1 3.32Å; S189-R302 PolarHBondContact O-NH1 3Å; P299-R302 HydrophobicContact CB-CG 3.63Å; P299-R302 HydrophobicContact CG-CG 3.95Å; R302-E336 IonicContact CZ-OE1 3.62Å; R302-E336 IonicContact CZ-OE2 3.71Å; R302-E336 IonicContact NH2-OE1 2.77Å; R302-E336 PolarHBondContact NH2-OE1 2.82Å; R302-E336 IonicContact NH2-OE2 3.61Å; R302-E336 PolarHBondContact NH2-OE2 2.82Å
303	K	81.7	Confident	76	Confident	99 Å²	99	40.3 Å²	40.3	43%	0.43	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-85	143	174.4	-56	179.8	-166.2	-83.1	0	112	P377 E378 E380	K303-P377 HydrophobicContact CG-CB 3.92Å; K303-P377 HydrophobicContact CG-CG 4.14Å; K303-P377 WeakPolarHBondContact CG-O 3.39Å; K303-P377 PolarHBondContact NZ-O 2.95Å; K303-E378 WeakPolarHBondContact CA-OE1 3.29Å; K303-E380 IonicContact NZ-OE1 2.76Å; K303-E380 PolarHBondContact NZ-OE1 2.72Å; K303-E380 IonicContact NZ-OE2 3.4Å; K303-E380 PolarHBondContact NZ-OE2 2.81Å
304	L	81.4	Confident	74.8	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-61.3	141	176.5	-67	178.6	0	0	0	111.1	W183 L298 E336 L339 K340 V343 E378	W183-L304 HydrophobicContact CH2-CD2 3.66Å; W183-L304 HydrophobicContact CZ2-CD2 3.71Å; L298-L304 HydrophobicContact CD2-CD1 3.68Å; L298-L304 HydrophobicContact CD2-CD2 4.42Å; L298-L304 HydrophobicContact CD2-CG 4.14Å; L304-E336 HydrophobicContact CD2-CG 4.05Å; L304-L339 HydrophobicContact CD1-CD2 4.29Å; L304-L339 HydrophobicContact CD1-CG 4.08Å; L304-L339 HydrophobicContact CD2-CD2 4.2Å; L304-K340 HydrophobicContact CB-CB 4.11Å; L304-K340 HydrophobicContact CB-CD 4.07Å; L304-K340 HydrophobicContact CB-CG 4.01Å; L304-K340 HydrophobicContact CD1-CB 4.05Å; L304-K340 HydrophobicContact CD1-CG 4.32Å; L304-K340 WeakPolarHBondContact O-CD 3.32Å; L304-K340 WeakPolarHBondContact O-CE 3.48Å; L304-K340 PolarHBondContact O-NZ 2.95Å; L304-V343 HydrophobicContact CD1-CG2 4.39Å; L304-E378 HydrophobicContact CD1-CG 4.33Å; L304-E378 HydrophobicContact CG-CG 4.29Å; L304-E378 WeakPolarHBondContact CG-OE1 3.4Å; L304-E378 PolarHBondContact N-OE1 3.18Å; L304-E378 PolarHBondContact N-OE2 3.11Å
305	R	75.6	Confident	73.9	Confident	36 Å²	36	43.9 Å²	43.9	14%	0.136	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-100.1	149	-174.1	-62.4	167.6	-175.4	-170.2	-0.1	112.2	S189 N190 E191 E336	S189-R305 PolarHBondContact O-NH1 3.48Å; N190-R305 PolarHBondContact O-NH1 3.09Å; N190-R305 PolarHBondContact O-NH2 3.15Å; E191-R305 PolarHBondContact O-NH1 3.4Å; R305-E336 WeakPolarHBondContact CB-OE1 3.47Å; R305-E336 WeakPolarHBondContact CG-OE1 3.29Å; R305-E336 PolarHBondContact N-OE1 3.3Å
306	I	78.9	Confident	72.9	Confident	70 Å²	70	45.1 Å²	45.1	36%	0.359	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-86.3	140.4	171.2	-56.2	171.2	0	0	0	107.4	S308 Q309 K340	I306-S308 PolarHBondContact O-N 2.9Å; I306-Q309 HydrophobicContact CB-CG 4.19Å; I306-Q309 VanDerWaalsContact O-CB 3.26Å; I306-Q309 WeakPolarHBondContact O-CB 3.4Å; I306-Q309 PolarHBondContact O-N 2.81Å; I306-K340 HydrophobicContact CG1-CD 4.03Å
307	F	77.9	Confident	72.3	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-44	-41.6	-179.6	-164.5	-104.7	0	0	0	113.8	V202 K206 A209 Q309 H310 F312 L330 W333 H337	V202-F307 HydrophobicContact CG1-CD1 3.9Å; V202-F307 HydrophobicContact CG1-CE1 4.36Å; K206-F307 HydrophobicContact CB-CD1 3.99Å; K206-F307 HydrophobicContact CB-CE1 3.6Å; K206-F307 HydrophobicContact CB-CZ 4.26Å; K206-F307 HydrophobicContact CD-CD1 4.4Å; K206-F307 HydrophobicContact CG-CD1 4.38Å; K206-F307 HydrophobicContact CG-CE1 4.33Å; A209-F307 HydrophobicContact CB-CE2 4.12Å; A209-F307 HydrophobicContact CB-CZ 4.02Å; F307-Q309 PolarHBondContact O-N 3.3Å; F307-Q309 VanDerWaalsContact O-N 3.15Å; F307-H310 PolarHBondContact O-N 3.18Å; F307-F312 HydrophobicContact CD1-CE1 4.39Å; F307-F312 HydrophobicContact CD1-CE2 4.33Å; F307-F312 AromaticContact CD1-CZ 3.59Å; F307-F312 HydrophobicContact CD1-CZ 3.59Å; F307-F312 HydrophobicContact CD2-CZ 4.44Å; F307-F312 AromaticContact CE1-CE1 3.72Å; F307-F312 HydrophobicContact CE1-CE1 3.72Å; F307-F312 HydrophobicContact CE1-CE2 4.36Å; F307-F312 AromaticContact CE1-CZ 3.35Å; F307-F312 HydrophobicContact CE1-CZ 3.35Å; F307-F312 HydrophobicContact CE2-CE1 4.44Å; F307-F312 HydrophobicContact CE2-CZ 4.27Å; F307-F312 HydrophobicContact CG-CZ 4.14Å; F307-F312 AromaticContact CZ-CE1 3.75Å; F307-F312 HydrophobicContact CZ-CE1 3.75Å; F307-F312 AromaticContact CZ-CZ 3.74Å; F307-F312 HydrophobicContact CZ-CZ 3.74Å; F307-F312 WeakPolarHBondContact O-CE2 3.35Å; F307-F312 VanDerWaalsContact O-CZ 3.24Å; F307-F312 WeakPolarHBondContact O-CZ 3.39Å; F307-L330 HydrophobicContact CZ-CD2 4.3Å; F307-W333 HydrophobicContact CD2-CB 4.19Å; F307-W333 HydrophobicContact CE2-CB 4.22Å; F307-H337 HydrophobicContact CB-CB 3.91Å
308	S	73.3	Confident	71.4	Confident	54 Å²	54	53.7 Å²	53.7	38%	0.378	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-66.2	-8	178.2	-43	0	0	0	0	116	I306	I306-S308 PolarHBondContact O-N 2.9Å
309	Q	74.9	Confident	70.4	Confident	63 Å²	63	53.8 Å²	53.8	29%	0.294	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-96.7	0.1	-178.3	-64.1	174.5	-35.2	0	0	113.2	Y192 S193 I306 F307	Y192-Q309 HydrophobicContact CD2-CB 4.29Å; Y192-Q309 WeakPolarHBondContact CD2-O 3.42Å; Y192-Q309 HydrophobicContact CE2-CB 4Å; S193-Q309 PolarHBondContact N-O 2.95Å; I306-Q309 HydrophobicContact CB-CG 4.19Å; I306-Q309 VanDerWaalsContact O-CB 3.26Å; I306-Q309 WeakPolarHBondContact O-CB 3.4Å; I306-Q309 PolarHBondContact O-N 2.81Å; F307-Q309 PolarHBondContact O-N 3.3Å; F307-Q309 VanDerWaalsContact O-N 3.15Å
310	H	73.9	Confident	69.6	Low	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.313	C	S	.	.	S	Bend	trans	-91.8	150.8	174.5	-62.2	-82	0	0	0	111.5	E191 F307 F312 W333	E191-H310 PolarHBondContact O-ND1 3.43Å; E191-H310 VanDerWaalsContact O-ND1 3.15Å; F307-H310 PolarHBondContact O-N 3.18Å; H310-F312 WeakPolarHBondContact O-CD2 3.39Å; H310-F312 PolarHBondContact O-N 3.38Å; H310-W333 HydrophobicContact CB-CD2 3.73Å; H310-W333 HydrophobicContact CB-CE3 3.58Å; H310-W333 HydrophobicContact CB-CG 4.36Å; H310-W333 HydrophobicContact CB-CH2 4.01Å; H310-W333 HydrophobicContact CB-CZ2 4.16Å; H310-W333 HydrophobicContact CB-CZ3 3.73Å; H310-W333 AromaticContact CD2-CG 3.81Å; H310-W333 AromaticContact CE1-CD1 3.46Å; H310-W333 VanDerWaalsContact CE1-CD1 3.46Å; H310-W333 AromaticContact CE1-CG 3.77Å; H310-W333 AromaticContact CE1-NE1 3.83Å; H310-W333 AromaticContact CG-CD2 3.6Å; H310-W333 AromaticContact CG-CE2 3.88Å; H310-W333 AromaticContact CG-CE3 3.96Å; H310-W333 AromaticContact CG-CG 3.73Å; H310-W333 AromaticContact ND1-CD1 3.55Å; H310-W333 AromaticContact ND1-CD2 3.77Å; H310-W333 AromaticContact ND1-CE2 3.63Å; H310-W333 AromaticContact ND1-CG 3.73Å; H310-W333 AromaticContact ND1-NE1 3.51Å; H310-W333 AromaticContact NE2-CD1 3.94Å; H310-W333 AromaticContact NE2-CG 3.85Å
311	P	72.4	Confident	69.2	Low	12 Å²	12	57.2 Å²	57.2	8%	0.078	32%	0.317	C	S	.	.			trans	-81.1	79.6	-174.6	33	-36.1	0	0	0	112.8	E191 D313 K314 L315 L318	E191-P311 HydrophobicContact CB-CG 4.38Å; P311-D313 VanDerWaalsContact C-N 3.3Å; P311-D313 PolarHBondContact O-N 2.68Å; P311-K314 HydrophobicContact CB-CB 4.28Å; P311-K314 PolarHBondContact O-N 3.09Å; P311-L315 PolarHBondContact O-N 3.49Å; P311-L318 HydrophobicContact CG-CD1 4.07Å
312	F	67	Low	69.6	Low	6 Å²	6	55.7 Å²	55.7	3%	0.026	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.5	-37.3	174.9	-61.8	-75	0	0	0	113	Q197 V201 V202 Y205 F307 H310 K314 L315 L330 W333	Q197-F312 HydrophobicContact CB-CD2 4.22Å; Q197-F312 HydrophobicContact CG-CD2 4.08Å; V201-F312 HydrophobicContact CG1-CB 4.43Å; V202-F312 HydrophobicContact CG1-CE2 4.19Å; V202-F312 HydrophobicContact CG2-CD2 3.94Å; V202-F312 HydrophobicContact CG2-CE2 4Å; Y205-F312 HydrophobicContact CD2-CB 4.21Å; Y205-F312 AromaticContact CD2-CD1 3.65Å; Y205-F312 HydrophobicContact CD2-CD1 3.65Å; Y205-F312 HydrophobicContact CD2-CE1 4.44Å; Y205-F312 HydrophobicContact CD2-CG 4.16Å; Y205-F312 HydrophobicContact CE2-CB 4.36Å; Y205-F312 HydrophobicContact CE2-CD1 4.38Å; Y205-F312 AromaticContact CG-CD1 3.97Å; Y205-F312 HydrophobicContact CG-CD1 3.97Å; Y205-F312 HydrophobicContact CG-CE1 4.38Å; F307-F312 HydrophobicContact CD1-CE1 4.39Å; F307-F312 HydrophobicContact CD1-CE2 4.33Å; F307-F312 AromaticContact CD1-CZ 3.59Å; F307-F312 HydrophobicContact CD1-CZ 3.59Å; F307-F312 HydrophobicContact CD2-CZ 4.44Å; F307-F312 AromaticContact CE1-CE1 3.72Å; F307-F312 HydrophobicContact CE1-CE1 3.72Å; F307-F312 HydrophobicContact CE1-CE2 4.36Å; F307-F312 AromaticContact CE1-CZ 3.35Å; F307-F312 HydrophobicContact CE1-CZ 3.35Å; F307-F312 HydrophobicContact CE2-CE1 4.44Å; F307-F312 HydrophobicContact CE2-CZ 4.27Å; F307-F312 HydrophobicContact CG-CZ 4.14Å; F307-F312 AromaticContact CZ-CE1 3.75Å; F307-F312 HydrophobicContact CZ-CE1 3.75Å; F307-F312 AromaticContact CZ-CZ 3.74Å; F307-F312 HydrophobicContact CZ-CZ 3.74Å; F307-F312 WeakPolarHBondContact O-CE2 3.35Å; F307-F312 VanDerWaalsContact O-CZ 3.24Å; F307-F312 WeakPolarHBondContact O-CZ 3.39Å; H310-F312 WeakPolarHBondContact O-CD2 3.39Å; H310-F312 PolarHBondContact O-N 3.38Å; F312-K314 PolarHBondContact O-N 2.61Å; F312-K314 VanDerWaalsContact O-N 3.14Å; F312-L315 HydrophobicContact CD1-CD2 4.35Å; F312-L315 VanDerWaalsContact O-CB 3.26Å; F312-L315 WeakPolarHBondContact O-CB 3.08Å; F312-L315 PolarHBondContact O-N 2.98Å; F312-L330 HydrophobicContact CE1-CD2 4.07Å; F312-W333 HydrophobicContact CD1-CZ3 4.31Å; F312-W333 HydrophobicContact CE1-CE3 4.12Å; F312-W333 HydrophobicContact CE1-CZ3 4.12Å
313	D	63.1	Low	69.3	Low	109 Å²	109	58.6 Å²	58.6	58%	0.583	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-59.4	-25.3	177.4	-64.1	-28.7	0	0	0	113.4	Q197 P311	Q197-D313 PolarHBondContact NE2-OD2 3.23Å; Q197-D313 PolarHBondContact OE1-OD2 2.99Å; P311-D313 VanDerWaalsContact C-N 3.3Å; P311-D313 PolarHBondContact O-N 2.68Å
314	K	61.3	Low	68.9	Low	118 Å²	118	56.5 Å²	56.5	51%	0.513	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-101.1	-5.4	178.2	-65.1	-172.6	175.5	-174.2	0	113.5	P311 F312 E316 Q317 L318	P311-K314 HydrophobicContact CB-CB 4.28Å; P311-K314 PolarHBondContact O-N 3.09Å; F312-K314 PolarHBondContact O-N 2.61Å; F312-K314 VanDerWaalsContact O-N 3.14Å; K314-E316 VanDerWaalsContact C-N 3.27Å; K314-E316 PolarHBondContact O-N 3.19Å; K314-E316 VanDerWaalsContact O-N 3.17Å; K314-Q317 WeakPolarHBondContact O-CA 3.25Å; K314-Q317 WeakPolarHBondContact O-CB 3.07Å; K314-Q317 PolarHBondContact O-N 2.7Å; K314-L318 HydrophobicContact CB-CD1 3.49Å; K314-L318 VanDerWaalsContact CB-CD1 3.49Å; K314-L318 HydrophobicContact CB-CG 4Å; K314-L318 HydrophobicContact CD-CD1 4.48Å; K314-L318 WeakPolarHBondContact O-CG 3.18Å; K314-L318 PolarHBondContact O-N 2.88Å
315	L	65.4	Low	68.6	Low	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-35	-169.3	175.8	59.7	0	0	0	113.1	Y205 P311 F312 S319 R326 R329 L330 W333	Y205-L315 HydrophobicContact CD1-CD2 4.4Å; Y205-L315 HydrophobicContact CE1-CD2 4.13Å; P311-L315 PolarHBondContact O-N 3.49Å; F312-L315 HydrophobicContact CD1-CD2 4.35Å; F312-L315 VanDerWaalsContact O-CB 3.26Å; F312-L315 WeakPolarHBondContact O-CB 3.08Å; F312-L315 PolarHBondContact O-N 2.98Å; L315-S319 WeakPolarHBondContact O-CB 3.39Å; L315-S319 PolarHBondContact O-N 3.32Å; L315-S319 VanDerWaalsContact O-N 3.12Å; L315-S319 PolarHBondContact O-OG 2.89Å; L315-R326 HydrophobicContact CD1-CG 3.94Å; L315-R326 HydrophobicContact CD2-CG 3.97Å; L315-R326 HydrophobicContact CG-CG 3.82Å; L315-R329 HydrophobicContact CD1-CB 4.2Å; L315-L330 HydrophobicContact CD2-CD1 4.28Å; L315-L330 HydrophobicContact CD2-CD2 3.77Å; L315-L330 HydrophobicContact CD2-CG 4.01Å; L315-W333 HydrophobicContact CD1-CH2 3.87Å; L315-W333 HydrophobicContact CD1-CZ3 3.98Å; L315-W333 HydrophobicContact CD2-CZ3 4.4Å
316	E	61.8	Low	68.6	Low	98 Å²	98	56.2 Å²	56.2	46%	0.458	31%	0.308	S	S	.	.	H	α-helix	trans	-72.6	-30.8	176	-60.8	-167.1	152	0	0	113.1	I166 K314 S319 G321	I166-E316 WeakPolarHBondContact CG2-OE1 3.44Å; K314-E316 VanDerWaalsContact C-N 3.27Å; K314-E316 PolarHBondContact O-N 3.19Å; K314-E316 VanDerWaalsContact O-N 3.17Å; E316-S319 WeakPolarHBondContact CA-OG 3.45Å; E316-S319 PolarHBondContact O-OG 2.93Å; E316-G321 PolarHBondContact O-N 3.34Å
317	Q	61.7	Low	68.6	Low	146 Å²	146	53.1 Å²	53.1	68%	0.682	29%	0.292	S	S	*	.	H	α-helix	trans	-75.5	-46.4	176	-62.1	177	-11.3	0	0	110.8	K314 S319 S320	K314-Q317 WeakPolarHBondContact O-CA 3.25Å; K314-Q317 WeakPolarHBondContact O-CB 3.07Å; K314-Q317 PolarHBondContact O-N 2.7Å; Q317-S319 VanDerWaalsContact C-N 3.26Å; Q317-S319 PolarHBondContact O-N 2.7Å; Q317-S320 PolarHBondContact O-N 2.79Å
318	L	60	Low	68.6	Low	62 Å²	62	57.3 Å²	57.3	33%	0.325	31%	0.308	S	S	.	.	H	α-helix	trans	-69.5	-21.5	-179.2	-64.2	163	0	0	0	113.1	E191 P311 K314 R329	E191-L318 WeakPolarHBondContact OE2-CD1 3.18Å; P311-L318 HydrophobicContact CG-CD1 4.07Å; K314-L318 HydrophobicContact CB-CD1 3.49Å; K314-L318 VanDerWaalsContact CB-CD1 3.49Å; K314-L318 HydrophobicContact CB-CG 4Å; K314-L318 HydrophobicContact CD-CD1 4.48Å; K314-L318 WeakPolarHBondContact O-CG 3.18Å; K314-L318 PolarHBondContact O-N 2.88Å; L318-R329 PolarHBondContact O-NH2 3.29Å
319	S	59.9	Low	68.9	Low	5 Å²	5	55.4 Å²	55.4	4%	0.035	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-2.3	170.3	54.4	0	0	0	0	113.8	L315 E316 Q317 G321 N322 S325	L315-S319 WeakPolarHBondContact O-CB 3.39Å; L315-S319 PolarHBondContact O-N 3.32Å; L315-S319 VanDerWaalsContact O-N 3.12Å; L315-S319 PolarHBondContact O-OG 2.89Å; E316-S319 WeakPolarHBondContact CA-OG 3.45Å; E316-S319 PolarHBondContact O-OG 2.93Å; Q317-S319 VanDerWaalsContact C-N 3.26Å; Q317-S319 PolarHBondContact O-N 2.7Å; S319-G321 PolarHBondContact O-N 2.84Å; S319-N322 WeakPolarHBondContact O-CB 3.49Å; S319-N322 PolarHBondContact O-N 3.35Å; S319-S325 WeakPolarHBondContact CA-OG 3.39Å; S319-S325 VanDerWaalsContact CB-OG 3.26Å; S319-S325 WeakPolarHBondContact CB-OG 3.41Å; S319-S325 PolarHBondContact O-OG 3.2Å; S319-S325 VanDerWaalsContact O-OG 3.08Å
320	S	59.8	Low	69.2	Low	115 Å²	115	52.4 Å²	52.4	80%	0.804	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	33.1	-172.1	-56.8	0	0	0	0	113.1	Q317 N322	Q317-S320 PolarHBondContact O-N 2.79Å; S320-N322 PolarHBondContact O-N 2.67Å
321	G	61.7	Low	69.6	Low	60 Å²	60	52.4 Å²	52.4	62%	0.619	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	0.7	-173	0	0	0	0	0	115.7	E316 S319 K323	E316-G321 PolarHBondContact O-N 3.34Å; S319-G321 PolarHBondContact O-N 2.84Å; G321-K323 PolarHBondContact O-N 2.66Å
322	N	74.9	Confident	70.1	Confident	85 Å²	85	52.2 Å²	52.2	46%	0.455	28%	0.277	S	S	.	.			trans	-80.4	112.3	179.2	-174	-3.4	0	0	0	110.8	S319 S320 D324 S325 R326	S319-N322 WeakPolarHBondContact O-CB 3.49Å; S319-N322 PolarHBondContact O-N 3.35Å; S320-N322 PolarHBondContact O-N 2.67Å; N322-D324 PolarHBondContact O-N 2.67Å; N322-D324 VanDerWaalsContact O-N 3.14Å; N322-D324 PolarHBondContact OD1-N 2.93Å; N322-D324 VanDerWaalsContact OD1-N 3.09Å; N322-S325 PolarHBondContact O-N 3.47Å; N322-S325 PolarHBondContact O-OG 2.75Å; N322-R326 PolarHBondContact O-N 3.31Å
323	K	69.4	Low	70.9	Confident	87 Å²	87	52 Å²	52	38%	0.378	28%	0.276	S	S	.	.	H	α-helix	trans	-54.8	-34.8	179.2	-62.9	-175.4	-178.8	-177.1	0	112	G321 R326 D327	G321-K323 PolarHBondContact O-N 2.66Å; K323-R326 WeakPolarHBondContact O-CB 3.36Å; K323-R326 PolarHBondContact O-N 3.46Å; K323-D327 WeakPolarHBondContact O-CB 3.45Å; K323-D327 PolarHBondContact O-N 3.16Å
324	D	72.1	Confident	71.9	Confident	56 Å²	56	47.5 Å²	47.5	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-71.9	-35.7	-174.7	-68.2	38.2	0	0	0	113	R172 L176 N322 R328	R172-D324 IonicContact CZ-OD1 2.63Å; R172-D324 IonicContact CZ-OD2 2.62Å; R172-D324 IonicContact NH1-OD1 3.37Å; R172-D324 PolarHBondContact NH1-OD1 3.45Å; R172-D324 IonicContact NH1-OD2 3.2Å; R172-D324 PolarHBondContact NH1-OD2 3.09Å; R172-D324 IonicContact NH2-OD1 3.23Å; R172-D324 PolarHBondContact NH2-OD1 3.09Å; L176-D324 HydrophobicContact CD2-CB 4.34Å; N322-D324 PolarHBondContact O-N 2.67Å; N322-D324 VanDerWaalsContact O-N 3.14Å; N322-D324 PolarHBondContact OD1-N 2.93Å; N322-D324 VanDerWaalsContact OD1-N 3.09Å; D324-R328 VanDerWaalsContact O-CG 3.3Å; D324-R328 WeakPolarHBondContact O-CG 3.4Å; D324-R328 PolarHBondContact O-N 3.35Å
325	S	74.5	Confident	73.1	Confident	16 Å²	16	41.9 Å²	41.9	11%	0.112	23%	0.226	C	C	.	.	H	α-helix	trans	-74	-40.6	173	61.3	0	0	0	0	110.6	S319 N322 D327 R328 R329	S319-S325 WeakPolarHBondContact CA-OG 3.39Å; S319-S325 VanDerWaalsContact CB-OG 3.26Å; S319-S325 WeakPolarHBondContact CB-OG 3.41Å; S319-S325 PolarHBondContact O-OG 3.2Å; S319-S325 VanDerWaalsContact O-OG 3.08Å; N322-S325 PolarHBondContact O-N 3.47Å; N322-S325 PolarHBondContact O-OG 2.75Å; S325-D327 PolarHBondContact O-N 3.37Å; S325-R328 WeakPolarHBondContact O-CB 3.49Å; S325-R328 PolarHBondContact O-N 3.03Å; S325-R329 WeakPolarHBondContact O-CD 3.39Å; S325-R329 WeakPolarHBondContact O-CG 3.4Å; S325-R329 PolarHBondContact O-N 2.85Å
326	R	77.3	Confident	74	Confident	18 Å²	18	42 Å²	42	7%	0.068	23%	0.227	C	C	.	.	H	α-helix	trans	-54.9	-49	172.7	-173.2	-159.3	70.9	161.9	1.3	112.2	I166 L315 N322 K323 R329 L330	I166-R326 PolarHBondContact O-NH1 3.04Å; L315-R326 HydrophobicContact CD1-CG 3.94Å; L315-R326 HydrophobicContact CD2-CG 3.97Å; L315-R326 HydrophobicContact CG-CG 3.82Å; N322-R326 PolarHBondContact O-N 3.31Å; K323-R326 WeakPolarHBondContact O-CB 3.36Å; K323-R326 PolarHBondContact O-N 3.46Å; R326-R329 WeakPolarHBondContact O-CB 3.27Å; R326-R329 PolarHBondContact O-N 3.45Å; R326-L330 HydrophobicContact CG-CD1 4.23Å; R326-L330 WeakPolarHBondContact O-CG 3.37Å; R326-L330 PolarHBondContact O-N 3.14Å
327	D	78.2	Confident	75.2	Confident	5 Å²	5	37.6 Å²	37.6	3%	0.027	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-41.1	-177.2	-63.2	-15.8	0	0	0	110.3	R172 L176 L212 K323 S325 R329 L330 I331	R172-D327 IonicContact CZ-OD2 3.35Å; R172-D327 IonicContact NE-OD2 2.67Å; R172-D327 IonicContact NH2-OD2 3.48Å; R172-D327 PolarHBondContact NH2-OD2 3.06Å; L176-D327 HydrophobicContact CD1-CB 3.79Å; L212-D327 HydrophobicContact CD1-CB 4.01Å; L212-D327 HydrophobicContact CD2-CB 4.46Å; K323-D327 WeakPolarHBondContact O-CB 3.45Å; K323-D327 PolarHBondContact O-N 3.16Å; S325-D327 PolarHBondContact O-N 3.37Å; D327-R329 PolarHBondContact O-N 2.91Å; D327-L330 PolarHBondContact O-N 3.24Å; D327-I331 WeakPolarHBondContact O-CB 3.48Å; D327-I331 WeakPolarHBondContact O-CD1 3.44Å; D327-I331 WeakPolarHBondContact O-CG1 3.37Å; D327-I331 PolarHBondContact O-N 3.19Å
328	R	77.7	Confident	76.3	Confident	89 Å²	89	32.9 Å²	32.9	34%	0.336	18%	0.184	S	C	.	.	H	α-helix	trans	-56.7	-48	170.2	-74	169.3	171.9	151.1	4.1	113.1	L176 L177 D324 S325 I331 L332	L176-R328 HydrophobicContact CB-CG 3.78Å; L176-R328 VanDerWaalsContact O-CZ 3.25Å; L176-R328 PolarHBondContact O-NE 3.05Å; L176-R328 PolarHBondContact O-NH2 2.78Å; L177-R328 HydrophobicContact CD2-CB 4.43Å; L177-R328 HydrophobicContact CD2-CG 4.22Å; D324-R328 VanDerWaalsContact O-CG 3.3Å; D324-R328 WeakPolarHBondContact O-CG 3.4Å; D324-R328 PolarHBondContact O-N 3.35Å; S325-R328 WeakPolarHBondContact O-CB 3.49Å; S325-R328 PolarHBondContact O-N 3.03Å; R328-I331 PolarHBondContact O-N 3.23Å; R328-L332 WeakPolarHBondContact O-CG 3.15Å; R328-L332 PolarHBondContact O-N 2.97Å
329	R	79.6	Confident	77.5	Confident	13 Å²	13	30 Å²	30	5%	0.049	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-49.1	-180	-70.6	153.8	161.2	-82.5	-3.6	110.6	Y188 E191 L315 L318 S325 R326 D327 I331 L332 W333	Y188-R329 HydrophobicContact CD1-CG 4.24Å; Y188-R329 HydrophobicContact CD2-CG 3.9Å; Y188-R329 HydrophobicContact CG-CG 3.7Å; E191-R329 IonicContact OE1-CZ 2.68Å; E191-R329 VanDerWaalsContact OE1-CZ 3.24Å; E191-R329 IonicContact OE1-NH1 3.92Å; E191-R329 PolarHBondContact OE1-NH1 2.99Å; E191-R329 IonicContact OE1-NH2 2.71Å; E191-R329 PolarHBondContact OE1-NH2 3.35Å; E191-R329 IonicContact OE2-CZ 2.77Å; E191-R329 IonicContact OE2-NH1 3.58Å; E191-R329 PolarHBondContact OE2-NH1 3.4Å; L315-R329 HydrophobicContact CD1-CB 4.2Å; L318-R329 PolarHBondContact O-NH2 3.29Å; S325-R329 WeakPolarHBondContact O-CD 3.39Å; S325-R329 WeakPolarHBondContact O-CG 3.4Å; S325-R329 PolarHBondContact O-N 2.85Å; R326-R329 WeakPolarHBondContact O-CB 3.27Å; R326-R329 PolarHBondContact O-N 3.45Å; D327-R329 PolarHBondContact O-N 2.91Å; R329-I331 VanDerWaalsContact C-N 3.33Å; R329-I331 PolarHBondContact O-N 3.21Å; R329-L332 PolarHBondContact O-N 3.24Å; R329-W333 HydrophobicContact CB-CZ2 4.37Å; R329-W333 WeakPolarHBondContact O-CB 3.36Å; R329-W333 PolarHBondContact O-N 2.82Å
330	L	81.3	Confident	78.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.7	-40	176.5	-74	172	0	0	0	112.9	Y205 L208 A209 L212 F307 F312 L315 R326 D327 W333 Y334	Y205-L330 HydrophobicContact CD1-CD1 4.01Å; Y205-L330 HydrophobicContact CD1-CD2 4.06Å; Y205-L330 HydrophobicContact CE1-CD1 4.44Å; Y205-L330 HydrophobicContact CG-CD2 4.32Å; L208-L330 HydrophobicContact CD2-CD1 4.13Å; A209-L330 HydrophobicContact CB-CB 4.07Å; L212-L330 HydrophobicContact CD1-CD1 4.45Å; F307-L330 HydrophobicContact CZ-CD2 4.3Å; F312-L330 HydrophobicContact CE1-CD2 4.07Å; L315-L330 HydrophobicContact CD2-CD1 4.28Å; L315-L330 HydrophobicContact CD2-CD2 3.77Å; L315-L330 HydrophobicContact CD2-CG 4.01Å; R326-L330 HydrophobicContact CG-CD1 4.23Å; R326-L330 WeakPolarHBondContact O-CG 3.37Å; R326-L330 PolarHBondContact O-N 3.14Å; D327-L330 PolarHBondContact O-N 3.24Å; L330-W333 HydrophobicContact CD2-CE3 4.47Å; L330-Y334 VanDerWaalsContact O-CB 3.26Å; L330-Y334 WeakPolarHBondContact O-CB 3.47Å; L330-Y334 PolarHBondContact O-N 3.21Å
331	I	83.1	Confident	80.2	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-65.8	-47	177.9	-72.3	166	0	0	0	111.3	L176 L177 L212 Y213 E216 D327 R328 R329 Y334 F335	L176-I331 HydrophobicContact CD1-CD1 4.25Å; L177-I331 HydrophobicContact CD1-CG2 3.92Å; L212-I331 HydrophobicContact CB-CD1 3.95Å; L212-I331 HydrophobicContact CB-CG1 3.84Å; Y213-I331 HydrophobicContact CD2-CG2 4.08Å; E216-I331 VanDerWaalsContact OE2-CD1 3.24Å; E216-I331 WeakPolarHBondContact OE2-CD1 3.47Å; D327-I331 WeakPolarHBondContact O-CB 3.48Å; D327-I331 WeakPolarHBondContact O-CD1 3.44Å; D327-I331 WeakPolarHBondContact O-CG1 3.37Å; D327-I331 PolarHBondContact O-N 3.19Å; R328-I331 PolarHBondContact O-N 3.23Å; R329-I331 VanDerWaalsContact C-N 3.33Å; R329-I331 PolarHBondContact O-N 3.21Å; I331-Y334 PolarHBondContact O-N 3.15Å; I331-F335 WeakPolarHBondContact O-CB 3.41Å; I331-F335 PolarHBondContact O-N 3.06Å
332	L	81.7	Confident	81.3	Confident	7 Å²	7	29.6 Å²	29.6	4%	0.037	14%	0.138	C	C	.	.	H	α-helix	trans	-64.4	-43.2	177.8	-69.2	170.3	0	0	0	112.2	L177 L186 Y188 V260 R328 R329 Y334 F335 E336	L177-L332 HydrophobicContact CD1-CD2 3.83Å; L177-L332 HydrophobicContact CD1-CG 4.28Å; L177-L332 HydrophobicContact CD2-CD1 4.22Å; L177-L332 HydrophobicContact CD2-CD2 4.22Å; L177-L332 HydrophobicContact CD2-CG 4.24Å; L186-L332 HydrophobicContact CB-CD1 4.28Å; L186-L332 HydrophobicContact CD1-CD1 3.9Å; L186-L332 HydrophobicContact CD1-CD2 3.79Å; Y188-L332 HydrophobicContact CD2-CD1 4.25Å; V260-L332 HydrophobicContact CG2-CD2 4.26Å; R328-L332 WeakPolarHBondContact O-CG 3.15Å; R328-L332 PolarHBondContact O-N 2.97Å; R329-L332 PolarHBondContact O-N 3.24Å; L332-Y334 VanDerWaalsContact C-N 3.32Å; L332-Y334 PolarHBondContact O-N 3.43Å; L332-F335 PolarHBondContact O-N 3.24Å; L332-E336 WeakPolarHBondContact O-CB 3.36Å; L332-E336 PolarHBondContact O-N 3.22Å
333	W	83.9	Confident	81.9	Confident	1 Å²	1	25.8 Å²	25.8	0%	0.004	12%	0.117	C	C	.	.	H	α-helix	trans	-66.8	-32.7	176.5	-60	-14.9	0	0	0	112.7	Y188 E191 F307 H310 F312 L315 R329 L330 H337	Y188-W333 PolarHBondContact O-NE1 2.93Å; E191-W333 HydrophobicContact CB-CZ2 4.4Å; E191-W333 WeakPolarHBondContact OE2-CZ2 3.37Å; F307-W333 HydrophobicContact CD2-CB 4.19Å; F307-W333 HydrophobicContact CE2-CB 4.22Å; H310-W333 HydrophobicContact CB-CD2 3.73Å; H310-W333 HydrophobicContact CB-CE3 3.58Å; H310-W333 HydrophobicContact CB-CG 4.36Å; H310-W333 HydrophobicContact CB-CH2 4.01Å; H310-W333 HydrophobicContact CB-CZ2 4.16Å; H310-W333 HydrophobicContact CB-CZ3 3.73Å; H310-W333 AromaticContact CD2-CG 3.81Å; H310-W333 AromaticContact CE1-CD1 3.46Å; H310-W333 VanDerWaalsContact CE1-CD1 3.46Å; H310-W333 AromaticContact CE1-CG 3.77Å; H310-W333 AromaticContact CE1-NE1 3.83Å; H310-W333 AromaticContact CG-CD2 3.6Å; H310-W333 AromaticContact CG-CE2 3.88Å; H310-W333 AromaticContact CG-CE3 3.96Å; H310-W333 AromaticContact CG-CG 3.73Å; H310-W333 AromaticContact ND1-CD1 3.55Å; H310-W333 AromaticContact ND1-CD2 3.77Å; H310-W333 AromaticContact ND1-CE2 3.63Å; H310-W333 AromaticContact ND1-CG 3.73Å; H310-W333 AromaticContact ND1-NE1 3.51Å; H310-W333 AromaticContact NE2-CD1 3.94Å; H310-W333 AromaticContact NE2-CG 3.85Å; F312-W333 HydrophobicContact CD1-CZ3 4.31Å; F312-W333 HydrophobicContact CE1-CE3 4.12Å; F312-W333 HydrophobicContact CE1-CZ3 4.12Å; L315-W333 HydrophobicContact CD1-CH2 3.87Å; L315-W333 HydrophobicContact CD1-CZ3 3.98Å; L315-W333 HydrophobicContact CD2-CZ3 4.4Å; R329-W333 HydrophobicContact CB-CZ2 4.37Å; R329-W333 WeakPolarHBondContact O-CB 3.36Å; R329-W333 PolarHBondContact O-N 2.82Å; L330-W333 HydrophobicContact CD2-CE3 4.47Å; W333-H337 WeakPolarHBondContact O-CB 3.34Å; W333-H337 PolarHBondContact O-N 3.3Å; W333-H337 VanDerWaalsContact O-N 3.08Å
334	Y	84.9	Confident	82.9	Confident	15 Å²	15	23 Å²	23	6%	0.059	11%	0.111	C	C	.	.	H	α-helix	trans	-69.8	-41.5	173.4	-174.9	-94.9	0	0	0	111.6	K206 A209 Q210 Y213 L330 I331 L332 H337 Q338	K206-Y334 HydrophobicContact CG-CE2 4.3Å; A209-Y334 HydrophobicContact CB-CD2 4.12Å; A209-Y334 HydrophobicContact CB-CG 4.23Å; Q210-Y334 HydrophobicContact CB-CE2 3.86Å; Y213-Y334 AromaticContact CD1-CD1 3.7Å; Y213-Y334 HydrophobicContact CD1-CD1 3.7Å; Y213-Y334 AromaticContact CD1-CE1 3.54Å; Y213-Y334 HydrophobicContact CD1-CE1 3.54Å; Y213-Y334 HydrophobicContact CE1-CD1 4.36Å; Y213-Y334 HydrophobicContact CE1-CE1 4.21Å; Y213-Y334 AromaticContact CG-CD1 3.82Å; Y213-Y334 HydrophobicContact CG-CD1 3.82Å; Y213-Y334 HydrophobicContact CG-CE1 4.09Å; L330-Y334 VanDerWaalsContact O-CB 3.26Å; L330-Y334 WeakPolarHBondContact O-CB 3.47Å; L330-Y334 PolarHBondContact O-N 3.21Å; I331-Y334 PolarHBondContact O-N 3.15Å; L332-Y334 VanDerWaalsContact C-N 3.32Å; L332-Y334 PolarHBondContact O-N 3.43Å; Y334-H337 PolarHBondContact O-N 2.83Å; Y334-Q338 HydrophobicContact CD1-CG 4.12Å; Y334-Q338 HydrophobicContact CE1-CG 3.74Å; Y334-Q338 VanDerWaalsContact CZ-NE2 3.31Å; Y334-Q338 WeakPolarHBondContact O-CG 3.32Å; Y334-Q338 PolarHBondContact O-N 2.96Å; Y334-Q338 PolarHBondContact OH-NE2 3.48Å
335	F	85.8	Confident	83.8	Confident	1 Å²	1	23.8 Å²	23.8	0%	0.004	11%	0.112	C	C	.	.	H	α-helix	trans	-60.7	-48	172.3	174.6	-100.3	0	0	0	111.8	W183 Y213 A259 V260 L263 I331 L332 H337 Q338 L339	W183-F335 HydrophobicContact CB-CE1 4.37Å; W183-F335 AromaticContact CD1-CE1 3.92Å; W183-F335 HydrophobicContact CD2-CD1 4.15Å; W183-F335 AromaticContact CD2-CE1 3.73Å; W183-F335 HydrophobicContact CD2-CE1 3.73Å; W183-F335 AromaticContact CE2-CE1 3.93Å; W183-F335 HydrophobicContact CE3-CD1 4.22Å; W183-F335 HydrophobicContact CE3-CE1 4.26Å; W183-F335 HydrophobicContact CG-CD1 4.42Å; W183-F335 AromaticContact CG-CE1 3.75Å; W183-F335 HydrophobicContact CG-CE1 3.75Å; Y213-F335 HydrophobicContact CE2-CD2 4.47Å; A259-F335 HydrophobicContact CB-CZ 4.43Å; A259-F335 VanDerWaalsContact O-CE2 3.27Å; A259-F335 WeakPolarHBondContact O-CE2 3.2Å; A259-F335 WeakPolarHBondContact O-CZ 3.27Å; V260-F335 HydrophobicContact CB-CD2 4.49Å; V260-F335 HydrophobicContact CG1-CB 4.24Å; V260-F335 HydrophobicContact CG1-CD2 4.18Å; V260-F335 HydrophobicContact CG1-CG 4.08Å; V260-F335 HydrophobicContact CG2-CD1 4.24Å; V260-F335 HydrophobicContact CG2-CE1 4.29Å; L263-F335 HydrophobicContact CD1-CD2 3.97Å; L263-F335 HydrophobicContact CD1-CE2 3.7Å; I331-F335 WeakPolarHBondContact O-CB 3.41Å; I331-F335 PolarHBondContact O-N 3.06Å; L332-F335 PolarHBondContact O-N 3.24Å; F335-H337 VanDerWaalsContact C-N 3.33Å; F335-H337 PolarHBondContact O-N 3.24Å; F335-Q338 PolarHBondContact O-N 3.1Å; F335-Q338 VanDerWaalsContact O-N 3.1Å; F335-L339 HydrophobicContact CE1-CD2 4.24Å; F335-L339 HydrophobicContact CZ-CD2 4.45Å; F335-L339 WeakPolarHBondContact O-CB 3.12Å; F335-L339 PolarHBondContact O-N 3.04Å
336	E	85.3	Confident	84.5	Confident	1 Å²	1	23 Å²	23	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-57.9	-44	177.4	-176	167.4	170.6	0	0	111.6	W183 R302 L304 R305 L332 L339 K340	W183-E336 HydrophobicContact CH2-CB 4.13Å; W183-E336 HydrophobicContact CH2-CG 3.83Å; W183-E336 HydrophobicContact CZ3-CB 4.03Å; W183-E336 HydrophobicContact CZ3-CG 4.13Å; R302-E336 IonicContact CZ-OE1 3.62Å; R302-E336 IonicContact CZ-OE2 3.71Å; R302-E336 IonicContact NH2-OE1 2.77Å; R302-E336 PolarHBondContact NH2-OE1 2.82Å; R302-E336 IonicContact NH2-OE2 3.61Å; R302-E336 PolarHBondContact NH2-OE2 2.82Å; L304-E336 HydrophobicContact CD2-CG 4.05Å; R305-E336 WeakPolarHBondContact CB-OE1 3.47Å; R305-E336 WeakPolarHBondContact CG-OE1 3.29Å; R305-E336 PolarHBondContact N-OE1 3.3Å; L332-E336 WeakPolarHBondContact O-CB 3.36Å; L332-E336 PolarHBondContact O-N 3.22Å; E336-L339 PolarHBondContact O-N 2.94Å; E336-K340 PolarHBondContact O-N 3.39Å
337	H	87.2	Confident	85.1	Confident	7 Å²	7	22.7 Å²	22.7	3%	0.032	11%	0.107	C	C	.	.	H	α-helix	trans	-61.1	-44.4	173	161.7	-74.9	0	0	0	112.7	K206 F307 W333 Y334 F335 K340 H341	K206-H337 PolarHBondContact NZ-CE1 2.81Å; K206-H337 PolarHBondContact NZ-NE2 2.93Å; F307-H337 HydrophobicContact CB-CB 3.91Å; W333-H337 WeakPolarHBondContact O-CB 3.34Å; W333-H337 PolarHBondContact O-N 3.3Å; W333-H337 VanDerWaalsContact O-N 3.08Å; Y334-H337 PolarHBondContact O-N 2.83Å; F335-H337 VanDerWaalsContact C-N 3.33Å; F335-H337 PolarHBondContact O-N 3.24Å; H337-K340 PolarHBondContact O-N 3.04Å; H337-H341 AromaticContact CD2-NE2 2.97Å; H337-H341 PolarHBondContact CD2-NE2 3.4Å; H337-H341 AromaticContact CE1-CD2 3.27Å; H337-H341 PolarHBondContact CE1-CD2 3.35Å; H337-H341 AromaticContact CE1-NE2 2.84Å; H337-H341 PolarHBondContact CE1-NE2 2.92Å; H337-H341 AromaticContact CG-NE2 3.73Å; H337-H341 AromaticContact ND1-CD2 3.65Å; H337-H341 AromaticContact ND1-NE2 3.66Å; H337-H341 AromaticContact NE2-CD2 3.57Å; H337-H341 AromaticContact NE2-NE2 2.31Å; H337-H341 PolarHBondContact NE2-NE2 3.25Å; H337-H341 PolarHBondContact O-CD2 3.09Å; H337-H341 PolarHBondContact O-N 2.94Å; H337-H341 VanDerWaalsContact O-N 3.14Å
338	Q	84.1	Confident	85.7	Confident	47 Å²	47	28.4 Å²	28.4	22%	0.22	13%	0.134	C	C	.	.	H	α-helix	trans	-69.6	-39.8	179.7	-68.6	-62.2	2.2	0	0	112.2	L263 Y334 F335 K340 H341 L342	L263-Q338 HydrophobicContact CD1-CB 4.4Å; L263-Q338 HydrophobicContact CD2-CB 4.27Å; Y334-Q338 HydrophobicContact CD1-CG 4.12Å; Y334-Q338 HydrophobicContact CE1-CG 3.74Å; Y334-Q338 VanDerWaalsContact CZ-NE2 3.31Å; Y334-Q338 WeakPolarHBondContact O-CG 3.32Å; Y334-Q338 PolarHBondContact O-N 2.96Å; Y334-Q338 PolarHBondContact OH-NE2 3.48Å; F335-Q338 PolarHBondContact O-N 3.1Å; F335-Q338 VanDerWaalsContact O-N 3.1Å; Q338-K340 VanDerWaalsContact C-N 3.29Å; Q338-K340 PolarHBondContact O-N 3.36Å; Q338-H341 PolarHBondContact O-N 3.2Å; Q338-L342 WeakPolarHBondContact O-CG 3.4Å; Q338-L342 PolarHBondContact O-N 3.25Å
339	L	86.1	Confident	86.2	Confident	1 Å²	1	25 Å²	25	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-58.2	-42.6	172.5	-177.7	62	0	0	0	110.8	W183 L297 L304 F335 E336 H341 L342 V343	W183-L339 HydrophobicContact CZ2-CD2 3.72Å; L297-L339 HydrophobicContact CB-CD1 4.45Å; L297-L339 HydrophobicContact CD1-CD1 4.47Å; L304-L339 HydrophobicContact CD1-CD2 4.29Å; L304-L339 HydrophobicContact CD1-CG 4.08Å; L304-L339 HydrophobicContact CD2-CD2 4.2Å; F335-L339 HydrophobicContact CE1-CD2 4.24Å; F335-L339 HydrophobicContact CZ-CD2 4.45Å; F335-L339 WeakPolarHBondContact O-CB 3.12Å; F335-L339 PolarHBondContact O-N 3.04Å; E336-L339 PolarHBondContact O-N 2.94Å; L339-H341 PolarHBondContact O-N 3.45Å; L339-L342 PolarHBondContact O-N 3.09Å; L339-V343 WeakPolarHBondContact O-CG2 3.44Å; L339-V343 PolarHBondContact O-N 3.45Å
340	K	87.4	Confident	86.6	Confident	34 Å²	34	24.4 Å²	24.4	15%	0.148	12%	0.12	C	C	.	.	H	α-helix	trans	-62.6	-40.3	176.2	-161.9	179.8	-175.9	81.1	0	113	L304 I306 E336 H337 Q338 V343 A344 E378 E379	L304-K340 HydrophobicContact CB-CB 4.11Å; L304-K340 HydrophobicContact CB-CD 4.07Å; L304-K340 HydrophobicContact CB-CG 4.01Å; L304-K340 HydrophobicContact CD1-CB 4.05Å; L304-K340 HydrophobicContact CD1-CG 4.32Å; L304-K340 WeakPolarHBondContact O-CD 3.32Å; L304-K340 WeakPolarHBondContact O-CE 3.48Å; L304-K340 PolarHBondContact O-NZ 2.95Å; I306-K340 HydrophobicContact CG1-CD 4.03Å; E336-K340 PolarHBondContact O-N 3.39Å; H337-K340 PolarHBondContact O-N 3.04Å; Q338-K340 VanDerWaalsContact C-N 3.29Å; Q338-K340 PolarHBondContact O-N 3.36Å; K340-V343 PolarHBondContact O-N 3.06Å; K340-A344 WeakPolarHBondContact O-CB 3.43Å; K340-A344 PolarHBondContact O-N 3.03Å; K340-E378 IonicContact NZ-OE2 2.72Å; K340-E378 PolarHBondContact NZ-OE2 2.91Å; K340-E378 VanDerWaalsContact NZ-OE2 3.13Å; K340-E379 IonicContact NZ-OE1 3.53Å
341	H	87.6	Confident	87	Confident	121 Å²	121	28.2 Å²	28.2	56%	0.56	14%	0.138	S	C	*	.	H	α-helix	trans	-64.2	-39.9	173.7	-79	-70.1	0	0	0	112.4	H337 Q338 L339 A344 E345	H337-H341 AromaticContact CD2-NE2 2.97Å; H337-H341 PolarHBondContact CD2-NE2 3.4Å; H337-H341 AromaticContact CE1-CD2 3.27Å; H337-H341 PolarHBondContact CE1-CD2 3.35Å; H337-H341 AromaticContact CE1-NE2 2.84Å; H337-H341 PolarHBondContact CE1-NE2 2.92Å; H337-H341 AromaticContact CG-NE2 3.73Å; H337-H341 AromaticContact ND1-CD2 3.65Å; H337-H341 AromaticContact ND1-NE2 3.66Å; H337-H341 AromaticContact NE2-CD2 3.57Å; H337-H341 AromaticContact NE2-NE2 2.31Å; H337-H341 PolarHBondContact NE2-NE2 3.25Å; H337-H341 PolarHBondContact O-CD2 3.09Å; H337-H341 PolarHBondContact O-N 2.94Å; H337-H341 VanDerWaalsContact O-N 3.14Å; Q338-H341 PolarHBondContact O-N 3.2Å; L339-H341 PolarHBondContact O-N 3.45Å; H341-A344 PolarHBondContact O-N 3.14Å; H341-E345 WeakPolarHBondContact O-CB 3.32Å; H341-E345 PolarHBondContact O-N 2.81Å
342	L	86	Confident	87.3	Confident	17 Å²	17	31.6 Å²	31.6	9%	0.089	16%	0.159	C	C	.	.	H	α-helix	trans	-68.1	-35.7	177.6	-68.4	168	0	0	0	112.5	L263 V266 E267 Q338 L339 F346	L263-L342 HydrophobicContact CD1-CD1 3.68Å; L263-L342 HydrophobicContact CD2-CD1 4.19Å; L263-L342 HydrophobicContact CG-CD1 3.8Å; V266-L342 HydrophobicContact CG1-CD1 4.03Å; E267-L342 HydrophobicContact CG-CD1 4.26Å; E267-L342 HydrophobicContact CG-CD2 4.01Å; Q338-L342 WeakPolarHBondContact O-CG 3.4Å; Q338-L342 PolarHBondContact O-N 3.25Å; L339-L342 PolarHBondContact O-N 3.09Å; L342-F346 WeakPolarHBondContact O-CB 3.33Å; L342-F346 PolarHBondContact O-N 3.09Å
343	V	87.8	Confident	87.5	Confident	5 Å²	5	32.1 Å²	32.1	3%	0.03	16%	0.162	C	C	.	.	H	α-helix	trans	-66.1	-47.5	171.9	171.8	0	0	0	0	110.8	L293 L298 L304 L339 K340 E345 F346 V347 E378	L293-V343 HydrophobicContact CD2-CG2 3.85Å; L298-V343 HydrophobicContact CD2-CG2 4.19Å; L304-V343 HydrophobicContact CD1-CG2 4.39Å; L339-V343 WeakPolarHBondContact O-CG2 3.44Å; L339-V343 PolarHBondContact O-N 3.45Å; K340-V343 PolarHBondContact O-N 3.06Å; V343-E345 VanDerWaalsContact C-N 3.35Å; V343-E345 PolarHBondContact O-N 2.91Å; V343-F346 WeakPolarHBondContact O-CB 3.47Å; V343-F346 PolarHBondContact O-N 3.33Å; V343-V347 WeakPolarHBondContact O-CG2 3.3Å; V343-V347 PolarHBondContact O-N 3.47Å; V343-E378 HydrophobicContact CG1-CB 4.35Å
344	A	89.3	Confident	87.5	Confident	29 Å²	29	32.5 Å²	32.5	24%	0.24	17%	0.165	C	C	.	.	H	α-helix	trans	-62.1	-40.4	177.5	0	0	0	0	0	112.4	K340 H341 V347 Q348	K340-A344 WeakPolarHBondContact O-CB 3.43Å; K340-A344 PolarHBondContact O-N 3.03Å; H341-A344 PolarHBondContact O-N 3.14Å; A344-V347 PolarHBondContact O-N 2.78Å; A344-Q348 WeakPolarHBondContact O-CG 3.43Å; A344-Q348 PolarHBondContact O-N 2.94Å
345	E	90.2	Very high	87.6	Confident	71 Å²	71	37.6 Å²	37.6	33%	0.332	19%	0.189	S	C	.	.	H	α-helix	trans	-65	-42	173.5	-165.6	-171.3	-145.9	0	0	111.3	V270 K274 H341 V343 V347 Q348 V349	V270-E345 WeakPolarHBondContact CG1-OE2 3.46Å; K274-E345 VanDerWaalsContact CE-CD 3.41Å; K274-E345 WeakPolarHBondContact CE-OE1 3.32Å; K274-E345 WeakPolarHBondContact CE-OE2 3.29Å; K274-E345 IonicContact NZ-OE1 2.67Å; K274-E345 PolarHBondContact NZ-OE1 3.43Å; K274-E345 IonicContact NZ-OE2 3.93Å; K274-E345 PolarHBondContact NZ-OE2 3.42Å; H341-E345 WeakPolarHBondContact O-CB 3.32Å; H341-E345 PolarHBondContact O-N 2.81Å; V343-E345 VanDerWaalsContact C-N 3.35Å; V343-E345 PolarHBondContact O-N 2.91Å; E345-V347 VanDerWaalsContact C-N 3.33Å; E345-V347 PolarHBondContact O-N 3.4Å; E345-Q348 WeakPolarHBondContact O-CB 3.36Å; E345-Q348 PolarHBondContact O-N 3.2Å; E345-V349 WeakPolarHBondContact O-CG2 3.38Å; E345-V349 PolarHBondContact O-N 2.91Å
346	F	90.2	Very high	87.5	Confident	1 Å²	1	39.2 Å²	39.2	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-40	174.8	173.7	-102	0	0	0	112.5	V270 V273 L286 F289 L293 L342 V343 Q348 V349 L350 V368 L372	V270-F346 HydrophobicContact CG2-CB 4.5Å; V273-F346 HydrophobicContact CG1-CE2 4.25Å; L286-F346 HydrophobicContact CG-CZ 4.47Å; F289-F346 HydrophobicContact CD1-CB 4.47Å; F289-F346 HydrophobicContact CD1-CD1 4.19Å; F289-F346 AromaticContact CD1-CD2 3.54Å; F289-F346 HydrophobicContact CD1-CD2 3.54Å; F289-F346 HydrophobicContact CD1-CE1 4.33Å; F289-F346 AromaticContact CD1-CE2 3.7Å; F289-F346 HydrophobicContact CD1-CE2 3.7Å; F289-F346 AromaticContact CD1-CG 3.8Å; F289-F346 HydrophobicContact CD1-CG 3.8Å; F289-F346 HydrophobicContact CD1-CZ 4.09Å; F289-F346 HydrophobicContact CE1-CB 3.79Å; F289-F346 AromaticContact CE1-CD1 3.96Å; F289-F346 HydrophobicContact CE1-CD1 3.96Å; F289-F346 AromaticContact CE1-CD2 3.75Å; F289-F346 HydrophobicContact CE1-CD2 3.75Å; F289-F346 HydrophobicContact CE1-CE2 4.32Å; F289-F346 AromaticContact CE1-CG 3.54Å; F289-F346 HydrophobicContact CE1-CG 3.54Å; L293-F346 HydrophobicContact CD1-CD1 4.32Å; L293-F346 HydrophobicContact CD1-CE1 4.39Å; L342-F346 WeakPolarHBondContact O-CB 3.33Å; L342-F346 PolarHBondContact O-N 3.09Å; V343-F346 WeakPolarHBondContact O-CB 3.47Å; V343-F346 PolarHBondContact O-N 3.33Å; F346-Q348 VanDerWaalsContact C-N 3.31Å; F346-Q348 PolarHBondContact O-N 2.9Å; F346-V349 CarbonylContact O-C 3.58Å; F346-V349 PolarHBondContact O-N 2.96Å; F346-V349 VanDerWaalsContact O-N 3.15Å; F346-L350 HydrophobicContact CE1-CD2 4.33Å; F346-L350 HydrophobicContact CZ-CD1 4.42Å; F346-L350 WeakPolarHBondContact O-CB 3.44Å; F346-L350 PolarHBondContact O-N 3.03Å; F346-V368 HydrophobicContact CZ-CG1 4.39Å; F346-L372 HydrophobicContact CE1-CD1 3.88Å
347	V	90.7	Very high	87.4	Confident	10 Å²	10	44.6 Å²	44.6	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-35.3	175.9	172.2	0	0	0	0	111.9	V343 A344 E345 L350 E351 E379 A382 L383 Q386	V343-V347 WeakPolarHBondContact O-CG2 3.3Å; V343-V347 PolarHBondContact O-N 3.47Å; A344-V347 PolarHBondContact O-N 2.78Å; E345-V347 VanDerWaalsContact C-N 3.33Å; E345-V347 PolarHBondContact O-N 3.4Å; V347-L350 PolarHBondContact O-N 3.13Å; V347-E351 PolarHBondContact O-N 3.1Å; V347-E379 HydrophobicContact CG2-CB 4.37Å; V347-A382 HydrophobicContact CG1-CB 3.93Å; V347-L383 HydrophobicContact CG1-CD2 4.32Å; V347-L383 HydrophobicContact CG2-CD2 4.11Å; V347-Q386 PolarHBondContact O-NE2 3.44Å
348	Q	89.7	Confident	87.3	Confident	126 Å²	126	47.9 Å²	47.9	59%	0.589	25%	0.248	S	C	*	.	H	α-helix	trans	-70.2	-35.7	172.7	-65.1	170.5	16.7	0	0	112.6	A344 E345 F346 E351 T352	A344-Q348 WeakPolarHBondContact O-CG 3.43Å; A344-Q348 PolarHBondContact O-N 2.94Å; E345-Q348 WeakPolarHBondContact O-CB 3.36Å; E345-Q348 PolarHBondContact O-N 3.2Å; F346-Q348 VanDerWaalsContact C-N 3.31Å; F346-Q348 PolarHBondContact O-N 2.9Å; Q348-E351 WeakPolarHBondContact O-CB 3.29Å; Q348-E351 PolarHBondContact O-N 3.33Å; Q348-T352 PolarHBondContact O-N 3.4Å; Q348-T352 PolarHBondContact O-OG1 3.32Å
349	V	88.8	Confident	87.4	Confident	16 Å²	16	48.3 Å²	48.3	10%	0.097	25%	0.254	C	S	.	.	H	α-helix	trans	-68.8	-39.3	173.7	176.4	0	0	0	0	110.7	V273 K274 E345 F346 E351 T352 L353	V273-V349 HydrophobicContact CB-CG1 4.42Å; V273-V349 HydrophobicContact CG1-CG1 3.7Å; K274-V349 HydrophobicContact CD-CG2 4.3Å; K274-V349 HydrophobicContact CG-CG1 4.14Å; K274-V349 HydrophobicContact CG-CG2 3.57Å; E345-V349 WeakPolarHBondContact O-CG2 3.38Å; E345-V349 PolarHBondContact O-N 2.91Å; F346-V349 CarbonylContact O-C 3.58Å; F346-V349 PolarHBondContact O-N 2.96Å; F346-V349 VanDerWaalsContact O-N 3.15Å; V349-E351 VanDerWaalsContact C-N 3.33Å; V349-E351 PolarHBondContact O-N 2.95Å; V349-T352 WeakPolarHBondContact O-CB 3.25Å; V349-T352 PolarHBondContact O-N 2.99Å; V349-T352 VanDerWaalsContact O-N 3.14Å; V349-L353 HydrophobicContact CG1-CD1 4.28Å; V349-L353 WeakPolarHBondContact O-CG 3.48Å; V349-L353 PolarHBondContact O-N 3.16Å
350	L	88.8	Confident	87.4	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-41.3	174.2	-167.5	64.6	0	0	0	111	L286 F346 V347 T352 L353 S354 A365 V368 A369 L383	L286-L350 HydrophobicContact CD1-CD1 3.76Å; F346-L350 HydrophobicContact CE1-CD2 4.33Å; F346-L350 HydrophobicContact CZ-CD1 4.42Å; F346-L350 WeakPolarHBondContact O-CB 3.44Å; F346-L350 PolarHBondContact O-N 3.03Å; V347-L350 PolarHBondContact O-N 3.13Å; L350-T352 VanDerWaalsContact C-N 3.34Å; L350-T352 PolarHBondContact O-N 3.1Å; L350-L353 PolarHBondContact O-N 3.4Å; L350-S354 WeakPolarHBondContact O-CB 3.45Å; L350-S354 PolarHBondContact O-N 3.36Å; L350-A365 HydrophobicContact CD1-CB 3.81Å; L350-V368 HydrophobicContact CD1-CG1 4.44Å; L350-A369 HydrophobicContact CD2-CB 3.91Å; L350-L383 HydrophobicContact CD2-CD2 4.03Å
351	E	89.1	Confident	87.3	Confident	81 Å²	81	51.1 Å²	51.1	38%	0.379	27%	0.274	S	S	.	.	H	α-helix	trans	-58.7	-46.1	171.2	-157.2	166	146.1	0	0	111.9	V347 Q348 V349 L353 S354 H355 Q386	V347-E351 PolarHBondContact O-N 3.1Å; Q348-E351 WeakPolarHBondContact O-CB 3.29Å; Q348-E351 PolarHBondContact O-N 3.33Å; V349-E351 VanDerWaalsContact C-N 3.33Å; V349-E351 PolarHBondContact O-N 2.95Å; E351-L353 VanDerWaalsContact C-N 3.31Å; E351-L353 PolarHBondContact O-N 3.13Å; E351-S354 WeakPolarHBondContact O-CB 3.4Å; E351-S354 PolarHBondContact O-N 3.01Å; E351-S354 PolarHBondContact O-OG 3.5Å; E351-H355 PolarHBondContact O-N 3.06Å; E351-H355 PolarHBondContact O-ND1 3.5Å; E351-Q386 HydrophobicContact CB-CG 4.44Å; E351-Q386 HydrophobicContact CG-CG 4.06Å; E351-Q386 PolarHBondContact OE2-NE2 3.39Å
352	T	88.6	Confident	87.4	Confident	72 Å²	72	46.4 Å²	46.4	44%	0.442	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-38.5	178.9	-57.8	0	0	0	0	111.7	Q348 V349 L350 H355	Q348-T352 PolarHBondContact O-N 3.4Å; Q348-T352 PolarHBondContact O-OG1 3.32Å; V349-T352 WeakPolarHBondContact O-CB 3.25Å; V349-T352 PolarHBondContact O-N 2.99Å; V349-T352 VanDerWaalsContact O-N 3.14Å; L350-T352 VanDerWaalsContact C-N 3.34Å; L350-T352 PolarHBondContact O-N 3.1Å; T352-H355 PolarHBondContact O-N 2.88Å
353	L	85.9	Confident	87.6	Confident	17 Å²	17	46.9 Å²	46.9	9%	0.089	26%	0.256	C	S	.	.	H	α-helix	trans	-71.8	-32.3	175.7	-68.9	173.2	0	0	0	112.6	V273 L286 V349 L350 E351 H355 D356 A365	V273-L353 HydrophobicContact CG1-CD1 3.61Å; L286-L353 HydrophobicContact CD1-CD1 3.63Å; V349-L353 HydrophobicContact CG1-CD1 4.28Å; V349-L353 WeakPolarHBondContact O-CG 3.48Å; V349-L353 PolarHBondContact O-N 3.16Å; L350-L353 PolarHBondContact O-N 3.4Å; E351-L353 VanDerWaalsContact C-N 3.31Å; E351-L353 PolarHBondContact O-N 3.13Å; L353-H355 PolarHBondContact O-N 2.99Å; L353-H355 VanDerWaalsContact O-N 3.13Å; L353-D356 WeakPolarHBondContact O-CB 3.43Å; L353-D356 PolarHBondContact O-N 3.25Å; L353-D356 VanDerWaalsContact O-N 3.12Å; L353-A365 HydrophobicContact CB-CB 4.28Å
354	S	84.9	Confident	87.6	Confident	10 Å²	10	52.8 Å²	52.8	7%	0.07	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-9.6	174.6	85.8	0	0	0	0	113.9	L350 E351 K390	L350-S354 WeakPolarHBondContact O-CB 3.45Å; L350-S354 PolarHBondContact O-N 3.36Å; E351-S354 WeakPolarHBondContact O-CB 3.4Å; E351-S354 PolarHBondContact O-N 3.01Å; E351-S354 PolarHBondContact O-OG 3.5Å; S354-K390 PolarHBondContact O-NZ 3.01Å; S354-K390 WeakPolarHBondContact OG-CE 3.28Å; S354-K390 PolarHBondContact OG-NZ 2.71Å
355	H	85.9	Confident	87.7	Confident	121 Å²	121	51.5 Å²	51.5	56%	0.56	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	8.5	176.4	-63.8	102.1	0	0	0	113.1	E351 T352 L353 K390	E351-H355 PolarHBondContact O-N 3.06Å; E351-H355 PolarHBondContact O-ND1 3.5Å; T352-H355 PolarHBondContact O-N 2.88Å; L353-H355 PolarHBondContact O-N 2.99Å; L353-H355 VanDerWaalsContact O-N 3.13Å; H355-K390 PolarHBondContact CD2-NZ 2.88Å; H355-K390 PolarHBondContact CE1-NZ 3.02Å; H355-K390 VanDerWaalsContact CE1-NZ 3.3Å; H355-K390 PolarHBondContact NE2-NZ 2.85Å
356	D	84.8	Confident	87.7	Confident	35 Å²	35	48.5 Å²	48.5	19%	0.187	25%	0.253	C	S	.	.	S	Bend	trans	-66.8	156.3	172	-176.9	34.1	0	0	0	111.6	K279 L353 L358 T361 K362	K279-D356 IonicContact NZ-OD1 2.71Å; K279-D356 PolarHBondContact NZ-OD1 3.36Å; K279-D356 IonicContact NZ-OD2 3.84Å; K279-D356 PolarHBondContact NZ-OD2 2.75Å; L353-D356 WeakPolarHBondContact O-CB 3.43Å; L353-D356 PolarHBondContact O-N 3.25Å; L353-D356 VanDerWaalsContact O-N 3.12Å; D356-L358 VanDerWaalsContact C-N 3.28Å; D356-L358 PolarHBondContact O-N 3.08Å; D356-T361 WeakPolarHBondContact OD2-CB 3.31Å; D356-T361 WeakPolarHBondContact OD2-CG2 3.44Å; D356-T361 PolarHBondContact OD2-OG1 3.05Å; D356-K362 WeakPolarHBondContact O-CE 3.34Å; D356-K362 WeakPolarHBondContact O-CG 3.43Å
357	T	82	Confident	87.7	Confident	115 Å²	115	49 Å²	49	71%	0.706	26%	0.257	S	S	*	.	S	Bend	trans	-74.2	-14.6	-172.9	56.2	0	0	0	0	114.4
358	L	85.9	Confident	87.7	Confident	75 Å²	75	48.6 Å²	48.6	39%	0.393	26%	0.255	S	S	.	.			trans	-94.8	130.7	-175.9	-59.9	-179.1	0	0	0	111.9	K279 D356 T360 T361 K362	K279-L358 HydrophobicContact CD-CD1 3.62Å; D356-L358 VanDerWaalsContact C-N 3.28Å; D356-L358 PolarHBondContact O-N 3.08Å; L358-T360 PolarHBondContact O-N 3.4Å; L358-T361 PolarHBondContact O-N 2.84Å; L358-T361 PolarHBondContact O-OG1 3Å; L358-K362 PolarHBondContact O-N 3.07Å; L358-K362 VanDerWaalsContact O-N 3.13Å
359	V	85.9	Confident	87.8	Confident	57 Å²	57	42.8 Å²	42.8	35%	0.345	23%	0.228	S	C	.	.	H	α-helix	trans	-55	-36.7	174.4	-176.3	0	0	0	0	111.3	T363 I398	V359-T363 HydrophobicContact CG1-CG2 3.92Å; V359-T363 VanDerWaalsContact O-CB 3.28Å; V359-T363 WeakPolarHBondContact O-CB 3.4Å; V359-T363 VanDerWaalsContact O-CG2 3.24Å; V359-T363 WeakPolarHBondContact O-CG2 3.48Å; V359-T363 PolarHBondContact O-N 3.35Å; V359-T363 PolarHBondContact O-OG1 3.46Å; V359-I398 HydrophobicContact CG1-CD1 4.18Å; V359-I398 HydrophobicContact CG1-CG1 4.27Å
360	T	85.7	Confident	87.9	Confident	87 Å²	87	42.6 Å²	42.6	53%	0.534	23%	0.226	S	C	.	.	H	α-helix	trans	-68.8	-36.6	-177.6	49.9	0	0	0	0	113.8	L358 R364	L358-T360 PolarHBondContact O-N 3.4Å; T360-R364 WeakPolarHBondContact O-CB 3.2Å; T360-R364 VanDerWaalsContact O-CG 3.28Å; T360-R364 WeakPolarHBondContact O-CG 3.48Å; T360-R364 PolarHBondContact O-N 2.88Å
361	T	86.4	Confident	87.9	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-76.9	-44.3	175.7	46	0	0	0	0	110.9	K279 L283 D356 L358 T363 R364 A365	K279-T361 HydrophobicContact CD-CG2 4.34Å; L283-T361 HydrophobicContact CD1-CG2 4.37Å; L283-T361 HydrophobicContact CD2-CG2 4.28Å; L283-T361 HydrophobicContact CG-CG2 4.4Å; D356-T361 WeakPolarHBondContact OD2-CB 3.31Å; D356-T361 WeakPolarHBondContact OD2-CG2 3.44Å; D356-T361 PolarHBondContact OD2-OG1 3.05Å; L358-T361 PolarHBondContact O-N 2.84Å; L358-T361 PolarHBondContact O-OG1 3Å; T361-T363 PolarHBondContact O-N 3.28Å; T361-R364 PolarHBondContact O-N 3.13Å; T361-A365 WeakPolarHBondContact O-CB 3.34Å; T361-A365 PolarHBondContact O-N 3.11Å
362	K	88.9	Confident	87.9	Confident	22 Å²	22	42.3 Å²	42.3	10%	0.096	23%	0.225	C	C	.	.	H	α-helix	trans	-54.4	-51.7	172.4	-70.1	-176	175.3	-175.6	0	112.4	D356 L358 R364 A365 L366 D393 I398	D356-K362 WeakPolarHBondContact O-CE 3.34Å; D356-K362 WeakPolarHBondContact O-CG 3.43Å; L358-K362 PolarHBondContact O-N 3.07Å; L358-K362 VanDerWaalsContact O-N 3.13Å; K362-R364 VanDerWaalsContact C-N 3.3Å; K362-R364 PolarHBondContact O-N 3.06Å; K362-A365 PolarHBondContact O-N 3.12Å; K362-L366 WeakPolarHBondContact O-CB 3.47Å; K362-L366 PolarHBondContact O-N 2.9Å; K362-D393 WeakPolarHBondContact CE-OD2 3.36Å; K362-D393 VanDerWaalsContact NZ-CG 3.25Å; K362-D393 IonicContact NZ-OD1 2.9Å; K362-D393 PolarHBondContact NZ-OD1 3.38Å; K362-D393 IonicContact NZ-OD2 2.71Å; K362-D393 PolarHBondContact NZ-OD2 3.27Å; K362-I398 HydrophobicContact CB-CD1 3.86Å; K362-I398 HydrophobicContact CD-CD1 3.27Å; K362-I398 HydrophobicContact CG-CD1 4.25Å
363	T	89.7	Confident	87.9	Confident	28 Å²	28	39.2 Å²	39.2	17%	0.172	21%	0.206	C	C	.	.	H	α-helix	trans	-74.2	-16.8	-175.1	55.8	0	0	0	0	114.3	V359 T361 A367 I398 K401	V359-T363 HydrophobicContact CG1-CG2 3.92Å; V359-T363 VanDerWaalsContact O-CB 3.28Å; V359-T363 WeakPolarHBondContact O-CB 3.4Å; V359-T363 VanDerWaalsContact O-CG2 3.24Å; V359-T363 WeakPolarHBondContact O-CG2 3.48Å; V359-T363 PolarHBondContact O-N 3.35Å; V359-T363 PolarHBondContact O-OG1 3.46Å; T361-T363 PolarHBondContact O-N 3.28Å; T363-A367 PolarHBondContact O-N 3.35Å; T363-I398 HydrophobicContact CG2-CD1 4.42Å; T363-I398 HydrophobicContact CG2-CG1 4.01Å; T363-K401 HydrophobicContact CG2-CD 4.18Å; T363-K401 PolarHBondContact O-NZ 2.84Å
364	R	88.4	Confident	87.9	Confident	129 Å²	129	38.9 Å²	38.9	49%	0.487	21%	0.205	S	C	.	.	H	α-helix	trans	-80.8	-48	166.7	-78.7	-79.8	172	176.7	-6.1	111.4	L283 D287 T360 T361 K362 L366 A367 V368	L283-R364 HydrophobicContact CD2-CB 3.7Å; L283-R364 HydrophobicContact CD2-CG 3.98Å; D287-R364 IonicContact OD1-NH1 3.2Å; D287-R364 IonicContact OD2-NH1 3.13Å; T360-R364 WeakPolarHBondContact O-CB 3.2Å; T360-R364 VanDerWaalsContact O-CG 3.28Å; T360-R364 WeakPolarHBondContact O-CG 3.48Å; T360-R364 PolarHBondContact O-N 2.88Å; T361-R364 PolarHBondContact O-N 3.13Å; K362-R364 VanDerWaalsContact C-N 3.3Å; K362-R364 PolarHBondContact O-N 3.06Å; R364-L366 VanDerWaalsContact C-N 3.28Å; R364-L366 PolarHBondContact O-N 3.03Å; R364-A367 PolarHBondContact O-N 3.41Å; R364-A367 VanDerWaalsContact O-N 3.1Å; R364-V368 WeakPolarHBondContact O-CG2 3.2Å; R364-V368 PolarHBondContact O-N 2.96Å
365	A	90.8	Very high	87.9	Confident	2 Å²	2	41.8 Å²	41.8	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-56.3	-43	175.1	0	0	0	0	0	111.9	L350 L353 T361 K362 V368 A369	L350-A365 HydrophobicContact CD1-CB 3.81Å; L353-A365 HydrophobicContact CB-CB 4.28Å; T361-A365 WeakPolarHBondContact O-CB 3.34Å; T361-A365 PolarHBondContact O-N 3.11Å; K362-A365 PolarHBondContact O-N 3.12Å; A365-V368 PolarHBondContact O-N 3.47Å; A365-A369 WeakPolarHBondContact O-CB 3.18Å; A365-A369 PolarHBondContact O-N 3.16Å
366	L	90.8	Very high	87.8	Confident	7 Å²	7	36.4 Å²	36.4	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-61.3	-42.4	174.9	-172.3	75.3	0	0	0	112.9	K362 R364 H370 V387 K390 I398 K401 A402 L405	K362-L366 WeakPolarHBondContact O-CB 3.47Å; K362-L366 PolarHBondContact O-N 2.9Å; R364-L366 VanDerWaalsContact C-N 3.28Å; R364-L366 PolarHBondContact O-N 3.03Å; L366-H370 PolarHBondContact O-N 2.86Å; L366-H370 VanDerWaalsContact O-N 3.11Å; L366-V387 HydrophobicContact CD1-CB 4.38Å; L366-V387 HydrophobicContact CD1-CG1 4.14Å; L366-V387 HydrophobicContact CD1-CG2 4.23Å; L366-K390 HydrophobicContact CD1-CB 3.99Å; L366-K390 HydrophobicContact CD1-CG 3.95Å; L366-I398 HydrophobicContact CD2-CG2 4.46Å; L366-K401 HydrophobicContact CD2-CB 4.25Å; L366-K401 HydrophobicContact CD2-CD 4.29Å; L366-K401 HydrophobicContact CD2-CG 4.13Å; L366-A402 HydrophobicContact CD1-CB 4.37Å; L366-A402 HydrophobicContact CD2-CB 4.22Å; L366-L405 HydrophobicContact CD2-CD1 3.79Å; L366-L405 HydrophobicContact CG-CD1 3.73Å
367	A	91.3	Very high	87.4	Confident	13 Å²	13	35.9 Å²	35.9	11%	0.107	19%	0.193	C	C	.	.	H	α-helix	trans	-66.4	-43.1	178.1	0	0	0	0	0	111.4	T363 R364 H370 E371	T363-A367 PolarHBondContact O-N 3.35Å; R364-A367 PolarHBondContact O-N 3.41Å; R364-A367 VanDerWaalsContact O-N 3.1Å; A367-H370 PolarHBondContact O-N 2.9Å; A367-E371 WeakPolarHBondContact O-CB 3.39Å; A367-E371 WeakPolarHBondContact O-CG 3.32Å; A367-E371 PolarHBondContact O-N 2.83Å
368	V	90.2	Very high	87.4	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-67.4	-37.3	177.4	172.1	0	0	0	0	112.4	L286 K290 F346 L350 R364 A365 E371 L372	L286-V368 HydrophobicContact CD2-CB 4.1Å; L286-V368 HydrophobicContact CD2-CG1 4.34Å; L286-V368 HydrophobicContact CD2-CG2 3.46Å; L286-V368 VanDerWaalsContact CD2-CG2 3.46Å; L286-V368 HydrophobicContact CG-CG2 4.47Å; K290-V368 HydrophobicContact CB-CG1 3.91Å; K290-V368 HydrophobicContact CD-CB 4.28Å; K290-V368 HydrophobicContact CD-CG1 4Å; K290-V368 HydrophobicContact CD-CG2 3.79Å; K290-V368 HydrophobicContact CG-CG1 3.9Å; F346-V368 HydrophobicContact CZ-CG1 4.39Å; L350-V368 HydrophobicContact CD1-CG1 4.44Å; R364-V368 WeakPolarHBondContact O-CG2 3.2Å; R364-V368 PolarHBondContact O-N 2.96Å; A365-V368 PolarHBondContact O-N 3.47Å; V368-E371 PolarHBondContact O-N 3.24Å; V368-L372 HydrophobicContact CG1-CD1 3.95Å; V368-L372 HydrophobicContact CG1-CG 4.44Å; V368-L372 WeakPolarHBondContact O-CB 3.43Å; V368-L372 VanDerWaalsContact O-CG 3.29Å; V368-L372 WeakPolarHBondContact O-CG 3.39Å; V368-L372 PolarHBondContact O-N 3.48Å
369	A	90.9	Very high	87.2	Confident	3 Å²	3	30.6 Å²	30.6	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-46	172	0	0	0	0	0	111.7	L350 A365 L373 L383 V387	L350-A369 HydrophobicContact CD2-CB 3.91Å; A365-A369 WeakPolarHBondContact O-CB 3.18Å; A365-A369 PolarHBondContact O-N 3.16Å; A369-L373 WeakPolarHBondContact O-CB 3.28Å; A369-L373 PolarHBondContact O-N 2.98Å; A369-L383 HydrophobicContact CB-CD2 4.2Å; A369-V387 HydrophobicContact CB-CG2 3.86Å
370	H	91.1	Very high	87.2	Confident	13 Å²	13	31.2 Å²	31.2	6%	0.06	16%	0.157	C	C	.	.	H	α-helix	trans	-65.9	-43.3	175.7	162	-90.1	0	0	0	113.2	L366 A367 L372 L373 C374 L405	L366-H370 PolarHBondContact O-N 2.86Å; L366-H370 VanDerWaalsContact O-N 3.11Å; A367-H370 PolarHBondContact O-N 2.9Å; H370-L372 PolarHBondContact O-N 2.6Å; H370-L373 PolarHBondContact O-N 3.45Å; H370-C374 VanDerWaalsContact CE1-SG 3.56Å; H370-C374 PolarHBondContact NE2-SG 3.08Å; H370-C374 VanDerWaalsContact NE2-SG 3.36Å; H370-C374 WeakPolarHBondContact O-CB 3.38Å; H370-C374 PolarHBondContact O-N 3.33Å; H370-C374 PolarHBondContact O-SG 3.47Å; H370-L405 HydrophobicContact CB-CB 4.23Å; H370-L405 HydrophobicContact CB-CD1 4.24Å; H370-L405 HydrophobicContact CB-CD2 4.24Å; H370-L405 HydrophobicContact CB-CG 4.48Å; H370-L405 PolarHBondContact CD2-O 2.85Å; H370-L405 PolarHBondContact NE2-O 3.32Å
371	E	89.9	Confident	87.2	Confident	66 Å²	66	33.6 Å²	33.6	31%	0.308	16%	0.16	S	C	.	.	H	α-helix	trans	-64.6	-38.8	179.5	-77	169.9	-133.8	0	0	111.9	K290 A367 V368 N375	K290-E371 HydrophobicContact CD-CB 4.32Å; K290-E371 VanDerWaalsContact CD-OE2 3.29Å; K290-E371 WeakPolarHBondContact CD-OE2 3.38Å; K290-E371 WeakPolarHBondContact CE-OE2 3.42Å; K290-E371 IonicContact NZ-OE2 3.85Å; K290-E371 PolarHBondContact NZ-OE2 3.49Å; A367-E371 WeakPolarHBondContact O-CB 3.39Å; A367-E371 WeakPolarHBondContact O-CG 3.32Å; A367-E371 PolarHBondContact O-N 2.83Å; V368-E371 PolarHBondContact O-N 3.24Å; E371-N375 WeakPolarHBondContact O-CB 3.4Å; E371-N375 PolarHBondContact O-N 3.2Å; E371-N375 PolarHBondContact O-ND2 3.18Å; E371-N375 VanDerWaalsContact O-ND2 3.15Å
372	L	87.7	Confident	87.3	Confident	10 Å²	10	34.9 Å²	34.9	5%	0.052	17%	0.172	C	C	.	.	H	α-helix	trans	-66.1	-47.9	172.5	-69.8	168.9	0	0	0	111	K290 L293 I294 F346 V368 H370 C374 N375 K376 L383	K290-L372 HydrophobicContact CG-CD2 4.23Å; K290-L372 HydrophobicContact CG-CG 4.34Å; L293-L372 HydrophobicContact CB-CD2 4.04Å; L293-L372 HydrophobicContact CD1-CD1 4.45Å; L293-L372 HydrophobicContact CD1-CD2 4.1Å; I294-L372 HydrophobicContact CG1-CD2 4.15Å; F346-L372 HydrophobicContact CE1-CD1 3.88Å; V368-L372 HydrophobicContact CG1-CD1 3.95Å; V368-L372 HydrophobicContact CG1-CG 4.44Å; V368-L372 WeakPolarHBondContact O-CB 3.43Å; V368-L372 VanDerWaalsContact O-CG 3.29Å; V368-L372 WeakPolarHBondContact O-CG 3.39Å; V368-L372 PolarHBondContact O-N 3.48Å; H370-L372 PolarHBondContact O-N 2.6Å; L372-C374 VanDerWaalsContact C-N 3.29Å; L372-C374 PolarHBondContact O-N 3.32Å; L372-N375 PolarHBondContact O-N 2.63Å; L372-N375 VanDerWaalsContact O-N 3.11Å; L372-K376 PolarHBondContact O-N 3.39Å; L372-L383 HydrophobicContact CB-CD1 3.94Å
373	L	87.9	Confident	87.4	Confident	6 Å²	6	34 Å²	34	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-28.8	179.9	-176	61.9	0	0	0	113.7	A369 H370 E380 L383 L384 L409 M416	A369-L373 WeakPolarHBondContact O-CB 3.28Å; A369-L373 PolarHBondContact O-N 2.98Å; H370-L373 PolarHBondContact O-N 3.45Å; L373-E380 HydrophobicContact CD1-CB 3.74Å; L373-E380 HydrophobicContact CD1-CG 4.02Å; L373-E380 WeakPolarHBondContact CD1-O 3.31Å; L373-L383 HydrophobicContact CB-CB 4.27Å; L373-L383 HydrophobicContact CB-CD1 4.29Å; L373-L383 HydrophobicContact CD1-CB 4.25Å; L373-L383 HydrophobicContact CD2-CB 4.42Å; L373-L384 HydrophobicContact CD2-CB 4.02Å; L373-L384 HydrophobicContact CD2-CD1 4.34Å; L373-L409 HydrophobicContact CB-CD1 4.45Å; L373-L409 HydrophobicContact CD2-CD1 3.33Å; L373-L409 HydrophobicContact CG-CD1 3.56Å; L373-M416 HydrophobicContact CD1-CE 4.1Å; L373-M416 HydrophobicContact CG-CE 4.43Å
374	C	86.6	Confident	87.5	Confident	10 Å²	10	32.8 Å²	32.8	7%	0.068	16%	0.16	C	C	.	.	H	α-helix	trans	-72.7	-36.1	172.7	-74.9	0	0	0	0	113.3	H370 L372 K412 H413	H370-C374 VanDerWaalsContact CE1-SG 3.56Å; H370-C374 PolarHBondContact NE2-SG 3.08Å; H370-C374 VanDerWaalsContact NE2-SG 3.36Å; H370-C374 WeakPolarHBondContact O-CB 3.38Å; H370-C374 PolarHBondContact O-N 3.33Å; H370-C374 PolarHBondContact O-SG 3.47Å; L372-C374 VanDerWaalsContact C-N 3.29Å; L372-C374 PolarHBondContact O-N 3.32Å; C374-K412 HydrophobicContact CB-CD 4.22Å; C374-H413 PolarHBondContact O-NE2 3.32Å
375	N	85.4	Confident	87.6	Confident	72 Å²	72	28.5 Å²	28.5	39%	0.385	15%	0.148	S	C	.	.	H	α-helix	trans	-108.6	-20.8	-160.5	-64.1	-14.1	0	0	0	113.8	E371 L372	E371-N375 WeakPolarHBondContact O-CB 3.4Å; E371-N375 PolarHBondContact O-N 3.2Å; E371-N375 PolarHBondContact O-ND2 3.18Å; E371-N375 VanDerWaalsContact O-ND2 3.15Å; L372-N375 PolarHBondContact O-N 2.63Å; L372-N375 VanDerWaalsContact O-N 3.11Å
376	K	83.2	Confident	87.5	Confident	8 Å²	8	28.9 Å²	28.9	4%	0.035	15%	0.15	C	C	.	.			trans	-141.2	141.8	-174.9	-62.6	-66.6	-177	-178.6	0	111.6	I294 L298 D300 L372 E378	I294-K376 WeakPolarHBondContact O-CE 3.24Å; I294-K376 PolarHBondContact O-NZ 3.06Å; L298-K376 HydrophobicContact CB-CD 3.77Å; L298-K376 HydrophobicContact CB-CG 4.14Å; L298-K376 HydrophobicContact CD1-CB 4.06Å; L298-K376 HydrophobicContact CD1-CG 3.98Å; L298-K376 PolarHBondContact O-NZ 3.37Å; D300-K376 VanDerWaalsContact CG-NZ 3.33Å; D300-K376 IonicContact OD1-NZ 2.82Å; D300-K376 PolarHBondContact OD1-NZ 3.39Å; D300-K376 IonicContact OD2-NZ 3.24Å; L372-K376 PolarHBondContact O-N 3.39Å; K376-E378 VanDerWaalsContact C-N 3.26Å; K376-E378 PolarHBondContact O-N 3.14Å
377	P	77.4	Confident	87.5	Confident	23 Å²	23	28.7 Å²	28.7	15%	0.149	15%	0.149	C	C	.	.			trans	-82.4	13.6	-176.7	34.8	-37.7	0	0	0	114.8	K303 E380	K303-P377 HydrophobicContact CG-CB 3.92Å; K303-P377 HydrophobicContact CG-CG 4.14Å; K303-P377 WeakPolarHBondContact CG-O 3.39Å; K303-P377 PolarHBondContact NZ-O 2.95Å; P377-E380 WeakPolarHBondContact CA-OE1 3.45Å; P377-E380 VanDerWaalsContact CB-OE1 3.29Å; P377-E380 WeakPolarHBondContact CB-OE1 3.26Å
378	E	81.1	Confident	87.5	Confident	7 Å²	7	28.1 Å²	28.1	3%	0.033	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	134.8	179.6	-68.9	-46.9	133	0	0	113	L298 K303 L304 K340 V343 K376 E380	L298-E378 HydrophobicContact CD1-CB 4.38Å; L298-E378 HydrophobicContact CD1-CG 3.87Å; L298-E378 HydrophobicContact CD2-CG 3.89Å; L298-E378 HydrophobicContact CG-CG 4.43Å; K303-E378 WeakPolarHBondContact CA-OE1 3.29Å; L304-E378 HydrophobicContact CD1-CG 4.33Å; L304-E378 HydrophobicContact CG-CG 4.29Å; L304-E378 WeakPolarHBondContact CG-OE1 3.4Å; L304-E378 PolarHBondContact N-OE1 3.18Å; L304-E378 PolarHBondContact N-OE2 3.11Å; K340-E378 IonicContact NZ-OE2 2.72Å; K340-E378 PolarHBondContact NZ-OE2 2.91Å; K340-E378 VanDerWaalsContact NZ-OE2 3.13Å; V343-E378 HydrophobicContact CG1-CB 4.35Å; K376-E378 VanDerWaalsContact C-N 3.26Å; K376-E378 PolarHBondContact O-N 3.14Å; E378-E380 PolarHBondContact O-N 2.84Å
379	E	82.1	Confident	87.6	Confident	72 Å²	72	30.1 Å²	30.1	34%	0.336	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	29.5	172.3	-63.4	-56.8	146	0	0	114.6	K340 V347 K381 A382 L383	K340-E379 IonicContact NZ-OE1 3.53Å; V347-E379 HydrophobicContact CG2-CB 4.37Å; E379-K381 PolarHBondContact O-N 3.42Å; E379-A382 HydrophobicContact CB-CB 4.33Å; E379-A382 WeakPolarHBondContact O-CA 3.2Å; E379-A382 WeakPolarHBondContact O-CB 3.44Å; E379-A382 PolarHBondContact O-N 2.95Å; E379-L383 PolarHBondContact O-N 3.12Å
380	E	84.9	Confident	87.5	Confident	71 Å²	71	30.4 Å²	30.4	33%	0.332	16%	0.156	S	C	.	.	H	α-helix	trans	-46.8	-44	-175.4	-68.2	156.7	176.8	0	0	112.3	K303 L373 P377 E378 L383 L384	K303-E380 IonicContact NZ-OE1 2.76Å; K303-E380 PolarHBondContact NZ-OE1 2.72Å; K303-E380 IonicContact NZ-OE2 3.4Å; K303-E380 PolarHBondContact NZ-OE2 2.81Å; L373-E380 HydrophobicContact CD1-CB 3.74Å; L373-E380 HydrophobicContact CD1-CG 4.02Å; L373-E380 WeakPolarHBondContact CD1-O 3.31Å; P377-E380 WeakPolarHBondContact CA-OE1 3.45Å; P377-E380 VanDerWaalsContact CB-OE1 3.29Å; P377-E380 WeakPolarHBondContact CB-OE1 3.26Å; E378-E380 PolarHBondContact O-N 2.84Å; E380-L383 PolarHBondContact O-N 2.62Å; E380-L384 WeakPolarHBondContact O-CB 3.31Å; E380-L384 PolarHBondContact O-N 3.05Å
381	K	87.3	Confident	87.3	Confident	137 Å²	137	29.8 Å²	29.8	60%	0.596	15%	0.153	S	C	*	.	H	α-helix	trans	-65.2	-40.4	-179.4	-173.5	176	-178.1	174.9	0	112.3	E379 V385 E423	E379-K381 PolarHBondContact O-N 3.42Å; K381-V385 VanDerWaalsContact O-CB 3.31Å; K381-V385 WeakPolarHBondContact O-CB 3.48Å; K381-V385 WeakPolarHBondContact O-CG2 3.46Å; K381-V385 PolarHBondContact O-N 3.42Å; K381-E423 WeakPolarHBondContact CE-OE1 3.25Å
382	A	88.7	Confident	87.1	Confident	33 Å²	33	28.2 Å²	28.2	27%	0.273	15%	0.154	S	C	.	.	H	α-helix	trans	-68.5	-45.9	177.3	0	0	0	0	0	110.6	V347 E379 V385 Q386	V347-A382 HydrophobicContact CG1-CB 3.93Å; E379-A382 HydrophobicContact CB-CB 4.33Å; E379-A382 WeakPolarHBondContact O-CA 3.2Å; E379-A382 WeakPolarHBondContact O-CB 3.44Å; E379-A382 PolarHBondContact O-N 2.95Å; A382-V385 PolarHBondContact O-N 2.7Å; A382-Q386 WeakPolarHBondContact O-CB 3.2Å; A382-Q386 VanDerWaalsContact O-CG 3.25Å; A382-Q386 WeakPolarHBondContact O-CG 3.25Å; A382-Q386 PolarHBondContact O-N 3.31Å
383	L	90.3	Very high	87.1	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-44.9	176.1	-67.2	176	0	0	0	112.1	V347 L350 A369 L372 L373 E379 E380 Q386 V387	V347-L383 HydrophobicContact CG1-CD2 4.32Å; V347-L383 HydrophobicContact CG2-CD2 4.11Å; L350-L383 HydrophobicContact CD2-CD2 4.03Å; A369-L383 HydrophobicContact CB-CD2 4.2Å; L372-L383 HydrophobicContact CB-CD1 3.94Å; L373-L383 HydrophobicContact CB-CB 4.27Å; L373-L383 HydrophobicContact CB-CD1 4.29Å; L373-L383 HydrophobicContact CD1-CB 4.25Å; L373-L383 HydrophobicContact CD2-CB 4.42Å; E379-L383 PolarHBondContact O-N 3.12Å; E380-L383 PolarHBondContact O-N 2.62Å; L383-Q386 WeakPolarHBondContact O-CB 3.34Å; L383-Q386 PolarHBondContact O-N 3.29Å; L383-V387 WeakPolarHBondContact O-CG2 3.38Å; L383-V387 PolarHBondContact O-N 3Å
384	L	91.1	Very high	86.9	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-46.9	177.6	177.3	59.7	0	0	0	111.4	L373 E380 Q386 V387 V388 L406 V419 V420 E423	L373-L384 HydrophobicContact CD2-CB 4.02Å; L373-L384 HydrophobicContact CD2-CD1 4.34Å; E380-L384 WeakPolarHBondContact O-CB 3.31Å; E380-L384 PolarHBondContact O-N 3.05Å; L384-Q386 VanDerWaalsContact C-N 3.29Å; L384-Q386 PolarHBondContact O-N 3.45Å; L384-V387 PolarHBondContact O-N 3.33Å; L384-V388 HydrophobicContact CD1-CG2 3.79Å; L384-V388 HydrophobicContact CG-CG2 4.28Å; L384-V388 WeakPolarHBondContact O-CB 3.21Å; L384-V388 WeakPolarHBondContact O-CG2 3.29Å; L384-V388 PolarHBondContact O-N 3.1Å; L384-L406 HydrophobicContact CD1-CD2 3.83Å; L384-V419 HydrophobicContact CD2-CG1 4.03Å; L384-V420 HydrophobicContact CD1-CG1 4.43Å; L384-V420 HydrophobicContact CD1-CG2 3.9Å; L384-V420 HydrophobicContact CD2-CG2 4.11Å; L384-E423 HydrophobicContact CD2-CG 3.92Å; L384-E423 HydrophobicContact CG-CG 4.28Å
385	V	91.1	Very high	86.9	Confident	38 Å²	38	36.4 Å²	36.4	23%	0.23	20%	0.201	C	C	.	.	H	α-helix	trans	-61.1	-38.9	175.1	167.5	0	0	0	0	110.9	K381 A382 N389 E423	K381-V385 VanDerWaalsContact O-CB 3.31Å; K381-V385 WeakPolarHBondContact O-CB 3.48Å; K381-V385 WeakPolarHBondContact O-CG2 3.46Å; K381-V385 PolarHBondContact O-N 3.42Å; A382-V385 PolarHBondContact O-N 2.7Å; V385-N389 WeakPolarHBondContact O-CB 3.48Å; V385-N389 PolarHBondContact O-N 3.18Å; V385-N389 PolarHBondContact O-ND2 3.28Å; V385-N389 VanDerWaalsContact O-ND2 3.13Å; V385-E423 HydrophobicContact CG2-CG 4.21Å
386	Q	88.6	Confident	87	Confident	10 Å²	10	36.2 Å²	36.2	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-44	174.9	-75.2	174.7	11.2	0	0	112.6	V347 E351 A382 L383 L384 K390	V347-Q386 PolarHBondContact O-NE2 3.44Å; E351-Q386 HydrophobicContact CB-CG 4.44Å; E351-Q386 HydrophobicContact CG-CG 4.06Å; E351-Q386 PolarHBondContact OE2-NE2 3.39Å; A382-Q386 WeakPolarHBondContact O-CB 3.2Å; A382-Q386 VanDerWaalsContact O-CG 3.25Å; A382-Q386 WeakPolarHBondContact O-CG 3.25Å; A382-Q386 PolarHBondContact O-N 3.31Å; L383-Q386 WeakPolarHBondContact O-CB 3.34Å; L383-Q386 PolarHBondContact O-N 3.29Å; L384-Q386 VanDerWaalsContact C-N 3.29Å; L384-Q386 PolarHBondContact O-N 3.45Å; Q386-K390 WeakPolarHBondContact O-CG 3.22Å
387	V	91.4	Very high	87.2	Confident	3 Å²	3	46 Å²	46	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-49.6	177.5	175	0	0	0	0	111.1	L366 A369 L383 L384 N389 K390 L406	L366-V387 HydrophobicContact CD1-CB 4.38Å; L366-V387 HydrophobicContact CD1-CG1 4.14Å; L366-V387 HydrophobicContact CD1-CG2 4.23Å; A369-V387 HydrophobicContact CB-CG2 3.86Å; L383-V387 WeakPolarHBondContact O-CG2 3.38Å; L383-V387 PolarHBondContact O-N 3Å; L384-V387 PolarHBondContact O-N 3.33Å; V387-N389 VanDerWaalsContact C-N 3.31Å; V387-N389 PolarHBondContact O-N 3.15Å; V387-K390 PolarHBondContact O-N 3.39Å; V387-L406 HydrophobicContact CB-CD2 4.43Å; V387-L406 HydrophobicContact CG1-CD1 4.36Å; V387-L406 HydrophobicContact CG1-CD2 3.69Å; V387-L406 HydrophobicContact CG1-CG 3.79Å
388	V	91.5	Very high	87.8	Confident	1 Å²	1	45 Å²	45	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-41.9	178.4	166.9	0	0	0	0	111	L384 K390 L391 L406 V424 L427	L384-V388 HydrophobicContact CD1-CG2 3.79Å; L384-V388 HydrophobicContact CG-CG2 4.28Å; L384-V388 WeakPolarHBondContact O-CB 3.21Å; L384-V388 WeakPolarHBondContact O-CG2 3.29Å; L384-V388 PolarHBondContact O-N 3.1Å; V388-K390 PolarHBondContact O-N 2.92Å; V388-L391 WeakPolarHBondContact O-CB 3.28Å; V388-L391 PolarHBondContact O-N 3.17Å; V388-L406 HydrophobicContact CG2-CD1 4.01Å; V388-L406 HydrophobicContact CG2-CD2 4.04Å; V388-V424 HydrophobicContact CG1-CG2 3.93Å; V388-V424 HydrophobicContact CG2-CG2 4.06Å; V388-L427 HydrophobicContact CG1-CB 4.1Å; V388-L427 HydrophobicContact CG1-CD1 3.86Å; V388-L427 VanDerWaalsContact O-CD1 3.27Å; V388-L427 WeakPolarHBondContact O-CD1 3.35Å
389	N	90.9	Very high	88.1	Confident	44 Å²	44	44.7 Å²	44.7	24%	0.235	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-57.1	-20.7	175	-76.3	-21.4	0	0	0	113.8	V385 V387 G392 R430	V385-N389 WeakPolarHBondContact O-CB 3.48Å; V385-N389 PolarHBondContact O-N 3.18Å; V385-N389 PolarHBondContact O-ND2 3.28Å; V385-N389 VanDerWaalsContact O-ND2 3.13Å; V387-N389 VanDerWaalsContact C-N 3.31Å; V387-N389 PolarHBondContact O-N 3.15Å; N389-G392 PolarHBondContact O-N 3.17Å; N389-R430 PolarHBondContact OD1-NH1 2.88Å; N389-R430 PolarHBondContact OD1-NH2 3.25Å
390	K	89.3	Confident	88.5	Confident	9 Å²	9	44.8 Å²	44.8	4%	0.039	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-88.3	-6.4	178	-54.9	-53.6	168.5	170.7	0	115	S354 H355 L366 Q386 V387 V388 G392 D393 I398 A399 A402	S354-K390 PolarHBondContact O-NZ 3.01Å; S354-K390 WeakPolarHBondContact OG-CE 3.28Å; S354-K390 PolarHBondContact OG-NZ 2.71Å; H355-K390 PolarHBondContact CD2-NZ 2.88Å; H355-K390 PolarHBondContact CE1-NZ 3.02Å; H355-K390 VanDerWaalsContact CE1-NZ 3.3Å; H355-K390 PolarHBondContact NE2-NZ 2.85Å; L366-K390 HydrophobicContact CD1-CB 3.99Å; L366-K390 HydrophobicContact CD1-CG 3.95Å; Q386-K390 WeakPolarHBondContact O-CG 3.22Å; V387-K390 PolarHBondContact O-N 3.39Å; V388-K390 PolarHBondContact O-N 2.92Å; K390-G392 PolarHBondContact O-N 2.77Å; K390-D393 PolarHBondContact O-N 3.44Å; K390-D393 VanDerWaalsContact O-N 3.13Å; K390-I398 HydrophobicContact CB-CG2 4.4Å; K390-A399 WeakPolarHBondContact O-CA 3.31Å; K390-A402 HydrophobicContact CB-CB 4.17Å
391	L	87.2	Confident	88.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-58.1	-23.6	160.7	-64.8	172.4	0	0	0	111.5	V388 A402 L406 V424 A441	V388-L391 WeakPolarHBondContact O-CB 3.28Å; V388-L391 PolarHBondContact O-N 3.17Å; L391-A402 HydrophobicContact CD2-CB 4.03Å; L391-A402 HydrophobicContact CG-CB 4.43Å; L391-L406 HydrophobicContact CD1-CD1 3.84Å; L391-L406 HydrophobicContact CD2-CD1 4.23Å; L391-L406 HydrophobicContact CG-CD1 4.13Å; L391-V424 HydrophobicContact CD1-CG2 4.33Å; L391-A441 HydrophobicContact CD1-CB 4.48Å
392	G	85.8	Confident	89	Confident	32 Å²	32	38.3 Å²	38.3	33%	0.33	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-100.9	15.1	174.8	0	0	0	0	0	116.5	N389 K390 A437	N389-G392 PolarHBondContact O-N 3.17Å; K390-G392 PolarHBondContact O-N 2.77Å; G392-A437 VanDerWaalsContact CA-CB 3.44Å
393	D	86.4	Confident	89.1	Confident	19 Å²	19	37.4 Å²	37.4	10%	0.102	20%	0.197	C	C	.	.			trans	-66.8	137.2	172.9	-164.3	-72.1	0	0	0	110.3	K362 K390 Q395 I398	K362-D393 WeakPolarHBondContact CE-OD2 3.36Å; K362-D393 VanDerWaalsContact NZ-CG 3.25Å; K362-D393 IonicContact NZ-OD1 2.9Å; K362-D393 PolarHBondContact NZ-OD1 3.38Å; K362-D393 IonicContact NZ-OD2 2.71Å; K362-D393 PolarHBondContact NZ-OD2 3.27Å; K390-D393 PolarHBondContact O-N 3.44Å; K390-D393 VanDerWaalsContact O-N 3.13Å; D393-Q395 PolarHBondContact O-N 2.73Å; D393-Q395 VanDerWaalsContact O-N 3.07Å; D393-Q395 WeakPolarHBondContact OD1-CB 3.39Å; D393-Q395 PolarHBondContact OD1-N 2.84Å; D393-I398 HydrophobicContact CB-CB 4.2Å; D393-I398 HydrophobicContact CB-CG2 4.1Å
394	P	84.7	Confident	89.1	Confident	113 Å²	113	42.6 Å²	42.6	73%	0.734	22%	0.221	S	C	*	.	S	Bend	trans	-61.9	-15	178.7	24.5	-35.7	0	0	0	114.3
395	Q	86.5	Confident	89.1	Confident	67 Å²	67	43.4 Å²	43.4	31%	0.313	23%	0.225	S	C	.	.	S	Bend	trans	-95.1	107.9	-179.9	-58.7	-179	-69	0	0	110.8	D393 R397 I398 A399	D393-Q395 PolarHBondContact O-N 2.73Å; D393-Q395 VanDerWaalsContact O-N 3.07Å; D393-Q395 WeakPolarHBondContact OD1-CB 3.39Å; D393-Q395 PolarHBondContact OD1-N 2.84Å; Q395-R397 PolarHBondContact O-N 2.96Å; Q395-I398 HydrophobicContact CB-CD1 4Å; Q395-I398 HydrophobicContact CB-CG1 4.04Å; Q395-I398 WeakPolarHBondContact O-CB 3.23Å; Q395-I398 PolarHBondContact O-N 3.47Å; Q395-A399 PolarHBondContact O-N 2.84Å
396	N	87.3	Confident	89.1	Confident	68 Å²	68	41.6 Å²	41.6	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-44.6	-46.2	-175.9	-49.5	-3.2	0	0	0	113.1	I398 A399 T400 K436	N396-I398 PolarHBondContact O-N 2.89Å; N396-A399 PolarHBondContact O-N 3.4Å; N396-A399 VanDerWaalsContact O-N 3.15Å; N396-T400 PolarHBondContact O-N 2.92Å; N396-T400 PolarHBondContact O-OG1 3.11Å; N396-K436 VanDerWaalsContact CG-NZ 3.33Å; N396-K436 PolarHBondContact ND2-NZ 2.87Å; N396-K436 PolarHBondContact OD1-NZ 3.29Å
397	R	87.9	Confident	89.2	Confident	213 Å²	213	44.9 Å²	44.9	80%	0.804	23%	0.229	S	C	*	.	H	α-helix	trans	-60.7	-14.2	-179.5	-62.7	-175.6	-179.1	-177.2	0.4	114.7	Q395 K401	Q395-R397 PolarHBondContact O-N 2.96Å; R397-K401 WeakPolarHBondContact O-CB 3.44Å
398	I	89.1	Confident	89.2	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-98.6	-40.8	178	-52.8	-171.9	0	0	0	109.9	V359 K362 T363 L366 K390 D393 Q395 N396 K401 A402	V359-I398 HydrophobicContact CG1-CD1 4.18Å; V359-I398 HydrophobicContact CG1-CG1 4.27Å; K362-I398 HydrophobicContact CB-CD1 3.86Å; K362-I398 HydrophobicContact CD-CD1 3.27Å; K362-I398 HydrophobicContact CG-CD1 4.25Å; T363-I398 HydrophobicContact CG2-CD1 4.42Å; T363-I398 HydrophobicContact CG2-CG1 4.01Å; L366-I398 HydrophobicContact CD2-CG2 4.46Å; K390-I398 HydrophobicContact CB-CG2 4.4Å; D393-I398 HydrophobicContact CB-CB 4.2Å; D393-I398 HydrophobicContact CB-CG2 4.1Å; Q395-I398 HydrophobicContact CB-CD1 4Å; Q395-I398 HydrophobicContact CB-CG1 4.04Å; Q395-I398 WeakPolarHBondContact O-CB 3.23Å; Q395-I398 PolarHBondContact O-N 3.47Å; N396-I398 PolarHBondContact O-N 2.89Å; I398-K401 PolarHBondContact O-N 2.68Å; I398-A402 WeakPolarHBondContact O-CB 3.49Å; I398-A402 PolarHBondContact O-N 2.85Å
399	A	88.7	Confident	89	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-45.4	173	0	0	0	0	0	112.1	K390 Q395 N396 A402 S403 Y440	K390-A399 WeakPolarHBondContact O-CA 3.31Å; Q395-A399 PolarHBondContact O-N 2.84Å; N396-A399 PolarHBondContact O-N 3.4Å; N396-A399 VanDerWaalsContact O-N 3.15Å; A399-A402 WeakPolarHBondContact O-CB 3.3Å; A399-A402 PolarHBondContact O-N 2.93Å; A399-S403 PolarHBondContact O-N 3.17Å; A399-Y440 HydrophobicContact CB-CD2 3.66Å; A399-Y440 HydrophobicContact CB-CE2 3.9Å; A399-Y440 HydrophobicContact CB-CG 4.23Å
400	T	89.4	Confident	88.9	Confident	74 Å²	74	45.3 Å²	45.3	45%	0.454	23%	0.233	S	C	.	.	H	α-helix	trans	-65.3	-39.9	175.8	57.1	0	0	0	0	112	N396 A402 S403 H404 Y440	N396-T400 PolarHBondContact O-N 2.92Å; N396-T400 PolarHBondContact O-OG1 3.11Å; T400-A402 VanDerWaalsContact C-N 3.31Å; T400-A402 PolarHBondContact O-N 3.29Å; T400-S403 WeakPolarHBondContact O-CB 3.4Å; T400-S403 PolarHBondContact O-N 3.11Å; T400-H404 PolarHBondContact O-N 2.81Å; T400-Y440 HydrophobicContact CG2-CE1 4.31Å
401	K	90	Very high	88.8	Confident	72 Å²	72	50 Å²	50	31%	0.313	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-36.2	173	-168.7	179.3	-177.4	-172.8	0	111.9	T363 L366 R397 I398 L405	T363-K401 HydrophobicContact CG2-CD 4.18Å; T363-K401 PolarHBondContact O-NZ 2.84Å; L366-K401 HydrophobicContact CD2-CB 4.25Å; L366-K401 HydrophobicContact CD2-CD 4.29Å; L366-K401 HydrophobicContact CD2-CG 4.13Å; R397-K401 WeakPolarHBondContact O-CB 3.44Å; I398-K401 PolarHBondContact O-N 2.68Å; K401-L405 HydrophobicContact CG-CD1 4.03Å; K401-L405 HydrophobicContact CG-CG 4.36Å; K401-L405 WeakPolarHBondContact O-CB 3.32Å; K401-L405 WeakPolarHBondContact O-CG 3.4Å; K401-L405 PolarHBondContact O-N 3.33Å
402	A	92.3	Very high	88.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-40.8	174.3	0	0	0	0	0	111.6	L366 K390 L391 I398 A399 T400 L405 L406	L366-A402 HydrophobicContact CD1-CB 4.37Å; L366-A402 HydrophobicContact CD2-CB 4.22Å; K390-A402 HydrophobicContact CB-CB 4.17Å; L391-A402 HydrophobicContact CD2-CB 4.03Å; L391-A402 HydrophobicContact CG-CB 4.43Å; I398-A402 WeakPolarHBondContact O-CB 3.49Å; I398-A402 PolarHBondContact O-N 2.85Å; A399-A402 WeakPolarHBondContact O-CB 3.3Å; A399-A402 PolarHBondContact O-N 2.93Å; T400-A402 VanDerWaalsContact C-N 3.31Å; T400-A402 PolarHBondContact O-N 3.29Å; A402-L405 PolarHBondContact O-N 2.93Å; A402-L406 WeakPolarHBondContact O-CG 3.33Å; A402-L406 PolarHBondContact O-N 3.29Å
403	S	91.1	Very high	88.8	Confident	15 Å²	15	57.1 Å²	57.1	11%	0.105	29%	0.288	C	S	.	.	H	α-helix	trans	-57.6	-55.1	173.5	-149.3	0	0	0	0	111.5	A399 T400 L405 L406 E407 Q447	A399-S403 PolarHBondContact O-N 3.17Å; T400-S403 WeakPolarHBondContact O-CB 3.4Å; T400-S403 PolarHBondContact O-N 3.11Å; S403-L405 VanDerWaalsContact C-N 3.3Å; S403-L405 PolarHBondContact O-N 3.07Å; S403-L406 PolarHBondContact O-N 3.11Å; S403-L406 VanDerWaalsContact O-N 3.13Å; S403-E407 WeakPolarHBondContact O-CB 3.46Å; S403-E407 PolarHBondContact O-N 3.33Å; S403-Q447 PolarHBondContact OG-OE1 2.88Å; S403-Q447 VanDerWaalsContact OG-OE1 3.05Å
404	H	91.7	Very high	88.8	Confident	113 Å²	113	59.2 Å²	59.2	52%	0.523	30%	0.303	S	S	.	.	H	α-helix	trans	-58.8	-37.6	178.7	-179.7	-48.1	0	0	0	112.5	T400 T408	T400-H404 PolarHBondContact O-N 2.81Å; H404-T408 PolarHBondContact CE1-OG1 2.9Å; H404-T408 PolarHBondContact ND1-OG1 2.79Å; H404-T408 WeakPolarHBondContact O-CB 3.29Å; H404-T408 PolarHBondContact O-N 2.94Å; H404-T408 PolarHBondContact O-OG1 3.09Å
405	L	90.7	Very high	88.8	Confident	19 Å²	19	61.6 Å²	61.6	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-72.5	-36.2	177.9	-70.1	172.5	0	0	0	112	L366 H370 K401 A402 S403 T408 L409	L366-L405 HydrophobicContact CD2-CD1 3.79Å; L366-L405 HydrophobicContact CG-CD1 3.73Å; H370-L405 HydrophobicContact CB-CB 4.23Å; H370-L405 HydrophobicContact CB-CD1 4.24Å; H370-L405 HydrophobicContact CB-CD2 4.24Å; H370-L405 HydrophobicContact CB-CG 4.48Å; H370-L405 PolarHBondContact CD2-O 2.85Å; H370-L405 PolarHBondContact NE2-O 3.32Å; K401-L405 HydrophobicContact CG-CD1 4.03Å; K401-L405 HydrophobicContact CG-CG 4.36Å; K401-L405 WeakPolarHBondContact O-CB 3.32Å; K401-L405 WeakPolarHBondContact O-CG 3.4Å; K401-L405 PolarHBondContact O-N 3.33Å; A402-L405 PolarHBondContact O-N 2.93Å; S403-L405 VanDerWaalsContact C-N 3.3Å; S403-L405 PolarHBondContact O-N 3.07Å; L405-T408 PolarHBondContact O-N 3.43Å; L405-L409 WeakPolarHBondContact O-CB 3.34Å; L405-L409 PolarHBondContact O-N 3.24Å
406	L	91.5	Very high	88.7	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67	-40.6	172.5	-70.3	168.7	0	0	0	111.4	L384 V387 V388 L391 A402 S403 L409 L410 V420 F444	L384-L406 HydrophobicContact CD1-CD2 3.83Å; V387-L406 HydrophobicContact CB-CD2 4.43Å; V387-L406 HydrophobicContact CG1-CD1 4.36Å; V387-L406 HydrophobicContact CG1-CD2 3.69Å; V387-L406 HydrophobicContact CG1-CG 3.79Å; V388-L406 HydrophobicContact CG2-CD1 4.01Å; V388-L406 HydrophobicContact CG2-CD2 4.04Å; L391-L406 HydrophobicContact CD1-CD1 3.84Å; L391-L406 HydrophobicContact CD2-CD1 4.23Å; L391-L406 HydrophobicContact CG-CD1 4.13Å; A402-L406 WeakPolarHBondContact O-CG 3.33Å; A402-L406 PolarHBondContact O-N 3.29Å; S403-L406 PolarHBondContact O-N 3.11Å; S403-L406 VanDerWaalsContact O-N 3.13Å; L406-L409 WeakPolarHBondContact O-CB 3.49Å; L406-L409 PolarHBondContact O-N 3.35Å; L406-L410 WeakPolarHBondContact O-CG 3.19Å; L406-L410 PolarHBondContact O-N 2.93Å; L406-V420 HydrophobicContact CD2-CG1 4.36Å; L406-F444 HydrophobicContact CB-CD2 4.1Å; L406-F444 HydrophobicContact CB-CE1 4.41Å; L406-F444 HydrophobicContact CB-CE2 3.35Å; L406-F444 HydrophobicContact CB-CZ 3.54Å; L406-F444 HydrophobicContact CD1-CE1 4.36Å; L406-F444 HydrophobicContact CD1-CE2 4.41Å; L406-F444 HydrophobicContact CD1-CZ 4.28Å; L406-F444 HydrophobicContact CG-CZ 4.47Å
407	E	89.9	Confident	88.8	Confident	78 Å²	78	57.9 Å²	57.9	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-59.4	-49.1	172.3	179.5	179.9	-149.9	0	0	111.6	S403 L409 L410 C411	S403-E407 WeakPolarHBondContact O-CB 3.46Å; S403-E407 PolarHBondContact O-N 3.33Å; E407-L409 PolarHBondContact O-N 3.5Å; E407-L410 PolarHBondContact O-N 3.45Å; E407-C411 PolarHBondContact O-N 3.02Å; E407-C411 PolarHBondContact O-SG 3.15Å; E407-C411 VanDerWaalsContact O-SG 3.35Å
408	T	90.8	Very high	88.8	Confident	42 Å²	42	50 Å²	50	26%	0.258	28%	0.275	S	S	.	.	H	α-helix	trans	-58.1	-34.9	175.6	-58.6	0	0	0	0	112.3	H404 L405 K412	H404-T408 PolarHBondContact CE1-OG1 2.9Å; H404-T408 PolarHBondContact ND1-OG1 2.79Å; H404-T408 WeakPolarHBondContact O-CB 3.29Å; H404-T408 PolarHBondContact O-N 2.94Å; H404-T408 PolarHBondContact O-OG1 3.09Å; L405-T408 PolarHBondContact O-N 3.43Å; T408-K412 WeakPolarHBondContact O-CG 3.38Å; T408-K412 PolarHBondContact O-N 2.95Å
409	L	88.4	Confident	88.9	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-70.3	-44.1	174.3	173.3	158.8	0	0	0	111.8	L373 L405 L406 E407 C411 K412 H413 M416 V420	L373-L409 HydrophobicContact CB-CD1 4.45Å; L373-L409 HydrophobicContact CD2-CD1 3.33Å; L373-L409 HydrophobicContact CG-CD1 3.56Å; L405-L409 WeakPolarHBondContact O-CB 3.34Å; L405-L409 PolarHBondContact O-N 3.24Å; L406-L409 WeakPolarHBondContact O-CB 3.49Å; L406-L409 PolarHBondContact O-N 3.35Å; E407-L409 PolarHBondContact O-N 3.5Å; L409-C411 VanDerWaalsContact C-N 3.31Å; L409-C411 PolarHBondContact O-N 3.41Å; L409-K412 PolarHBondContact O-N 2.88Å; L409-K412 VanDerWaalsContact O-N 3.1Å; L409-H413 PolarHBondContact O-N 3.49Å; L409-M416 HydrophobicContact CD1-CE 4.25Å; L409-M416 HydrophobicContact CD2-CB 4.19Å; L409-M416 HydrophobicContact CD2-CE 4.12Å; L409-M416 HydrophobicContact CD2-SD 3.96Å; L409-M416 HydrophobicContact CG-SD 4.38Å; L409-V420 HydrophobicContact CD2-CG2 4.07Å
410	L	88.9	Confident	89	Confident	13 Å²	13	53.8 Å²	53.8	7%	0.068	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-35.9	178.9	-68.4	-174.3	0	0	0	112.3	L406 E407 K412 H413 K417 V420 F444 M448	L406-L410 WeakPolarHBondContact O-CG 3.19Å; L406-L410 PolarHBondContact O-N 2.93Å; E407-L410 PolarHBondContact O-N 3.45Å; L410-K412 VanDerWaalsContact C-N 3.26Å; L410-K412 PolarHBondContact O-N 2.89Å; L410-H413 CarbonylContact O-C 3.54Å; L410-H413 PolarHBondContact O-N 3.33Å; L410-K417 HydrophobicContact CD1-CG 4.35Å; L410-K417 HydrophobicContact CD2-CB 4.27Å; L410-K417 HydrophobicContact CD2-CG 3.79Å; L410-K417 HydrophobicContact CG-CG 4.47Å; L410-V420 HydrophobicContact CD2-CB 4.16Å; L410-V420 HydrophobicContact CD2-CG2 3.86Å; L410-F444 HydrophobicContact CD1-CE2 4.35Å; L410-F444 HydrophobicContact CD1-CZ 3.81Å; L410-M448 HydrophobicContact CD1-CE 3.91Å; L410-M448 HydrophobicContact CD1-CG 3.79Å; L410-M448 HydrophobicContact CD1-SD 4.29Å
411	C	86.5	Confident	89	Confident	108 Å²	108	50.4 Å²	50.4	73%	0.73	28%	0.278	S	S	*	.	H	α-helix	trans	-67.3	-24.1	174.1	-63.7	0	0	0	0	113.4	E407 L409	E407-C411 PolarHBondContact O-N 3.02Å; E407-C411 PolarHBondContact O-SG 3.15Å; E407-C411 VanDerWaalsContact O-SG 3.35Å; L409-C411 VanDerWaalsContact C-N 3.31Å; L409-C411 PolarHBondContact O-N 3.41Å
412	K	86.5	Confident	89	Confident	109 Å²	109	47.6 Å²	47.6	47%	0.474	27%	0.269	S	S	.	.	H	α-helix	trans	-87.7	-36.2	174	-72.5	177.4	178.3	-175.6	0	113.2	C374 T408 L409 L410	C374-K412 HydrophobicContact CB-CD 4.22Å; T408-K412 WeakPolarHBondContact O-CG 3.38Å; T408-K412 PolarHBondContact O-N 2.95Å; L409-K412 PolarHBondContact O-N 2.88Å; L409-K412 VanDerWaalsContact O-N 3.1Å; L410-K412 VanDerWaalsContact C-N 3.26Å; L410-K412 PolarHBondContact O-N 2.89Å
413	H	86.1	Confident	88.9	Confident	72 Å²	72	48.1 Å²	48.1	33%	0.333	27%	0.271	S	S	.	.			trans	-131.8	76.4	-172.2	-66.4	-61.7	0	0	0	111.3	C374 L409 L410 N415 M416	C374-H413 PolarHBondContact O-NE2 3.32Å; L409-H413 PolarHBondContact O-N 3.49Å; L410-H413 CarbonylContact O-C 3.54Å; L410-H413 PolarHBondContact O-N 3.33Å; H413-N415 PolarHBondContact O-N 3.33Å; H413-M416 HydrophobicContact CB-CB 4.27Å; H413-M416 HydrophobicContact CB-CG 3.8Å; H413-M416 HydrophobicContact CB-SD 3.64Å; H413-M416 WeakPolarHBondContact O-CB 3.29Å; H413-M416 PolarHBondContact O-N 3.48Å
414	P	85.9	Confident	88.9	Confident	63 Å²	63	47.4 Å²	47.4	41%	0.409	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-54	-39.2	-180	-27.9	36	0	0	0	113.1	M416 K417	P414-M416 PolarHBondContact O-N 2.98Å; P414-K417 WeakPolarHBondContact O-CB 3.32Å; P414-K417 WeakPolarHBondContact O-CD 3.38Å; P414-K417 WeakPolarHBondContact O-CG 3Å; P414-K417 PolarHBondContact O-N 3.13Å
415	N	85.1	Confident	88.9	Confident	164 Å²	164	45.5 Å²	45.5	88%	0.877	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-59.2	-17	177.8	-65	-12.9	0	0	0	114.1	H413	H413-N415 PolarHBondContact O-N 3.33Å
416	M	85.9	Confident	88.8	Confident	34 Å²	34	51 Å²	51	17%	0.167	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-81	-16	175.4	-67.6	-177.7	73.3	0	0	113.8	L373 L409 H413 P414 G418 V419 V420	L373-M416 HydrophobicContact CD1-CE 4.1Å; L373-M416 HydrophobicContact CG-CE 4.43Å; L409-M416 HydrophobicContact CD1-CE 4.25Å; L409-M416 HydrophobicContact CD2-CB 4.19Å; L409-M416 HydrophobicContact CD2-CE 4.12Å; L409-M416 HydrophobicContact CD2-SD 3.96Å; L409-M416 HydrophobicContact CG-SD 4.38Å; H413-M416 HydrophobicContact CB-CB 4.27Å; H413-M416 HydrophobicContact CB-CG 3.8Å; H413-M416 HydrophobicContact CB-SD 3.64Å; H413-M416 WeakPolarHBondContact O-CB 3.29Å; H413-M416 PolarHBondContact O-N 3.48Å; P414-M416 PolarHBondContact O-N 2.98Å; M416-G418 VanDerWaalsContact C-N 3.3Å; M416-G418 PolarHBondContact O-N 2.95Å; M416-G418 VanDerWaalsContact O-N 3.15Å; M416-V419 PolarHBondContact O-N 3.11Å; M416-V420 HydrophobicContact CB-CG2 4.29Å; M416-V420 WeakPolarHBondContact O-CG2 3.14Å; M416-V420 PolarHBondContact O-N 3.5Å
417	K	88.6	Confident	88.6	Confident	23 Å²	23	51.2 Å²	51.2	10%	0.1	28%	0.278	C	S	.	.	H	α-helix	trans	-47.1	-47.9	-175.6	-75.2	170	-177.1	-179.3	0	113.5	L410 P414 V419 V420 C421 M448 A449 E454 L457	L410-K417 HydrophobicContact CD1-CG 4.35Å; L410-K417 HydrophobicContact CD2-CB 4.27Å; L410-K417 HydrophobicContact CD2-CG 3.79Å; L410-K417 HydrophobicContact CG-CG 4.47Å; P414-K417 WeakPolarHBondContact O-CB 3.32Å; P414-K417 WeakPolarHBondContact O-CD 3.38Å; P414-K417 WeakPolarHBondContact O-CG 3Å; P414-K417 PolarHBondContact O-N 3.13Å; K417-V419 PolarHBondContact O-N 3.3Å; K417-V420 PolarHBondContact O-N 3Å; K417-C421 VanDerWaalsContact O-CB 3.3Å; K417-C421 WeakPolarHBondContact O-CB 3.48Å; K417-C421 PolarHBondContact O-N 2.82Å; K417-M448 HydrophobicContact CB-CE 3.82Å; K417-M448 HydrophobicContact CG-CE 4.03Å; K417-A449 VanDerWaalsContact CE-O 3.23Å; K417-A449 WeakPolarHBondContact CE-O 3.15Å; K417-A449 PolarHBondContact NZ-O 3.49Å; K417-E454 WeakPolarHBondContact CD-OE1 3.31Å; K417-E454 VanDerWaalsContact CD-OE2 3.31Å; K417-E454 WeakPolarHBondContact CD-OE2 3.33Å; K417-E454 WeakPolarHBondContact CE-OE1 3.4Å; K417-E454 IonicContact NZ-OE1 2.74Å; K417-E454 PolarHBondContact NZ-OE1 2.95Å; K417-E454 IonicContact NZ-OE2 2.87Å; K417-E454 PolarHBondContact NZ-OE2 3.38Å; K417-L457 HydrophobicContact CB-CD2 3.74Å; K417-L457 HydrophobicContact CD-CD2 4.32Å
418	G	88.6	Confident	88.4	Confident	46 Å²	46	47.6 Å²	47.6	47%	0.474	26%	0.261	S	S	.	.	H	α-helix	trans	-64.9	-34.4	179.5	0	0	0	0	0	114.1	M416 G422	M416-G418 VanDerWaalsContact C-N 3.3Å; M416-G418 PolarHBondContact O-N 2.95Å; M416-G418 VanDerWaalsContact O-N 3.15Å; G418-G422 PolarHBondContact O-N 3.37Å; G418-G422 VanDerWaalsContact O-N 3.17Å
419	V	89.4	Confident	88.2	Confident	83 Å²	83	50.6 Å²	50.6	50%	0.503	27%	0.271	S	S	.	.	H	α-helix	trans	-73.7	-43.9	176.7	-175	0	0	0	0	110.6	L384 M416 K417 G422 E423	L384-V419 HydrophobicContact CD2-CG1 4.03Å; M416-V419 PolarHBondContact O-N 3.11Å; K417-V419 PolarHBondContact O-N 3.3Å; V419-G422 PolarHBondContact O-N 2.75Å; V419-E423 PolarHBondContact O-N 3.37Å
420	V	91.4	Very high	88.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-47.4	176.8	178.8	0	0	0	0	110.6	L384 L406 L409 L410 M416 K417 G422 E423 V424 F444	L384-V420 HydrophobicContact CD1-CG1 4.43Å; L384-V420 HydrophobicContact CD1-CG2 3.9Å; L384-V420 HydrophobicContact CD2-CG2 4.11Å; L406-V420 HydrophobicContact CD2-CG1 4.36Å; L409-V420 HydrophobicContact CD2-CG2 4.07Å; L410-V420 HydrophobicContact CD2-CB 4.16Å; L410-V420 HydrophobicContact CD2-CG2 3.86Å; M416-V420 HydrophobicContact CB-CG2 4.29Å; M416-V420 WeakPolarHBondContact O-CG2 3.14Å; M416-V420 PolarHBondContact O-N 3.5Å; K417-V420 PolarHBondContact O-N 3Å; V420-G422 VanDerWaalsContact C-N 3.3Å; V420-G422 PolarHBondContact O-N 3.07Å; V420-E423 PolarHBondContact O-N 3.03Å; V420-V424 HydrophobicContact CG1-CG2 4.42Å; V420-V424 WeakPolarHBondContact O-CG2 3.31Å; V420-V424 PolarHBondContact O-N 3.44Å; V420-F444 HydrophobicContact CG1-CE1 3.82Å; V420-F444 HydrophobicContact CG1-CZ 3.9Å
421	C	90.6	Very high	87.4	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.02	33%	0.325	C	S	.	.	H	α-helix	trans	-54.5	-45.4	173.9	-176.3	0	0	0	0	111.7	K417 E423 V424 E425 L457	K417-C421 VanDerWaalsContact O-CB 3.3Å; K417-C421 WeakPolarHBondContact O-CB 3.48Å; K417-C421 PolarHBondContact O-N 2.82Å; C421-E423 PolarHBondContact O-N 2.71Å; C421-V424 PolarHBondContact O-N 3.4Å; C421-E425 WeakPolarHBondContact O-CB 3.48Å; C421-E425 PolarHBondContact O-N 3.09Å; C421-L457 HydrophobicContact CB-CD1 3.8Å
422	G	88.7	Confident	87	Confident	12 Å²	12	62.7 Å²	62.7	12%	0.124	33%	0.329	C	S	.	.	H	α-helix	trans	-67.7	-28.2	179.3	0	0	0	0	0	115.2	G418 V419 V420 R426	G418-G422 PolarHBondContact O-N 3.37Å; G418-G422 VanDerWaalsContact O-N 3.17Å; V419-G422 PolarHBondContact O-N 2.75Å; V420-G422 VanDerWaalsContact C-N 3.3Å; V420-G422 PolarHBondContact O-N 3.07Å; G422-R426 VanDerWaalsContact O-CG 3.3Å; G422-R426 WeakPolarHBondContact O-CG 3.34Å; G422-R426 PolarHBondContact O-N 3.06Å
423	E	90.3	Very high	86.9	Confident	12 Å²	12	59.4 Å²	59.4	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-80.9	-32.8	171.6	-61.5	-59.3	171.9	0	0	112.4	K381 L384 V385 V419 V420 C421 R426 L427	K381-E423 WeakPolarHBondContact CE-OE1 3.25Å; L384-E423 HydrophobicContact CD2-CG 3.92Å; L384-E423 HydrophobicContact CG-CG 4.28Å; V385-E423 HydrophobicContact CG2-CG 4.21Å; V419-E423 PolarHBondContact O-N 3.37Å; V420-E423 PolarHBondContact O-N 3.03Å; C421-E423 PolarHBondContact O-N 2.71Å; E423-R426 PolarHBondContact O-N 2.97Å; E423-R426 IonicContact OE1-NH1 3.61Å; E423-R426 PolarHBondContact OE1-NH1 2.92Å; E423-R426 IonicContact OE2-CZ 3.6Å; E423-R426 IonicContact OE2-NH1 2.79Å; E423-R426 PolarHBondContact OE2-NH1 3.19Å; E423-L427 PolarHBondContact O-N 2.85Å; E423-L427 VanDerWaalsContact O-N 3.11Å
424	V	91.3	Very high	86.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-67.8	-39.7	173.1	174.9	0	0	0	0	111	V388 L391 V420 C421 R426 L427 L428 A441 F444 L445	V388-V424 HydrophobicContact CG1-CG2 3.93Å; V388-V424 HydrophobicContact CG2-CG2 4.06Å; L391-V424 HydrophobicContact CD1-CG2 4.33Å; V420-V424 HydrophobicContact CG1-CG2 4.42Å; V420-V424 WeakPolarHBondContact O-CG2 3.31Å; V420-V424 PolarHBondContact O-N 3.44Å; C421-V424 PolarHBondContact O-N 3.4Å; V424-R426 VanDerWaalsContact C-N 3.35Å; V424-R426 PolarHBondContact O-N 3.24Å; V424-L427 WeakPolarHBondContact O-CA 3.41Å; V424-L427 WeakPolarHBondContact O-CB 3.43Å; V424-L427 PolarHBondContact O-N 3.45Å; V424-L428 HydrophobicContact CG1-CD1 4.21Å; V424-L428 HydrophobicContact CG1-CG 4.43Å; V424-L428 WeakPolarHBondContact O-CG 3.29Å; V424-L428 PolarHBondContact O-N 3.48Å; V424-A441 HydrophobicContact CG1-CB 4.06Å; V424-F444 HydrophobicContact CG2-CD1 4.1Å; V424-F444 HydrophobicContact CG2-CE1 4.05Å; V424-L445 HydrophobicContact CB-CD2 4.27Å; V424-L445 HydrophobicContact CG1-CD1 4.11Å; V424-L445 HydrophobicContact CG1-CD2 3.95Å; V424-L445 HydrophobicContact CG1-CG 4Å
425	E	90.8	Very high	86.7	Confident	72 Å²	72	59.6 Å²	59.6	34%	0.336	33%	0.327	S	S	.	.	H	α-helix	trans	-55.8	-47.6	170.6	-176.9	-178.5	-161.3	0	0	111.5	C421 L427 L428 F429 I464	C421-E425 WeakPolarHBondContact O-CB 3.48Å; C421-E425 PolarHBondContact O-N 3.09Å; E425-L427 PolarHBondContact O-N 3.41Å; E425-L428 PolarHBondContact O-N 3.15Å; E425-F429 HydrophobicContact CG-CD2 3.72Å; E425-F429 HydrophobicContact CG-CE2 3.68Å; E425-F429 WeakPolarHBondContact O-CD2 3.33Å; E425-F429 PolarHBondContact O-N 2.88Å; E425-F429 VanDerWaalsContact O-N 3.12Å; E425-I464 HydrophobicContact CB-CD1 3.99Å; E425-I464 HydrophobicContact CG-CD1 3.93Å; E425-I464 HydrophobicContact CG-CG1 4.21Å
426	R	89.1	Confident	86.6	Confident	134 Å²	134	56.6 Å²	56.6	51%	0.506	31%	0.306	S	S	.	.	H	α-helix	trans	-68.2	-10.6	175.3	-70.4	176.7	-154.4	123.7	13.7	114.4	G422 E423 V424 R430	G422-R426 VanDerWaalsContact O-CG 3.3Å; G422-R426 WeakPolarHBondContact O-CG 3.34Å; G422-R426 PolarHBondContact O-N 3.06Å; E423-R426 PolarHBondContact O-N 2.97Å; E423-R426 IonicContact OE1-NH1 3.61Å; E423-R426 PolarHBondContact OE1-NH1 2.92Å; E423-R426 IonicContact OE2-CZ 3.6Å; E423-R426 IonicContact OE2-NH1 2.79Å; E423-R426 PolarHBondContact OE2-NH1 3.19Å; V424-R426 VanDerWaalsContact C-N 3.35Å; V424-R426 PolarHBondContact O-N 3.24Å; R426-R430 VanDerWaalsContact O-CG 3.24Å; R426-R430 WeakPolarHBondContact O-CG 3.46Å; R426-R430 PolarHBondContact O-NE 3.26Å
427	L	87.8	Confident	86.6	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-89.7	-46.2	169.2	174.8	140	0	0	0	110.7	V388 E423 V424 E425 F429 R430 I433 A441	V388-L427 HydrophobicContact CG1-CB 4.1Å; V388-L427 HydrophobicContact CG1-CD1 3.86Å; V388-L427 VanDerWaalsContact O-CD1 3.27Å; V388-L427 WeakPolarHBondContact O-CD1 3.35Å; E423-L427 PolarHBondContact O-N 2.85Å; E423-L427 VanDerWaalsContact O-N 3.11Å; V424-L427 WeakPolarHBondContact O-CA 3.41Å; V424-L427 WeakPolarHBondContact O-CB 3.43Å; V424-L427 PolarHBondContact O-N 3.45Å; E425-L427 PolarHBondContact O-N 3.41Å; L427-F429 PolarHBondContact O-N 2.66Å; L427-R430 WeakPolarHBondContact O-CG 3.47Å; L427-R430 PolarHBondContact O-N 2.83Å; L427-I433 HydrophobicContact CD2-CD1 3.44Å; L427-I433 VanDerWaalsContact CD2-CD1 3.44Å; L427-I433 HydrophobicContact CG-CD1 3.88Å; L427-I433 WeakPolarHBondContact O-CD1 3.4Å; L427-A441 HydrophobicContact CD2-CB 3.99Å
428	L	86.4	Confident	86.6	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-57.7	-41.7	179.8	-78.7	171.8	0	0	0	113.3	V424 E425 R430 Q438 A441 I442 L445 I464 F468	V424-L428 HydrophobicContact CG1-CD1 4.21Å; V424-L428 HydrophobicContact CG1-CG 4.43Å; V424-L428 WeakPolarHBondContact O-CG 3.29Å; V424-L428 PolarHBondContact O-N 3.48Å; E425-L428 PolarHBondContact O-N 3.15Å; L428-R430 VanDerWaalsContact C-N 3.32Å; L428-R430 PolarHBondContact O-N 3.04Å; L428-Q438 HydrophobicContact CD2-CB 4.22Å; L428-Q438 HydrophobicContact CD2-CG 4.27Å; L428-Q438 PolarHBondContact O-NE2 3.17Å; L428-A441 HydrophobicContact CD2-CB 3.67Å; L428-A441 HydrophobicContact CG-CB 4.07Å; L428-I442 HydrophobicContact CD2-CG1 4.27Å; L428-L445 HydrophobicContact CD1-CD1 3.86Å; L428-I464 HydrophobicContact CD1-CG2 4.04Å; L428-F468 HydrophobicContact CB-CE2 3.88Å; L428-F468 HydrophobicContact CB-CZ 3.7Å; L428-F468 HydrophobicContact CD1-CE2 4.37Å
429	F	85.8	Confident	86.6	Confident	106 Å²	106	56 Å²	56	47%	0.465	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	6.8	-178.1	-74.3	-62.4	0	0	0	115.4	E425 L427 C467 F468	E425-F429 HydrophobicContact CG-CD2 3.72Å; E425-F429 HydrophobicContact CG-CE2 3.68Å; E425-F429 WeakPolarHBondContact O-CD2 3.33Å; E425-F429 PolarHBondContact O-N 2.88Å; E425-F429 VanDerWaalsContact O-N 3.12Å; L427-F429 PolarHBondContact O-N 2.66Å; F429-C467 HydrophobicContact CZ-CB 4.24Å; F429-F468 HydrophobicContact CD1-CE2 4.07Å; F429-F468 AromaticContact CD1-CZ 3.87Å; F429-F468 HydrophobicContact CD1-CZ 3.87Å; F429-F468 AromaticContact CE1-CE2 3.65Å; F429-F468 HydrophobicContact CE1-CE2 3.65Å; F429-F468 AromaticContact CE1-CZ 3.86Å; F429-F468 HydrophobicContact CE1-CZ 3.86Å; F429-F468 HydrophobicContact CE2-CE2 4.23Å; F429-F468 HydrophobicContact CG-CZ 4.39Å; F429-F468 AromaticContact CZ-CE2 3.74Å; F429-F468 HydrophobicContact CZ-CE2 3.74Å; F429-F468 HydrophobicContact CZ-CZ 4.38Å
430	R	86.4	Confident	86.6	Confident	107 Å²	107	54.1 Å²	54.1	40%	0.404	27%	0.274	S	S	.	.			trans	-73.9	138.3	177.2	-61.6	-177.9	-169.6	165.3	10.1	111	N389 R426 L427 L428 N432 I433	N389-R430 PolarHBondContact OD1-NH1 2.88Å; N389-R430 PolarHBondContact OD1-NH2 3.25Å; R426-R430 VanDerWaalsContact O-CG 3.24Å; R426-R430 WeakPolarHBondContact O-CG 3.46Å; R426-R430 PolarHBondContact O-NE 3.26Å; L427-R430 WeakPolarHBondContact O-CG 3.47Å; L427-R430 PolarHBondContact O-N 2.83Å; L428-R430 VanDerWaalsContact C-N 3.32Å; L428-R430 PolarHBondContact O-N 3.04Å; R430-N432 PolarHBondContact O-N 3.14Å; R430-I433 VanDerWaalsContact O-CG2 3.24Å; R430-I433 WeakPolarHBondContact O-CG2 3.32Å
431	S	73.8	Confident	86.5	Confident	115 Å²	115	54.1 Å²	54.1	80%	0.804	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-26.9	-178.4	57.6	0	0	0	0	114.7
432	N	78.8	Confident	86.5	Confident	155 Å²	155	54 Å²	54	83%	0.829	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	24.9	-168.6	-59.7	11.1	0	0	0	112.7	R430	R430-N432 PolarHBondContact O-N 3.14Å
433	I	84.4	Confident	86.5	Confident	39 Å²	39	54.7 Å²	54.7	20%	0.2	28%	0.275	C	S	.	.			trans	-88.3	146	178	-167.9	166	0	0	0	111.5	L427 R430 A437 Q438	L427-I433 HydrophobicContact CD2-CD1 3.44Å; L427-I433 VanDerWaalsContact CD2-CD1 3.44Å; L427-I433 HydrophobicContact CG-CD1 3.88Å; L427-I433 WeakPolarHBondContact O-CD1 3.4Å; R430-I433 VanDerWaalsContact O-CG2 3.24Å; R430-I433 WeakPolarHBondContact O-CG2 3.32Å; I433-A437 HydrophobicContact CD1-CB 3.9Å; I433-A437 HydrophobicContact CG1-CB 3.59Å; I433-Q438 HydrophobicContact CD1-CG 4.07Å; I433-Q438 HydrophobicContact CG1-CG 4.15Å; I433-Q438 HydrophobicContact CG2-CG 3.66Å; I433-Q438 VanDerWaalsContact CG2-NE2 3.29Å
434	S	84.4	Confident	86.6	Confident	66 Å²	66	54.2 Å²	54.2	46%	0.462	27%	0.273	S	S	.	.			trans	-81.1	149.7	175.2	69.7	0	0	0	0	111.8	K436 A437 Q438	S434-K436 PolarHBondContact O-N 3.31Å; S434-K436 VanDerWaalsContact O-N 3.14Å; S434-A437 WeakPolarHBondContact O-CB 3.2Å; S434-A437 PolarHBondContact O-N 3.15Å; S434-A437 WeakPolarHBondContact OG-CB 3.41Å; S434-A437 PolarHBondContact OG-N 3.47Å; S434-Q438 PolarHBondContact O-N 3.18Å
435	S	82.6	Confident	86.6	Confident	73 Å²	73	54.3 Å²	54.3	51%	0.51	27%	0.273	S	S	.	.	H	α-helix	trans	-57.5	-29.9	175.9	-43.2	0	0	0	0	112.6	Q438 Y439	S435-Q438 PolarHBondContact O-N 2.8Å; S435-Y439 WeakPolarHBondContact O-CB 3.41Å; S435-Y439 PolarHBondContact O-N 3.19Å
436	K	83.8	Confident	86.5	Confident	101 Å²	101	51.3 Å²	51.3	44%	0.439	26%	0.26	S	S	.	.	H	α-helix	trans	-69.7	-38.6	175.9	-164.7	173.1	-164.2	175.1	0	112.6	N396 S434 Y439 Y440	N396-K436 VanDerWaalsContact CG-NZ 3.33Å; N396-K436 PolarHBondContact ND2-NZ 2.87Å; N396-K436 PolarHBondContact OD1-NZ 3.29Å; S434-K436 PolarHBondContact O-N 3.31Å; S434-K436 VanDerWaalsContact O-N 3.14Å; K436-Y439 PolarHBondContact O-N 3.34Å; K436-Y440 HydrophobicContact CD-CE2 4.14Å; K436-Y440 WeakPolarHBondContact CE-OH 3.4Å; K436-Y440 HydrophobicContact CG-CD2 4.16Å; K436-Y440 HydrophobicContact CG-CE2 3.74Å; K436-Y440 VanDerWaalsContact O-CD2 3.31Å; K436-Y440 WeakPolarHBondContact O-CD2 3.32Å; K436-Y440 PolarHBondContact O-N 2.97Å
437	A	86.1	Confident	86.5	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-68.9	-36.8	173.1	0	0	0	0	0	111.8	G392 I433 S434 A441	G392-A437 VanDerWaalsContact CA-CB 3.44Å; I433-A437 HydrophobicContact CD1-CB 3.9Å; I433-A437 HydrophobicContact CG1-CB 3.59Å; S434-A437 WeakPolarHBondContact O-CB 3.2Å; S434-A437 PolarHBondContact O-N 3.15Å; S434-A437 WeakPolarHBondContact OG-CB 3.41Å; S434-A437 PolarHBondContact OG-N 3.47Å; A437-A441 VanDerWaalsContact O-CB 3.3Å; A437-A441 WeakPolarHBondContact O-CB 3.2Å; A437-A441 PolarHBondContact O-N 3.34Å
438	Q	88	Confident	86.4	Confident	17 Å²	17	47.2 Å²	47.2	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-44.2	171.2	-67.9	-176.5	-39.3	0	0	111.4	L428 I433 S434 S435 A441 I442	L428-Q438 HydrophobicContact CD2-CB 4.22Å; L428-Q438 HydrophobicContact CD2-CG 4.27Å; L428-Q438 PolarHBondContact O-NE2 3.17Å; I433-Q438 HydrophobicContact CD1-CG 4.07Å; I433-Q438 HydrophobicContact CG1-CG 4.15Å; I433-Q438 HydrophobicContact CG2-CG 3.66Å; I433-Q438 VanDerWaalsContact CG2-NE2 3.29Å; S434-Q438 PolarHBondContact O-N 3.18Å; S435-Q438 PolarHBondContact O-N 2.8Å; Q438-A441 PolarHBondContact O-N 3.47Å; Q438-I442 WeakPolarHBondContact O-CD1 3.28Å; Q438-I442 VanDerWaalsContact O-CG1 3.29Å; Q438-I442 WeakPolarHBondContact O-CG1 3.24Å; Q438-I442 PolarHBondContact O-N 2.96Å
439	Y	88.2	Confident	86.1	Confident	70 Å²	70	50.3 Å²	50.3	28%	0.275	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-53.8	175.4	-178.6	-100.8	0	0	0	112.4	S435 K436 A441 I442 C443 K481 M482 A485	S435-Y439 WeakPolarHBondContact O-CB 3.41Å; S435-Y439 PolarHBondContact O-N 3.19Å; K436-Y439 PolarHBondContact O-N 3.34Å; Y439-A441 VanDerWaalsContact C-N 3.3Å; Y439-A441 PolarHBondContact O-N 3.35Å; Y439-I442 PolarHBondContact O-N 2.95Å; Y439-I442 VanDerWaalsContact O-N 3.13Å; Y439-C443 VanDerWaalsContact CE1-SG 3.6Å; Y439-C443 VanDerWaalsContact CZ-SG 3.53Å; Y439-C443 PolarHBondContact O-N 3.07Å; Y439-C443 PolarHBondContact O-SG 3.47Å; Y439-C443 VanDerWaalsContact O-SG 3.32Å; Y439-K481 HydrophobicContact CE2-CB 3.85Å; Y439-M482 HydrophobicContact CD2-CB 4.24Å; Y439-A485 HydrophobicContact CE2-CB 4.19Å
440	Y	88.9	Confident	86	Confident	45 Å²	45	46.2 Å²	46.2	18%	0.176	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-36.5	179	-71.2	-50.4	0	0	0	113	A399 T400 K436 C443 F444	A399-Y440 HydrophobicContact CB-CD2 3.66Å; A399-Y440 HydrophobicContact CB-CE2 3.9Å; A399-Y440 HydrophobicContact CB-CG 4.23Å; T400-Y440 HydrophobicContact CG2-CE1 4.31Å; K436-Y440 HydrophobicContact CD-CE2 4.14Å; K436-Y440 WeakPolarHBondContact CE-OH 3.4Å; K436-Y440 HydrophobicContact CG-CD2 4.16Å; K436-Y440 HydrophobicContact CG-CE2 3.74Å; K436-Y440 VanDerWaalsContact O-CD2 3.31Å; K436-Y440 WeakPolarHBondContact O-CD2 3.32Å; K436-Y440 PolarHBondContact O-N 2.97Å; Y440-C443 PolarHBondContact O-N 2.91Å; Y440-F444 WeakPolarHBondContact O-CB 3.43Å; Y440-F444 PolarHBondContact O-N 3.44Å
441	A	90.6	Very high	85.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-38.7	174.4	0	0	0	0	0	112.6	L391 V424 L427 L428 A437 Q438 Y439 F444 L445	L391-A441 HydrophobicContact CD1-CB 4.48Å; V424-A441 HydrophobicContact CG1-CB 4.06Å; L427-A441 HydrophobicContact CD2-CB 3.99Å; L428-A441 HydrophobicContact CD2-CB 3.67Å; L428-A441 HydrophobicContact CG-CB 4.07Å; A437-A441 VanDerWaalsContact O-CB 3.3Å; A437-A441 WeakPolarHBondContact O-CB 3.2Å; A437-A441 PolarHBondContact O-N 3.34Å; Q438-A441 PolarHBondContact O-N 3.47Å; Y439-A441 VanDerWaalsContact C-N 3.3Å; Y439-A441 PolarHBondContact O-N 3.35Å; A441-F444 PolarHBondContact O-N 3.21Å; A441-L445 WeakPolarHBondContact O-CG 3.25Å; A441-L445 PolarHBondContact O-N 3.45Å; A441-L445 VanDerWaalsContact O-N 3.11Å
442	I	90	Very high	86.2	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-66.7	-45.7	173.9	-68.9	160.6	0	0	0	110.7	L428 Q438 Y439 F444 L445 N446 Y465 M482 A485 L486	L428-I442 HydrophobicContact CD2-CG1 4.27Å; Q438-I442 WeakPolarHBondContact O-CD1 3.28Å; Q438-I442 VanDerWaalsContact O-CG1 3.29Å; Q438-I442 WeakPolarHBondContact O-CG1 3.24Å; Q438-I442 PolarHBondContact O-N 2.96Å; Y439-I442 PolarHBondContact O-N 2.95Å; Y439-I442 VanDerWaalsContact O-N 3.13Å; I442-F444 VanDerWaalsContact C-N 3.28Å; I442-F444 PolarHBondContact O-N 3.19Å; I442-L445 PolarHBondContact O-N 2.95Å; I442-L445 VanDerWaalsContact O-N 3.07Å; I442-N446 PolarHBondContact O-N 3.29Å; I442-N446 PolarHBondContact O-OD1 2.99Å; I442-Y465 HydrophobicContact CG2-CE1 4.43Å; I442-M482 HydrophobicContact CD1-CG 3.92Å; I442-M482 HydrophobicContact CD1-SD 4.16Å; I442-A485 HydrophobicContact CG2-CB 4.03Å; I442-L486 HydrophobicContact CD1-CD2 3.86Å; I442-L486 HydrophobicContact CD1-CG 4.21Å; I442-L486 HydrophobicContact CG1-CD2 4.23Å; I442-L486 HydrophobicContact CG2-CD2 4.03Å; I442-L486 HydrophobicContact CG2-CG 4.35Å
443	C	89.1	Confident	86.1	Confident	26 Å²	26	44.7 Å²	44.7	18%	0.176	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-38.4	176.3	-65.1	0	0	0	0	112.5	Y439 Y440 N446 Q447	Y439-C443 VanDerWaalsContact CE1-SG 3.6Å; Y439-C443 VanDerWaalsContact CZ-SG 3.53Å; Y439-C443 PolarHBondContact O-N 3.07Å; Y439-C443 PolarHBondContact O-SG 3.47Å; Y439-C443 VanDerWaalsContact O-SG 3.32Å; Y440-C443 PolarHBondContact O-N 2.91Å; C443-N446 WeakPolarHBondContact O-CB 3.46Å; C443-N446 PolarHBondContact O-N 3.03Å; C443-Q447 VanDerWaalsContact O-CG 3.28Å; C443-Q447 WeakPolarHBondContact O-CG 3.3Å; C443-Q447 PolarHBondContact O-N 3.19Å; C443-Q447 VanDerWaalsContact O-N 3.08Å
444	F	91.8	Very high	86.1	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-43.4	172.6	171.1	-103.9	0	0	0	112.4	L406 L410 V420 V424 Y440 A441 I442 N446 Q447 M448	L406-F444 HydrophobicContact CB-CD2 4.1Å; L406-F444 HydrophobicContact CB-CE1 4.41Å; L406-F444 HydrophobicContact CB-CE2 3.35Å; L406-F444 HydrophobicContact CB-CZ 3.54Å; L406-F444 HydrophobicContact CD1-CE1 4.36Å; L406-F444 HydrophobicContact CD1-CE2 4.41Å; L406-F444 HydrophobicContact CD1-CZ 4.28Å; L406-F444 HydrophobicContact CG-CZ 4.47Å; L410-F444 HydrophobicContact CD1-CE2 4.35Å; L410-F444 HydrophobicContact CD1-CZ 3.81Å; V420-F444 HydrophobicContact CG1-CE1 3.82Å; V420-F444 HydrophobicContact CG1-CZ 3.9Å; V424-F444 HydrophobicContact CG2-CD1 4.1Å; V424-F444 HydrophobicContact CG2-CE1 4.05Å; Y440-F444 WeakPolarHBondContact O-CB 3.43Å; Y440-F444 PolarHBondContact O-N 3.44Å; A441-F444 PolarHBondContact O-N 3.21Å; I442-F444 VanDerWaalsContact C-N 3.28Å; I442-F444 PolarHBondContact O-N 3.19Å; F444-N446 VanDerWaalsContact C-N 3.32Å; F444-N446 PolarHBondContact O-N 2.88Å; F444-Q447 WeakPolarHBondContact O-CB 3.45Å; F444-Q447 PolarHBondContact O-N 2.97Å; F444-Q447 VanDerWaalsContact O-N 3.14Å; F444-M448 HydrophobicContact CE1-SD 4.35Å; F444-M448 HydrophobicContact CZ-CG 4.45Å; F444-M448 PolarHBondContact O-N 3.46Å
445	L	90.9	Very high	86.1	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-64	-36.5	175.8	-66.1	178	0	0	0	112	V424 L428 A441 I442 Q447 M448 L461 I464 Y465	V424-L445 HydrophobicContact CB-CD2 4.27Å; V424-L445 HydrophobicContact CG1-CD1 4.11Å; V424-L445 HydrophobicContact CG1-CD2 3.95Å; V424-L445 HydrophobicContact CG1-CG 4Å; L428-L445 HydrophobicContact CD1-CD1 3.86Å; A441-L445 WeakPolarHBondContact O-CG 3.25Å; A441-L445 PolarHBondContact O-N 3.45Å; A441-L445 VanDerWaalsContact O-N 3.11Å; I442-L445 PolarHBondContact O-N 2.95Å; I442-L445 VanDerWaalsContact O-N 3.07Å; L445-Q447 VanDerWaalsContact C-N 3.3Å; L445-Q447 PolarHBondContact O-N 2.95Å; L445-M448 HydrophobicContact CD2-SD 3.74Å; L445-M448 WeakPolarHBondContact O-CB 3.36Å; L445-M448 PolarHBondContact O-N 2.9Å; L445-L461 HydrophobicContact CB-CD2 4.15Å; L445-L461 HydrophobicContact CD1-CD2 4.27Å; L445-L461 HydrophobicContact CD2-CD2 3.92Å; L445-L461 HydrophobicContact CG-CD2 4.33Å; L445-I464 HydrophobicContact CD1-CG2 4.49Å; L445-Y465 HydrophobicContact CB-CE1 4.07Å; L445-Y465 WeakPolarHBondContact CB-OH 3.48Å; L445-Y465 HydrophobicContact CD1-CE1 4.41Å; L445-Y465 PolarHBondContact O-OH 2.99Å
446	N	90.1	Very high	86.2	Confident	9 Å²	9	45.2 Å²	45.2	5%	0.048	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-34.8	172.4	-74.4	26.7	0	0	0	112.4	I442 C443 F444 M448 Y465 A485 G489 R492 E916	I442-N446 PolarHBondContact O-N 3.29Å; I442-N446 PolarHBondContact O-OD1 2.99Å; C443-N446 WeakPolarHBondContact O-CB 3.46Å; C443-N446 PolarHBondContact O-N 3.03Å; F444-N446 VanDerWaalsContact C-N 3.32Å; F444-N446 PolarHBondContact O-N 2.88Å; N446-M448 VanDerWaalsContact C-N 3.27Å; N446-M448 PolarHBondContact O-N 2.87Å; N446-Y465 PolarHBondContact N-OH 3.1Å; N446-Y465 PolarHBondContact OD1-OH 3.44Å; N446-A485 PolarHBondContact ND2-O 2.74Å; N446-A485 PolarHBondContact OD1-O 2.96Å; N446-G489 PolarHBondContact ND2-N 3.12Å; N446-G489 VanDerWaalsContact OD1-CA 3.27Å; N446-G489 WeakPolarHBondContact OD1-CA 3.11Å; N446-R492 WeakPolarHBondContact O-CD 3.13Å; N446-R492 PolarHBondContact O-NE 2.98Å; N446-R492 PolarHBondContact O-NH1 3.35Å; N446-R492 PolarHBondContact O-NH2 3.46Å; N446-E916 PolarHBondContact ND2-OE1 2.85Å
447	Q	88	Confident	86.4	Confident	49 Å²	49	41 Å²	41	23%	0.229	21%	0.209	C	C	.	.	H	α-helix	trans	-70.3	-21.3	-179.4	-74.7	163.9	-12.9	0	0	113	S403 C443 F444 L445 A449 R492 I914	S403-Q447 PolarHBondContact OG-OE1 2.88Å; S403-Q447 VanDerWaalsContact OG-OE1 3.05Å; C443-Q447 VanDerWaalsContact O-CG 3.28Å; C443-Q447 WeakPolarHBondContact O-CG 3.3Å; C443-Q447 PolarHBondContact O-N 3.19Å; C443-Q447 VanDerWaalsContact O-N 3.08Å; F444-Q447 WeakPolarHBondContact O-CB 3.45Å; F444-Q447 PolarHBondContact O-N 2.97Å; F444-Q447 VanDerWaalsContact O-N 3.14Å; L445-Q447 VanDerWaalsContact C-N 3.3Å; L445-Q447 PolarHBondContact O-N 2.95Å; Q447-A449 PolarHBondContact O-N 3.25Å; Q447-R492 PolarHBondContact O-NH2 3.05Å; Q447-I914 VanDerWaalsContact NE2-CD1 3.34Å
448	M	85.4	Confident	86.4	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.03	21%	0.208	C	C	.	.			trans	-58.4	123.9	-179.8	-64.5	-177.5	63.1	0	0	111.8	L410 K417 F444 L445 N446 L457 R492	L410-M448 HydrophobicContact CD1-CE 3.91Å; L410-M448 HydrophobicContact CD1-CG 3.79Å; L410-M448 HydrophobicContact CD1-SD 4.29Å; K417-M448 HydrophobicContact CB-CE 3.82Å; K417-M448 HydrophobicContact CG-CE 4.03Å; F444-M448 HydrophobicContact CE1-SD 4.35Å; F444-M448 HydrophobicContact CZ-CG 4.45Å; F444-M448 PolarHBondContact O-N 3.46Å; L445-M448 HydrophobicContact CD2-SD 3.74Å; L445-M448 WeakPolarHBondContact O-CB 3.36Å; L445-M448 PolarHBondContact O-N 2.9Å; N446-M448 VanDerWaalsContact C-N 3.27Å; N446-M448 PolarHBondContact O-N 2.87Å; M448-L457 HydrophobicContact CE-CD2 4.12Å; M448-R492 PolarHBondContact O-NE 2.86Å; M448-R492 PolarHBondContact O-NH2 3.34Å
449	A	81.6	Confident	86.4	Confident	65 Å²	65	41.3 Å²	41.3	54%	0.537	21%	0.21	S	C	.	.			trans	-74.2	129.4	169.8	0	0	0	0	0	109.7	K417 Q447	K417-A449 VanDerWaalsContact CE-O 3.23Å; K417-A449 WeakPolarHBondContact CE-O 3.15Å; K417-A449 PolarHBondContact NZ-O 3.49Å; Q447-A449 PolarHBondContact O-N 3.25Å
450	L	84.1	Confident	86.4	Confident	21 Å²	21	42.8 Å²	42.8	11%	0.11	22%	0.218	C	C	.	.			trans	-111.3	143.1	178.3	-66	170.3	0	0	0	109.4	L457 A458 L461 A493 Y496	L450-L457 HydrophobicContact CD2-CD2 3.88Å; L450-L457 HydrophobicContact CD2-CG 4.07Å; L450-A458 HydrophobicContact CD1-CB 4.33Å; L450-L461 HydrophobicContact CD1-CD1 4.02Å; L450-L461 HydrophobicContact CD2-CD1 3.89Å; L450-L461 HydrophobicContact CG-CD1 4.44Å; L450-A493 HydrophobicContact CD1-CB 4.03Å; L450-Y496 HydrophobicContact CB-CD1 4.49Å; L450-Y496 HydrophobicContact CB-CD2 3.71Å; L450-Y496 HydrophobicContact CB-CE2 4.02Å; L450-Y496 HydrophobicContact CB-CG 3.97Å; L450-Y496 HydrophobicContact CD1-CD2 3.99Å
451	S	83.8	Confident	86.4	Confident	35 Å²	35	40.7 Å²	40.7	25%	0.245	21%	0.21	C	C	.	.			trans	-108.5	164.7	168.3	61.4	0	0	0	0	110.4	E453 E454	S451-E453 PolarHBondContact O-N 3.08Å; S451-E454 PolarHBondContact O-N 3.41Å; S451-E454 WeakPolarHBondContact OG-CG 3.37Å
452	H	78.7	Confident	86.4	Confident	130 Å²	130	40.8 Å²	40.8	60%	0.602	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-65.4	-22.2	176.7	-69.2	-81.6	0	0	0	113.3	E454 Y496	H452-E454 VanDerWaalsContact C-N 3.28Å; H452-E454 PolarHBondContact O-N 3.47Å; H452-Y496 AromaticContact CD2-CE1 3.9Å; H452-Y496 AromaticContact CE1-CD1 3.74Å; H452-Y496 AromaticContact CE1-CE1 3.75Å; H452-Y496 AromaticContact CG-CD1 3.95Å; H452-Y496 AromaticContact ND1-CD1 3.72Å; H452-Y496 AromaticContact NE2-CD1 3.95Å; H452-Y496 AromaticContact NE2-CE1 3.56Å
453	E	77.7	Confident	86.3	Confident	180 Å²	180	43.5 Å²	43.5	84%	0.841	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-67.7	-26.7	171.7	-57.5	175.5	154.8	0	0	112.5	S451 S455	S451-E453 PolarHBondContact O-N 3.08Å; E453-S455 PolarHBondContact O-N 3.45Å
454	E	83.9	Confident	86.3	Confident	38 Å²	38	42.5 Å²	42.5	18%	0.178	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-88.6	30.4	-174.1	-70.9	173.4	-178.8	0	0	113	K417 S451 H452 E456 L457 A458	K417-E454 WeakPolarHBondContact CD-OE1 3.31Å; K417-E454 VanDerWaalsContact CD-OE2 3.31Å; K417-E454 WeakPolarHBondContact CD-OE2 3.33Å; K417-E454 WeakPolarHBondContact CE-OE1 3.4Å; K417-E454 IonicContact NZ-OE1 2.74Å; K417-E454 PolarHBondContact NZ-OE1 2.95Å; K417-E454 IonicContact NZ-OE2 2.87Å; K417-E454 PolarHBondContact NZ-OE2 3.38Å; S451-E454 PolarHBondContact O-N 3.41Å; S451-E454 WeakPolarHBondContact OG-CG 3.37Å; H452-E454 VanDerWaalsContact C-N 3.28Å; H452-E454 PolarHBondContact O-N 3.47Å; E454-E456 VanDerWaalsContact C-N 3.27Å; E454-E456 PolarHBondContact O-N 3.36Å; E454-L457 HydrophobicContact CB-CB 4.24Å; E454-L457 WeakPolarHBondContact O-CA 3.18Å; E454-L457 WeakPolarHBondContact O-CB 3.34Å; E454-L457 PolarHBondContact O-N 3.09Å; E454-A458 PolarHBondContact O-N 3.38Å
455	S	84.1	Confident	86.3	Confident	19 Å²	19	42.6 Å²	42.6	13%	0.133	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-34.5	-174.1	73.3	0	0	0	0	113.6	E453 L457 A458 N459 Y496 Q498	E453-S455 PolarHBondContact O-N 3.45Å; S455-L457 VanDerWaalsContact C-N 3.31Å; S455-L457 PolarHBondContact O-N 3.01Å; S455-A458 PolarHBondContact O-N 3.03Å; S455-N459 WeakPolarHBondContact O-CB 3.31Å; S455-N459 PolarHBondContact O-N 3.42Å; S455-N459 PolarHBondContact O-ND2 3.46Å; S455-Y496 VanDerWaalsContact CA-O 3.25Å; S455-Y496 WeakPolarHBondContact CA-O 3.42Å; S455-Y496 VanDerWaalsContact CB-O 3.3Å; S455-Y496 WeakPolarHBondContact CB-O 3.49Å; S455-Q498 PolarHBondContact OG-OE1 3.38Å
456	E	85.9	Confident	86.1	Confident	131 Å²	131	43 Å²	43	61%	0.612	22%	0.222	S	C	*	.	H	α-helix	trans	-59.8	-37.6	170.2	-94.5	-155.3	-139.9	0	0	113.2	E454 K460	E454-E456 VanDerWaalsContact C-N 3.27Å; E454-E456 PolarHBondContact O-N 3.36Å; E456-K460 WeakPolarHBondContact O-CD 3.46Å; E456-K460 WeakPolarHBondContact O-CE 3.27Å; E456-K460 WeakPolarHBondContact O-CG 3.39Å; E456-K460 PolarHBondContact O-N 3.35Å; E456-K460 IonicContact OE2-NZ 2.66Å; E456-K460 PolarHBondContact OE2-NZ 3.08Å
457	L	86.8	Confident	86	Confident	14 Å²	14	45 Å²	45	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-75.5	-42.9	179.9	-179.1	60.7	0	0	0	110.6	K417 C421 M448 L450 E454 S455 N459 K460 L461	K417-L457 HydrophobicContact CB-CD2 3.74Å; K417-L457 HydrophobicContact CD-CD2 4.32Å; C421-L457 HydrophobicContact CB-CD1 3.8Å; M448-L457 HydrophobicContact CE-CD2 4.12Å; L450-L457 HydrophobicContact CD2-CD2 3.88Å; L450-L457 HydrophobicContact CD2-CG 4.07Å; E454-L457 HydrophobicContact CB-CB 4.24Å; E454-L457 WeakPolarHBondContact O-CA 3.18Å; E454-L457 WeakPolarHBondContact O-CB 3.34Å; E454-L457 PolarHBondContact O-N 3.09Å; S455-L457 VanDerWaalsContact C-N 3.31Å; S455-L457 PolarHBondContact O-N 3.01Å; L457-N459 VanDerWaalsContact C-N 3.34Å; L457-N459 PolarHBondContact O-N 3.21Å; L457-K460 PolarHBondContact O-N 3.41Å; L457-K460 VanDerWaalsContact O-N 3.1Å; L457-L461 HydrophobicContact CD1-CG 4.5Å; L457-L461 HydrophobicContact CG-CD1 4.23Å; L457-L461 WeakPolarHBondContact O-CG 3.32Å; L457-L461 PolarHBondContact O-N 3.1Å
458	A	87.9	Confident	85.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.6	-46.9	172.3	0	0	0	0	0	111.6	L450 E454 S455 K460 L461 I462	L450-A458 HydrophobicContact CD1-CB 4.33Å; E454-A458 PolarHBondContact O-N 3.38Å; S455-A458 PolarHBondContact O-N 3.03Å; A458-K460 VanDerWaalsContact C-N 3.3Å; A458-K460 PolarHBondContact O-N 3.42Å; A458-L461 PolarHBondContact O-N 3.34Å; A458-I462 VanDerWaalsContact O-CG1 3.31Å; A458-I462 WeakPolarHBondContact O-CG1 3.43Å; A458-I462 PolarHBondContact O-N 3.25Å
459	N	87.8	Confident	86	Confident	25 Å²	25	43 Å²	43	13%	0.134	23%	0.227	C	C	.	.	H	α-helix	trans	-57.2	-38	173.9	-85.5	-30.9	0	0	0	113.2	S455 L457 T463 T499 G500	S455-N459 WeakPolarHBondContact O-CB 3.31Å; S455-N459 PolarHBondContact O-N 3.42Å; S455-N459 PolarHBondContact O-ND2 3.46Å; L457-N459 VanDerWaalsContact C-N 3.34Å; L457-N459 PolarHBondContact O-N 3.21Å; N459-T463 PolarHBondContact O-N 3.46Å; N459-T463 PolarHBondContact O-OG1 3.06Å; N459-T499 WeakPolarHBondContact ND2-CB 3.16Å; N459-T499 PolarHBondContact ND2-OG1 3.46Å; N459-T499 WeakPolarHBondContact OD1-CA 3.49Å; N459-T499 WeakPolarHBondContact OD1-CB 3.22Å; N459-T499 PolarHBondContact OD1-N 3.07Å; N459-G500 PolarHBondContact OD1-N 2.99Å
460	K	87.7	Confident	86.1	Confident	102 Å²	102	44.3 Å²	44.3	44%	0.443	22%	0.218	S	C	.	.	H	α-helix	trans	-71	-47.7	176.4	-70.8	157.9	-163.6	162.8	0	111.3	E456 L457 A458 I462 T463 I464	E456-K460 WeakPolarHBondContact O-CD 3.46Å; E456-K460 WeakPolarHBondContact O-CE 3.27Å; E456-K460 WeakPolarHBondContact O-CG 3.39Å; E456-K460 PolarHBondContact O-N 3.35Å; E456-K460 IonicContact OE2-NZ 2.66Å; E456-K460 PolarHBondContact OE2-NZ 3.08Å; L457-K460 PolarHBondContact O-N 3.41Å; L457-K460 VanDerWaalsContact O-N 3.1Å; A458-K460 VanDerWaalsContact C-N 3.3Å; A458-K460 PolarHBondContact O-N 3.42Å; K460-I462 PolarHBondContact O-N 3.44Å; K460-T463 WeakPolarHBondContact O-CB 3.46Å; K460-T463 PolarHBondContact O-N 3.36Å; K460-T463 VanDerWaalsContact O-N 3.12Å; K460-I464 WeakPolarHBondContact O-CG1 3.24Å; K460-I464 PolarHBondContact O-N 3.14Å
461	L	89.7	Confident	86.2	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-56.7	-48.7	176.9	-72.3	170.4	0	0	0	112.2	L445 L450 L457 A458 T463 I464 Y465	L445-L461 HydrophobicContact CB-CD2 4.15Å; L445-L461 HydrophobicContact CD1-CD2 4.27Å; L445-L461 HydrophobicContact CD2-CD2 3.92Å; L445-L461 HydrophobicContact CG-CD2 4.33Å; L450-L461 HydrophobicContact CD1-CD1 4.02Å; L450-L461 HydrophobicContact CD2-CD1 3.89Å; L450-L461 HydrophobicContact CG-CD1 4.44Å; L457-L461 HydrophobicContact CD1-CG 4.5Å; L457-L461 HydrophobicContact CG-CD1 4.23Å; L457-L461 WeakPolarHBondContact O-CG 3.32Å; L457-L461 PolarHBondContact O-N 3.1Å; A458-L461 PolarHBondContact O-N 3.34Å; L461-T463 VanDerWaalsContact C-N 3.26Å; L461-T463 PolarHBondContact O-N 2.92Å; L461-I464 WeakPolarHBondContact O-CB 3.39Å; L461-I464 PolarHBondContact O-N 2.94Å; L461-I464 VanDerWaalsContact O-N 3.11Å; L461-Y465 HydrophobicContact CB-CD2 4.42Å; L461-Y465 HydrophobicContact CB-CE2 3.93Å; L461-Y465 VanDerWaalsContact O-CD2 3.23Å; L461-Y465 WeakPolarHBondContact O-CD2 3.45Å; L461-Y465 VanDerWaalsContact O-CG 3.29Å; L461-Y465 PolarHBondContact O-N 3.02Å
462	I	89.2	Confident	86.1	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-37.6	177	-68.3	167.5	0	0	0	111.6	A458 K460 Y465 F466 A493 Y494 S497	A458-I462 VanDerWaalsContact O-CG1 3.31Å; A458-I462 WeakPolarHBondContact O-CG1 3.43Å; A458-I462 PolarHBondContact O-N 3.25Å; K460-I462 PolarHBondContact O-N 3.44Å; I462-Y465 PolarHBondContact O-N 3.35Å; I462-F466 HydrophobicContact CG2-CD2 3.57Å; I462-F466 HydrophobicContact CG2-CE2 3.52Å; I462-F466 WeakPolarHBondContact O-CD2 3.46Å; I462-F466 PolarHBondContact O-N 3.43Å; I462-A493 HydrophobicContact CD1-CB 4.09Å; I462-A493 HydrophobicContact CG1-CB 3.71Å; I462-Y494 HydrophobicContact CD1-CD2 4.47Å; I462-S497 WeakPolarHBondContact CD1-OG 3.29Å
463	T	88.6	Confident	86.2	Confident	59 Å²	59	40.4 Å²	40.4	36%	0.362	20%	0.2	S	C	.	.	H	α-helix	trans	-65.4	-41.9	176.2	-54.2	0	0	0	0	111.4	N459 K460 L461 C467 K503	N459-T463 PolarHBondContact O-N 3.46Å; N459-T463 PolarHBondContact O-OG1 3.06Å; K460-T463 WeakPolarHBondContact O-CB 3.46Å; K460-T463 PolarHBondContact O-N 3.36Å; K460-T463 VanDerWaalsContact O-N 3.12Å; L461-T463 VanDerWaalsContact C-N 3.26Å; L461-T463 PolarHBondContact O-N 2.92Å; T463-C467 WeakPolarHBondContact O-CB 3.44Å; T463-C467 PolarHBondContact O-N 2.9Å; T463-C467 VanDerWaalsContact O-N 3.09Å; T463-K503 PolarHBondContact OG1-NZ 2.83Å
464	I	89.4	Confident	86.5	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-52.3	174.2	-65	165	0	0	0	109.8	E425 L428 L445 K460 L461 F466 C467 F468	E425-I464 HydrophobicContact CB-CD1 3.99Å; E425-I464 HydrophobicContact CG-CD1 3.93Å; E425-I464 HydrophobicContact CG-CG1 4.21Å; L428-I464 HydrophobicContact CD1-CG2 4.04Å; L445-I464 HydrophobicContact CD1-CG2 4.49Å; K460-I464 WeakPolarHBondContact O-CG1 3.24Å; K460-I464 PolarHBondContact O-N 3.14Å; L461-I464 WeakPolarHBondContact O-CB 3.39Å; L461-I464 PolarHBondContact O-N 2.94Å; L461-I464 VanDerWaalsContact O-N 3.11Å; I464-F466 PolarHBondContact O-N 3.24Å; I464-C467 WeakPolarHBondContact O-CB 3.39Å; I464-C467 PolarHBondContact O-N 3.05Å; I464-C467 VanDerWaalsContact O-N 3.09Å; I464-F468 HydrophobicContact CG2-CD2 3.99Å; I464-F468 HydrophobicContact CG2-CE2 4.22Å; I464-F468 WeakPolarHBondContact O-CD2 3.43Å; I464-F468 PolarHBondContact O-N 3.25Å
465	Y	90.3	Very high	86.4	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-57.8	-45.8	-178.5	-62.7	-40.9	0	0	0	112.2	I442 L445 N446 L461 I462 C467 F468 F469 L486 G489 V490 A493	I442-Y465 HydrophobicContact CG2-CE1 4.43Å; L445-Y465 HydrophobicContact CB-CE1 4.07Å; L445-Y465 WeakPolarHBondContact CB-OH 3.48Å; L445-Y465 HydrophobicContact CD1-CE1 4.41Å; L445-Y465 PolarHBondContact O-OH 2.99Å; N446-Y465 PolarHBondContact N-OH 3.1Å; N446-Y465 PolarHBondContact OD1-OH 3.44Å; L461-Y465 HydrophobicContact CB-CD2 4.42Å; L461-Y465 HydrophobicContact CB-CE2 3.93Å; L461-Y465 VanDerWaalsContact O-CD2 3.23Å; L461-Y465 WeakPolarHBondContact O-CD2 3.45Å; L461-Y465 VanDerWaalsContact O-CG 3.29Å; L461-Y465 PolarHBondContact O-N 3.02Å; I462-Y465 PolarHBondContact O-N 3.35Å; Y465-C467 PolarHBondContact O-N 3.14Å; Y465-F468 PolarHBondContact O-N 3.46Å; Y465-F469 WeakPolarHBondContact O-CB 3.44Å; Y465-F469 PolarHBondContact O-N 3.12Å; Y465-L486 HydrophobicContact CD1-CD2 3.85Å; Y465-L486 HydrophobicContact CG-CD2 4.44Å; Y465-G489 VanDerWaalsContact CE2-O 3.24Å; Y465-G489 WeakPolarHBondContact CE2-O 3.43Å; Y465-V490 HydrophobicContact CD2-CG2 3.92Å; Y465-V490 HydrophobicContact CG-CG2 4.12Å; Y465-A493 HydrophobicContact CE2-CB 4.35Å
466	F	88.2	Confident	85.8	Confident	10 Å²	10	51.7 Å²	51.7	4%	0.044	24%	0.243	C	C	.	.	H	α-helix	trans	-69	-30.6	176.6	-76.9	-54.3	0	0	0	113.7	I462 I464 F468 F469 R470 V490 V504 Q507 L529	I462-F466 HydrophobicContact CG2-CD2 3.57Å; I462-F466 HydrophobicContact CG2-CE2 3.52Å; I462-F466 WeakPolarHBondContact O-CD2 3.46Å; I462-F466 PolarHBondContact O-N 3.43Å; I464-F466 PolarHBondContact O-N 3.24Å; F466-F468 VanDerWaalsContact C-N 3.34Å; F466-F469 HydrophobicContact CD1-CB 4.43Å; F466-F469 HydrophobicContact CD1-CD1 4.13Å; F466-F469 HydrophobicContact CD1-CG 4.41Å; F466-F469 PolarHBondContact O-N 3.36Å; F466-R470 WeakPolarHBondContact O-CB 3.49Å; F466-R470 VanDerWaalsContact O-CG 3.27Å; F466-R470 WeakPolarHBondContact O-CG 3.28Å; F466-R470 PolarHBondContact O-N 3.21Å; F466-V490 HydrophobicContact CE1-CG2 4.47Å; F466-V490 HydrophobicContact CE2-CG1 4.13Å; F466-V490 HydrophobicContact CZ-CG1 3.85Å; F466-V490 HydrophobicContact CZ-CG2 4.33Å; F466-V504 HydrophobicContact CE2-CB 4.25Å; F466-V504 HydrophobicContact CE2-CG2 3.6Å; F466-V504 HydrophobicContact CZ-CB 4.22Å; F466-V504 HydrophobicContact CZ-CG1 4.05Å; F466-V504 HydrophobicContact CZ-CG2 3.87Å; F466-Q507 HydrophobicContact CD1-CB 4.17Å; F466-Q507 HydrophobicContact CD1-CG 3.79Å; F466-Q507 HydrophobicContact CE1-CB 3.92Å; F466-Q507 HydrophobicContact CE1-CG 4.04Å; F466-Q507 HydrophobicContact CG-CG 4.18Å; F466-Q507 HydrophobicContact CZ-CB 4.44Å; F466-L529 HydrophobicContact CZ-CD2 4.29Å
467	C	87.8	Confident	85.2	Confident	50 Å²	50	48.4 Å²	48.4	34%	0.338	23%	0.23	S	C	.	.	H	α-helix	trans	-63.3	-42.1	173	-165.7	0	0	0	0	111.5	F429 T463 I464 Y465 T471	F429-C467 HydrophobicContact CZ-CB 4.24Å; T463-C467 WeakPolarHBondContact O-CB 3.44Å; T463-C467 PolarHBondContact O-N 2.9Å; T463-C467 VanDerWaalsContact O-N 3.09Å; I464-C467 WeakPolarHBondContact O-CB 3.39Å; I464-C467 PolarHBondContact O-N 3.05Å; I464-C467 VanDerWaalsContact O-N 3.09Å; Y465-C467 PolarHBondContact O-N 3.14Å; C467-T471 PolarHBondContact O-N 3.13Å; C467-T471 PolarHBondContact O-OG1 3.44Å
468	F	86.2	Confident	84	Confident	11 Å²	11	48.9 Å²	48.9	5%	0.048	23%	0.233	C	C	.	.	H	α-helix	trans	-71.8	-40.4	174.6	-80.5	-82	0	0	0	112.5	L428 F429 I464 Y465 F466 R470 T471 C472 L486	L428-F468 HydrophobicContact CB-CE2 3.88Å; L428-F468 HydrophobicContact CB-CZ 3.7Å; L428-F468 HydrophobicContact CD1-CE2 4.37Å; F429-F468 HydrophobicContact CD1-CE2 4.07Å; F429-F468 AromaticContact CD1-CZ 3.87Å; F429-F468 HydrophobicContact CD1-CZ 3.87Å; F429-F468 AromaticContact CE1-CE2 3.65Å; F429-F468 HydrophobicContact CE1-CE2 3.65Å; F429-F468 AromaticContact CE1-CZ 3.86Å; F429-F468 HydrophobicContact CE1-CZ 3.86Å; F429-F468 HydrophobicContact CE2-CE2 4.23Å; F429-F468 HydrophobicContact CG-CZ 4.39Å; F429-F468 AromaticContact CZ-CE2 3.74Å; F429-F468 HydrophobicContact CZ-CE2 3.74Å; F429-F468 HydrophobicContact CZ-CZ 4.38Å; I464-F468 HydrophobicContact CG2-CD2 3.99Å; I464-F468 HydrophobicContact CG2-CE2 4.22Å; I464-F468 WeakPolarHBondContact O-CD2 3.43Å; I464-F468 PolarHBondContact O-N 3.25Å; Y465-F468 PolarHBondContact O-N 3.46Å; F466-F468 VanDerWaalsContact C-N 3.34Å; F468-R470 PolarHBondContact O-N 3.05Å; F468-T471 CarbonylContact O-C 3.57Å; F468-T471 WeakPolarHBondContact O-CA 3.43Å; F468-T471 VanDerWaalsContact O-CB 3.29Å; F468-T471 WeakPolarHBondContact O-CB 3.33Å; F468-T471 PolarHBondContact O-N 3.28Å; F468-C472 PolarHBondContact O-N 3.41Å; F468-C472 PolarHBondContact O-SG 2.82Å; F468-L486 HydrophobicContact CB-CD1 4.06Å; F468-L486 HydrophobicContact CB-CD2 3.91Å
469	F	86.4	Confident	82.5	Confident	3 Å²	3	56.8 Å²	56.8	1%	0.013	27%	0.27	C	S	.	.	H	α-helix	trans	-55	-49.6	172.9	179.4	-99	0	0	0	112.3	Y465 F466 T471 C472 I473 L483 L487 L511 V514	Y465-F469 WeakPolarHBondContact O-CB 3.44Å; Y465-F469 PolarHBondContact O-N 3.12Å; F466-F469 HydrophobicContact CD1-CB 4.43Å; F466-F469 HydrophobicContact CD1-CD1 4.13Å; F466-F469 HydrophobicContact CD1-CG 4.41Å; F466-F469 PolarHBondContact O-N 3.36Å; F469-T471 PolarHBondContact O-N 2.72Å; F469-C472 PolarHBondContact O-N 3.32Å; F469-I473 HydrophobicContact CD1-CD1 3.79Å; F469-I473 HydrophobicContact CE1-CD1 3.44Å; F469-I473 VanDerWaalsContact CE1-CD1 3.44Å; F469-I473 HydrophobicContact CE2-CD1 4.33Å; F469-I473 HydrophobicContact CG-CD1 4.38Å; F469-I473 HydrophobicContact CZ-CD1 3.74Å; F469-I473 WeakPolarHBondContact O-CG1 3.29Å; F469-I473 PolarHBondContact O-N 3.43Å; F469-L483 HydrophobicContact CD2-CD1 3.52Å; F469-L483 HydrophobicContact CE2-CD1 3.73Å; F469-L487 HydrophobicContact CE2-CD2 4.11Å; F469-L487 HydrophobicContact CE2-CG 4.43Å; F469-L511 HydrophobicContact CE1-CD2 4.45Å; F469-L511 HydrophobicContact CE2-CD2 4.09Å; F469-L511 HydrophobicContact CZ-CD2 3.66Å; F469-L511 HydrophobicContact CZ-CG 4.18Å; F469-V514 HydrophobicContact CE2-CG2 4.41Å; F469-V514 HydrophobicContact CZ-CG2 4.02Å
470	R	84.9	Confident	81.6	Confident	93 Å²	93	56.5 Å²	56.5	35%	0.351	27%	0.27	S	S	.	.	H	α-helix	trans	-56.4	-34.7	172.4	-74	174.9	176.5	-173	-3.6	112.1	F466 F468 K474 E506 Q507	F466-R470 WeakPolarHBondContact O-CB 3.49Å; F466-R470 VanDerWaalsContact O-CG 3.27Å; F466-R470 WeakPolarHBondContact O-CG 3.28Å; F466-R470 PolarHBondContact O-N 3.21Å; F468-R470 PolarHBondContact O-N 3.05Å; R470-K474 WeakPolarHBondContact O-CB 3.43Å; R470-K474 VanDerWaalsContact O-CG 3.25Å; R470-K474 WeakPolarHBondContact O-CG 3.44Å; R470-K474 PolarHBondContact O-N 2.88Å; R470-K474 VanDerWaalsContact O-N 3.15Å; R470-E506 IonicContact CZ-OE2 3.76Å; R470-E506 IonicContact NH1-OE2 2.73Å; R470-E506 PolarHBondContact NH1-OE2 3.26Å; R470-E506 IonicContact NH2-OE2 2.67Å; R470-E506 PolarHBondContact NH2-OE2 2.91Å; R470-Q507 VanDerWaalsContact NE-CD 3.25Å; R470-Q507 VanDerWaalsContact NH2-CD 3.26Å
471	T	85.1	Confident	81.2	Confident	49 Å²	49	58.4 Å²	58.4	30%	0.301	28%	0.278	S	S	.	.	H	α-helix	trans	-75.9	-40.3	179.6	-58.9	0	0	0	0	112.3	C467 F468 F469 K474 K475	C467-T471 PolarHBondContact O-N 3.13Å; C467-T471 PolarHBondContact O-OG1 3.44Å; F468-T471 CarbonylContact O-C 3.57Å; F468-T471 WeakPolarHBondContact O-CA 3.43Å; F468-T471 VanDerWaalsContact O-CB 3.29Å; F468-T471 WeakPolarHBondContact O-CB 3.33Å; F468-T471 PolarHBondContact O-N 3.28Å; F469-T471 PolarHBondContact O-N 2.72Å; T471-K474 PolarHBondContact O-N 3.5Å; T471-K475 HydrophobicContact CG2-CD 4.36Å; T471-K475 WeakPolarHBondContact O-CB 3.42Å; T471-K475 WeakPolarHBondContact O-CG 3.46Å; T471-K475 PolarHBondContact O-N 3.25Å
472	C	81.5	Confident	81	Confident	4 Å²	4	59 Å²	59	3%	0.027	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-47.4	173.9	-61.5	0	0	0	0	111.3	F468 F469 K474 K475 K476 D477	F468-C472 PolarHBondContact O-N 3.41Å; F468-C472 PolarHBondContact O-SG 2.82Å; F469-C472 PolarHBondContact O-N 3.32Å; C472-K474 PolarHBondContact O-N 2.87Å; C472-K475 CarbonylContact O-C 3.58Å; C472-K475 PolarHBondContact O-N 3.05Å; C472-K476 PolarHBondContact O-N 2.98Å; C472-D477 PolarHBondContact O-N 3.17Å
473	I	82.1	Confident	80.8	Confident	51 Å²	51	59 Å²	59	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-45	176.4	-65.5	169.9	0	0	0	111	F469 K475 K476 V514	F469-I473 HydrophobicContact CD1-CD1 3.79Å; F469-I473 HydrophobicContact CE1-CD1 3.44Å; F469-I473 VanDerWaalsContact CE1-CD1 3.44Å; F469-I473 HydrophobicContact CE2-CD1 4.33Å; F469-I473 HydrophobicContact CG-CD1 4.38Å; F469-I473 HydrophobicContact CZ-CD1 3.74Å; F469-I473 WeakPolarHBondContact O-CG1 3.29Å; F469-I473 PolarHBondContact O-N 3.43Å; I473-K475 VanDerWaalsContact C-N 3.31Å; I473-K475 PolarHBondContact O-N 3.01Å; I473-K476 PolarHBondContact O-N 3.03Å; I473-V514 HydrophobicContact CD1-CG2 3.75Å; I473-V514 HydrophobicContact CG1-CG2 4.09Å
474	K	84.2	Confident	80.7	Confident	177 Å²	177	57.5 Å²	57.5	77%	0.77	27%	0.273	S	S	*	.	H	α-helix	trans	-61.7	-35.8	175.9	-78.4	173.8	179.9	-178.5	0	113.1	R470 T471 C472 K476	R470-K474 WeakPolarHBondContact O-CB 3.43Å; R470-K474 VanDerWaalsContact O-CG 3.25Å; R470-K474 WeakPolarHBondContact O-CG 3.44Å; R470-K474 PolarHBondContact O-N 2.88Å; R470-K474 VanDerWaalsContact O-N 3.15Å; T471-K474 PolarHBondContact O-N 3.5Å; C472-K474 PolarHBondContact O-N 2.87Å; K474-K476 VanDerWaalsContact C-N 3.26Å; K474-K476 PolarHBondContact O-N 3.16Å
475	K	80	Confident	80.6	Confident	121 Å²	121	57.8 Å²	57.8	53%	0.526	28%	0.275	S	S	.	.	H	α-helix	trans	-75.7	-9.6	174.2	-72.7	177.9	176.9	-177.8	0	113.7	T471 C472 I473 D477	T471-K475 HydrophobicContact CG2-CD 4.36Å; T471-K475 WeakPolarHBondContact O-CB 3.42Å; T471-K475 WeakPolarHBondContact O-CG 3.46Å; T471-K475 PolarHBondContact O-N 3.25Å; C472-K475 CarbonylContact O-C 3.58Å; C472-K475 PolarHBondContact O-N 3.05Å; I473-K475 VanDerWaalsContact C-N 3.31Å; I473-K475 PolarHBondContact O-N 3.01Å; K475-D477 HydrophobicContact CB-CB 4.15Å; K475-D477 PolarHBondContact O-N 2.73Å
476	K	72.8	Confident	80.5	Confident	175 Å²	175	57.7 Å²	57.7	76%	0.761	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	23	-167.7	-57.1	-175.9	178.1	-178	0	114.3	C472 I473 K474 I478	C472-K476 PolarHBondContact O-N 2.98Å; I473-K476 PolarHBondContact O-N 3.03Å; K474-K476 VanDerWaalsContact C-N 3.26Å; K474-K476 PolarHBondContact O-N 3.16Å; K476-I478 PolarHBondContact O-N 3.4Å
477	D	72.5	Confident	80.5	Confident	62 Å²	62	57.2 Å²	57.2	33%	0.332	27%	0.273	S	S	.	.			trans	-84.1	56.8	-178.6	-166.2	12.9	0	0	0	111	C472 K475 S480	C472-D477 PolarHBondContact O-N 3.17Å; K475-D477 HydrophobicContact CB-CB 4.15Å; K475-D477 PolarHBondContact O-N 2.73Å; D477-S480 PolarHBondContact O-OG 2.85Å; D477-S480 WeakPolarHBondContact OD1-CB 3.4Å
478	I	61.4	Low	80.5	Confident	25 Å²	25	55.7 Å²	55.7	13%	0.128	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-24.3	-159.9	-68	165.7	0	0	0	112.6	K476 L483 M517 V518	K476-I478 PolarHBondContact O-N 3.4Å; I478-L483 WeakPolarHBondContact O-CD2 3.44Å; I478-M517 HydrophobicContact CD1-CE 3.73Å; I478-M517 HydrophobicContact CD1-SD 4.35Å; I478-M517 HydrophobicContact CG2-CB 3.97Å; I478-V518 HydrophobicContact CG2-CG2 3.66Å
479	E	57.4	Low	80.6	Confident	166 Å²	166	55.2 Å²	55.2	78%	0.776	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	2.5	178.2	-66.6	172	-171	0	0	113
480	S	67.5	Low	80.7	Confident	19 Å²	19	55.2 Å²	55.2	13%	0.133	26%	0.261	C	S	.	.			trans	-65.3	140.1	-173	59.8	0	0	0	0	113.6	D477 M482 L483	D477-S480 PolarHBondContact O-OG 2.85Å; D477-S480 WeakPolarHBondContact OD1-CB 3.4Å; S480-M482 PolarHBondContact O-N 3.34Å; S480-L483 WeakPolarHBondContact O-CB 3.41Å; S480-L483 PolarHBondContact O-N 3.43Å; S480-L483 PolarHBondContact OG-N 3.25Å
481	K	81.2	Confident	80.8	Confident	142 Å²	142	51.6 Å²	51.6	62%	0.617	25%	0.248	S	C	*	.	H	α-helix	trans	-53.7	-27.6	168.8	-62.1	-166.3	178.3	-167.5	0	111.4	Y439 L483 S484 A485 E909	Y439-K481 HydrophobicContact CE2-CB 3.85Å; K481-L483 PolarHBondContact O-N 3.35Å; K481-S484 PolarHBondContact O-N 2.95Å; K481-A485 PolarHBondContact O-N 3.36Å; K481-A485 VanDerWaalsContact O-N 3.12Å; K481-E909 IonicContact NZ-OE1 3.97Å
482	M	83.6	Confident	80.9	Confident	12 Å²	12	53.9 Å²	53.9	6%	0.059	25%	0.251	C	S	.	.	H	α-helix	trans	-60.4	-37	171.7	176.3	173	49.1	0	0	113.9	Y439 I442 S480 A485 L486	Y439-M482 HydrophobicContact CD2-CB 4.24Å; I442-M482 HydrophobicContact CD1-CG 3.92Å; I442-M482 HydrophobicContact CD1-SD 4.16Å; S480-M482 PolarHBondContact O-N 3.34Å; M482-A485 PolarHBondContact O-N 2.91Å; M482-L486 HydrophobicContact CG-CD1 4.09Å; M482-L486 HydrophobicContact CG-CG 4.44Å; M482-L486 WeakPolarHBondContact O-CB 3.38Å; M482-L486 VanDerWaalsContact O-CG 3.25Å; M482-L486 WeakPolarHBondContact O-CG 3.47Å; M482-L486 PolarHBondContact O-N 3.17Å
483	L	85.3	Confident	81.2	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-69.2	-39	179.4	-172.9	64	0	0	0	112.2	F469 I478 S480 K481 L487 V514 V518 T522	F469-L483 HydrophobicContact CD2-CD1 3.52Å; F469-L483 HydrophobicContact CE2-CD1 3.73Å; I478-L483 WeakPolarHBondContact O-CD2 3.44Å; S480-L483 WeakPolarHBondContact O-CB 3.41Å; S480-L483 PolarHBondContact O-N 3.43Å; S480-L483 PolarHBondContact OG-N 3.25Å; K481-L483 PolarHBondContact O-N 3.35Å; L483-L487 HydrophobicContact CG-CD1 4.35Å; L483-L487 WeakPolarHBondContact O-CG 3.47Å; L483-L487 PolarHBondContact O-N 3.48Å; L483-L487 VanDerWaalsContact O-N 3.1Å; L483-V514 HydrophobicContact CD2-CG1 3.97Å; L483-V518 HydrophobicContact CD2-CG2 3.69Å; L483-T522 HydrophobicContact CG-CG2 4.4Å
484	S	86.3	Confident	81.4	Confident	29 Å²	29	52 Å²	52	20%	0.203	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-47.4	172.6	176.9	0	0	0	0	111.2	K481 L486 L487 T488 Q525	K481-S484 PolarHBondContact O-N 2.95Å; S484-L486 PolarHBondContact O-N 2.61Å; S484-L487 PolarHBondContact O-N 3.04Å; S484-L487 VanDerWaalsContact O-N 3.09Å; S484-T488 PolarHBondContact O-N 3.01Å; S484-T488 PolarHBondContact O-OG1 2.92Å; S484-Q525 PolarHBondContact OG-OE1 3.16Å
485	A	87.8	Confident	81.5	Confident	9 Å²	9	45.9 Å²	45.9	7%	0.074	22%	0.219	C	C	.	.	H	α-helix	trans	-58.7	-44.6	176.3	0	0	0	0	0	112.4	Y439 I442 N446 K481 M482 L487 T488 G489	Y439-A485 HydrophobicContact CE2-CB 4.19Å; I442-A485 HydrophobicContact CG2-CB 4.03Å; N446-A485 PolarHBondContact ND2-O 2.74Å; N446-A485 PolarHBondContact OD1-O 2.96Å; K481-A485 PolarHBondContact O-N 3.36Å; K481-A485 VanDerWaalsContact O-N 3.12Å; M482-A485 PolarHBondContact O-N 2.91Å; A485-L487 VanDerWaalsContact C-N 3.29Å; A485-L487 PolarHBondContact O-N 3.28Å; A485-T488 PolarHBondContact O-N 2.98Å; A485-G489 PolarHBondContact O-N 3.41Å
486	L	89.4	Confident	81.8	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-38.2	175	-73.9	169.8	0	0	0	112.3	I442 Y465 F468 M482 S484 G489 V490	I442-L486 HydrophobicContact CD1-CD2 3.86Å; I442-L486 HydrophobicContact CD1-CG 4.21Å; I442-L486 HydrophobicContact CG1-CD2 4.23Å; I442-L486 HydrophobicContact CG2-CD2 4.03Å; I442-L486 HydrophobicContact CG2-CG 4.35Å; Y465-L486 HydrophobicContact CD1-CD2 3.85Å; Y465-L486 HydrophobicContact CG-CD2 4.44Å; F468-L486 HydrophobicContact CB-CD1 4.06Å; F468-L486 HydrophobicContact CB-CD2 3.91Å; M482-L486 HydrophobicContact CG-CD1 4.09Å; M482-L486 HydrophobicContact CG-CG 4.44Å; M482-L486 WeakPolarHBondContact O-CB 3.38Å; M482-L486 VanDerWaalsContact O-CG 3.25Å; M482-L486 WeakPolarHBondContact O-CG 3.47Å; M482-L486 PolarHBondContact O-N 3.17Å; S484-L486 PolarHBondContact O-N 2.61Å; L486-G489 PolarHBondContact O-N 3.01Å; L486-V490 WeakPolarHBondContact O-CG2 3.2Å; L486-V490 PolarHBondContact O-N 3.1Å; L486-V490 VanDerWaalsContact O-N 3.08Å
487	L	87.8	Confident	82.3	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-74.1	-38.8	-179.5	-76.3	166.3	0	0	0	113.1	F469 L483 S484 A485 G489 V490 N491 L511 T522 Q525 A526 L529	F469-L487 HydrophobicContact CE2-CD2 4.11Å; F469-L487 HydrophobicContact CE2-CG 4.43Å; L483-L487 HydrophobicContact CG-CD1 4.35Å; L483-L487 WeakPolarHBondContact O-CG 3.47Å; L483-L487 PolarHBondContact O-N 3.48Å; L483-L487 VanDerWaalsContact O-N 3.1Å; S484-L487 PolarHBondContact O-N 3.04Å; S484-L487 VanDerWaalsContact O-N 3.09Å; A485-L487 VanDerWaalsContact C-N 3.29Å; A485-L487 PolarHBondContact O-N 3.28Å; L487-G489 VanDerWaalsContact C-N 3.34Å; L487-V490 PolarHBondContact O-N 3.17Å; L487-N491 PolarHBondContact O-N 2.77Å; L487-N491 PolarHBondContact O-ND2 3.34Å; L487-L511 HydrophobicContact CD2-CD2 3.64Å; L487-T522 HydrophobicContact CD1-CG2 3.54Å; L487-Q525 HydrophobicContact CB-CB 4.2Å; L487-A526 HydrophobicContact CD1-CB 4.23Å; L487-L529 HydrophobicContact CD2-CD2 4.18Å
488	T	88.3	Confident	82.3	Confident	17 Å²	17	38.7 Å²	38.7	10%	0.104	19%	0.188	C	C	.	.	H	α-helix	trans	-68.9	-33.7	169.6	-2.3	0	0	0	0	112.6	S484 A485 V490 N491 R492 Q525 E916	S484-T488 PolarHBondContact O-N 3.01Å; S484-T488 PolarHBondContact O-OG1 2.92Å; A485-T488 PolarHBondContact O-N 2.98Å; T488-V490 VanDerWaalsContact C-N 3.33Å; T488-V490 PolarHBondContact O-N 2.77Å; T488-N491 PolarHBondContact O-N 2.88Å; T488-R492 WeakPolarHBondContact O-CB 3.29Å; T488-R492 PolarHBondContact O-N 3.07Å; T488-Q525 PolarHBondContact OG1-NE2 3.1Å; T488-E916 VanDerWaalsContact CB-CD 3.44Å; T488-E916 VanDerWaalsContact CB-OE1 3.3Å; T488-E916 WeakPolarHBondContact CB-OE1 3.26Å; T488-E916 WeakPolarHBondContact CB-OE2 3.3Å; T488-E916 VanDerWaalsContact CG2-CD 3.49Å; T488-E916 HydrophobicContact CG2-CG 4.15Å; T488-E916 VanDerWaalsContact CG2-OE2 3.26Å; T488-E916 WeakPolarHBondContact CG2-OE2 3.47Å; T488-E916 PolarHBondContact OG1-OE1 3.26Å; T488-E916 PolarHBondContact OG1-OE2 3.19Å
489	G	86.8	Confident	82.4	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-43.8	174.3	0	0	0	0	0	112.4	N446 Y465 A485 L486 L487 A493	N446-G489 PolarHBondContact ND2-N 3.12Å; N446-G489 VanDerWaalsContact OD1-CA 3.27Å; N446-G489 WeakPolarHBondContact OD1-CA 3.11Å; Y465-G489 VanDerWaalsContact CE2-O 3.24Å; Y465-G489 WeakPolarHBondContact CE2-O 3.43Å; A485-G489 PolarHBondContact O-N 3.41Å; L486-G489 PolarHBondContact O-N 3.01Å; L487-G489 VanDerWaalsContact C-N 3.34Å; G489-A493 VanDerWaalsContact O-CB 3.31Å; G489-A493 WeakPolarHBondContact O-CB 3.33Å; G489-A493 PolarHBondContact O-N 2.86Å
490	V	88.8	Confident	82.5	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.024	17%	0.168	C	C	.	.	H	α-helix	trans	-68.1	-46.8	173.4	179.4	0	0	0	0	111.6	Y465 F466 L486 L487 T488 R492 A493 Y494 L529	Y465-V490 HydrophobicContact CD2-CG2 3.92Å; Y465-V490 HydrophobicContact CG-CG2 4.12Å; F466-V490 HydrophobicContact CE1-CG2 4.47Å; F466-V490 HydrophobicContact CE2-CG1 4.13Å; F466-V490 HydrophobicContact CZ-CG1 3.85Å; F466-V490 HydrophobicContact CZ-CG2 4.33Å; L486-V490 WeakPolarHBondContact O-CG2 3.2Å; L486-V490 PolarHBondContact O-N 3.1Å; L486-V490 VanDerWaalsContact O-N 3.08Å; L487-V490 PolarHBondContact O-N 3.17Å; T488-V490 VanDerWaalsContact C-N 3.33Å; T488-V490 PolarHBondContact O-N 2.77Å; V490-R492 PolarHBondContact O-N 2.67Å; V490-A493 PolarHBondContact O-N 3.49Å; V490-Y494 VanDerWaalsContact O-CB 3.26Å; V490-Y494 WeakPolarHBondContact O-CB 3.31Å; V490-Y494 PolarHBondContact O-N 3.26Å; V490-L529 HydrophobicContact CB-CD2 4.28Å; V490-L529 HydrophobicContact CG1-CD1 3.68Å; V490-L529 HydrophobicContact CG1-CD2 3.7Å; V490-L529 HydrophobicContact CG1-CG 4.37Å
491	N	87.5	Confident	82.6	Confident	16 Å²	16	34.7 Å²	34.7	9%	0.086	17%	0.174	C	C	.	.	H	α-helix	trans	-57.4	-37.1	178.2	-76.2	-23.9	0	0	0	112.8	L487 T488 P495 Q525 L529	L487-N491 PolarHBondContact O-N 2.77Å; L487-N491 PolarHBondContact O-ND2 3.34Å; T488-N491 PolarHBondContact O-N 2.88Å; N491-P495 WeakPolarHBondContact O-CD 3.42Å; N491-Q525 PolarHBondContact ND2-O 2.99Å; N491-L529 WeakPolarHBondContact OD1-CA 3.34Å; N491-L529 WeakPolarHBondContact OD1-CB 3.5Å; N491-L529 PolarHBondContact OD1-N 2.82Å
492	R	86.6	Confident	82.3	Confident	97 Å²	97	32.2 Å²	32.2	37%	0.366	17%	0.167	S	C	.	.	H	α-helix	trans	-77.1	-32.9	178.2	179.1	170.2	165.3	156.5	-8.7	113.1	N446 Q447 M448 T488 V490 Y496	N446-R492 WeakPolarHBondContact O-CD 3.13Å; N446-R492 PolarHBondContact O-NE 2.98Å; N446-R492 PolarHBondContact O-NH1 3.35Å; N446-R492 PolarHBondContact O-NH2 3.46Å; Q447-R492 PolarHBondContact O-NH2 3.05Å; M448-R492 PolarHBondContact O-NE 2.86Å; M448-R492 PolarHBondContact O-NH2 3.34Å; T488-R492 WeakPolarHBondContact O-CB 3.29Å; T488-R492 PolarHBondContact O-N 3.07Å; V490-R492 PolarHBondContact O-N 2.67Å; R492-Y496 WeakPolarHBondContact O-CD2 3.18Å; R492-Y496 VanDerWaalsContact O-CE2 3.3Å; R492-Y496 WeakPolarHBondContact O-CE2 3.43Å
493	A	87.5	Confident	81.9	Confident	2 Å²	2	35.7 Å²	35.7	2%	0.017	18%	0.182	C	C	.	.	H	α-helix	trans	-84.4	-29.5	179.7	0	0	0	0	0	113.7	L450 I462 Y465 G489 V490 Y496	L450-A493 HydrophobicContact CD1-CB 4.03Å; I462-A493 HydrophobicContact CD1-CB 4.09Å; I462-A493 HydrophobicContact CG1-CB 3.71Å; Y465-A493 HydrophobicContact CE2-CB 4.35Å; G489-A493 VanDerWaalsContact O-CB 3.31Å; G489-A493 WeakPolarHBondContact O-CB 3.33Å; G489-A493 PolarHBondContact O-N 2.86Å; V490-A493 PolarHBondContact O-N 3.49Å; A493-Y496 PolarHBondContact O-N 2.84Å
494	Y	86.8	Confident	81.5	Confident	14 Å²	14	35.7 Å²	35.7	6%	0.055	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-59.6	-40.8	-174	-175.2	-123.4	0	0	0	115.3	I462 V490 Y496 S497 D501 V504 L529 Q532 V533 S536	I462-Y494 HydrophobicContact CD1-CD2 4.47Å; V490-Y494 VanDerWaalsContact O-CB 3.26Å; V490-Y494 WeakPolarHBondContact O-CB 3.31Å; V490-Y494 PolarHBondContact O-N 3.26Å; Y494-Y496 PolarHBondContact O-N 3.18Å; Y494-Y496 VanDerWaalsContact O-N 3.1Å; Y494-S497 WeakPolarHBondContact CD2-OG 3.32Å; Y494-S497 PolarHBondContact O-N 3.06Å; Y494-S497 PolarHBondContact O-OG 3.4Å; Y494-D501 VanDerWaalsContact CE2-OD1 3.26Å; Y494-D501 WeakPolarHBondContact CE2-OD1 3.19Å; Y494-D501 PolarHBondContact OH-OD1 3.28Å; Y494-V504 HydrophobicContact CD2-CG2 4.21Å; Y494-V504 HydrophobicContact CE2-CG2 4.17Å; Y494-L529 HydrophobicContact CD1-CD1 4.45Å; Y494-Q532 HydrophobicContact CD1-CB 4.37Å; Y494-Q532 HydrophobicContact CD1-CG 3.9Å; Y494-Q532 HydrophobicContact CE1-CB 4.33Å; Y494-Q532 HydrophobicContact CE1-CG 3.92Å; Y494-V533 HydrophobicContact CD1-CG2 4.05Å; Y494-V533 HydrophobicContact CE1-CB 4.22Å; Y494-V533 HydrophobicContact CE1-CG2 3.42Å; Y494-V533 VanDerWaalsContact CE1-CG2 3.42Å; Y494-V533 HydrophobicContact CE2-CG2 4.33Å; Y494-S536 PolarHBondContact OH-OG 3.42Å
495	P	85.8	Confident	81.1	Confident	48 Å²	48	40.9 Å²	40.9	31%	0.312	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-55	-28.3	174.7	-23.2	29.4	0	0	0	114.9	N491	N491-P495 WeakPolarHBondContact O-CD 3.42Å
496	Y	86.4	Confident	80.9	Confident	43 Å²	43	46.5 Å²	46.5	17%	0.169	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-94.8	-3.6	-177.6	-52.4	-74.6	0	0	0	112.5	L450 H452 S455 R492 A493 Y494	L450-Y496 HydrophobicContact CB-CD1 4.49Å; L450-Y496 HydrophobicContact CB-CD2 3.71Å; L450-Y496 HydrophobicContact CB-CE2 4.02Å; L450-Y496 HydrophobicContact CB-CG 3.97Å; L450-Y496 HydrophobicContact CD1-CD2 3.99Å; H452-Y496 AromaticContact CD2-CE1 3.9Å; H452-Y496 AromaticContact CE1-CD1 3.74Å; H452-Y496 AromaticContact CE1-CE1 3.75Å; H452-Y496 AromaticContact CG-CD1 3.95Å; H452-Y496 AromaticContact ND1-CD1 3.72Å; H452-Y496 AromaticContact NE2-CD1 3.95Å; H452-Y496 AromaticContact NE2-CE1 3.56Å; S455-Y496 VanDerWaalsContact CA-O 3.25Å; S455-Y496 WeakPolarHBondContact CA-O 3.42Å; S455-Y496 VanDerWaalsContact CB-O 3.3Å; S455-Y496 WeakPolarHBondContact CB-O 3.49Å; R492-Y496 WeakPolarHBondContact O-CD2 3.18Å; R492-Y496 VanDerWaalsContact O-CE2 3.3Å; R492-Y496 WeakPolarHBondContact O-CE2 3.43Å; A493-Y496 PolarHBondContact O-N 2.84Å; Y494-Y496 PolarHBondContact O-N 3.18Å; Y494-Y496 VanDerWaalsContact O-N 3.1Å
497	S	82.8	Confident	80.6	Confident	11 Å²	11	46.8 Å²	46.8	8%	0.077	22%	0.223	C	C	.	.			trans	-99.1	106	-173.5	71.4	0	0	0	0	113	I462 Y494 T499	I462-S497 WeakPolarHBondContact CD1-OG 3.29Å; Y494-S497 WeakPolarHBondContact CD2-OG 3.32Å; Y494-S497 PolarHBondContact O-N 3.06Å; Y494-S497 PolarHBondContact O-OG 3.4Å; S497-T499 PolarHBondContact O-N 2.88Å
498	Q	72.7	Confident	80.5	Confident	154 Å²	154	48.3 Å²	48.3	72%	0.72	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.5	175.4	-67	170.9	-13.3	0	0	113.7	S455	S455-Q498 PolarHBondContact OG-OE1 3.38Å
499	T	64	Low	80.4	Confident	78 Å²	78	51.5 Å²	51.5	48%	0.479	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.1	19.8	-174.1	-24.6	0	0	0	0	112.4	N459 S497	N459-T499 WeakPolarHBondContact ND2-CB 3.16Å; N459-T499 PolarHBondContact ND2-OG1 3.46Å; N459-T499 WeakPolarHBondContact OD1-CA 3.49Å; N459-T499 WeakPolarHBondContact OD1-CB 3.22Å; N459-T499 PolarHBondContact OD1-N 3.07Å; S497-T499 PolarHBondContact O-N 2.88Å
500	G	60.6	Low	80.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.257	C	S	.	.			trans	-68.1	-36.1	178.9	0	0	0	0	0	113	N459 D502 K503 V504	N459-G500 PolarHBondContact OD1-N 2.99Å; G500-D502 PolarHBondContact O-N 3.33Å; G500-K503 PolarHBondContact O-N 2.85Å; G500-V504 WeakPolarHBondContact O-CG2 3.47Å; G500-V504 PolarHBondContact O-N 2.88Å
501	D	68.5	Low	80.3	Confident	48 Å²	48	53 Å²	53	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-51.3	-50.1	-165.4	-81.1	36.7	0	0	0	115.6	Y494 K503 V504 R505 Q537	Y494-D501 VanDerWaalsContact CE2-OD1 3.26Å; Y494-D501 WeakPolarHBondContact CE2-OD1 3.19Å; Y494-D501 PolarHBondContact OH-OD1 3.28Å; D501-K503 VanDerWaalsContact C-N 3.33Å; D501-K503 PolarHBondContact O-N 3.23Å; D501-V504 PolarHBondContact O-N 3.07Å; D501-R505 WeakPolarHBondContact O-CB 3.28Å; D501-R505 PolarHBondContact O-N 3.21Å; D501-Q537 WeakPolarHBondContact OD2-CG 3.26Å; D501-Q537 PolarHBondContact OD2-NE2 3.06Å
502	D	75.5	Confident	80.3	Confident	89 Å²	89	52.6 Å²	52.6	48%	0.476	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-41.9	179.9	-72.7	-39.4	0	0	0	112.1	G500 R505 E506	G500-D502 PolarHBondContact O-N 3.33Å; D502-R505 PolarHBondContact O-N 2.97Å; D502-R505 IonicContact OD1-CZ 3.25Å; D502-R505 VanDerWaalsContact OD1-CZ 3.23Å; D502-R505 IonicContact OD1-NH1 3.69Å; D502-R505 PolarHBondContact OD1-NH1 2.97Å; D502-R505 IonicContact OD1-NH2 3.8Å; D502-R505 PolarHBondContact OD1-NH2 3.44Å; D502-E506 PolarHBondContact O-N 3.45Å; D502-E506 VanDerWaalsContact O-N 3.14Å
503	K	74.6	Confident	80.3	Confident	85 Å²	85	54.1 Å²	54.1	37%	0.37	26%	0.263	S	S	.	.	H	α-helix	trans	-72.3	-35.4	-179.4	-67.7	173.6	-178.6	169.1	0	111.8	T463 G500 D501 Q507	T463-K503 PolarHBondContact OG1-NZ 2.83Å; G500-K503 PolarHBondContact O-N 2.85Å; D501-K503 VanDerWaalsContact C-N 3.33Å; D501-K503 PolarHBondContact O-N 3.23Å; K503-Q507 WeakPolarHBondContact O-CG 3.26Å
504	V	77	Confident	80.2	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-71.5	-38.1	173.4	-172.4	0	0	0	0	110.5	F466 Y494 G500 D501 E506 Q507 I508 V533	F466-V504 HydrophobicContact CE2-CB 4.25Å; F466-V504 HydrophobicContact CE2-CG2 3.6Å; F466-V504 HydrophobicContact CZ-CB 4.22Å; F466-V504 HydrophobicContact CZ-CG1 4.05Å; F466-V504 HydrophobicContact CZ-CG2 3.87Å; Y494-V504 HydrophobicContact CD2-CG2 4.21Å; Y494-V504 HydrophobicContact CE2-CG2 4.17Å; G500-V504 WeakPolarHBondContact O-CG2 3.47Å; G500-V504 PolarHBondContact O-N 2.88Å; D501-V504 PolarHBondContact O-N 3.07Å; V504-E506 PolarHBondContact O-N 3.04Å; V504-Q507 CarbonylContact O-C 3.49Å; V504-Q507 VanDerWaalsContact O-CA 3.3Å; V504-Q507 WeakPolarHBondContact O-CA 3.3Å; V504-Q507 WeakPolarHBondContact O-CB 3.23Å; V504-Q507 PolarHBondContact O-N 3.31Å; V504-I508 PolarHBondContact O-N 3.43Å; V504-V533 HydrophobicContact CB-CG1 4.39Å; V504-V533 HydrophobicContact CB-CG2 4.26Å; V504-V533 HydrophobicContact CG1-CB 4.34Å; V504-V533 HydrophobicContact CG1-CG1 4.04Å; V504-V533 HydrophobicContact CG1-CG2 3.52Å
505	R	79	Confident	80.1	Confident	138 Å²	138	53.7 Å²	53.7	52%	0.521	26%	0.262	S	S	.	.	H	α-helix	trans	-60	-41.4	177.9	-172.4	172	68.5	-142.8	-4.4	112.3	D501 D502 Q507 I508	D501-R505 WeakPolarHBondContact O-CB 3.28Å; D501-R505 PolarHBondContact O-N 3.21Å; D502-R505 PolarHBondContact O-N 2.97Å; D502-R505 IonicContact OD1-CZ 3.25Å; D502-R505 VanDerWaalsContact OD1-CZ 3.23Å; D502-R505 IonicContact OD1-NH1 3.69Å; D502-R505 PolarHBondContact OD1-NH1 2.97Å; D502-R505 IonicContact OD1-NH2 3.8Å; D502-R505 PolarHBondContact OD1-NH2 3.44Å; R505-Q507 PolarHBondContact O-N 2.66Å; R505-I508 HydrophobicContact CB-CD1 4.47Å; R505-I508 HydrophobicContact CG-CD1 4.39Å; R505-I508 PolarHBondContact O-N 3.32Å
506	E	83.4	Confident	79.9	Confident	127 Å²	127	55.5 Å²	55.5	59%	0.593	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-20.4	169.2	-75.1	-170.9	-173.1	0	0	113.5	R470 D502 V504	R470-E506 IonicContact CZ-OE2 3.76Å; R470-E506 IonicContact NH1-OE2 2.73Å; R470-E506 PolarHBondContact NH1-OE2 3.26Å; R470-E506 IonicContact NH2-OE2 2.67Å; R470-E506 PolarHBondContact NH2-OE2 2.91Å; D502-E506 PolarHBondContact O-N 3.45Å; D502-E506 VanDerWaalsContact O-N 3.14Å; V504-E506 PolarHBondContact O-N 3.04Å
507	Q	82.6	Confident	79.7	Confident	9 Å²	9	59 Å²	59	4%	0.042	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-6.4	-172.6	-59.6	-62.6	-106.3	0	0	115.2	F466 R470 K503 V504 R505 D509 T510 L511	F466-Q507 HydrophobicContact CD1-CB 4.17Å; F466-Q507 HydrophobicContact CD1-CG 3.79Å; F466-Q507 HydrophobicContact CE1-CB 3.92Å; F466-Q507 HydrophobicContact CE1-CG 4.04Å; F466-Q507 HydrophobicContact CG-CG 4.18Å; F466-Q507 HydrophobicContact CZ-CB 4.44Å; R470-Q507 VanDerWaalsContact NE-CD 3.25Å; R470-Q507 VanDerWaalsContact NH2-CD 3.26Å; K503-Q507 WeakPolarHBondContact O-CG 3.26Å; V504-Q507 CarbonylContact O-C 3.49Å; V504-Q507 VanDerWaalsContact O-CA 3.3Å; V504-Q507 WeakPolarHBondContact O-CA 3.3Å; V504-Q507 WeakPolarHBondContact O-CB 3.23Å; V504-Q507 PolarHBondContact O-N 3.31Å; R505-Q507 PolarHBondContact O-N 2.66Å; Q507-D509 VanDerWaalsContact C-N 3.28Å; Q507-D509 PolarHBondContact O-N 3.02Å; Q507-T510 VanDerWaalsContact CA-OG1 3.28Å; Q507-T510 WeakPolarHBondContact CA-OG1 3.35Å; Q507-T510 CarbonylContact O-C 3.58Å; Q507-T510 PolarHBondContact O-N 3.18Å; Q507-T510 PolarHBondContact O-OG1 2.72Å; Q507-L511 WeakPolarHBondContact O-CG 3.32Å; Q507-L511 PolarHBondContact O-N 3.38Å
508	I	86	Confident	79.8	Confident	33 Å²	33	59 Å²	59	17%	0.169	29%	0.285	C	S	.	.	H	α-helix	trans	-52.4	-46.3	176.2	-70.7	174.4	0	0	0	111.2	V504 R505 T510 L511 F512 L530 V533	V504-I508 PolarHBondContact O-N 3.43Å; R505-I508 HydrophobicContact CB-CD1 4.47Å; R505-I508 HydrophobicContact CG-CD1 4.39Å; R505-I508 PolarHBondContact O-N 3.32Å; I508-T510 VanDerWaalsContact C-N 3.32Å; I508-T510 PolarHBondContact O-N 2.87Å; I508-L511 PolarHBondContact O-N 2.9Å; I508-F512 HydrophobicContact CG2-CD2 3.69Å; I508-F512 HydrophobicContact CG2-CE2 3.59Å; I508-F512 VanDerWaalsContact O-CD2 3.32Å; I508-F512 WeakPolarHBondContact O-CD2 3.42Å; I508-F512 PolarHBondContact O-N 3.01Å; I508-L530 HydrophobicContact CB-CD2 4.38Å; I508-L530 HydrophobicContact CG1-CD2 4.3Å; I508-L530 HydrophobicContact CG2-CD2 3.98Å; I508-V533 HydrophobicContact CD1-CG1 4.39Å
509	D	86.1	Confident	80.4	Confident	84 Å²	84	55.7 Å²	55.7	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-69.6	-26.2	179.7	-112.3	-30.9	0	0	0	114	Q507 K513 R543	Q507-D509 VanDerWaalsContact C-N 3.28Å; Q507-D509 PolarHBondContact O-N 3.02Å; D509-K513 VanDerWaalsContact O-CD 3.31Å; D509-K513 WeakPolarHBondContact O-CD 3.34Å; D509-K513 VanDerWaalsContact O-CG 3.28Å; D509-K513 WeakPolarHBondContact O-CG 3.32Å; D509-K513 PolarHBondContact O-N 3.49Å; D509-R543 IonicContact OD1-CZ 2.77Å; D509-R543 IonicContact OD1-NH1 3.28Å; D509-R543 PolarHBondContact OD1-NH1 2.69Å; D509-R543 IonicContact OD1-NH2 3.47Å; D509-R543 PolarHBondContact OD1-NH2 3.3Å
510	T	86.8	Confident	81.5	Confident	35 Å²	35	52.4 Å²	52.4	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-77.9	-37.8	171.1	40.6	0	0	0	0	111.9	Q507 I508 K513 V514	Q507-T510 VanDerWaalsContact CA-OG1 3.28Å; Q507-T510 WeakPolarHBondContact CA-OG1 3.35Å; Q507-T510 CarbonylContact O-C 3.58Å; Q507-T510 PolarHBondContact O-N 3.18Å; Q507-T510 PolarHBondContact O-OG1 2.72Å; I508-T510 VanDerWaalsContact C-N 3.32Å; I508-T510 PolarHBondContact O-N 2.87Å; T510-K513 PolarHBondContact O-N 2.71Å; T510-K513 VanDerWaalsContact O-N 3.17Å; T510-V514 WeakPolarHBondContact O-CB 3.37Å; T510-V514 VanDerWaalsContact O-CG2 3.32Å; T510-V514 WeakPolarHBondContact O-CG2 3.23Å; T510-V514 PolarHBondContact O-N 3.36Å
511	L	86.1	Confident	82.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-45.4	174.6	-71.6	164.2	0	0	0	111	F469 L487 Q507 I508 K513 V514 L515 L529 L530	F469-L511 HydrophobicContact CE1-CD2 4.45Å; F469-L511 HydrophobicContact CE2-CD2 4.09Å; F469-L511 HydrophobicContact CZ-CD2 3.66Å; F469-L511 HydrophobicContact CZ-CG 4.18Å; L487-L511 HydrophobicContact CD2-CD2 3.64Å; Q507-L511 WeakPolarHBondContact O-CG 3.32Å; Q507-L511 PolarHBondContact O-N 3.38Å; I508-L511 PolarHBondContact O-N 2.9Å; L511-K513 VanDerWaalsContact C-N 3.26Å; L511-K513 PolarHBondContact O-N 3.44Å; L511-V514 PolarHBondContact O-N 3.03Å; L511-L515 WeakPolarHBondContact O-CB 3.49Å; L511-L515 PolarHBondContact O-N 3.47Å; L511-L529 HydrophobicContact CD1-CD2 3.77Å; L511-L529 HydrophobicContact CD1-CG 4.2Å; L511-L529 HydrophobicContact CD2-CD2 4.03Å; L511-L530 HydrophobicContact CB-CD1 4.19Å; L511-L530 HydrophobicContact CB-CD2 3.97Å; L511-L530 HydrophobicContact CB-CG 4.14Å; L511-L530 HydrophobicContact CD1-CD2 4.12Å; L511-L530 HydrophobicContact CD1-CG 4.44Å
512	F	88.6	Confident	83.6	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.035	25%	0.251	C	S	.	.	H	α-helix	trans	-63.8	-25	174.3	-83.5	-62.1	0	0	0	114.4	I508 L515 L530 M534 R543 A547	I508-F512 HydrophobicContact CG2-CD2 3.69Å; I508-F512 HydrophobicContact CG2-CE2 3.59Å; I508-F512 VanDerWaalsContact O-CD2 3.32Å; I508-F512 WeakPolarHBondContact O-CD2 3.42Å; I508-F512 PolarHBondContact O-N 3.01Å; F512-L515 HydrophobicContact CD1-CD2 4.37Å; F512-L530 HydrophobicContact CD1-CD1 3.97Å; F512-L530 HydrophobicContact CD2-CD1 4.45Å; F512-L530 HydrophobicContact CD2-CD2 4.21Å; F512-L530 HydrophobicContact CE1-CD1 3.89Å; F512-L530 HydrophobicContact CE2-CD1 4.38Å; F512-L530 HydrophobicContact CE2-CD2 3.96Å; F512-L530 HydrophobicContact CG-CD1 4.25Å; F512-L530 HydrophobicContact CZ-CD1 4.1Å; F512-L530 HydrophobicContact CZ-CD2 4.29Å; F512-M534 HydrophobicContact CE2-SD 4.4Å; F512-M534 HydrophobicContact CZ-SD 4.25Å; F512-R543 VanDerWaalsContact CB-NH2 3.3Å; F512-R543 HydrophobicContact CD1-CG 4.19Å; F512-R543 HydrophobicContact CE1-CG 3.88Å; F512-R543 HydrophobicContact CE2-CG 4.25Å; F512-R543 HydrophobicContact CZ-CB 4.31Å; F512-R543 HydrophobicContact CZ-CG 3.91Å; F512-A547 HydrophobicContact CE1-CB 4.19Å
513	K	86.2	Confident	84.3	Confident	130 Å²	130	48.1 Å²	48.1	57%	0.565	23%	0.228	S	C	*	.	H	α-helix	trans	-77.2	-49.2	172.6	-72.5	164.7	-171.8	168.8	0	110.6	D509 T510 L511 L515 H516	D509-K513 VanDerWaalsContact O-CD 3.31Å; D509-K513 WeakPolarHBondContact O-CD 3.34Å; D509-K513 VanDerWaalsContact O-CG 3.28Å; D509-K513 WeakPolarHBondContact O-CG 3.32Å; D509-K513 PolarHBondContact O-N 3.49Å; T510-K513 PolarHBondContact O-N 2.71Å; T510-K513 VanDerWaalsContact O-N 3.17Å; L511-K513 VanDerWaalsContact C-N 3.26Å; L511-K513 PolarHBondContact O-N 3.44Å; K513-L515 VanDerWaalsContact C-N 3.28Å; K513-L515 PolarHBondContact O-N 3.31Å; K513-H516 PolarHBondContact O-N 3.45Å
514	V	83.9	Confident	84.9	Confident	7 Å²	7	44.1 Å²	44.1	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-56.3	-41.4	176.9	168.4	0	0	0	0	111.5	F469 I473 L483 T510 L511 H516 M517 V518	F469-V514 HydrophobicContact CE2-CG2 4.41Å; F469-V514 HydrophobicContact CZ-CG2 4.02Å; I473-V514 HydrophobicContact CD1-CG2 3.75Å; I473-V514 HydrophobicContact CG1-CG2 4.09Å; L483-V514 HydrophobicContact CD2-CG1 3.97Å; T510-V514 WeakPolarHBondContact O-CB 3.37Å; T510-V514 VanDerWaalsContact O-CG2 3.32Å; T510-V514 WeakPolarHBondContact O-CG2 3.23Å; T510-V514 PolarHBondContact O-N 3.36Å; L511-V514 PolarHBondContact O-N 3.03Å; V514-H516 PolarHBondContact O-N 3.14Å; V514-M517 PolarHBondContact O-N 2.84Å; V514-V518 HydrophobicContact CG1-CG2 3.55Å; V514-V518 WeakPolarHBondContact O-CG2 3.42Å; V514-V518 PolarHBondContact O-N 3.46Å; V514-V518 VanDerWaalsContact O-N 3.14Å
515	L	85.6	Confident	85.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-38.4	177.4	-178.3	75.2	0	0	0	114.6	L511 F512 K513 S523 L527 A547 K551	L511-L515 WeakPolarHBondContact O-CB 3.49Å; L511-L515 PolarHBondContact O-N 3.47Å; F512-L515 HydrophobicContact CD1-CD2 4.37Å; K513-L515 VanDerWaalsContact C-N 3.28Å; K513-L515 PolarHBondContact O-N 3.31Å; L515-S523 WeakPolarHBondContact CD1-O 3.38Å; L515-L527 HydrophobicContact CD1-CD1 3.98Å; L515-L527 HydrophobicContact CD1-CD2 3.65Å; L515-L527 HydrophobicContact CD1-CG 3.46Å; L515-L527 VanDerWaalsContact CD1-CG 3.46Å; L515-L527 HydrophobicContact CD2-CD2 3.96Å; L515-L527 HydrophobicContact CG-CD2 4.48Å; L515-A547 HydrophobicContact CD2-CB 3.37Å; L515-K551 WeakPolarHBondContact O-CE 3.46Å
516	H	82.6	Confident	86	Confident	85 Å²	85	37.7 Å²	37.7	39%	0.394	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	2.8	-176.6	-65.6	-35.9	0	0	0	113.5	K513 V514	K513-H516 PolarHBondContact O-N 3.45Å; V514-H516 PolarHBondContact O-N 3.14Å
517	M	82	Confident	86.3	Confident	117 Å²	117	31.6 Å²	31.6	58%	0.576	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-18.5	-177.8	-62.6	-174.1	71.2	0	0	114.3	I478 V514	I478-M517 HydrophobicContact CD1-CE 3.73Å; I478-M517 HydrophobicContact CD1-SD 4.35Å; I478-M517 HydrophobicContact CG2-CB 3.97Å; V514-M517 PolarHBondContact O-N 2.84Å
518	V	84	Confident	86.6	Confident	11 Å²	11	33.7 Å²	33.7	7%	0.067	17%	0.169	C	C	.	.	S	Bend	trans	-105.1	159.6	-178.2	-159.5	0	0	0	0	111.7	I478 L483 V514 T522	I478-V518 HydrophobicContact CG2-CG2 3.66Å; L483-V518 HydrophobicContact CD2-CG2 3.69Å; V514-V518 HydrophobicContact CG1-CG2 3.55Å; V514-V518 WeakPolarHBondContact O-CG2 3.42Å; V514-V518 PolarHBondContact O-N 3.46Å; V514-V518 VanDerWaalsContact O-N 3.14Å; V518-T522 HydrophobicContact CB-CG2 4.39Å; V518-T522 VanDerWaalsContact CG1-CB 3.47Å; V518-T522 HydrophobicContact CG1-CG2 3.8Å
519	N	86.1	Confident	86.8	Confident	85 Å²	85	32.1 Å²	32.1	46%	0.455	16%	0.161	S	C	.	.			trans	-48.1	162.4	171.2	70.8	28.8	0	0	0	114.2	N521 T522 S523	N519-N521 PolarHBondContact O-N 2.94Å; N519-T522 PolarHBondContact O-N 3.47Å; N519-T522 VanDerWaalsContact OD1-CB 3.29Å; N519-T522 WeakPolarHBondContact OD1-CB 3.44Å; N519-T522 PolarHBondContact OD1-N 3.45Å; N519-T522 PolarHBondContact OD1-OG1 2.87Å; N519-S523 WeakPolarHBondContact O-CB 3.2Å; N519-S523 PolarHBondContact O-N 3.25Å; N519-S523 PolarHBondContact O-OG 2.98Å
520	F	86.9	Confident	86.9	Confident	9 Å²	9	28.2 Å²	28.2	4%	0.039	14%	0.14	C	C	.	.	H	α-helix	trans	-56	-53.7	-174.4	-170	-95.9	0	0	0	112.7	T522 S523 V524 K551 D554 L557 C560 F566	F520-T522 PolarHBondContact O-N 2.86Å; F520-S523 WeakPolarHBondContact CA-OG 3.19Å; F520-S523 CarbonylContact O-C 3.58Å; F520-S523 WeakPolarHBondContact O-CA 3.26Å; F520-S523 WeakPolarHBondContact O-CB 3.3Å; F520-S523 PolarHBondContact O-N 2.85Å; F520-S523 PolarHBondContact O-OG 3.24Å; F520-V524 HydrophobicContact CD1-CG2 3.9Å; F520-V524 HydrophobicContact CE1-CG2 3.45Å; F520-V524 VanDerWaalsContact CE1-CG2 3.45Å; F520-V524 HydrophobicContact CZ-CG2 3.79Å; F520-V524 WeakPolarHBondContact O-CG2 3.06Å; F520-V524 PolarHBondContact O-N 3.37Å; F520-K551 HydrophobicContact CD2-CD 4.25Å; F520-K551 HydrophobicContact CE2-CD 4.31Å; F520-K551 WeakPolarHBondContact CE2-O 3.45Å; F520-D554 HydrophobicContact CD2-CB 3.87Å; F520-D554 HydrophobicContact CE2-CB 4.11Å; F520-L557 HydrophobicContact CE1-CB 4.46Å; F520-L557 HydrophobicContact CE1-CD1 3.84Å; F520-L557 HydrophobicContact CE2-CB 4.14Å; F520-L557 HydrophobicContact CZ-CB 4.08Å; F520-L557 HydrophobicContact CZ-CD1 3.7Å; F520-L557 HydrophobicContact CZ-CG 4.41Å; F520-C560 HydrophobicContact CD1-CB 3.72Å; F520-C560 VanDerWaalsContact CD1-SG 3.59Å; F520-C560 HydrophobicContact CE1-CB 3.96Å; F520-F566 HydrophobicContact CE1-CB 4.42Å; F520-F566 HydrophobicContact CE1-CD2 4.29Å; F520-F566 HydrophobicContact CE1-CG 4.2Å; F520-F566 HydrophobicContact CZ-CD1 4.21Å; F520-F566 AromaticContact CZ-CD2 3.75Å; F520-F566 HydrophobicContact CZ-CD2 3.75Å; F520-F566 HydrophobicContact CZ-CE1 4.28Å; F520-F566 AromaticContact CZ-CE2 3.83Å; F520-F566 HydrophobicContact CZ-CE2 3.83Å; F520-F566 AromaticContact CZ-CG 3.93Å; F520-F566 HydrophobicContact CZ-CG 3.93Å; F520-F566 HydrophobicContact CZ-CZ 4.09Å
521	N	86.3	Confident	87.1	Confident	41 Å²	41	27.5 Å²	27.5	22%	0.219	13%	0.134	C	C	.	.	H	α-helix	trans	-53.2	-48.8	-178	-68.1	-9.4	0	0	0	113.1	N519 S523 V524 Q525 C560 S561	N519-N521 PolarHBondContact O-N 2.94Å; N521-S523 VanDerWaalsContact C-N 3.33Å; N521-S523 PolarHBondContact O-N 2.95Å; N521-V524 PolarHBondContact O-N 3.28Å; N521-Q525 PolarHBondContact O-N 3.35Å; N521-C560 PolarHBondContact OD1-SG 3.09Å; N521-C560 VanDerWaalsContact OD1-SG 3.35Å; N521-S561 PolarHBondContact ND2-OG 3.34Å
522	T	87.1	Confident	87.1	Confident	5 Å²	5	30 Å²	30	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-69.8	-33.5	179.1	-46	0	0	0	0	111.4	L483 L487 V518 N519 F520 V524 Q525 A526	L483-T522 HydrophobicContact CG-CG2 4.4Å; L487-T522 HydrophobicContact CD1-CG2 3.54Å; V518-T522 HydrophobicContact CB-CG2 4.39Å; V518-T522 VanDerWaalsContact CG1-CB 3.47Å; V518-T522 HydrophobicContact CG1-CG2 3.8Å; N519-T522 PolarHBondContact O-N 3.47Å; N519-T522 VanDerWaalsContact OD1-CB 3.29Å; N519-T522 WeakPolarHBondContact OD1-CB 3.44Å; N519-T522 PolarHBondContact OD1-N 3.45Å; N519-T522 PolarHBondContact OD1-OG1 2.87Å; F520-T522 PolarHBondContact O-N 2.86Å; T522-V524 VanDerWaalsContact C-N 3.34Å; T522-Q525 PolarHBondContact O-N 2.83Å; T522-A526 PolarHBondContact O-N 3.4Å
523	S	88.6	Confident	87	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.007	14%	0.144	C	C	.	.	H	α-helix	trans	-67.2	-32.8	175.2	78	0	0	0	0	112.6	L515 N519 F520 N521 A526 L527 K551	L515-S523 WeakPolarHBondContact CD1-O 3.38Å; N519-S523 WeakPolarHBondContact O-CB 3.2Å; N519-S523 PolarHBondContact O-N 3.25Å; N519-S523 PolarHBondContact O-OG 2.98Å; F520-S523 WeakPolarHBondContact CA-OG 3.19Å; F520-S523 CarbonylContact O-C 3.58Å; F520-S523 WeakPolarHBondContact O-CA 3.26Å; F520-S523 WeakPolarHBondContact O-CB 3.3Å; F520-S523 PolarHBondContact O-N 2.85Å; F520-S523 PolarHBondContact O-OG 3.24Å; N521-S523 VanDerWaalsContact C-N 3.33Å; N521-S523 PolarHBondContact O-N 2.95Å; S523-A526 PolarHBondContact O-N 3.32Å; S523-L527 WeakPolarHBondContact O-CG 3.48Å; S523-L527 PolarHBondContact O-N 2.82Å; S523-K551 WeakPolarHBondContact OG-CD 3.36Å; S523-K551 VanDerWaalsContact OG-CE 3.23Å; S523-K551 WeakPolarHBondContact OG-CE 3.24Å; S523-K551 PolarHBondContact OG-NZ 2.78Å
524	V	89	Confident	86.9	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-65.5	-46.1	170.3	177.9	0	0	0	0	110.6	F520 N521 T522 A526 L527 M528 F566 L569	F520-V524 HydrophobicContact CD1-CG2 3.9Å; F520-V524 HydrophobicContact CE1-CG2 3.45Å; F520-V524 VanDerWaalsContact CE1-CG2 3.45Å; F520-V524 HydrophobicContact CZ-CG2 3.79Å; F520-V524 WeakPolarHBondContact O-CG2 3.06Å; F520-V524 PolarHBondContact O-N 3.37Å; N521-V524 PolarHBondContact O-N 3.28Å; T522-V524 VanDerWaalsContact C-N 3.34Å; V524-A526 VanDerWaalsContact C-N 3.28Å; V524-A526 PolarHBondContact O-N 2.67Å; V524-L527 PolarHBondContact O-N 3.01Å; V524-L527 VanDerWaalsContact O-N 3.07Å; V524-M528 HydrophobicContact CG1-CG 4.49Å; V524-M528 HydrophobicContact CG1-SD 4.26Å; V524-M528 WeakPolarHBondContact O-CG 3.35Å; V524-M528 PolarHBondContact O-N 2.98Å; V524-F566 HydrophobicContact CG1-CB 4.26Å; V524-F566 HydrophobicContact CG2-CB 4.23Å; V524-F566 HydrophobicContact CG2-CD2 3.84Å; V524-F566 HydrophobicContact CG2-CG 4.4Å; V524-L569 HydrophobicContact CG1-CD2 4.24Å
525	Q	88.4	Confident	87	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.009	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-37.6	176.6	-66.9	175.6	-49.9	0	0	112.5	S484 L487 T488 N491 N521 T522 M528 L529	S484-Q525 PolarHBondContact OG-OE1 3.16Å; L487-Q525 HydrophobicContact CB-CB 4.2Å; T488-Q525 PolarHBondContact OG1-NE2 3.1Å; N491-Q525 PolarHBondContact ND2-O 2.99Å; N521-Q525 PolarHBondContact O-N 3.35Å; T522-Q525 PolarHBondContact O-N 2.83Å; Q525-M528 PolarHBondContact O-N 3.44Å; Q525-L529 PolarHBondContact O-N 2.76Å
526	A	89.5	Confident	86.9	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-68.9	-35.6	173.6	0	0	0	0	0	113.1	L487 T522 S523 V524 L530	L487-A526 HydrophobicContact CD1-CB 4.23Å; T522-A526 PolarHBondContact O-N 3.4Å; S523-A526 PolarHBondContact O-N 3.32Å; V524-A526 VanDerWaalsContact C-N 3.28Å; V524-A526 PolarHBondContact O-N 2.67Å; A526-L530 WeakPolarHBondContact O-CB 3.45Å; A526-L530 VanDerWaalsContact O-CG 3.32Å; A526-L530 WeakPolarHBondContact O-CG 3.5Å; A526-L530 PolarHBondContact O-N 3.14Å
527	L	90.4	Very high	86.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-70.8	-32.3	173.5	-69.6	167.3	0	0	0	112.7	L515 S523 V524 F531 Y544 A547 L548 K551 L569	L515-L527 HydrophobicContact CD1-CD1 3.98Å; L515-L527 HydrophobicContact CD1-CD2 3.65Å; L515-L527 HydrophobicContact CD1-CG 3.46Å; L515-L527 VanDerWaalsContact CD1-CG 3.46Å; L515-L527 HydrophobicContact CD2-CD2 3.96Å; L515-L527 HydrophobicContact CG-CD2 4.48Å; S523-L527 WeakPolarHBondContact O-CG 3.48Å; S523-L527 PolarHBondContact O-N 2.82Å; V524-L527 PolarHBondContact O-N 3.01Å; V524-L527 VanDerWaalsContact O-N 3.07Å; L527-F531 VanDerWaalsContact O-CB 3.26Å; L527-F531 WeakPolarHBondContact O-CB 3.39Å; L527-F531 PolarHBondContact O-N 3.22Å; L527-Y544 HydrophobicContact CB-CE2 4.23Å; L527-Y544 HydrophobicContact CD2-CD2 4.23Å; L527-Y544 HydrophobicContact CD2-CE2 3.81Å; L527-Y544 WeakPolarHBondContact O-CE2 3.2Å; L527-A547 HydrophobicContact CD2-CB 4.22Å; L527-L548 HydrophobicContact CD1-CD1 3.88Å; L527-K551 HydrophobicContact CD1-CB 4.44Å; L527-K551 HydrophobicContact CD1-CG 4.37Å; L527-L569 HydrophobicContact CB-CD2 3.53Å; L527-L569 HydrophobicContact CD1-CD2 4.37Å
528	M	89.5	Confident	86.2	Confident	53 Å²	53	31.3 Å²	31.3	26%	0.261	16%	0.162	S	C	.	.	H	α-helix	trans	-62.1	-46.8	172.4	-69.2	169.9	70.7	0	0	110.6	V524 Q525 F531 Q532 M565 L569	V524-M528 HydrophobicContact CG1-CG 4.49Å; V524-M528 HydrophobicContact CG1-SD 4.26Å; V524-M528 WeakPolarHBondContact O-CG 3.35Å; V524-M528 PolarHBondContact O-N 2.98Å; Q525-M528 PolarHBondContact O-N 3.44Å; M528-F531 PolarHBondContact O-N 2.81Å; M528-Q532 WeakPolarHBondContact O-CB 3.39Å; M528-Q532 PolarHBondContact O-N 3.41Å; M528-M565 HydrophobicContact SD-CB 4.26Å; M528-L569 HydrophobicContact CG-CB 4.45Å; M528-L569 HydrophobicContact CG-CD1 4.04Å; M528-L569 HydrophobicContact CG-CD2 4.18Å; M528-L569 HydrophobicContact CG-CG 4.45Å
529	L	88.9	Confident	85.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-50	176.2	-173.7	51.8	0	0	0	111.7	F466 L487 V490 N491 Y494 L511 Q525 F531 Q532 V533	F466-L529 HydrophobicContact CZ-CD2 4.29Å; L487-L529 HydrophobicContact CD2-CD2 4.18Å; V490-L529 HydrophobicContact CB-CD2 4.28Å; V490-L529 HydrophobicContact CG1-CD1 3.68Å; V490-L529 HydrophobicContact CG1-CD2 3.7Å; V490-L529 HydrophobicContact CG1-CG 4.37Å; N491-L529 WeakPolarHBondContact OD1-CA 3.34Å; N491-L529 WeakPolarHBondContact OD1-CB 3.5Å; N491-L529 PolarHBondContact OD1-N 2.82Å; Y494-L529 HydrophobicContact CD1-CD1 4.45Å; L511-L529 HydrophobicContact CD1-CD2 3.77Å; L511-L529 HydrophobicContact CD1-CG 4.2Å; L511-L529 HydrophobicContact CD2-CD2 4.03Å; Q525-L529 PolarHBondContact O-N 2.76Å; L529-F531 VanDerWaalsContact C-N 3.34Å; L529-F531 PolarHBondContact O-N 3.17Å; L529-Q532 PolarHBondContact O-N 2.94Å; L529-V533 HydrophobicContact CD1-CG2 3.96Å; L529-V533 HydrophobicContact CG-CG2 4.46Å; L529-V533 WeakPolarHBondContact O-CG2 3.09Å; L529-V533 PolarHBondContact O-N 3.36Å; L529-V533 VanDerWaalsContact O-N 3.12Å
530	L	89.5	Confident	85.6	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-44.4	178.5	-74.5	168.6	0	0	0	111.5	I508 L511 F512 A526 M534 Y544	I508-L530 HydrophobicContact CB-CD2 4.38Å; I508-L530 HydrophobicContact CG1-CD2 4.3Å; I508-L530 HydrophobicContact CG2-CD2 3.98Å; L511-L530 HydrophobicContact CB-CD1 4.19Å; L511-L530 HydrophobicContact CB-CD2 3.97Å; L511-L530 HydrophobicContact CB-CG 4.14Å; L511-L530 HydrophobicContact CD1-CD2 4.12Å; L511-L530 HydrophobicContact CD1-CG 4.44Å; F512-L530 HydrophobicContact CD1-CD1 3.97Å; F512-L530 HydrophobicContact CD2-CD1 4.45Å; F512-L530 HydrophobicContact CD2-CD2 4.21Å; F512-L530 HydrophobicContact CE1-CD1 3.89Å; F512-L530 HydrophobicContact CE2-CD1 4.38Å; F512-L530 HydrophobicContact CE2-CD2 3.96Å; F512-L530 HydrophobicContact CG-CD1 4.25Å; F512-L530 HydrophobicContact CZ-CD1 4.1Å; F512-L530 HydrophobicContact CZ-CD2 4.29Å; A526-L530 WeakPolarHBondContact O-CB 3.45Å; A526-L530 VanDerWaalsContact O-CG 3.32Å; A526-L530 WeakPolarHBondContact O-CG 3.5Å; A526-L530 PolarHBondContact O-N 3.14Å; L530-M534 HydrophobicContact CB-SD 4.27Å; L530-M534 HydrophobicContact CD2-SD 4.32Å; L530-M534 WeakPolarHBondContact O-CB 3.43Å; L530-M534 WeakPolarHBondContact O-CG 3.17Å; L530-M534 PolarHBondContact O-N 2.93Å; L530-Y544 HydrophobicContact CB-CD2 4.07Å; L530-Y544 HydrophobicContact CB-CE2 4.27Å
531	F	89.7	Confident	85.2	Confident	21 Å²	21	34.2 Å²	34.2	9%	0.092	18%	0.184	C	C	.	.	H	α-helix	trans	-60.8	-49.5	176.8	178.6	-104.2	0	0	0	111.6	L527 M528 L529 V533 M534 N535 I540 Y544 L569 K572 A576	L527-F531 VanDerWaalsContact O-CB 3.26Å; L527-F531 WeakPolarHBondContact O-CB 3.39Å; L527-F531 PolarHBondContact O-N 3.22Å; M528-F531 PolarHBondContact O-N 2.81Å; L529-F531 VanDerWaalsContact C-N 3.34Å; L529-F531 PolarHBondContact O-N 3.17Å; F531-V533 PolarHBondContact O-N 2.91Å; F531-M534 PolarHBondContact O-N 3.01Å; F531-N535 HydrophobicContact CE1-CB 4.34Å; F531-N535 HydrophobicContact CE2-CB 4.33Å; F531-N535 HydrophobicContact CZ-CB 4.14Å; F531-N535 WeakPolarHBondContact O-CB 3.33Å; F531-N535 PolarHBondContact O-N 3.45Å; F531-I540 HydrophobicContact CE2-CD1 3.99Å; F531-Y544 HydrophobicContact CB-CE2 3.95Å; F531-Y544 HydrophobicContact CD2-CE1 4.04Å; F531-L569 HydrophobicContact CB-CD1 3.86Å; F531-L569 HydrophobicContact CD1-CD1 4.38Å; F531-L569 HydrophobicContact CG-CD1 4.16Å; F531-K572 HydrophobicContact CE1-CB 3.78Å; F531-K572 HydrophobicContact CZ-CB 4.04Å; F531-A576 HydrophobicContact CE2-CB 4.29Å; F531-A576 HydrophobicContact CZ-CB 4.17Å
532	Q	86.9	Confident	85.1	Confident	51 Å²	51	35.7 Å²	35.7	24%	0.238	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-44.3	-175.5	-167.4	178.8	-13.3	0	0	112.2	Y494 M528 L529 S536	Y494-Q532 HydrophobicContact CD1-CB 4.37Å; Y494-Q532 HydrophobicContact CD1-CG 3.9Å; Y494-Q532 HydrophobicContact CE1-CB 4.33Å; Y494-Q532 HydrophobicContact CE1-CG 3.92Å; M528-Q532 WeakPolarHBondContact O-CB 3.39Å; M528-Q532 PolarHBondContact O-N 3.41Å; L529-Q532 PolarHBondContact O-N 2.94Å; Q532-S536 PolarHBondContact O-N 3.44Å; Q532-S536 PolarHBondContact O-OG 2.87Å
533	V	85.4	Confident	85.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-70.3	-38.1	179.8	179.1	0	0	0	0	112	Y494 V504 I508 L529 F531 S536 Q537	Y494-V533 HydrophobicContact CD1-CG2 4.05Å; Y494-V533 HydrophobicContact CE1-CB 4.22Å; Y494-V533 HydrophobicContact CE1-CG2 3.42Å; Y494-V533 VanDerWaalsContact CE1-CG2 3.42Å; Y494-V533 HydrophobicContact CE2-CG2 4.33Å; V504-V533 HydrophobicContact CB-CG1 4.39Å; V504-V533 HydrophobicContact CB-CG2 4.26Å; V504-V533 HydrophobicContact CG1-CB 4.34Å; V504-V533 HydrophobicContact CG1-CG1 4.04Å; V504-V533 HydrophobicContact CG1-CG2 3.52Å; I508-V533 HydrophobicContact CD1-CG1 4.39Å; L529-V533 HydrophobicContact CD1-CG2 3.96Å; L529-V533 HydrophobicContact CG-CG2 4.46Å; L529-V533 WeakPolarHBondContact O-CG2 3.09Å; L529-V533 PolarHBondContact O-N 3.36Å; L529-V533 VanDerWaalsContact O-N 3.12Å; F531-V533 PolarHBondContact O-N 2.91Å; V533-S536 PolarHBondContact O-OG 3.04Å; V533-Q537 WeakPolarHBondContact O-CB 3.44Å; V533-Q537 WeakPolarHBondContact O-CG 3.45Å; V533-Q537 PolarHBondContact O-N 2.81Å
534	M	85.3	Confident	85.2	Confident	7 Å²	7	40.9 Å²	40.9	3%	0.034	21%	0.211	C	C	.	.	H	α-helix	trans	-79.7	-23.7	-179.8	-64.3	168.5	63.6	0	0	111.6	F512 L530 F531 Q538 T539 I540 S541	F512-M534 HydrophobicContact CE2-SD 4.4Å; F512-M534 HydrophobicContact CZ-SD 4.25Å; L530-M534 HydrophobicContact CB-SD 4.27Å; L530-M534 HydrophobicContact CD2-SD 4.32Å; L530-M534 WeakPolarHBondContact O-CB 3.43Å; L530-M534 WeakPolarHBondContact O-CG 3.17Å; L530-M534 PolarHBondContact O-N 2.93Å; F531-M534 PolarHBondContact O-N 3.01Å; M534-Q538 CarbonylContact O-C 3.45Å; M534-Q538 WeakPolarHBondContact O-CA 3.12Å; M534-Q538 PolarHBondContact O-N 3.37Å; M534-Q538 VanDerWaalsContact O-N 3.16Å; M534-T539 WeakPolarHBondContact CE-O 3.37Å; M534-T539 PolarHBondContact O-N 3.19Å; M534-I540 HydrophobicContact CB-CG1 4.3Å; M534-I540 WeakPolarHBondContact O-CG1 3.39Å; M534-S541 VanDerWaalsContact CE-OG 3.29Å; M534-S541 WeakPolarHBondContact CE-OG 3.33Å
535	N	85.5	Confident	85.3	Confident	68 Å²	68	41 Å²	41	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-79.3	-42.2	174.2	-171.9	95.3	0	0	0	112	F531 Q537 Q538 I540	F531-N535 HydrophobicContact CE1-CB 4.34Å; F531-N535 HydrophobicContact CE2-CB 4.33Å; F531-N535 HydrophobicContact CZ-CB 4.14Å; F531-N535 WeakPolarHBondContact O-CB 3.33Å; F531-N535 PolarHBondContact O-N 3.45Å; N535-Q537 VanDerWaalsContact C-N 3.26Å; N535-Q537 PolarHBondContact O-N 3.05Å; N535-Q538 PolarHBondContact O-N 3.44Å; N535-Q538 VanDerWaalsContact O-N 3.1Å; N535-I540 HydrophobicContact CB-CD1 4.05Å
536	S	82.6	Confident	85.5	Confident	67 Å²	67	41.9 Å²	41.9	47%	0.469	22%	0.217	S	C	.	.	H	α-helix	trans	-59.8	-38.7	173.4	56.1	0	0	0	0	111.9	Y494 Q532 V533 Q538	Y494-S536 PolarHBondContact OH-OG 3.42Å; Q532-S536 PolarHBondContact O-N 3.44Å; Q532-S536 PolarHBondContact O-OG 2.87Å; V533-S536 PolarHBondContact O-OG 3.04Å; S536-Q538 VanDerWaalsContact C-N 3.34Å
537	Q	75.1	Confident	85.5	Confident	53 Å²	53	42 Å²	42	25%	0.248	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	1.7	176.4	-63.7	178.4	8.9	0	0	114	D501 V533 N535 T539	D501-Q537 WeakPolarHBondContact OD2-CG 3.26Å; D501-Q537 PolarHBondContact OD2-NE2 3.06Å; V533-Q537 WeakPolarHBondContact O-CB 3.44Å; V533-Q537 WeakPolarHBondContact O-CG 3.45Å; V533-Q537 PolarHBondContact O-N 2.81Å; N535-Q537 VanDerWaalsContact C-N 3.26Å; N535-Q537 PolarHBondContact O-N 3.05Å; Q537-T539 WeakPolarHBondContact CB-OG1 3.39Å; Q537-T539 WeakPolarHBondContact O-CG2 3.45Å; Q537-T539 PolarHBondContact O-N 3.33Å
538	Q	76.1	Confident	85.6	Confident	180 Å²	180	42 Å²	42	84%	0.841	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	19.9	-174.6	-56.9	-176.3	-1.6	0	0	115.5	M534 N535 S536	M534-Q538 CarbonylContact O-C 3.45Å; M534-Q538 WeakPolarHBondContact O-CA 3.12Å; M534-Q538 PolarHBondContact O-N 3.37Å; M534-Q538 VanDerWaalsContact O-N 3.16Å; N535-Q538 PolarHBondContact O-N 3.44Å; N535-Q538 VanDerWaalsContact O-N 3.1Å; S536-Q538 VanDerWaalsContact C-N 3.34Å
539	T	76.9	Confident	85.7	Confident	83 Å²	83	39.5 Å²	39.5	51%	0.509	21%	0.205	S	C	.	.			trans	-105.4	43	-174.6	46.3	0	0	0	0	112.6	M534 Q537 S541	M534-T539 WeakPolarHBondContact CE-O 3.37Å; M534-T539 PolarHBondContact O-N 3.19Å; Q537-T539 WeakPolarHBondContact CB-OG1 3.39Å; Q537-T539 WeakPolarHBondContact O-CG2 3.45Å; Q537-T539 PolarHBondContact O-N 3.33Å; T539-S541 VanDerWaalsContact C-N 3.3Å; T539-S541 PolarHBondContact O-N 2.96Å
540	I	79.3	Confident	85.8	Confident	32 Å²	32	46 Å²	46	16%	0.164	23%	0.23	C	C	.	.			trans	-71.3	80.4	-176.7	-43.7	178.6	0	0	0	111.8	F531 M534 N535 Y544 Y545 A576	F531-I540 HydrophobicContact CE2-CD1 3.99Å; M534-I540 HydrophobicContact CB-CG1 4.3Å; M534-I540 WeakPolarHBondContact O-CG1 3.39Å; N535-I540 HydrophobicContact CB-CD1 4.05Å; I540-Y544 HydrophobicContact CG2-CD1 3.86Å; I540-Y544 HydrophobicContact CG2-CG 4.34Å; I540-Y545 HydrophobicContact CB-CE2 4.22Å; I540-Y545 HydrophobicContact CG2-CD2 4.12Å; I540-Y545 HydrophobicContact CG2-CE2 3.39Å; I540-A576 HydrophobicContact CD1-CB 4.3Å
541	S	79.3	Confident	85.8	Confident	51 Å²	51	46.6 Å²	46.6	36%	0.357	23%	0.232	S	C	.	.			trans	-64.2	152.3	-177.6	71.1	0	0	0	0	114.1	M534 T539 R543 Y544	M534-S541 VanDerWaalsContact CE-OG 3.29Å; M534-S541 WeakPolarHBondContact CE-OG 3.33Å; T539-S541 VanDerWaalsContact C-N 3.3Å; T539-S541 PolarHBondContact O-N 2.96Å; S541-R543 PolarHBondContact O-N 3.19Å; S541-Y544 WeakPolarHBondContact O-CB 3.27Å; S541-Y544 PolarHBondContact O-N 3.39Å
542	D	83.5	Confident	85.7	Confident	73 Å²	73	45.7 Å²	45.7	39%	0.39	23%	0.229	S	C	.	.	H	α-helix	trans	-55.1	-22.2	174.7	-65.8	-3.3	0	0	0	114	Y544 Y545 T546 R582 L704	D542-Y544 VanDerWaalsContact C-N 3.31Å; D542-Y544 PolarHBondContact O-N 3.32Å; D542-Y545 PolarHBondContact O-N 3.03Å; D542-T546 WeakPolarHBondContact O-CB 3.5Å; D542-T546 PolarHBondContact O-N 3.01Å; D542-T546 PolarHBondContact O-OG1 2.82Å; D542-R582 IonicContact OD1-CZ 3.04Å; D542-R582 IonicContact OD1-NH1 2.99Å; D542-R582 PolarHBondContact OD1-NH1 3.16Å; D542-L704 WeakPolarHBondContact OD2-CD1 3.46Å
543	R	87.3	Confident	85.8	Confident	114 Å²	114	47.3 Å²	47.3	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-62.5	-37.5	173.2	-173.7	-177.7	178.3	-179.3	-1.3	111.7	D509 F512 S541 A547	D509-R543 IonicContact OD1-CZ 2.77Å; D509-R543 IonicContact OD1-NH1 3.28Å; D509-R543 PolarHBondContact OD1-NH1 2.69Å; D509-R543 IonicContact OD1-NH2 3.47Å; D509-R543 PolarHBondContact OD1-NH2 3.3Å; F512-R543 VanDerWaalsContact CB-NH2 3.3Å; F512-R543 HydrophobicContact CD1-CG 4.19Å; F512-R543 HydrophobicContact CE1-CG 3.88Å; F512-R543 HydrophobicContact CE2-CG 4.25Å; F512-R543 HydrophobicContact CZ-CB 4.31Å; F512-R543 HydrophobicContact CZ-CG 3.91Å; S541-R543 PolarHBondContact O-N 3.19Å; R543-A547 VanDerWaalsContact O-CB 3.29Å; R543-A547 WeakPolarHBondContact O-CB 3.33Å; R543-A547 PolarHBondContact O-N 3.29Å; R543-A547 VanDerWaalsContact O-N 3.07Å
544	Y	91.6	Very high	85.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65	-53.1	174.2	173.6	-95.9	0	0	0	111	L527 L530 F531 I540 S541 D542 T546 A547 L548 L569 S573	L527-Y544 HydrophobicContact CB-CE2 4.23Å; L527-Y544 HydrophobicContact CD2-CD2 4.23Å; L527-Y544 HydrophobicContact CD2-CE2 3.81Å; L527-Y544 WeakPolarHBondContact O-CE2 3.2Å; L530-Y544 HydrophobicContact CB-CD2 4.07Å; L530-Y544 HydrophobicContact CB-CE2 4.27Å; F531-Y544 HydrophobicContact CB-CE2 3.95Å; F531-Y544 HydrophobicContact CD2-CE1 4.04Å; I540-Y544 HydrophobicContact CG2-CD1 3.86Å; I540-Y544 HydrophobicContact CG2-CG 4.34Å; S541-Y544 WeakPolarHBondContact O-CB 3.27Å; S541-Y544 PolarHBondContact O-N 3.39Å; D542-Y544 VanDerWaalsContact C-N 3.31Å; D542-Y544 PolarHBondContact O-N 3.32Å; Y544-T546 PolarHBondContact O-N 3.1Å; Y544-A547 WeakPolarHBondContact O-CA 3.08Å; Y544-A547 VanDerWaalsContact O-CB 3.28Å; Y544-A547 WeakPolarHBondContact O-CB 3.08Å; Y544-A547 PolarHBondContact O-N 3.12Å; Y544-L548 HydrophobicContact CE1-CB 4.5Å; Y544-L548 HydrophobicContact CE1-CD2 4.11Å; Y544-L548 PolarHBondContact O-N 3.47Å; Y544-L569 WeakPolarHBondContact OH-CD1 3.36Å; Y544-S573 PolarHBondContact OH-OG 3.35Å; Y544-S573 VanDerWaalsContact OH-OG 3.04Å
545	Y	91.4	Very high	85.6	Confident	3 Å²	3	54.3 Å²	54.3	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-63.9	-39.1	179.8	-72	-75.2	0	0	0	112.6	I540 D542 A547 L548 Y549 S573 D577 R582 F586	I540-Y545 HydrophobicContact CB-CE2 4.22Å; I540-Y545 HydrophobicContact CG2-CD2 4.12Å; I540-Y545 HydrophobicContact CG2-CE2 3.39Å; D542-Y545 PolarHBondContact O-N 3.03Å; Y545-A547 VanDerWaalsContact C-N 3.27Å; Y545-A547 PolarHBondContact O-N 3.29Å; Y545-L548 PolarHBondContact O-N 3.28Å; Y545-Y549 WeakPolarHBondContact O-CB 3.5Å; Y545-Y549 PolarHBondContact O-N 3Å; Y545-S573 WeakPolarHBondContact CE1-O 3.37Å; Y545-S573 PolarHBondContact OH-O 2.71Å; Y545-D577 HydrophobicContact CE1-CB 4.15Å; Y545-D577 WeakPolarHBondContact OH-CA 3.49Å; Y545-D577 WeakPolarHBondContact OH-CB 3.28Å; Y545-R582 HydrophobicContact CD1-CG 4.49Å; Y545-F586 AromaticContact CD1-CE2 3.77Å; Y545-F586 HydrophobicContact CD1-CE2 3.77Å; Y545-F586 HydrophobicContact CD1-CZ 4.05Å; Y545-F586 HydrophobicContact CG-CE2 4.43Å; Y545-F586 WeakPolarHBondContact O-CZ 3.47Å
546	T	91.1	Very high	85.4	Confident	22 Å²	22	52.1 Å²	52.1	14%	0.135	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-38.7	172	-65.1	0	0	0	0	111.9	D542 Y544 R550 R701	D542-T546 WeakPolarHBondContact O-CB 3.5Å; D542-T546 PolarHBondContact O-N 3.01Å; D542-T546 PolarHBondContact O-OG1 2.82Å; Y544-T546 PolarHBondContact O-N 3.1Å; T546-R550 WeakPolarHBondContact O-CB 3.18Å; T546-R550 PolarHBondContact O-N 2.96Å; T546-R701 HydrophobicContact CG2-CG 3.92Å
547	A	91.3	Very high	85.5	Confident	3 Å²	3	49.1 Å²	49.1	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-49.8	175.9	0	0	0	0	0	112.5	F512 L515 L527 R543 Y544 Y545 R550 K551	F512-A547 HydrophobicContact CE1-CB 4.19Å; L515-A547 HydrophobicContact CD2-CB 3.37Å; L527-A547 HydrophobicContact CD2-CB 4.22Å; R543-A547 VanDerWaalsContact O-CB 3.29Å; R543-A547 WeakPolarHBondContact O-CB 3.33Å; R543-A547 PolarHBondContact O-N 3.29Å; R543-A547 VanDerWaalsContact O-N 3.07Å; Y544-A547 WeakPolarHBondContact O-CA 3.08Å; Y544-A547 VanDerWaalsContact O-CB 3.28Å; Y544-A547 WeakPolarHBondContact O-CB 3.08Å; Y544-A547 PolarHBondContact O-N 3.12Å; Y545-A547 VanDerWaalsContact C-N 3.27Å; Y545-A547 PolarHBondContact O-N 3.29Å; A547-R550 PolarHBondContact O-N 2.82Å; A547-K551 PolarHBondContact O-N 2.94Å
548	L	91.7	Very high	85.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-46.3	178	-175.9	69.2	0	0	0	111.3	L527 Y544 Y545 R550 K551 M552 F566 L569 V570 F586	L527-L548 HydrophobicContact CD1-CD1 3.88Å; Y544-L548 HydrophobicContact CE1-CB 4.5Å; Y544-L548 HydrophobicContact CE1-CD2 4.11Å; Y544-L548 PolarHBondContact O-N 3.47Å; Y545-L548 PolarHBondContact O-N 3.28Å; L548-R550 VanDerWaalsContact C-N 3.32Å; L548-R550 PolarHBondContact O-N 3.12Å; L548-K551 PolarHBondContact O-N 3.19Å; L548-M552 PolarHBondContact O-N 2.77Å; L548-F566 HydrophobicContact CD1-CE2 4.13Å; L548-L569 HydrophobicContact CD1-CD2 4.06Å; L548-L569 HydrophobicContact CD1-CG 4.44Å; L548-V570 HydrophobicContact CD1-CG2 4.18Å; L548-V570 HydrophobicContact CD2-CG2 4.43Å; L548-F586 HydrophobicContact CB-CE1 4.25Å; L548-F586 HydrophobicContact CB-CZ 4.14Å; L548-F586 HydrophobicContact CD2-CE1 3.82Å; L548-F586 HydrophobicContact CD2-CZ 4.02Å; L548-F586 HydrophobicContact CG-CE1 3.85Å; L548-F586 HydrophobicContact CG-CZ 4.18Å
549	Y	92.2	Very high	85.9	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.5	-39.2	179.3	-167.8	-127	0	0	0	112.2	Y545 M552 A585 F586 R589 P703	Y545-Y549 WeakPolarHBondContact O-CB 3.5Å; Y545-Y549 PolarHBondContact O-N 3Å; Y549-M552 HydrophobicContact CD2-SD 4.12Å; Y549-A585 HydrophobicContact CE2-CB 4.28Å; Y549-A585 WeakPolarHBondContact CE2-O 3.27Å; Y549-A585 PolarHBondContact OH-O 3.38Å; Y549-F586 AromaticContact CD2-CD1 3.97Å; Y549-F586 HydrophobicContact CD2-CD1 3.97Å; Y549-F586 HydrophobicContact CD2-CD2 4.2Å; Y549-F586 AromaticContact CD2-CE1 3.97Å; Y549-F586 HydrophobicContact CD2-CE1 3.97Å; Y549-F586 HydrophobicContact CD2-CE2 4.23Å; Y549-F586 HydrophobicContact CD2-CG 4.07Å; Y549-F586 HydrophobicContact CD2-CZ 4.12Å; Y549-F586 HydrophobicContact CG-CE1 4.47Å; Y549-F586 HydrophobicContact CG-CZ 4.3Å; Y549-R589 HydrophobicContact CD2-CB 4.46Å; Y549-R589 VanDerWaalsContact CE1-NH2 3.25Å; Y549-R589 HydrophobicContact CE2-CB 3.64Å; Y549-R589 HydrophobicContact CE2-CG 4.19Å; Y549-R589 PolarHBondContact O-NH1 3.1Å; Y549-P703 HydrophobicContact CD1-CB 3.63Å; Y549-P703 HydrophobicContact CD1-CG 4.02Å; Y549-P703 HydrophobicContact CD2-CB 3.96Å; Y549-P703 VanDerWaalsContact CE1-CA 3.5Å; Y549-P703 HydrophobicContact CE1-CB 3.73Å; Y549-P703 HydrophobicContact CE2-CB 4.07Å; Y549-P703 HydrophobicContact CG-CB 3.76Å; Y549-P703 HydrophobicContact CG-CG 4.02Å
550	R	89.6	Confident	86.1	Confident	136 Å²	136	46.3 Å²	46.3	51%	0.513	24%	0.239	S	C	.	.	H	α-helix	trans	-66.9	-40.6	172.6	-176.4	-179.6	179.4	-161.4	-0.6	112	T546 A547 L548 M552 L553	T546-R550 WeakPolarHBondContact O-CB 3.18Å; T546-R550 PolarHBondContact O-N 2.96Å; A547-R550 PolarHBondContact O-N 2.82Å; L548-R550 VanDerWaalsContact C-N 3.32Å; L548-R550 PolarHBondContact O-N 3.12Å; R550-M552 PolarHBondContact O-N 3.23Å; R550-L553 PolarHBondContact O-N 3.07Å
551	K	89.6	Confident	85.9	Confident	14 Å²	14	48.5 Å²	48.5	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-20.5	-178.6	-85.7	-78.8	174.6	174.6	0	113.7	L515 F520 S523 L527 A547 L548 L553 D554	L515-K551 WeakPolarHBondContact O-CE 3.46Å; F520-K551 HydrophobicContact CD2-CD 4.25Å; F520-K551 HydrophobicContact CE2-CD 4.31Å; F520-K551 WeakPolarHBondContact CE2-O 3.45Å; S523-K551 WeakPolarHBondContact OG-CD 3.36Å; S523-K551 VanDerWaalsContact OG-CE 3.23Å; S523-K551 WeakPolarHBondContact OG-CE 3.24Å; S523-K551 PolarHBondContact OG-NZ 2.78Å; L527-K551 HydrophobicContact CD1-CB 4.44Å; L527-K551 HydrophobicContact CD1-CG 4.37Å; A547-K551 PolarHBondContact O-N 2.94Å; L548-K551 PolarHBondContact O-N 3.19Å; K551-L553 PolarHBondContact O-N 3.19Å; K551-D554 HydrophobicContact CD-CB 4.17Å; K551-D554 WeakPolarHBondContact CD-OD2 3.49Å; K551-D554 WeakPolarHBondContact CE-OD2 3.46Å; K551-D554 IonicContact NZ-OD2 3.06Å; K551-D554 PolarHBondContact NZ-OD2 3.05Å; K551-D554 WeakPolarHBondContact O-CB 3.44Å; K551-D554 PolarHBondContact O-N 2.93Å; K551-D554 VanDerWaalsContact O-N 3.16Å
552	M	88.4	Confident	86	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25	171.5	-63.5	171.5	77.5	0	0	114	L548 Y549 R550 F566 F586 R589 L590 V593	L548-M552 PolarHBondContact O-N 2.77Å; Y549-M552 HydrophobicContact CD2-SD 4.12Å; R550-M552 PolarHBondContact O-N 3.23Å; M552-F566 HydrophobicContact CG-CZ 4.01Å; M552-F586 HydrophobicContact CE-CD1 4.3Å; M552-F586 HydrophobicContact SD-CD1 3.37Å; M552-F586 WeakPolarHBondContact SD-CD1 3.17Å; M552-F586 HydrophobicContact SD-CE1 3.63Å; M552-F586 HydrophobicContact SD-CG 4.48Å; M552-R589 HydrophobicContact CB-CG 4.33Å; M552-R589 HydrophobicContact CE-CB 4.23Å; M552-R589 HydrophobicContact CE-CG 4.2Å; M552-R589 HydrophobicContact SD-CG 4.36Å; M552-L590 VanDerWaalsContact CE-CA 3.48Å; M552-L590 HydrophobicContact CE-CB 3.6Å; M552-L590 HydrophobicContact CE-CD1 4.17Å; M552-L590 HydrophobicContact CE-CG 4.46Å; M552-V593 VanDerWaalsContact O-CG2 3.3Å; M552-V593 WeakPolarHBondContact O-CG2 3.25Å
553	L	88.1	Confident	86	Confident	84 Å²	84	47.1 Å²	47.1	44%	0.44	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	14.1	176.9	-57.7	-178.5	0	0	0	112.7	R550 K551 P555 R589 V593	R550-L553 PolarHBondContact O-N 3.07Å; K551-L553 PolarHBondContact O-N 3.19Å; L553-P555 WeakPolarHBondContact O-CD 3.46Å; L553-R589 HydrophobicContact CD2-CG 4.04Å; L553-R589 HydrophobicContact CG-CG 4.48Å; L553-V593 HydrophobicContact CD2-CG2 4.02Å
554	D	85.6	Confident	86	Confident	47 Å²	47	43.9 Å²	43.9	25%	0.251	24%	0.239	S	C	.	.			trans	-78.2	121	176.7	-168.5	-36.3	0	0	0	109.4	F520 K551 G556 L557	F520-D554 HydrophobicContact CD2-CB 3.87Å; F520-D554 HydrophobicContact CE2-CB 4.11Å; K551-D554 HydrophobicContact CD-CB 4.17Å; K551-D554 WeakPolarHBondContact CD-OD2 3.49Å; K551-D554 WeakPolarHBondContact CE-OD2 3.46Å; K551-D554 IonicContact NZ-OD2 3.06Å; K551-D554 PolarHBondContact NZ-OD2 3.05Å; K551-D554 WeakPolarHBondContact O-CB 3.44Å; K551-D554 PolarHBondContact O-N 2.93Å; K551-D554 VanDerWaalsContact O-N 3.16Å; D554-G556 PolarHBondContact O-N 3.14Å; D554-G556 PolarHBondContact OD1-N 3.47Å; D554-L557 WeakPolarHBondContact O-CB 3.27Å; D554-L557 PolarHBondContact O-N 2.89Å
555	P	82.3	Confident	85.7	Confident	107 Å²	107	46 Å²	46	70%	0.695	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-56.2	-23.6	179.5	-26.5	35.7	0	0	0	113.9	L553 L557 M558	L553-P555 WeakPolarHBondContact O-CD 3.46Å; P555-L557 PolarHBondContact O-N 3.36Å; P555-L557 VanDerWaalsContact O-N 3.1Å; P555-M558 PolarHBondContact O-N 2.82Å
556	G	80.9	Confident	85.7	Confident	23 Å²	23	46 Å²	46	24%	0.237	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-62.4	-10.6	173.9	0	0	0	0	0	114.9	D554 M559 C560	D554-G556 PolarHBondContact O-N 3.14Å; D554-G556 PolarHBondContact OD1-N 3.47Å; G556-M559 CarbonylContact O-C 3Å; G556-C560 PolarHBondContact O-N 3.02Å; G556-C560 VanDerWaalsContact O-N 3.12Å
557	L	84.3	Confident	85.7	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.016	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-66.8	-36.5	173.7	177.7	58.5	0	0	0	112.8	F520 D554 P555 M559 C560 F566 V593 F601	F520-L557 HydrophobicContact CE1-CB 4.46Å; F520-L557 HydrophobicContact CE1-CD1 3.84Å; F520-L557 HydrophobicContact CE2-CB 4.14Å; F520-L557 HydrophobicContact CZ-CB 4.08Å; F520-L557 HydrophobicContact CZ-CD1 3.7Å; F520-L557 HydrophobicContact CZ-CG 4.41Å; D554-L557 WeakPolarHBondContact O-CB 3.27Å; D554-L557 PolarHBondContact O-N 2.89Å; P555-L557 PolarHBondContact O-N 3.36Å; P555-L557 VanDerWaalsContact O-N 3.1Å; L557-M559 VanDerWaalsContact C-N 3.32Å; L557-M559 PolarHBondContact O-N 3.01Å; L557-C560 WeakPolarHBondContact O-CB 3.33Å; L557-C560 PolarHBondContact O-N 3.22Å; L557-F566 HydrophobicContact CD1-CD1 3.59Å; L557-F566 HydrophobicContact CD1-CE1 3.74Å; L557-F566 HydrophobicContact CD1-CG 4.39Å; L557-F566 HydrophobicContact CD2-CE1 3.98Å; L557-V593 HydrophobicContact CD2-CG1 3.64Å; L557-F601 HydrophobicContact CD1-CE2 4.01Å; L557-F601 HydrophobicContact CD1-CZ 4.24Å; L557-F601 HydrophobicContact CD2-CZ 4.15Å; L557-F601 HydrophobicContact CG-CZ 4.48Å
558	M	80.4	Confident	85.6	Confident	84 Å²	84	49.6 Å²	49.6	41%	0.414	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-36	177.4	-68.5	177.8	-179.3	0	0	112.1	P555 C560 Q596	P555-M558 PolarHBondContact O-N 2.82Å; M558-C560 VanDerWaalsContact C-N 3.33Å; M558-Q596 HydrophobicContact CE-CB 3.63Å; M558-Q596 WeakPolarHBondContact CE-O 3.43Å
559	M	79.9	Confident	85.6	Confident	168 Å²	168	50 Å²	50	83%	0.828	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	13.8	179.1	-55.3	-60	170.7	0	0	112.5	G556 L557	G556-M559 CarbonylContact O-C 3Å; L557-M559 VanDerWaalsContact C-N 3.32Å; L557-M559 PolarHBondContact O-N 3.01Å
560	C	79.9	Confident	85.7	Confident	5 Å²	5	50 Å²	50	3%	0.034	27%	0.27	C	S	.	.			trans	-77	124.8	178	-180	0	0	0	0	109.9	F520 N521 G556 L557 M558 K562 Q563	F520-C560 HydrophobicContact CD1-CB 3.72Å; F520-C560 VanDerWaalsContact CD1-SG 3.59Å; F520-C560 HydrophobicContact CE1-CB 3.96Å; N521-C560 PolarHBondContact OD1-SG 3.09Å; N521-C560 VanDerWaalsContact OD1-SG 3.35Å; G556-C560 PolarHBondContact O-N 3.02Å; G556-C560 VanDerWaalsContact O-N 3.12Å; L557-C560 WeakPolarHBondContact O-CB 3.33Å; L557-C560 PolarHBondContact O-N 3.22Å; M558-C560 VanDerWaalsContact C-N 3.33Å; C560-K562 PolarHBondContact SG-N 3.46Å; C560-Q563 HydrophobicContact CB-CG 4.22Å; C560-Q563 WeakPolarHBondContact O-CG 3.38Å; C560-Q563 PolarHBondContact O-NE2 3.1Å
561	S	76.7	Confident	85.8	Confident	79 Å²	79	46.7 Å²	46.7	55%	0.552	26%	0.258	S	S	*	.	S	Bend	trans	-78.6	-32.8	167.2	52.3	0	0	0	0	112	N521 Q563	N521-S561 PolarHBondContact ND2-OG 3.34Å; S561-Q563 PolarHBondContact O-N 2.73Å; S561-Q563 VanDerWaalsContact O-N 3.07Å
562	K	79.7	Confident	85.8	Confident	50 Å²	50	51.2 Å²	51.2	22%	0.217	28%	0.278	C	S	.	.			trans	-86.7	41.4	-175.7	-60.7	-169.4	171.6	-161.7	0	113.4	C560 A564 M565 F566	C560-K562 PolarHBondContact SG-N 3.46Å; K562-A564 PolarHBondContact O-N 3.21Å; K562-M565 HydrophobicContact CB-CB 4.4Å; K562-M565 HydrophobicContact CB-CG 4.4Å; K562-M565 HydrophobicContact CB-SD 4.15Å; K562-M565 HydrophobicContact CD-CE 4.34Å; K562-M565 HydrophobicContact CD-SD 3.79Å; K562-M565 HydrophobicContact CG-SD 4.25Å; K562-M565 PolarHBondContact O-N 3.25Å; K562-F566 PolarHBondContact O-N 2.77Å
563	Q	84.9	Confident	85.9	Confident	45 Å²	45	51.1 Å²	51.1	21%	0.21	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-41.1	-174.6	-55.2	-170.1	0.9	0	0	112.8	C560 S561 M565 F566 L567 F601	C560-Q563 HydrophobicContact CB-CG 4.22Å; C560-Q563 WeakPolarHBondContact O-CG 3.38Å; C560-Q563 PolarHBondContact O-NE2 3.1Å; S561-Q563 PolarHBondContact O-N 2.73Å; S561-Q563 VanDerWaalsContact O-N 3.07Å; Q563-M565 PolarHBondContact O-N 2.99Å; Q563-F566 PolarHBondContact O-N 2.91Å; Q563-L567 PolarHBondContact O-N 3.39Å; Q563-F601 HydrophobicContact CB-CD2 4.31Å
564	A	86.8	Confident	86.1	Confident	45 Å²	45	47.2 Å²	47.2	37%	0.372	26%	0.257	S	S	.	.	H	α-helix	trans	-58.1	-45.2	176.1	0	0	0	0	0	112.2	K562 F566 L567 N568 L747	K562-A564 PolarHBondContact O-N 3.21Å; A564-F566 VanDerWaalsContact C-N 3.31Å; A564-F566 PolarHBondContact O-N 3.39Å; A564-L567 PolarHBondContact O-N 2.92Å; A564-N568 VanDerWaalsContact O-CB 3.27Å; A564-N568 WeakPolarHBondContact O-CB 3.47Å; A564-N568 VanDerWaalsContact O-CG 3.22Å; A564-N568 PolarHBondContact O-N 3.08Å; A564-N568 PolarHBondContact O-ND2 2.92Å; A564-L747 HydrophobicContact CB-CD1 3.6Å
565	M	86.2	Confident	86.3	Confident	45 Å²	45	51 Å²	51	22%	0.222	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-38.3	178.4	-60.3	-175.9	-175.2	0	0	111.7	M528 K562 Q563 L569	M528-M565 HydrophobicContact SD-CB 4.26Å; K562-M565 HydrophobicContact CB-CB 4.4Å; K562-M565 HydrophobicContact CB-CG 4.4Å; K562-M565 HydrophobicContact CB-SD 4.15Å; K562-M565 HydrophobicContact CD-CE 4.34Å; K562-M565 HydrophobicContact CD-SD 3.79Å; K562-M565 HydrophobicContact CG-SD 4.25Å; K562-M565 PolarHBondContact O-N 3.25Å; Q563-M565 PolarHBondContact O-N 2.99Å; M565-L569 VanDerWaalsContact O-CB 3.28Å; M565-L569 WeakPolarHBondContact O-CB 3.26Å; M565-L569 PolarHBondContact O-N 3.42Å
566	F	91.2	Very high	86.6	Confident	2 Å²	2	48 Å²	48	1%	0.009	26%	0.255	C	S	.	.	H	α-helix	trans	-67.8	-46.8	176.5	179.1	-113.3	0	0	0	112.5	F520 V524 L548 M552 L557 K562 Q563 A564 L569 V570	F520-F566 HydrophobicContact CE1-CB 4.42Å; F520-F566 HydrophobicContact CE1-CD2 4.29Å; F520-F566 HydrophobicContact CE1-CG 4.2Å; F520-F566 HydrophobicContact CZ-CD1 4.21Å; F520-F566 AromaticContact CZ-CD2 3.75Å; F520-F566 HydrophobicContact CZ-CD2 3.75Å; F520-F566 HydrophobicContact CZ-CE1 4.28Å; F520-F566 AromaticContact CZ-CE2 3.83Å; F520-F566 HydrophobicContact CZ-CE2 3.83Å; F520-F566 AromaticContact CZ-CG 3.93Å; F520-F566 HydrophobicContact CZ-CG 3.93Å; F520-F566 HydrophobicContact CZ-CZ 4.09Å; V524-F566 HydrophobicContact CG1-CB 4.26Å; V524-F566 HydrophobicContact CG2-CB 4.23Å; V524-F566 HydrophobicContact CG2-CD2 3.84Å; V524-F566 HydrophobicContact CG2-CG 4.4Å; L548-F566 HydrophobicContact CD1-CE2 4.13Å; M552-F566 HydrophobicContact CG-CZ 4.01Å; L557-F566 HydrophobicContact CD1-CD1 3.59Å; L557-F566 HydrophobicContact CD1-CE1 3.74Å; L557-F566 HydrophobicContact CD1-CG 4.39Å; L557-F566 HydrophobicContact CD2-CE1 3.98Å; K562-F566 PolarHBondContact O-N 2.77Å; Q563-F566 PolarHBondContact O-N 2.91Å; A564-F566 VanDerWaalsContact C-N 3.31Å; A564-F566 PolarHBondContact O-N 3.39Å; F566-L569 WeakPolarHBondContact O-CB 3.46Å; F566-L569 PolarHBondContact O-N 3.16Å; F566-V570 HydrophobicContact CD2-CG2 4.43Å; F566-V570 HydrophobicContact CE1-CG2 4.28Å; F566-V570 HydrophobicContact CE2-CG2 4.06Å; F566-V570 HydrophobicContact CZ-CG2 3.98Å; F566-V570 WeakPolarHBondContact O-CG2 3.44Å; F566-V570 PolarHBondContact O-N 3.44Å
567	L	90.6	Very high	86.9	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-42.4	176.6	-69	175.5	0	0	0	111.3	Q563 A564 L569 V570 Y571 L590 F601 A605 L608 L747	Q563-L567 PolarHBondContact O-N 3.39Å; A564-L567 PolarHBondContact O-N 2.92Å; L567-L569 VanDerWaalsContact C-N 3.33Å; L567-L569 PolarHBondContact O-N 3.46Å; L567-V570 PolarHBondContact O-N 2.69Å; L567-Y571 PolarHBondContact O-N 3.2Å; L567-L590 HydrophobicContact CD2-CD1 4.48Å; L567-F601 HydrophobicContact CD1-CD2 4.22Å; L567-F601 HydrophobicContact CD1-CE2 4.11Å; L567-F601 HydrophobicContact CD2-CE2 3.93Å; L567-F601 HydrophobicContact CD2-CZ 3.92Å; L567-F601 HydrophobicContact CG-CE2 4.05Å; L567-A605 HydrophobicContact CD2-CB 4.34Å; L567-L608 HydrophobicContact CB-CD1 4.01Å; L567-L608 HydrophobicContact CD2-CD1 4.15Å; L567-L608 WeakPolarHBondContact O-CD1 3.47Å; L567-L747 HydrophobicContact CD1-CD1 4.41Å; L567-L747 HydrophobicContact CD1-CD2 4.12Å
568	N	89.8	Confident	87	Confident	95 Å²	95	54.7 Å²	54.7	51%	0.508	28%	0.284	S	S	.	.	H	α-helix	trans	-62	-38.8	175.5	-74.6	-20.4	0	0	0	112.6	A564 K572	A564-N568 VanDerWaalsContact O-CB 3.27Å; A564-N568 WeakPolarHBondContact O-CB 3.47Å; A564-N568 VanDerWaalsContact O-CG 3.22Å; A564-N568 PolarHBondContact O-N 3.08Å; A564-N568 PolarHBondContact O-ND2 2.92Å; N568-K572 WeakPolarHBondContact O-CB 3.27Å; N568-K572 WeakPolarHBondContact O-CG 3.2Å; N568-K572 PolarHBondContact O-N 3.41Å
569	L	91.5	Very high	87.3	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-45.5	173.1	176.7	67.1	0	0	0	111.7	V524 L527 M528 F531 Y544 L548 M565 F566 L567 K572 S573	V524-L569 HydrophobicContact CG1-CD2 4.24Å; L527-L569 HydrophobicContact CB-CD2 3.53Å; L527-L569 HydrophobicContact CD1-CD2 4.37Å; M528-L569 HydrophobicContact CG-CB 4.45Å; M528-L569 HydrophobicContact CG-CD1 4.04Å; M528-L569 HydrophobicContact CG-CD2 4.18Å; M528-L569 HydrophobicContact CG-CG 4.45Å; F531-L569 HydrophobicContact CB-CD1 3.86Å; F531-L569 HydrophobicContact CD1-CD1 4.38Å; F531-L569 HydrophobicContact CG-CD1 4.16Å; Y544-L569 WeakPolarHBondContact OH-CD1 3.36Å; L548-L569 HydrophobicContact CD1-CD2 4.06Å; L548-L569 HydrophobicContact CD1-CG 4.44Å; M565-L569 VanDerWaalsContact O-CB 3.28Å; M565-L569 WeakPolarHBondContact O-CB 3.26Å; M565-L569 PolarHBondContact O-N 3.42Å; F566-L569 WeakPolarHBondContact O-CB 3.46Å; F566-L569 PolarHBondContact O-N 3.16Å; L567-L569 VanDerWaalsContact C-N 3.33Å; L567-L569 PolarHBondContact O-N 3.46Å; L569-K572 PolarHBondContact O-N 3.34Å; L569-S573 VanDerWaalsContact O-CB 3.26Å; L569-S573 WeakPolarHBondContact O-CB 3.34Å; L569-S573 PolarHBondContact O-N 3.41Å; L569-S573 PolarHBondContact O-OG 3.28Å
570	V	92.6	Very high	87.6	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-45.7	176.7	169.8	0	0	0	0	110.5	L548 F566 L567 S573 L574 L608	L548-V570 HydrophobicContact CD1-CG2 4.18Å; L548-V570 HydrophobicContact CD2-CG2 4.43Å; F566-V570 HydrophobicContact CD2-CG2 4.43Å; F566-V570 HydrophobicContact CE1-CG2 4.28Å; F566-V570 HydrophobicContact CE2-CG2 4.06Å; F566-V570 HydrophobicContact CZ-CG2 3.98Å; F566-V570 WeakPolarHBondContact O-CG2 3.44Å; F566-V570 PolarHBondContact O-N 3.44Å; L567-V570 PolarHBondContact O-N 2.69Å; V570-S573 PolarHBondContact O-N 3.32Å; V570-L574 HydrophobicContact CG1-CD1 3.6Å; V570-L574 HydrophobicContact CG1-CG 4.35Å; V570-L574 WeakPolarHBondContact O-CB 3.49Å; V570-L574 VanDerWaalsContact O-CG 3.23Å; V570-L574 WeakPolarHBondContact O-CG 3Å; V570-L574 PolarHBondContact O-N 2.89Å; V570-L608 HydrophobicContact CB-CD1 4.47Å; V570-L608 HydrophobicContact CG1-CD1 4.38Å; V570-L608 HydrophobicContact CG1-CD2 4.44Å
571	Y	91.7	Very high	88	Confident	65 Å²	65	52.7 Å²	52.7	26%	0.255	27%	0.274	S	S	.	.	H	α-helix	trans	-58.8	-52.5	175.9	176	-110.1	0	0	0	112.1	L567 S573 L574 K575 L608 E611 I612	L567-Y571 PolarHBondContact O-N 3.2Å; Y571-S573 VanDerWaalsContact C-N 3.33Å; Y571-S573 PolarHBondContact O-N 2.97Å; Y571-L574 PolarHBondContact O-N 2.72Å; Y571-K575 HydrophobicContact CE1-CD 4.46Å; Y571-K575 WeakPolarHBondContact O-CB 3.23Å; Y571-K575 PolarHBondContact O-N 3.49Å; Y571-L608 HydrophobicContact CD2-CG 4.4Å; Y571-E611 HydrophobicContact CD2-CB 4.45Å; Y571-E611 HydrophobicContact CE2-CB 3.74Å; Y571-I612 HydrophobicContact CD2-CD1 4.45Å; Y571-I612 HydrophobicContact CD2-CG1 3.95Å; Y571-I612 HydrophobicContact CE2-CG1 4.26Å
572	K	90.2	Very high	88.6	Confident	110 Å²	110	49.6 Å²	49.6	48%	0.478	25%	0.25	S	C	.	.	H	α-helix	trans	-59.3	-43.6	178.6	-72.3	-178.5	178.6	-173.1	0	111.6	F531 N568 L569 L574 K575 A576	F531-K572 HydrophobicContact CE1-CB 3.78Å; F531-K572 HydrophobicContact CZ-CB 4.04Å; N568-K572 WeakPolarHBondContact O-CB 3.27Å; N568-K572 WeakPolarHBondContact O-CG 3.2Å; N568-K572 PolarHBondContact O-N 3.41Å; L569-K572 PolarHBondContact O-N 3.34Å; K572-L574 VanDerWaalsContact C-N 3.34Å; K572-L574 PolarHBondContact O-N 2.95Å; K572-K575 PolarHBondContact O-N 3.48Å; K572-A576 WeakPolarHBondContact O-CB 3.36Å; K572-A576 PolarHBondContact O-N 2.97Å; K572-A576 VanDerWaalsContact O-N 3.08Å
573	S	91.4	Very high	89.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-39	177.8	-58.6	0	0	0	0	113.3	Y544 Y545 L569 V570 Y571 D577	Y544-S573 PolarHBondContact OH-OG 3.35Å; Y544-S573 VanDerWaalsContact OH-OG 3.04Å; Y545-S573 WeakPolarHBondContact CE1-O 3.37Å; Y545-S573 PolarHBondContact OH-O 2.71Å; L569-S573 VanDerWaalsContact O-CB 3.26Å; L569-S573 WeakPolarHBondContact O-CB 3.34Å; L569-S573 PolarHBondContact O-N 3.41Å; L569-S573 PolarHBondContact O-OG 3.28Å; V570-S573 PolarHBondContact O-N 3.32Å; Y571-S573 VanDerWaalsContact C-N 3.33Å; Y571-S573 PolarHBondContact O-N 2.97Å; S573-D577 PolarHBondContact O-N 3.39Å
574	L	91	Very high	89.3	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-86.7	-21.6	-178.5	-65.2	175.2	0	0	0	113.3	V570 Y571 K572 V583 F586 I612 K616	V570-L574 HydrophobicContact CG1-CD1 3.6Å; V570-L574 HydrophobicContact CG1-CG 4.35Å; V570-L574 WeakPolarHBondContact O-CB 3.49Å; V570-L574 VanDerWaalsContact O-CG 3.23Å; V570-L574 WeakPolarHBondContact O-CG 3Å; V570-L574 PolarHBondContact O-N 2.89Å; Y571-L574 PolarHBondContact O-N 2.72Å; K572-L574 VanDerWaalsContact C-N 3.34Å; K572-L574 PolarHBondContact O-N 2.95Å; L574-V583 HydrophobicContact CD2-CG1 4.43Å; L574-V583 HydrophobicContact CD2-CG2 4.29Å; L574-F586 HydrophobicContact CD1-CB 3.81Å; L574-F586 HydrophobicContact CD1-CD1 4.46Å; L574-F586 HydrophobicContact CD1-CG 4.31Å; L574-F586 HydrophobicContact CD2-CB 3.58Å; L574-F586 HydrophobicContact CD2-CD1 4.19Å; L574-F586 HydrophobicContact CD2-CD2 3.7Å; L574-F586 HydrophobicContact CD2-CE2 4.39Å; L574-F586 HydrophobicContact CD2-CG 3.59Å; L574-F586 HydrophobicContact CG-CB 4.34Å; L574-F586 HydrophobicContact CG-CG 4.46Å; L574-I612 HydrophobicContact CB-CD1 3.64Å; L574-I612 HydrophobicContact CD1-CD1 3.59Å; L574-I612 HydrophobicContact CG-CD1 4.27Å; L574-K616 PolarHBondContact O-NZ 3.41Å
575	K	89.9	Confident	89.6	Confident	128 Å²	128	44.2 Å²	44.2	56%	0.557	22%	0.217	S	C	*	.	H	α-helix	trans	-68.4	-49.5	167	-170.1	176.2	179.5	-177.7	0	109.9	Y571 K572 D577 K616	Y571-K575 HydrophobicContact CE1-CD 4.46Å; Y571-K575 WeakPolarHBondContact O-CB 3.23Å; Y571-K575 PolarHBondContact O-N 3.49Å; K572-K575 PolarHBondContact O-N 3.48Å; K575-D577 PolarHBondContact O-N 2.88Å; K575-K616 PolarHBondContact O-NZ 2.96Å
576	A	88.6	Confident	89.9	Confident	43 Å²	43	42.1 Å²	42.1	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-69.8	-21.5	-178.7	0	0	0	0	0	115.4	F531 I540 K572	F531-A576 HydrophobicContact CE2-CB 4.29Å; F531-A576 HydrophobicContact CZ-CB 4.17Å; I540-A576 HydrophobicContact CD1-CB 4.3Å; K572-A576 WeakPolarHBondContact O-CB 3.36Å; K572-A576 PolarHBondContact O-N 2.97Å; K572-A576 VanDerWaalsContact O-N 3.08Å
577	D	88.4	Confident	89.9	Confident	6 Å²	6	42.3 Å²	42.3	3%	0.032	21%	0.208	C	C	.	.			trans	-66.2	135.2	-179.9	-165.7	-2.8	0	0	0	112.7	Y545 S573 K575 V579 R582 V583 K616	Y545-D577 HydrophobicContact CE1-CB 4.15Å; Y545-D577 WeakPolarHBondContact OH-CA 3.49Å; Y545-D577 WeakPolarHBondContact OH-CB 3.28Å; S573-D577 PolarHBondContact O-N 3.39Å; K575-D577 PolarHBondContact O-N 2.88Å; D577-V579 PolarHBondContact OD1-N 3.21Å; D577-R582 VanDerWaalsContact CG-NE 3.35Å; D577-R582 IonicContact OD1-CZ 2.65Å; D577-R582 IonicContact OD1-NE 3.55Å; D577-R582 PolarHBondContact OD1-NE 3.23Å; D577-R582 IonicContact OD1-NH2 3.9Å; D577-R582 PolarHBondContact OD1-NH2 3.04Å; D577-R582 WeakPolarHBondContact OD2-CB 3.4Å; D577-R582 VanDerWaalsContact OD2-CG 3.27Å; D577-R582 WeakPolarHBondContact OD2-CG 3.37Å; D577-R582 IonicContact OD2-CZ 3.79Å; D577-R582 IonicContact OD2-NE 3.04Å; D577-R582 PolarHBondContact OD2-NE 3.37Å; D577-R582 IonicContact OD2-NH2 2.82Å; D577-V583 HydrophobicContact CB-CG2 4Å; D577-K616 PolarHBondContact O-NZ 3.41Å
578	I	85.6	Confident	89.9	Confident	160 Å²	160	42.4 Å²	42.4	82%	0.821	21%	0.208	S	C	*	.			trans	-88.4	-23.3	173.8	-58	174.6	0	0	0	111.2	L580	I578-L580 PolarHBondContact O-N 3.44Å
579	V	87.9	Confident	90	Very high	56 Å²	56	38 Å²	38	34%	0.339	19%	0.185	S	C	.	.			trans	-87.4	97.4	-167.2	-172.8	0	0	0	0	112	D577 R581 R582 V583 L704	D577-V579 PolarHBondContact OD1-N 3.21Å; V579-R581 VanDerWaalsContact C-N 3.28Å; V579-R581 HydrophobicContact CG1-CB 4.22Å; V579-R581 PolarHBondContact O-N 2.86Å; V579-R581 VanDerWaalsContact O-N 3.16Å; V579-R582 HydrophobicContact CB-CB 4.15Å; V579-R582 HydrophobicContact CG1-CB 4.23Å; V579-R582 WeakPolarHBondContact O-CB 3.38Å; V579-R582 PolarHBondContact O-N 2.88Å; V579-V583 PolarHBondContact O-N 3.39Å; V579-L704 HydrophobicContact CG1-CD2 3.66Å
580	L	86.1	Confident	90.1	Very high	83 Å²	83	37.8 Å²	37.8	44%	0.435	18%	0.183	S	C	.	.	H	α-helix	trans	-52.5	-39.7	-179.4	-68	178.4	0	0	0	114	I578 R582 V583 K584 K616	I578-L580 PolarHBondContact O-N 3.44Å; L580-R582 VanDerWaalsContact C-N 3.26Å; L580-R582 PolarHBondContact O-N 3.29Å; L580-V583 PolarHBondContact O-N 3.21Å; L580-V583 VanDerWaalsContact O-N 3.12Å; L580-K584 WeakPolarHBondContact O-CG 3.27Å; L580-K584 PolarHBondContact O-N 3.34Å; L580-K616 HydrophobicContact CD2-CB 4.3Å; L580-K616 HydrophobicContact CD2-CD 4.15Å; L580-K616 HydrophobicContact CD2-CG 4.47Å
581	R	87.1	Confident	90	Very high	77 Å²	77	37.8 Å²	37.8	29%	0.291	18%	0.183	S	C	.	.	H	α-helix	trans	-52.8	-43.2	175.5	-72.2	-177.8	162.2	-164	-21.7	112.6	V579 A585 G689 E709	V579-R581 VanDerWaalsContact C-N 3.28Å; V579-R581 HydrophobicContact CG1-CB 4.22Å; V579-R581 PolarHBondContact O-N 2.86Å; V579-R581 VanDerWaalsContact O-N 3.16Å; R581-A585 PolarHBondContact O-N 3.07Å; R581-A585 VanDerWaalsContact O-N 3.09Å; R581-G689 PolarHBondContact NH1-O 2.84Å; R581-E709 WeakPolarHBondContact CD-OE1 3.43Å; R581-E709 IonicContact CZ-OE1 2.88Å; R581-E709 IonicContact CZ-OE2 2.94Å; R581-E709 IonicContact NE-OE1 2.68Å; R581-E709 PolarHBondContact NE-OE1 3Å; R581-E709 IonicContact NE-OE2 2.73Å; R581-E709 PolarHBondContact NE-OE2 3.33Å; R581-E709 IonicContact NH1-OE1 2.79Å; R581-E709 VanDerWaalsContact NH2-CD 3.29Å; R581-E709 IonicContact NH2-OE1 2.87Å; R581-E709 PolarHBondContact NH2-OE1 3.46Å; R581-E709 IonicContact NH2-OE2 2.65Å; R581-E709 PolarHBondContact NH2-OE2 2.88Å
582	R	90.1	Very high	90	Very high	14 Å²	14	36.9 Å²	36.9	5%	0.053	18%	0.182	C	C	.	.	H	α-helix	trans	-69.1	-43	178.5	-176.9	155.5	61.6	-163.5	4.4	111.1	D542 Y545 D577 V579 L580 A585 F586 P703 L704	D542-R582 IonicContact OD1-CZ 3.04Å; D542-R582 IonicContact OD1-NH1 2.99Å; D542-R582 PolarHBondContact OD1-NH1 3.16Å; Y545-R582 HydrophobicContact CD1-CG 4.49Å; D577-R582 VanDerWaalsContact CG-NE 3.35Å; D577-R582 IonicContact OD1-CZ 2.65Å; D577-R582 IonicContact OD1-NE 3.55Å; D577-R582 PolarHBondContact OD1-NE 3.23Å; D577-R582 IonicContact OD1-NH2 3.9Å; D577-R582 PolarHBondContact OD1-NH2 3.04Å; D577-R582 WeakPolarHBondContact OD2-CB 3.4Å; D577-R582 VanDerWaalsContact OD2-CG 3.27Å; D577-R582 WeakPolarHBondContact OD2-CG 3.37Å; D577-R582 IonicContact OD2-CZ 3.79Å; D577-R582 IonicContact OD2-NE 3.04Å; D577-R582 PolarHBondContact OD2-NE 3.37Å; D577-R582 IonicContact OD2-NH2 2.82Å; V579-R582 HydrophobicContact CB-CB 4.15Å; V579-R582 HydrophobicContact CG1-CB 4.23Å; V579-R582 WeakPolarHBondContact O-CB 3.38Å; V579-R582 PolarHBondContact O-N 2.88Å; L580-R582 VanDerWaalsContact C-N 3.26Å; L580-R582 PolarHBondContact O-N 3.29Å; R582-A585 WeakPolarHBondContact O-CB 3.46Å; R582-A585 PolarHBondContact O-N 3.5Å; R582-F586 HydrophobicContact CG-CD2 3.87Å; R582-F586 HydrophobicContact CG-CE2 3.87Å; R582-F586 WeakPolarHBondContact O-CD2 3.44Å; R582-F586 PolarHBondContact O-N 2.95Å; R582-P703 HydrophobicContact CG-CB 4.07Å; R582-P703 HydrophobicContact CG-CG 3.8Å; R582-L704 HydrophobicContact CB-CD2 3.9Å
583	V	90.3	Very high	90	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.9	-43	175.9	-173.4	0	0	0	0	111.4	L574 D577 V579 L580 A585 F586 V587 I612 K616 L619	L574-V583 HydrophobicContact CD2-CG1 4.43Å; L574-V583 HydrophobicContact CD2-CG2 4.29Å; D577-V583 HydrophobicContact CB-CG2 4Å; V579-V583 PolarHBondContact O-N 3.39Å; L580-V583 PolarHBondContact O-N 3.21Å; L580-V583 VanDerWaalsContact O-N 3.12Å; V583-A585 VanDerWaalsContact C-N 3.33Å; V583-A585 PolarHBondContact O-N 3.19Å; V583-F586 PolarHBondContact O-N 3.21Å; V583-V587 HydrophobicContact CG1-CG2 4.38Å; V583-V587 WeakPolarHBondContact O-CG2 3.34Å; V583-V587 PolarHBondContact O-N 3.46Å; V583-I612 HydrophobicContact CG1-CG2 3.84Å; V583-K616 HydrophobicContact CG2-CD 4.39Å; V583-L619 HydrophobicContact CB-CD2 4.26Å; V583-L619 HydrophobicContact CG1-CD1 3.72Å; V583-L619 HydrophobicContact CG1-CD2 4.09Å
584	K	89.3	Confident	89.9	Confident	27 Å²	27	32.2 Å²	32.2	12%	0.117	16%	0.163	C	C	.	.	H	α-helix	trans	-54.2	-46.9	171.8	-69.7	-160.4	165.5	-167.6	0	111.5	L580 F586 V587 K588 L619 S621 Q622 E709	L580-K584 WeakPolarHBondContact O-CG 3.27Å; L580-K584 PolarHBondContact O-N 3.34Å; K584-F586 PolarHBondContact O-N 3.27Å; K584-V587 PolarHBondContact O-N 3.47Å; K584-K588 WeakPolarHBondContact O-CB 3.3Å; K584-K588 PolarHBondContact O-N 3.28Å; K584-L619 HydrophobicContact CB-CD2 4.48Å; K584-L619 HydrophobicContact CG-CD2 3.56Å; K584-S621 WeakPolarHBondContact CE-OG 3.47Å; K584-S621 PolarHBondContact NZ-OG 2.82Å; K584-Q622 VanDerWaalsContact CB-OE1 3.25Å; K584-Q622 HydrophobicContact CD-CG 3.87Å; K584-Q622 HydrophobicContact CG-CG 4.46Å; K584-E709 HydrophobicContact CD-CB 3.98Å
585	A	91.2	Very high	89.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-43.6	176.9	0	0	0	0	0	113.9	Y549 R581 R582 V583 R589 P703 C706 A708	Y549-A585 HydrophobicContact CE2-CB 4.28Å; Y549-A585 WeakPolarHBondContact CE2-O 3.27Å; Y549-A585 PolarHBondContact OH-O 3.38Å; R581-A585 PolarHBondContact O-N 3.07Å; R581-A585 VanDerWaalsContact O-N 3.09Å; R582-A585 WeakPolarHBondContact O-CB 3.46Å; R582-A585 PolarHBondContact O-N 3.5Å; V583-A585 VanDerWaalsContact C-N 3.33Å; V583-A585 PolarHBondContact O-N 3.19Å; A585-R589 PolarHBondContact O-N 2.9Å; A585-P703 HydrophobicContact CB-CB 3.76Å; A585-P703 WeakPolarHBondContact CB-O 3.35Å; A585-C706 WeakPolarHBondContact CB-SG 3.4Å; A585-A708 HydrophobicContact CB-CB 4.13Å
586	F	92.8	Very high	89.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-44.2	177.6	-93	-84.9	0	0	0	112.4	Y545 L548 Y549 M552 L574 R582 V583 K584 R589 L590 P703	Y545-F586 AromaticContact CD1-CE2 3.77Å; Y545-F586 HydrophobicContact CD1-CE2 3.77Å; Y545-F586 HydrophobicContact CD1-CZ 4.05Å; Y545-F586 HydrophobicContact CG-CE2 4.43Å; Y545-F586 WeakPolarHBondContact O-CZ 3.47Å; L548-F586 HydrophobicContact CB-CE1 4.25Å; L548-F586 HydrophobicContact CB-CZ 4.14Å; L548-F586 HydrophobicContact CD2-CE1 3.82Å; L548-F586 HydrophobicContact CD2-CZ 4.02Å; L548-F586 HydrophobicContact CG-CE1 3.85Å; L548-F586 HydrophobicContact CG-CZ 4.18Å; Y549-F586 AromaticContact CD2-CD1 3.97Å; Y549-F586 HydrophobicContact CD2-CD1 3.97Å; Y549-F586 HydrophobicContact CD2-CD2 4.2Å; Y549-F586 AromaticContact CD2-CE1 3.97Å; Y549-F586 HydrophobicContact CD2-CE1 3.97Å; Y549-F586 HydrophobicContact CD2-CE2 4.23Å; Y549-F586 HydrophobicContact CD2-CG 4.07Å; Y549-F586 HydrophobicContact CD2-CZ 4.12Å; Y549-F586 HydrophobicContact CG-CE1 4.47Å; Y549-F586 HydrophobicContact CG-CZ 4.3Å; M552-F586 HydrophobicContact CE-CD1 4.3Å; M552-F586 HydrophobicContact SD-CD1 3.37Å; M552-F586 WeakPolarHBondContact SD-CD1 3.17Å; M552-F586 HydrophobicContact SD-CE1 3.63Å; M552-F586 HydrophobicContact SD-CG 4.48Å; L574-F586 HydrophobicContact CD1-CB 3.81Å; L574-F586 HydrophobicContact CD1-CD1 4.46Å; L574-F586 HydrophobicContact CD1-CG 4.31Å; L574-F586 HydrophobicContact CD2-CB 3.58Å; L574-F586 HydrophobicContact CD2-CD1 4.19Å; L574-F586 HydrophobicContact CD2-CD2 3.7Å; L574-F586 HydrophobicContact CD2-CE2 4.39Å; L574-F586 HydrophobicContact CD2-CG 3.59Å; L574-F586 HydrophobicContact CG-CB 4.34Å; L574-F586 HydrophobicContact CG-CG 4.46Å; R582-F586 HydrophobicContact CG-CD2 3.87Å; R582-F586 HydrophobicContact CG-CE2 3.87Å; R582-F586 WeakPolarHBondContact O-CD2 3.44Å; R582-F586 PolarHBondContact O-N 2.95Å; V583-F586 PolarHBondContact O-N 3.21Å; K584-F586 PolarHBondContact O-N 3.27Å; F586-R589 PolarHBondContact O-N 3.36Å; F586-L590 WeakPolarHBondContact O-CB 3.43Å; F586-L590 PolarHBondContact O-N 3.45Å; F586-P703 HydrophobicContact CD2-CB 4.24Å; F586-P703 HydrophobicContact CD2-CG 4.42Å; F586-P703 HydrophobicContact CE2-CB 4.15Å; F586-P703 HydrophobicContact CE2-CG 3.86Å
587	V	91.8	Very high	89.7	Confident	7 Å²	7	35 Å²	35	4%	0.042	18%	0.176	C	C	.	.	H	α-helix	trans	-61.4	-46.7	176.2	170.3	0	0	0	0	110.6	V583 K584 R589 L590 L591 V609 I612 L713	V583-V587 HydrophobicContact CG1-CG2 4.38Å; V583-V587 WeakPolarHBondContact O-CG2 3.34Å; V583-V587 PolarHBondContact O-N 3.46Å; K584-V587 PolarHBondContact O-N 3.47Å; V587-R589 PolarHBondContact O-N 3.27Å; V587-L590 PolarHBondContact O-N 2.96Å; V587-L591 HydrophobicContact CG1-CD1 4.02Å; V587-L591 WeakPolarHBondContact O-CG 3.3Å; V587-L591 PolarHBondContact O-N 3.38Å; V587-V609 HydrophobicContact CG1-CG1 4.15Å; V587-V609 HydrophobicContact CG1-CG2 4.28Å; V587-I612 HydrophobicContact CG2-CG2 4.38Å; V587-L713 HydrophobicContact CG1-CD1 3.99Å
588	K	91.1	Very high	89.7	Confident	8 Å²	8	41 Å²	41	4%	0.035	21%	0.206	C	C	.	.	H	α-helix	trans	-57.1	-48.2	176.7	-173.6	62.4	170	171.4	0	112.2	K584 Q592 Y696 A708 S712 L713 E715	K584-K588 WeakPolarHBondContact O-CB 3.3Å; K584-K588 PolarHBondContact O-N 3.28Å; K588-Q592 WeakPolarHBondContact O-CG 3.47Å; K588-Q592 PolarHBondContact O-N 3.47Å; K588-Y696 HydrophobicContact CB-CE2 4.46Å; K588-Y696 HydrophobicContact CG-CD2 4.26Å; K588-Y696 HydrophobicContact CG-CE1 4.22Å; K588-Y696 HydrophobicContact CG-CE2 3.86Å; K588-A708 HydrophobicContact CB-CB 4.17Å; K588-A708 HydrophobicContact CG-CB 4.35Å; K588-S712 PolarHBondContact NZ-O 3.38Å; K588-L713 HydrophobicContact CB-CD2 4.46Å; K588-L713 HydrophobicContact CD-CD2 3.88Å; K588-E715 VanDerWaalsContact CE-OE1 3.29Å; K588-E715 WeakPolarHBondContact CE-OE1 3.49Å; K588-E715 IonicContact NZ-OE1 2.75Å; K588-E715 PolarHBondContact NZ-OE1 2.96Å; K588-E715 IonicContact NZ-OE2 3.55Å; K588-E715 PolarHBondContact NZ-OE2 3.46Å
589	R	92.1	Very high	89.8	Confident	3 Å²	3	34.2 Å²	34.2	1%	0.011	17%	0.172	C	C	.	.	H	α-helix	trans	-68.6	-35.8	177.4	-176.3	171.7	-77.6	175.6	6	112.8	Y549 M552 L553 A585 F586 V587 Q592 V593 P698 S700	Y549-R589 HydrophobicContact CD2-CB 4.46Å; Y549-R589 VanDerWaalsContact CE1-NH2 3.25Å; Y549-R589 HydrophobicContact CE2-CB 3.64Å; Y549-R589 HydrophobicContact CE2-CG 4.19Å; Y549-R589 PolarHBondContact O-NH1 3.1Å; M552-R589 HydrophobicContact CB-CG 4.33Å; M552-R589 HydrophobicContact CE-CB 4.23Å; M552-R589 HydrophobicContact CE-CG 4.2Å; M552-R589 HydrophobicContact SD-CG 4.36Å; L553-R589 HydrophobicContact CD2-CG 4.04Å; L553-R589 HydrophobicContact CG-CG 4.48Å; A585-R589 PolarHBondContact O-N 2.9Å; F586-R589 PolarHBondContact O-N 3.36Å; V587-R589 PolarHBondContact O-N 3.27Å; R589-Q592 PolarHBondContact O-N 3.36Å; R589-V593 WeakPolarHBondContact O-CG2 3.48Å; R589-V593 PolarHBondContact O-N 3.06Å; R589-P698 PolarHBondContact NH2-O 2.99Å; R589-S700 PolarHBondContact NH2-O 3.45Å
590	L	92.4	Very high	89.8	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-62.1	-45.8	177.3	-179.4	59.2	0	0	0	110.8	M552 L567 F586 V587 Q592 V593 T594 A605 L608 V609	M552-L590 VanDerWaalsContact CE-CA 3.48Å; M552-L590 HydrophobicContact CE-CB 3.6Å; M552-L590 HydrophobicContact CE-CD1 4.17Å; M552-L590 HydrophobicContact CE-CG 4.46Å; L567-L590 HydrophobicContact CD2-CD1 4.48Å; F586-L590 WeakPolarHBondContact O-CB 3.43Å; F586-L590 PolarHBondContact O-N 3.45Å; V587-L590 PolarHBondContact O-N 2.96Å; L590-Q592 VanDerWaalsContact C-N 3.34Å; L590-Q592 PolarHBondContact O-N 3.44Å; L590-V593 WeakPolarHBondContact O-CB 3.48Å; L590-V593 PolarHBondContact O-N 3.41Å; L590-T594 WeakPolarHBondContact O-CG2 3.37Å; L590-T594 PolarHBondContact O-N 3.05Å; L590-A605 HydrophobicContact CD1-CB 4.1Å; L590-A605 HydrophobicContact CD2-CB 4.24Å; L590-A605 HydrophobicContact CG-CB 4.19Å; L590-L608 HydrophobicContact CD2-CD2 3.68Å; L590-V609 HydrophobicContact CD2-CG2 3.96Å
591	L	91.3	Very high	90	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-41.4	177.5	-67.5	166.8	0	0	0	111.7	V587 V593 T594 C595 L606 L713 E715 L716 L719	V587-L591 HydrophobicContact CG1-CD1 4.02Å; V587-L591 WeakPolarHBondContact O-CG 3.3Å; V587-L591 PolarHBondContact O-N 3.38Å; L591-V593 VanDerWaalsContact C-N 3.3Å; L591-V593 PolarHBondContact O-N 3.17Å; L591-T594 WeakPolarHBondContact CA-OG1 3.34Å; L591-T594 PolarHBondContact O-N 3.3Å; L591-T594 VanDerWaalsContact O-N 3.11Å; L591-T594 PolarHBondContact O-OG1 3.48Å; L591-C595 PolarHBondContact O-N 3.44Å; L591-C595 PolarHBondContact O-SG 3.22Å; L591-C595 VanDerWaalsContact O-SG 3.4Å; L591-L606 HydrophobicContact CD2-CD2 3.82Å; L591-L713 HydrophobicContact CD1-CB 4.11Å; L591-L713 HydrophobicContact CD1-CD1 3.85Å; L591-L713 HydrophobicContact CD1-CD2 4.17Å; L591-L713 HydrophobicContact CD1-CG 4.26Å; L591-E715 HydrophobicContact CB-CB 3.79Å; L591-E715 HydrophobicContact CB-CG 4.27Å; L591-L716 HydrophobicContact CD1-CD1 4.29Å; L591-L716 HydrophobicContact CD1-CD2 4.4Å; L591-L716 HydrophobicContact CD1-CG 3.97Å; L591-L716 HydrophobicContact CD2-CD2 3.64Å; L591-L716 HydrophobicContact CD2-CG 4.07Å; L591-L719 HydrophobicContact CD2-CD1 4.46Å
592	Q	90.9	Very high	90.2	Very high	46 Å²	46	24.8 Å²	24.8	22%	0.215	13%	0.127	C	C	.	.	H	α-helix	trans	-60.3	-38.7	174.1	-71.6	167.6	-5.4	0	0	112.7	K588 R589 L590 Y696 E715	K588-Q592 WeakPolarHBondContact O-CG 3.47Å; K588-Q592 PolarHBondContact O-N 3.47Å; R589-Q592 PolarHBondContact O-N 3.36Å; L590-Q592 VanDerWaalsContact C-N 3.34Å; L590-Q592 PolarHBondContact O-N 3.44Å; Q592-Y696 PolarHBondContact OE1-OH 3.06Å; Q592-E715 HydrophobicContact CG-CG 3.76Å; Q592-E715 WeakPolarHBondContact CG-OE1 3.14Å; Q592-E715 PolarHBondContact NE2-OE1 3.46Å
593	V	90.4	Very high	90.2	Very high	13 Å²	13	24.1 Å²	24.1	8%	0.079	12%	0.124	C	C	.	.	H	α-helix	trans	-66.5	-41.5	173.2	170.2	0	0	0	0	111.2	M552 L553 L557 R589 L590 L591 C595 Q596 Q597 F601	M552-V593 VanDerWaalsContact O-CG2 3.3Å; M552-V593 WeakPolarHBondContact O-CG2 3.25Å; L553-V593 HydrophobicContact CD2-CG2 4.02Å; L557-V593 HydrophobicContact CD2-CG1 3.64Å; R589-V593 WeakPolarHBondContact O-CG2 3.48Å; R589-V593 PolarHBondContact O-N 3.06Å; L590-V593 WeakPolarHBondContact O-CB 3.48Å; L590-V593 PolarHBondContact O-N 3.41Å; L591-V593 VanDerWaalsContact C-N 3.3Å; L591-V593 PolarHBondContact O-N 3.17Å; V593-C595 PolarHBondContact O-N 3.26Å; V593-Q596 PolarHBondContact O-N 3.38Å; V593-Q596 VanDerWaalsContact O-N 3.09Å; V593-Q597 HydrophobicContact CG1-CG 4.13Å; V593-Q597 VanDerWaalsContact O-CG 3.26Å; V593-Q597 WeakPolarHBondContact O-CG 3.35Å; V593-F601 HydrophobicContact CG1-CE1 4.29Å
594	T	90.3	Very high	90.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-27.6	179.2	59	0	0	0	0	113.7	L590 L591 Q596 Q597 F601 I602 A605	L590-T594 WeakPolarHBondContact O-CG2 3.37Å; L590-T594 PolarHBondContact O-N 3.05Å; L591-T594 WeakPolarHBondContact CA-OG1 3.34Å; L591-T594 PolarHBondContact O-N 3.3Å; L591-T594 VanDerWaalsContact O-N 3.11Å; L591-T594 PolarHBondContact O-OG1 3.48Å; T594-Q596 PolarHBondContact O-N 3.21Å; T594-Q597 PolarHBondContact O-N 2.58Å; T594-F601 HydrophobicContact CG2-CD1 4.3Å; T594-F601 HydrophobicContact CG2-CE1 4.17Å; T594-I602 WeakPolarHBondContact O-CD1 3.43Å; T594-I602 WeakPolarHBondContact O-CG1 3.43Å; T594-A605 HydrophobicContact CG2-CB 3.38Å
595	C	89.1	Confident	90.3	Very high	64 Å²	64	23.3 Å²	23.3	43%	0.432	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-6.7	175.8	-62.2	0	0	0	0	114.8	L591 V593	L591-C595 PolarHBondContact O-N 3.44Å; L591-C595 PolarHBondContact O-SG 3.22Å; L591-C595 VanDerWaalsContact O-SG 3.4Å; V593-C595 PolarHBondContact O-N 3.26Å
596	Q	86.6	Confident	90.3	Very high	143 Å²	143	23.3 Å²	23.3	67%	0.668	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.9	8.3	177.7	-57.5	-175.6	-9.6	0	0	113.5	M558 V593 T594	M558-Q596 HydrophobicContact CE-CB 3.63Å; M558-Q596 WeakPolarHBondContact CE-O 3.43Å; V593-Q596 PolarHBondContact O-N 3.38Å; V593-Q596 VanDerWaalsContact O-N 3.09Å; T594-Q596 PolarHBondContact O-N 3.21Å
597	Q	88.4	Confident	90.2	Very high	23 Å²	23	26.9 Å²	26.9	11%	0.107	14%	0.138	C	C	.	.	S	Bend	trans	-111.5	164.5	-168.7	-68.3	-73.2	-6.9	0	0	112.9	V593 T594 F601 I602	V593-Q597 HydrophobicContact CG1-CG 4.13Å; V593-Q597 VanDerWaalsContact O-CG 3.26Å; V593-Q597 WeakPolarHBondContact O-CG 3.35Å; T594-Q597 PolarHBondContact O-N 2.58Å; Q597-F601 HydrophobicContact CB-CB 4.19Å; Q597-F601 HydrophobicContact CB-CD1 3.58Å; Q597-F601 HydrophobicContact CB-CE1 4.36Å; Q597-F601 HydrophobicContact CB-CG 4.16Å; Q597-F601 HydrophobicContact CG-CD1 3.59Å; Q597-F601 HydrophobicContact CG-CE1 3.89Å; Q597-F601 HydrophobicContact CG-CG 4.33Å; Q597-I602 HydrophobicContact CB-CG1 4.34Å; Q597-I602 WeakPolarHBondContact O-CD1 3.24Å
598	M	88.1	Confident	90.1	Very high	132 Å²	132	27 Å²	27	65%	0.65	14%	0.138	S	C	*	.			trans	-71	149.9	177.3	-66.2	-67.2	-87.5	0	0	111.6	P600 F601 I602	M598-P600 WeakPolarHBondContact O-CD 3.35Å; M598-P600 VanDerWaalsContact O-N 3.11Å; M598-F601 PolarHBondContact O-N 2.86Å; M598-I602 PolarHBondContact O-N 3.41Å
599	P	88.3	Confident	90.1	Very high	18 Å²	18	26.7 Å²	26.7	12%	0.117	14%	0.137	C	C	.	.	H	α-helix	trans	-49	-37.5	-175.6	-28.6	34.4	0	0	0	117.2	F601 I602 C603 F723 H724 V727	P599-F601 PolarHBondContact O-N 3.06Å; P599-I602 PolarHBondContact O-N 3.04Å; P599-C603 PolarHBondContact O-N 3.28Å; P599-C603 PolarHBondContact O-SG 3.25Å; P599-F723 HydrophobicContact CG-CE2 4.3Å; P599-F723 HydrophobicContact CG-CZ 4.08Å; P599-H724 HydrophobicContact CB-CB 4.24Å; P599-H724 HydrophobicContact CG-CB 4.35Å; P599-V727 HydrophobicContact CB-CG2 4.43Å
600	P	87.9	Confident	90	Very high	15 Å²	15	26.6 Å²	26.6	10%	0.097	14%	0.137	C	C	.	.	H	α-helix	trans	-61.6	-45	176.8	-19.1	30	0	0	0	112.6	M598 I602 C603 G604 L747 F750	M598-P600 WeakPolarHBondContact O-CD 3.35Å; M598-P600 VanDerWaalsContact O-N 3.11Å; P600-I602 PolarHBondContact O-N 2.99Å; P600-C603 PolarHBondContact O-N 2.97Å; P600-G604 PolarHBondContact O-N 3.09Å; P600-L747 WeakPolarHBondContact CB-O 3.42Å; P600-F750 HydrophobicContact CG-CB 4.48Å
601	F	90.5	Very high	89.9	Confident	1 Å²	1	28 Å²	28	0%	0.004	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-40.5	177.3	-175.5	-86.4	0	0	0	111.3	L557 Q563 L567 V593 T594 Q597 M598 P599 G604 A605	L557-F601 HydrophobicContact CD1-CE2 4.01Å; L557-F601 HydrophobicContact CD1-CZ 4.24Å; L557-F601 HydrophobicContact CD2-CZ 4.15Å; L557-F601 HydrophobicContact CG-CZ 4.48Å; Q563-F601 HydrophobicContact CB-CD2 4.31Å; L567-F601 HydrophobicContact CD1-CD2 4.22Å; L567-F601 HydrophobicContact CD1-CE2 4.11Å; L567-F601 HydrophobicContact CD2-CE2 3.93Å; L567-F601 HydrophobicContact CD2-CZ 3.92Å; L567-F601 HydrophobicContact CG-CE2 4.05Å; V593-F601 HydrophobicContact CG1-CE1 4.29Å; T594-F601 HydrophobicContact CG2-CD1 4.3Å; T594-F601 HydrophobicContact CG2-CE1 4.17Å; Q597-F601 HydrophobicContact CB-CB 4.19Å; Q597-F601 HydrophobicContact CB-CD1 3.58Å; Q597-F601 HydrophobicContact CB-CE1 4.36Å; Q597-F601 HydrophobicContact CB-CG 4.16Å; Q597-F601 HydrophobicContact CG-CD1 3.59Å; Q597-F601 HydrophobicContact CG-CE1 3.89Å; Q597-F601 HydrophobicContact CG-CG 4.33Å; M598-F601 PolarHBondContact O-N 2.86Å; P599-F601 PolarHBondContact O-N 3.06Å; F601-G604 PolarHBondContact O-N 2.87Å; F601-A605 HydrophobicContact CE1-CB 4.3Å; F601-A605 WeakPolarHBondContact O-CB 3.4Å; F601-A605 PolarHBondContact O-N 2.74Å
602	I	91.9	Very high	89.8	Confident	3 Å²	3	28 Å²	28	2%	0.015	14%	0.143	C	C	.	.	H	α-helix	trans	-59.6	-49.8	174.9	-55.6	-179.4	0	0	0	110.1	T594 Q597 M598 P599 P600 G604 A605 L606 L719 V727	T594-I602 WeakPolarHBondContact O-CD1 3.43Å; T594-I602 WeakPolarHBondContact O-CG1 3.43Å; Q597-I602 HydrophobicContact CB-CG1 4.34Å; Q597-I602 WeakPolarHBondContact O-CD1 3.24Å; M598-I602 PolarHBondContact O-N 3.41Å; P599-I602 PolarHBondContact O-N 3.04Å; P600-I602 PolarHBondContact O-N 2.99Å; I602-G604 PolarHBondContact O-N 3.16Å; I602-A605 PolarHBondContact O-N 2.86Å; I602-L606 HydrophobicContact CG2-CD1 3.86Å; I602-L606 HydrophobicContact CG2-CG 4.2Å; I602-L606 WeakPolarHBondContact O-CB 3.27Å; I602-L606 VanDerWaalsContact O-CG 3.31Å; I602-L606 WeakPolarHBondContact O-CG 3.34Å; I602-L606 PolarHBondContact O-N 3.12Å; I602-L719 HydrophobicContact CD1-CD2 4.39Å; I602-L719 HydrophobicContact CG2-CD1 4.37Å; I602-L719 HydrophobicContact CG2-CD2 4.04Å; I602-V727 HydrophobicContact CB-CG2 4.1Å; I602-V727 HydrophobicContact CG2-CB 4.43Å; I602-V727 HydrophobicContact CG2-CG1 3.59Å; I602-V727 HydrophobicContact CG2-CG2 3.96Å
603	C	89.7	Confident	89.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-43.7	179.1	-74.6	0	0	0	0	112.7	P599 P600 L606 Y607 V727 F730 P746 F750	P599-C603 PolarHBondContact O-N 3.28Å; P599-C603 PolarHBondContact O-SG 3.25Å; P600-C603 PolarHBondContact O-N 2.97Å; C603-L606 PolarHBondContact O-N 3.21Å; C603-Y607 WeakPolarHBondContact O-CB 3.14Å; C603-Y607 PolarHBondContact O-N 2.69Å; C603-V727 VanDerWaalsContact SG-CG2 3.52Å; C603-F730 HydrophobicContact CB-CD2 4.08Å; C603-F730 HydrophobicContact CB-CE2 3.94Å; C603-P746 HydrophobicContact CB-CB 4.02Å; C603-F750 HydrophobicContact CB-CD2 3.32Å; C603-F750 HydrophobicContact CB-CE2 3.46Å; C603-F750 VanDerWaalsContact CB-CE2 3.46Å; C603-F750 HydrophobicContact CB-CG 4.44Å; C603-F750 WeakPolarHBondContact SG-CD2 3.39Å; C603-F750 VanDerWaalsContact SG-CE2 3.57Å
604	G	89.3	Confident	89.5	Confident	9 Å²	9	29.3 Å²	29.3	9%	0.093	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-39.9	176.3	0	0	0	0	0	113.2	P600 F601 I602 L608	P600-G604 PolarHBondContact O-N 3.09Å; F601-G604 PolarHBondContact O-N 2.87Å; I602-G604 PolarHBondContact O-N 3.16Å; G604-L608 WeakPolarHBondContact O-CB 3.33Å; G604-L608 PolarHBondContact O-N 3.23Å
605	A	91.5	Very high	89.3	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-70.2	-38.5	176.1	0	0	0	0	0	112.8	L567 L590 T594 F601 I602 L608 V609	L567-A605 HydrophobicContact CD2-CB 4.34Å; L590-A605 HydrophobicContact CD1-CB 4.1Å; L590-A605 HydrophobicContact CD2-CB 4.24Å; L590-A605 HydrophobicContact CG-CB 4.19Å; T594-A605 HydrophobicContact CG2-CB 3.38Å; F601-A605 HydrophobicContact CE1-CB 4.3Å; F601-A605 WeakPolarHBondContact O-CB 3.4Å; F601-A605 PolarHBondContact O-N 2.74Å; I602-A605 PolarHBondContact O-N 2.86Å; A605-L608 PolarHBondContact O-N 2.82Å; A605-V609 WeakPolarHBondContact O-CG2 3.33Å; A605-V609 PolarHBondContact O-N 2.65Å
606	L	91.6	Very high	89.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.8	-41.4	173.3	-71.2	175.8	0	0	0	111.5	L591 I602 C603 V609 S610 L716 L719 V727 F730 A731 I734 I740	L591-L606 HydrophobicContact CD2-CD2 3.82Å; I602-L606 HydrophobicContact CG2-CD1 3.86Å; I602-L606 HydrophobicContact CG2-CG 4.2Å; I602-L606 WeakPolarHBondContact O-CB 3.27Å; I602-L606 VanDerWaalsContact O-CG 3.31Å; I602-L606 WeakPolarHBondContact O-CG 3.34Å; I602-L606 PolarHBondContact O-N 3.12Å; C603-L606 PolarHBondContact O-N 3.21Å; L606-V609 PolarHBondContact O-N 3.07Å; L606-S610 PolarHBondContact O-N 3.32Å; L606-L716 HydrophobicContact CD2-CD2 3.53Å; L606-L719 HydrophobicContact CD2-CD1 4.08Å; L606-V727 HydrophobicContact CD1-CG1 4.21Å; L606-F730 HydrophobicContact CB-CB 4.18Å; L606-F730 HydrophobicContact CB-CD2 4.49Å; L606-F730 HydrophobicContact CD1-CB 3.84Å; L606-A731 HydrophobicContact CD1-CB 4.43Å; L606-I734 HydrophobicContact CB-CD1 4.09Å; L606-I734 HydrophobicContact CD2-CD1 4Å; L606-I734 WeakPolarHBondContact O-CD1 3.26Å; L606-I740 HydrophobicContact CB-CD1 4.29Å
607	Y	90.8	Very high	88.9	Confident	75 Å²	75	27.2 Å²	27.2	29%	0.294	15%	0.147	S	C	.	.	H	α-helix	trans	-59	-46.8	172.6	-178.6	-98.7	0	0	0	111.6	C603 V609 S610 E611 I740	C603-Y607 WeakPolarHBondContact O-CB 3.14Å; C603-Y607 PolarHBondContact O-N 2.69Å; Y607-V609 VanDerWaalsContact C-N 3.32Å; Y607-V609 PolarHBondContact O-N 2.97Å; Y607-S610 WeakPolarHBondContact O-CA 3.26Å; Y607-S610 VanDerWaalsContact O-CB 3.29Å; Y607-S610 WeakPolarHBondContact O-CB 3.17Å; Y607-S610 PolarHBondContact O-N 2.95Å; Y607-S610 VanDerWaalsContact O-N 3.11Å; Y607-E611 HydrophobicContact CD1-CG 4.34Å; Y607-E611 HydrophobicContact CE1-CG 3.9Å; Y607-E611 PolarHBondContact O-N 3.21Å; Y607-I740 HydrophobicContact CD2-CB 4.21Å; Y607-I740 HydrophobicContact CD2-CG2 3.86Å; Y607-I740 HydrophobicContact CE2-CG2 4.5Å
608	L	90.6	Very high	88.3	Confident	10 Å²	10	28 Å²	28	5%	0.052	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-41.5	174	178.6	159.4	0	0	0	112.4	L567 V570 Y571 L590 G604 A605 E611 I612	L567-L608 HydrophobicContact CB-CD1 4.01Å; L567-L608 HydrophobicContact CD2-CD1 4.15Å; L567-L608 WeakPolarHBondContact O-CD1 3.47Å; V570-L608 HydrophobicContact CB-CD1 4.47Å; V570-L608 HydrophobicContact CG1-CD1 4.38Å; V570-L608 HydrophobicContact CG1-CD2 4.44Å; Y571-L608 HydrophobicContact CD2-CG 4.4Å; L590-L608 HydrophobicContact CD2-CD2 3.68Å; G604-L608 WeakPolarHBondContact O-CB 3.33Å; G604-L608 PolarHBondContact O-N 3.23Å; A605-L608 PolarHBondContact O-N 2.82Å; L608-E611 PolarHBondContact O-N 3.45Å; L608-I612 HydrophobicContact CD2-CD1 3.48Å; L608-I612 VanDerWaalsContact CD2-CD1 3.48Å; L608-I612 HydrophobicContact CD2-CG1 4.34Å; L608-I612 HydrophobicContact CG-CD1 4.33Å; L608-I612 WeakPolarHBondContact O-CG1 3.36Å; L608-I612 PolarHBondContact O-N 2.93Å
609	V	91	Very high	87.9	Confident	1 Å²	1	22 Å²	22	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-64.6	-39.7	175.2	169.1	0	0	0	0	111.3	V587 L590 A605 L606 Y607 I612 L613 I734	V587-V609 HydrophobicContact CG1-CG1 4.15Å; V587-V609 HydrophobicContact CG1-CG2 4.28Å; L590-V609 HydrophobicContact CD2-CG2 3.96Å; A605-V609 WeakPolarHBondContact O-CG2 3.33Å; A605-V609 PolarHBondContact O-N 2.65Å; L606-V609 PolarHBondContact O-N 3.07Å; Y607-V609 VanDerWaalsContact C-N 3.32Å; Y607-V609 PolarHBondContact O-N 2.97Å; V609-I612 PolarHBondContact O-N 3.17Å; V609-L613 HydrophobicContact CG1-CD1 3.82Å; V609-L613 HydrophobicContact CG1-CG 4.37Å; V609-L613 WeakPolarHBondContact O-CB 3.22Å; V609-L613 VanDerWaalsContact O-CG 3.27Å; V609-L613 WeakPolarHBondContact O-CG 3.43Å; V609-L613 PolarHBondContact O-N 3.33Å; V609-I734 HydrophobicContact CG1-CD1 4.46Å
610	S	90.1	Very high	87.4	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-57.3	-47.6	171.5	160.9	0	0	0	0	112	L606 Y607 I612 L613 K614 I740	L606-S610 PolarHBondContact O-N 3.32Å; Y607-S610 WeakPolarHBondContact O-CA 3.26Å; Y607-S610 VanDerWaalsContact O-CB 3.29Å; Y607-S610 WeakPolarHBondContact O-CB 3.17Å; Y607-S610 PolarHBondContact O-N 2.95Å; Y607-S610 VanDerWaalsContact O-N 3.11Å; S610-I612 PolarHBondContact O-N 3.23Å; S610-L613 PolarHBondContact O-N 2.73Å; S610-K614 PolarHBondContact O-N 3.24Å; S610-I740 PolarHBondContact OG-N 3.39Å
611	E	89.3	Confident	86.9	Confident	31 Å²	31	28 Å²	28	15%	0.145	16%	0.161	C	C	.	.	H	α-helix	trans	-67.7	-33.9	179.5	-60.1	-43.1	104.8	0	0	113	Y571 Y607 L608 K614 A615	Y571-E611 HydrophobicContact CD2-CB 4.45Å; Y571-E611 HydrophobicContact CE2-CB 3.74Å; Y607-E611 HydrophobicContact CD1-CG 4.34Å; Y607-E611 HydrophobicContact CE1-CG 3.9Å; Y607-E611 PolarHBondContact O-N 3.21Å; L608-E611 PolarHBondContact O-N 3.45Å; E611-K614 PolarHBondContact O-N 3Å; E611-K614 VanDerWaalsContact OE1-CE 3.22Å; E611-K614 WeakPolarHBondContact OE1-CE 3.45Å; E611-K614 IonicContact OE1-NZ 2.85Å; E611-K614 PolarHBondContact OE1-NZ 3.5Å; E611-K614 WeakPolarHBondContact OE2-CD 3.37Å; E611-K614 WeakPolarHBondContact OE2-CE 3.4Å; E611-K614 IonicContact OE2-NZ 3.92Å; E611-K614 PolarHBondContact OE2-NZ 2.85Å; E611-A615 PolarHBondContact O-N 3.46Å; E611-A615 VanDerWaalsContact O-N 3.09Å
612	I	89.7	Confident	86.1	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-70.5	-36.8	173.6	-68.6	177.3	0	0	0	111.3	Y571 L574 V583 V587 L608 V609 S610 A615 K616 L619	Y571-I612 HydrophobicContact CD2-CD1 4.45Å; Y571-I612 HydrophobicContact CD2-CG1 3.95Å; Y571-I612 HydrophobicContact CE2-CG1 4.26Å; L574-I612 HydrophobicContact CB-CD1 3.64Å; L574-I612 HydrophobicContact CD1-CD1 3.59Å; L574-I612 HydrophobicContact CG-CD1 4.27Å; V583-I612 HydrophobicContact CG1-CG2 3.84Å; V587-I612 HydrophobicContact CG2-CG2 4.38Å; L608-I612 HydrophobicContact CD2-CD1 3.48Å; L608-I612 VanDerWaalsContact CD2-CD1 3.48Å; L608-I612 HydrophobicContact CD2-CG1 4.34Å; L608-I612 HydrophobicContact CG-CD1 4.33Å; L608-I612 WeakPolarHBondContact O-CG1 3.36Å; L608-I612 PolarHBondContact O-N 2.93Å; V609-I612 PolarHBondContact O-N 3.17Å; S610-I612 PolarHBondContact O-N 3.23Å; I612-A615 PolarHBondContact O-N 2.96Å; I612-K616 PolarHBondContact O-N 2.83Å; I612-L619 HydrophobicContact CG2-CD1 3.51Å
613	L	87.9	Confident	85.3	Confident	10 Å²	10	29.3 Å²	29.3	5%	0.052	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-35.8	174	-76.1	164.2	0	0	0	112.4	V609 S610 K616 L619 R620 L623 I734	V609-L613 HydrophobicContact CG1-CD1 3.82Å; V609-L613 HydrophobicContact CG1-CG 4.37Å; V609-L613 WeakPolarHBondContact O-CB 3.22Å; V609-L613 VanDerWaalsContact O-CG 3.27Å; V609-L613 WeakPolarHBondContact O-CG 3.43Å; V609-L613 PolarHBondContact O-N 3.33Å; S610-L613 PolarHBondContact O-N 2.73Å; L613-K616 CarbonylContact O-C 3.57Å; L613-L619 HydrophobicContact CD2-CB 3.79Å; L613-R620 HydrophobicContact CD2-CG 4.42Å; L613-L623 HydrophobicContact CD1-CD2 4.28Å; L613-L623 HydrophobicContact CD2-CD1 4.09Å; L613-L623 HydrophobicContact CD2-CD2 4.47Å; L613-I734 HydrophobicContact CD1-CG2 3.69Å
614	K	87.1	Confident	84.3	Confident	76 Å²	76	34.7 Å²	34.7	33%	0.33	20%	0.196	S	C	.	.	H	α-helix	trans	-60.9	-52.2	168.8	-68.8	175.1	-170.7	168	0	111.2	S610 E611 K616 Y739	S610-K614 PolarHBondContact O-N 3.24Å; E611-K614 PolarHBondContact O-N 3Å; E611-K614 VanDerWaalsContact OE1-CE 3.22Å; E611-K614 WeakPolarHBondContact OE1-CE 3.45Å; E611-K614 IonicContact OE1-NZ 2.85Å; E611-K614 PolarHBondContact OE1-NZ 3.5Å; E611-K614 WeakPolarHBondContact OE2-CD 3.37Å; E611-K614 WeakPolarHBondContact OE2-CE 3.4Å; E611-K614 IonicContact OE2-NZ 3.92Å; E611-K614 PolarHBondContact OE2-NZ 2.85Å; K614-K616 VanDerWaalsContact C-N 3.27Å; K614-K616 PolarHBondContact O-N 3.45Å; K614-Y739 HydrophobicContact CB-CE1 4.14Å; K614-Y739 HydrophobicContact CD-CD1 4.35Å; K614-Y739 HydrophobicContact CD-CG 4.25Å; K614-Y739 VanDerWaalsContact CE-CB 3.48Å; K614-Y739 HydrophobicContact CG-CD1 3.36Å; K614-Y739 HydrophobicContact CG-CD2 3.97Å; K614-Y739 HydrophobicContact CG-CE1 3.4Å; K614-Y739 VanDerWaalsContact CG-CE1 3.4Å; K614-Y739 HydrophobicContact CG-CE2 3.99Å; K614-Y739 HydrophobicContact CG-CG 3.66Å
615	A	86.8	Confident	82.8	Confident	51 Å²	51	38.3 Å²	38.3	42%	0.421	21%	0.213	S	C	.	.	H	α-helix	trans	-68.2	-25.1	-174	0	0	0	0	0	113.3	E611 I612	E611-A615 PolarHBondContact O-N 3.46Å; E611-A615 VanDerWaalsContact O-N 3.09Å; I612-A615 PolarHBondContact O-N 2.96Å
616	K	85.9	Confident	80.5	Confident	30 Å²	30	46 Å²	46	13%	0.13	25%	0.249	C	C	.	.			trans	-137	79.1	-174.3	-68.3	-178	179.9	167.4	0	111.1	L574 K575 D577 L580 V583 I612 L613 K614 G618 L619	L574-K616 PolarHBondContact O-NZ 3.41Å; K575-K616 PolarHBondContact O-NZ 2.96Å; D577-K616 PolarHBondContact O-NZ 3.41Å; L580-K616 HydrophobicContact CD2-CB 4.3Å; L580-K616 HydrophobicContact CD2-CD 4.15Å; L580-K616 HydrophobicContact CD2-CG 4.47Å; V583-K616 HydrophobicContact CG2-CD 4.39Å; I612-K616 PolarHBondContact O-N 2.83Å; L613-K616 CarbonylContact O-C 3.57Å; K614-K616 VanDerWaalsContact C-N 3.27Å; K614-K616 PolarHBondContact O-N 3.45Å; K616-G618 PolarHBondContact O-N 3.05Å; K616-G618 VanDerWaalsContact O-N 3.08Å; K616-L619 HydrophobicContact CB-CD1 3.76Å; K616-L619 HydrophobicContact CB-CG 4Å; K616-L619 WeakPolarHBondContact O-CB 3.26Å; K616-L619 WeakPolarHBondContact O-CG 3.49Å; K616-L619 PolarHBondContact O-N 3.05Å
617	P	80.8	Confident	78.3	Confident	82 Å²	82	50.4 Å²	50.4	53%	0.532	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-59.3	-25.7	-175.6	22.2	-33.7	0	0	0	113.8	L619 R620	P617-L619 PolarHBondContact O-N 2.79Å; P617-R620 VanDerWaalsContact O-CB 3.28Å; P617-R620 WeakPolarHBondContact O-CB 3.49Å; P617-R620 WeakPolarHBondContact O-CG 3.28Å; P617-R620 PolarHBondContact O-N 2.79Å
618	G	76.6	Confident	76	Confident	40 Å²	40	55.6 Å²	55.6	41%	0.412	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-59.8	-14.9	174.2	0	0	0	0	0	115.1	K616 R620 S621	K616-G618 PolarHBondContact O-N 3.05Å; K616-G618 VanDerWaalsContact O-N 3.08Å; G618-R620 VanDerWaalsContact C-N 3.33Å; G618-S621 PolarHBondContact O-OG 2.99Å
619	L	79.9	Confident	73.7	Confident	4 Å²	4	60 Å²	60	2%	0.021	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-74.7	-18.8	172.1	-62.6	174.2	0	0	0	113.5	V583 K584 I612 L613 K616 P617 S621 Q622	V583-L619 HydrophobicContact CB-CD2 4.26Å; V583-L619 HydrophobicContact CG1-CD1 3.72Å; V583-L619 HydrophobicContact CG1-CD2 4.09Å; K584-L619 HydrophobicContact CB-CD2 4.48Å; K584-L619 HydrophobicContact CG-CD2 3.56Å; I612-L619 HydrophobicContact CG2-CD1 3.51Å; L613-L619 HydrophobicContact CD2-CB 3.79Å; K616-L619 HydrophobicContact CB-CD1 3.76Å; K616-L619 HydrophobicContact CB-CG 4Å; K616-L619 WeakPolarHBondContact O-CB 3.26Å; K616-L619 WeakPolarHBondContact O-CG 3.49Å; K616-L619 PolarHBondContact O-N 3.05Å; P617-L619 PolarHBondContact O-N 2.79Å; L619-S621 PolarHBondContact O-N 3.38Å; L619-S621 VanDerWaalsContact O-N 3.16Å; L619-Q622 PolarHBondContact O-N 3.18Å; L619-Q622 VanDerWaalsContact O-N 3.16Å
620	R	77.7	Confident	71.2	Confident	92 Å²	92	65.1 Å²	65.1	35%	0.347	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-59.2	-25.7	177.1	-72.2	175.5	153.8	-177.7	-12	112.8	L613 P617 G618 Q622 L623 D624 G737 Y739	L613-R620 HydrophobicContact CD2-CG 4.42Å; P617-R620 VanDerWaalsContact O-CB 3.28Å; P617-R620 WeakPolarHBondContact O-CB 3.49Å; P617-R620 WeakPolarHBondContact O-CG 3.28Å; P617-R620 PolarHBondContact O-N 2.79Å; G618-R620 VanDerWaalsContact C-N 3.33Å; R620-Q622 PolarHBondContact O-N 3.34Å; R620-L623 WeakPolarHBondContact O-CB 3.37Å; R620-L623 PolarHBondContact O-N 3.46Å; R620-D624 PolarHBondContact O-N 3.4Å; R620-G737 PolarHBondContact NH2-O 2.94Å; R620-Y739 PolarHBondContact NH2-OH 3.38Å
621	S	76	Confident	69.2	Low	69 Å²	69	72.3 Å²	72.3	48%	0.483	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-59.8	9.3	169.8	65.2	0	0	0	0	116.5	K584 G618 L619	K584-S621 WeakPolarHBondContact CE-OG 3.47Å; K584-S621 PolarHBondContact NZ-OG 2.82Å; G618-S621 PolarHBondContact O-OG 2.99Å; L619-S621 PolarHBondContact O-N 3.38Å; L619-S621 VanDerWaalsContact O-N 3.16Å
622	Q	74	Confident	67.3	Low	5 Å²	5	78.4 Å²	78.4	2%	0.023	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-121.6	-1.9	168.7	-56.4	-171.5	-94.8	0	0	113.8	K584 L619 R620 A708 T711 L713	K584-Q622 VanDerWaalsContact CB-OE1 3.25Å; K584-Q622 HydrophobicContact CD-CG 3.87Å; K584-Q622 HydrophobicContact CG-CG 4.46Å; L619-Q622 PolarHBondContact O-N 3.18Å; L619-Q622 VanDerWaalsContact O-N 3.16Å; R620-Q622 PolarHBondContact O-N 3.34Å; Q622-A708 PolarHBondContact NE2-O 2.93Å; Q622-T711 PolarHBondContact NE2-O 3.18Å; Q622-L713 HydrophobicContact CB-CD1 4.36Å; Q622-L713 HydrophobicContact CB-CD2 4.28Å; Q622-L713 HydrophobicContact CB-CG 3.91Å; Q622-L713 PolarHBondContact O-N 3.39Å
623	L	75.8	Confident	65.3	Low	26 Å²	26	85.2 Å²	85.2	14%	0.136	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-39.8	174.3	-82.8	58.1	0	0	0	109.8	L613 R620 D625 L713 I734	L613-L623 HydrophobicContact CD1-CD2 4.28Å; L613-L623 HydrophobicContact CD2-CD1 4.09Å; L613-L623 HydrophobicContact CD2-CD2 4.47Å; R620-L623 WeakPolarHBondContact O-CB 3.37Å; R620-L623 PolarHBondContact O-N 3.46Å; L623-D625 PolarHBondContact O-N 2.67Å; L623-L713 HydrophobicContact CD1-CD1 3.73Å; L623-I734 HydrophobicContact CD2-CG2 4.2Å; L623-I734 WeakPolarHBondContact CD2-O 3.47Å
624	D	69.3	Low	63.1	Low	113 Å²	113	93.5 Å²	93.5	60%	0.604	50%	0.499	S	S	*	.	S	Bend	trans	-62	117.2	165.1	-52.2	-48.3	0	0	0	107.8	R620 H626	R620-D624 PolarHBondContact O-N 3.4Å; D624-H626 PolarHBondContact O-N 3.28Å
625	D	57.1	Low	61	Low	85 Å²	85	98 Å²	98	46%	0.455	52%	0.52	S	S	.	.			trans	-65	101.8	166.8	-84.9	-32.6	0	0	0	106.2	L623 S712 K717	L623-D625 PolarHBondContact O-N 2.67Å; D625-S712 PolarHBondContact OD1-OG 3.21Å; D625-K717 IonicContact OD2-NZ 2.71Å; D625-K717 PolarHBondContact OD2-NZ 3.11Å
626	H	43.6	Very low	59.1	Low	163 Å²	163	103 Å²	103	76%	0.755	54%	0.537	S	S	*	.			trans	-60.3	127.1	172.2	-160	58.6	0	0	0	107.2	D624 E628	D624-H626 PolarHBondContact O-N 3.28Å; H626-E628 PolarHBondContact O-N 2.88Å
627	P	43.7	Very low	57.6	Low	91 Å²	91	108.5 Å²	108.5	59%	0.591	57%	0.568	S	S	*	*			trans	-67.1	97.7	178.9	26	-32.4	0	0	0	109	S629 D630	P627-S629 PolarHBondContact O-N 2.92Å; P627-D630 HydrophobicContact CB-CB 4.44Å
628	E	43.2	Very low	55.7	Low	185 Å²	185	108.9 Å²	108.9	86%	0.864	58%	0.578	S	S	*	*	S	Bend	trans	-63	89.7	158.8	-76.3	-169.1	157.5	0	0	107.3	H626	H626-E628 PolarHBondContact O-N 2.88Å
629	S	42.9	Very low	54	Low	101 Å²	101	114.5 Å²	114.5	71%	0.706	60%	0.599	S	S	*	*			trans	50	76.2	176.5	-169.3	0	0	0	0	112.6	P627	P627-S629 PolarHBondContact O-N 2.92Å
630	D	38.3	Very low	52.5	Low	110 Å²	110	121.5 Å²	121.5	59%	0.588	64%	0.637	S	S	*	*			trans	-54.3	144.3	156.8	-154.2	-17.3	0	0	0	107.9	P627 E632	P627-D630 HydrophobicContact CB-CB 4.44Å; D630-E632 HydrophobicContact CB-CG 4.2Å; D630-E632 PolarHBondContact O-N 3.42Å
631	D	48.3	Very low	50.9	Low	152 Å²	152	125.1 Å²	125.1	81%	0.813	66%	0.663	S	S	*	*			trans	-76.7	37.3	-179.5	-74.4	-54.2	0	0	0	110.6	E633	D631-E633 PolarHBondContact O-N 3.2Å; D631-E633 VanDerWaalsContact O-N 3.15Å
632	E	48.7	Very low	49.4	Very low	158 Å²	158	130.7 Å²	130.7	74%	0.738	68%	0.681	S	S	*	*			trans	-68.3	106.3	172.7	-75.1	-165.2	139.4	0	0	109.2	D630 H634	D630-E632 HydrophobicContact CB-CG 4.2Å; D630-E632 PolarHBondContact O-N 3.42Å; E632-H634 PolarHBondContact O-N 2.81Å; E632-H634 VanDerWaalsContact O-N 3.12Å
633	E	49.1	Very low	47.7	Very low	147 Å²	147	137.8 Å²	137.8	69%	0.687	72%	0.719	S	S	*	*			trans	-46.8	114.6	-176	-60.1	177.6	147.2	0	0	112	D631 F635	D631-E633 PolarHBondContact O-N 3.2Å; D631-E633 VanDerWaalsContact O-N 3.15Å; E633-F635 VanDerWaalsContact C-N 3.31Å; E633-F635 HydrophobicContact CB-CD2 4.29Å; E633-F635 HydrophobicContact CB-CE2 3.82Å; E633-F635 HydrophobicContact CB-CZ 4.31Å; E633-F635 WeakPolarHBondContact O-CD2 3.05Å; E633-F635 PolarHBondContact O-N 3.25Å; E633-F635 WeakPolarHBondContact OE2-CZ 3.3Å
634	H	39.9	Very low	45.7	Very low	183 Å²	183	144.2 Å²	144.2	85%	0.847	75%	0.75	S	S	*	*			trans	-65.9	91.4	169.1	-92.6	-35.5	0	0	0	109.7	E632 I636	E632-H634 PolarHBondContact O-N 2.81Å; E632-H634 VanDerWaalsContact O-N 3.12Å; H634-I636 VanDerWaalsContact C-N 3.32Å; H634-I636 PolarHBondContact O-N 3.19Å
635	F	42.8	Very low	44	Very low	172 Å²	172	146.3 Å²	146.3	75%	0.754	76%	0.756	S	S	*	*			trans	-64.5	92.5	166.1	-72.9	-83.6	0	0	0	109.5	E633 D637	E633-F635 VanDerWaalsContact C-N 3.31Å; E633-F635 HydrophobicContact CB-CD2 4.29Å; E633-F635 HydrophobicContact CB-CE2 3.82Å; E633-F635 HydrophobicContact CB-CZ 4.31Å; E633-F635 WeakPolarHBondContact O-CD2 3.05Å; E633-F635 PolarHBondContact O-N 3.25Å; E633-F635 WeakPolarHBondContact OE2-CZ 3.3Å; F635-D637 PolarHBondContact O-N 3.02Å
636	I	46.8	Very low	43	Very low	154 Å²	154	150.6 Å²	150.6	79%	0.79	77%	0.771	S	S	*	*			trans	-77.4	111.8	162.3	-59	173.1	0	0	0	105.9	H634 A638	H634-I636 VanDerWaalsContact C-N 3.32Å; H634-I636 PolarHBondContact O-N 3.19Å; I636-A638 PolarHBondContact O-N 3.17Å
637	D	55.8	Low	42.4	Very low	146 Å²	146	152 Å²	152	78%	0.781	78%	0.775	S	S	*	*			trans	-57.2	122.8	170.9	-77.8	-40.9	0	0	0	109	F635 N639	F635-D637 PolarHBondContact O-N 3.02Å; D637-N639 PolarHBondContact O-N 3.09Å; D637-N639 VanDerWaalsContact O-N 3.11Å
638	A	41.3	Very low	41.8	Very low	91 Å²	91	152.4 Å²	152.4	75%	0.752	78%	0.777	S	S	*	*			trans	-73.9	103.9	-179.9	0	0	0	0	0	109.6	I636 D640	I636-A638 PolarHBondContact O-N 3.17Å; A638-D640 PolarHBondContact O-N 3.03Å; A638-D640 VanDerWaalsContact O-N 3.12Å
639	N	40.8	Very low	41.2	Very low	158 Å²	158	151.2 Å²	151.2	85%	0.845	78%	0.776	S	S	*	*			trans	-69.3	102.8	162.2	-74.6	-13.5	0	0	0	108.3	D637 D641	D637-N639 PolarHBondContact O-N 3.09Å; D637-N639 VanDerWaalsContact O-N 3.11Å; N639-D641 PolarHBondContact O-N 3.5Å
640	D	47.9	Very low	40.8	Very low	151 Å²	151	150.2 Å²	150.2	81%	0.807	77%	0.774	S	S	*	*			trans	-58.7	115.2	159.9	-76.6	-34.8	0	0	0	108.8	A638	A638-D640 PolarHBondContact O-N 3.03Å; A638-D640 VanDerWaalsContact O-N 3.12Å
641	D	44.7	Very low	40.5	Very low	167 Å²	167	152.5 Å²	152.5	89%	0.893	79%	0.786	S	S	*	*			trans	-172.4	81.3	155.2	-96.8	-25.6	0	0	0	108.1	N639	N639-D641 PolarHBondContact O-N 3.5Å
642	E	43	Very low	39.7	Very low	187 Å²	187	155.2 Å²	155.2	87%	0.874	79%	0.791	S	S	*	*			trans	-77.2	163.2	163.8	-71.6	-166.8	129.9	0	0	110.8
643	D	39.4	Very low	38.8	Very low	153 Å²	153	156.2 Å²	156.2	82%	0.818	80%	0.795	S	S	*	*			trans	64	107.3	173.1	-64.9	-27	0	0	0	118.7
644	M	33	Very low	37.9	Very low	161 Å²	161	155 Å²	155	79%	0.793	80%	0.798	S	S	*	*				-170.1	111.1	110.5	-98.4	-70.6	-76.7	0	0	113.6
645	E	34.3	Very low	37.3	Very low	157 Å²	157	153.7 Å²	153.7	73%	0.734	79%	0.792	S	S	*	*			trans	42.4	126	154.1	-61.6	-163.7	158.1	0	0	123.3
646	K	34.7	Very low	36.5	Very low	176 Å²	176	153.5 Å²	153.5	77%	0.765	80%	0.796	S	S	*	*			trans	-93.6	128	169.5	165.8	-170.9	175.5	-177.4	0	110.6	T648	K646-T648 HydrophobicContact CD-CG2 4.47Å; K646-T648 HydrophobicContact CG-CG2 4.03Å
647	F	30.7	Very low	35.6	Very low	191 Å²	191	151.7 Å²	151.7	84%	0.838	79%	0.792	S	S	*	*			trans	-117.7	141.1	160.6	-102.9	-93.1	0	0	0	111.2
648	T	31.5	Very low	34.3	Very low	101 Å²	101	154.1 Å²	154.1	62%	0.62	80%	0.795	S	S	*	*			trans	-143.4	120.8	-176.6	51	0	0	0	0	111.3	K646	K646-T648 HydrophobicContact CD-CG2 4.47Å; K646-T648 HydrophobicContact CG-CG2 4.03Å
649	D	32.2	Very low	33.5	Very low	160 Å²	160	157 Å²	157	86%	0.856	79%	0.791	S	S	*	*			trans	-117.6	115.9	154.3	-74.6	-51.3	0	0	0	106.1
650	A	32.5	Very low	32.8	Very low	80 Å²	80	156.8 Å²	156.8	66%	0.661	79%	0.789	S	S	*	*				84.9	79.7	63.6	0	0	0	0	0	113
651	D	33.5	Very low	31.6	Very low	157 Å²	157	156 Å²	156	84%	0.84	78%	0.781	S	S	*	*				177.9	103.1	128.4	-98.3	-9	0	0	0	112.9
652	K	31.2	Very low	30.5	Very low	209 Å²	209	153.4 Å²	153.4	91%	0.909	77%	0.771	S	S	*	*			trans	153.5	78.1	143.8	-84.2	163.1	-176.4	168.4	0	114.5
653	E	30	Very low	29.7	Very low	179 Å²	179	153.1 Å²	153.1	84%	0.836	77%	0.769	S	S	*	*			trans	-72.4	154.4	138.6	-65.5	-178.1	176.4	0	0	108
654	T	29.6	Very low	29	Very low	121 Å²	121	152.7 Å²	152.7	74%	0.742	76%	0.762	S	S	*	*			cis	-156	172.3	-7.6	15.6	0	0	0	0	105.3
655	E	27.6	Very low	28.5	Very low	157 Å²	157	150.7 Å²	150.7	73%	0.734	76%	0.76	S	S	*	*			cis	-159.7	136.3	26.4	-156.9	166.3	-129.4	0	0	110.8
656	M	26.7	Very low	28.3	Very low	167 Å²	167	148 Å²	148	82%	0.823	75%	0.754	S	S	*	*			trans	37.4	153.9	146.7	-52.7	-170.2	-166.6	0	0	122.7
657	V	27.6	Very low	28.3	Very low	117 Å²	117	145.7 Å²	145.7	71%	0.709	76%	0.757	S	S	*	*			cis	-142.9	137.8	23.1	178	0	0	0	0	111.2
658	K	27.3	Very low	28.1	Very low	197 Å²	197	144.6 Å²	144.6	86%	0.857	75%	0.754	S	S	*	*			trans	17.6	131.5	154.8	-53.4	168.8	-176.4	176	0	118.9
659	K	25.2	Very low	27.8	Very low	151 Å²	151	145.4 Å²	145.4	66%	0.657	76%	0.764	S	S	*	*			cis	-144.5	-141.4	0.8	-155.2	-155.8	174.4	-172.8	0	110.2	E661	K659-E661 VanDerWaalsContact CE-CD 3.44Å; K659-E661 VanDerWaalsContact CE-OE1 3.24Å; K659-E661 WeakPolarHBondContact CE-OE1 3.47Å; K659-E661 WeakPolarHBondContact CE-OE2 3.24Å; K659-E661 IonicContact NZ-OE1 3.97Å; K659-E661 PolarHBondContact NZ-OE1 3.2Å; K659-E661 IonicContact NZ-OE2 2.76Å; K659-E661 PolarHBondContact NZ-OE2 2.91Å
660	L	25.1	Very low	27.4	Very low	154 Å²	154	144.2 Å²	144.2	81%	0.806	76%	0.758	S	S	*	*			trans	-142.1	-160.6	-159.5	-77.3	162.6	0	0	0	106.4
661	E	23.6	Very low	27.2	Very low	135 Å²	135	148.6 Å²	148.6	63%	0.631	77%	0.768	S	S	*	*			cis	-149.4	137.2	26.6	-69.9	153.9	129	0	0	110.6	K659	K659-E661 VanDerWaalsContact CE-CD 3.44Å; K659-E661 VanDerWaalsContact CE-OE1 3.24Å; K659-E661 WeakPolarHBondContact CE-OE1 3.47Å; K659-E661 WeakPolarHBondContact CE-OE2 3.24Å; K659-E661 IonicContact NZ-OE1 3.97Å; K659-E661 PolarHBondContact NZ-OE1 3.2Å; K659-E661 IonicContact NZ-OE2 2.76Å; K659-E661 PolarHBondContact NZ-OE2 2.91Å
662	T	21.7	Very low	26.9	Very low	111 Å²	111	147.7 Å²	147.7	68%	0.681	76%	0.759	S	S	*	*			trans	-163	122.9	-172	-45.1	0	0	0	0	110.1
663	E	25.3	Very low	26.7	Very low	181 Å²	181	144.7 Å²	144.7	85%	0.846	76%	0.758	S	S	*	*			trans	56.2	152.7	151.6	-68.2	153.9	-164.1	0	0	120.1
664	E	25.1	Very low	26.7	Very low	144 Å²	144	144.2 Å²	144.2	67%	0.673	75%	0.753	S	S	*	*			cis	-139.4	-130	-13.7	-148.8	-159.4	101.9	0	0	110.6	V666	E664-V666 VanDerWaalsContact OE1-CG2 3.24Å; E664-V666 WeakPolarHBondContact OE1-CG2 3.46Å; E664-V666 PolarHBondContact OE1-N 3.27Å
665	T	23.3	Very low	26.6	Very low	120 Å²	120	147.7 Å²	147.7	74%	0.736	76%	0.758	S	S	*	*			cis	-158	138	5.4	-16.5	0	0	0	0	114.4
666	V	30.9	Very low	26.8	Very low	100 Å²	100	146.3 Å²	146.3	61%	0.606	76%	0.763	S	S	*	*			trans	-0.8	141.6	144.8	165.6	0	0	0	0	121.2	E664 E668	E664-V666 VanDerWaalsContact OE1-CG2 3.24Å; E664-V666 WeakPolarHBondContact OE1-CG2 3.46Å; E664-V666 PolarHBondContact OE1-N 3.27Å; V666-E668 HydrophobicContact CG1-CG 4.42Å
667	P	34.8	Very low	27.2	Very low	128 Å²	128	146.7 Å²	146.7	83%	0.831	76%	0.762	S	S	*	*				-143.3	-176	85.2	38.7	-18.4	0	0	0	119
668	E	24.9	Very low	27.7	Very low	168 Å²	168	148.9 Å²	148.9	79%	0.785	77%	0.769	S	S	*	*			trans	-110.9	167.6	-145.5	-53.3	152.7	125.7	0	0	117.2	V666	V666-E668 HydrophobicContact CG1-CG 4.42Å
669	S	25	Very low	27.9	Very low	118 Å²	118	142.8 Å²	142.8	83%	0.825	76%	0.755	S	S	*	*				-164.2	153	128.1	48.6	0	0	0	0	112.4
670	D	25.3	Very low	28.5	Very low	135 Å²	135	138.9 Å²	138.9	72%	0.722	75%	0.747	S	S	*	*			trans	-93	166.2	-159.3	-53.1	-86.1	0	0	0	117.8
671	I	27.7	Very low	29.4	Very low	171 Å²	171	143.2 Å²	143.2	88%	0.877	75%	0.752	S	S	*	*				-155.5	134.4	117.2	-98.4	153.4	0	0	0	109.8
672	E	26.2	Very low	30.5	Very low	139 Å²	139	141.7 Å²	141.7	65%	0.65	75%	0.752	S	S	*	*			trans	-80.5	153.6	-176.4	-61.1	-170.5	120	0	0	114.7	K674	E672-K674 WeakPolarHBondContact OE2-CE 3.39Å
673	T	27.1	Very low	31.6	Very low	145 Å²	145	142.3 Å²	142.3	89%	0.89	75%	0.747	S	S	*	*			trans	-151.1	152.3	133.5	-1.8	0	0	0	0	111
674	K	30.2	Very low	32.1	Very low	169 Å²	169	140.3 Å²	140.3	74%	0.735	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-96	144.4	-148.2	-65	172.1	-179.1	174.7	0	114.6	E672	E672-K674 WeakPolarHBondContact OE2-CE 3.39Å
675	K	28.9	Very low	32.8	Very low	194 Å²	194	139 Å²	139	84%	0.843	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-97.6	144.9	162.5	-66.9	175.4	-177.5	165.8	0	110.3
676	P	31.8	Very low	33.8	Very low	128 Å²	128	138.7 Å²	138.7	83%	0.831	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-74.9	154	152.4	33.5	-32.2	0	0	0	110.3
677	E	34.5	Very low	34.5	Very low	175 Å²	175	141 Å²	141	82%	0.818	74%	0.735	S	S	*	*			trans	-101.9	-177.3	-172.1	-58	-173.4	114.1	0	0	113.9
678	I	37.5	Very low	34.9	Very low	164 Å²	164	143.2 Å²	143.2	84%	0.841	73%	0.732	S	S	*	*			trans	76.3	80.1	161.3	-49	153.7	0	0	0	115.8
679	A	31.6	Very low	35.6	Very low	68 Å²	68	136.3 Å²	136.3	56%	0.562	71%	0.706	S	S	*	*	S	Bend	trans	-144.8	136.8	139.9	0	0	0	0	0	109.4
680	S	37.3	Very low	36.4	Very low	70 Å²	70	132.5 Å²	132.5	49%	0.49	69%	0.685	S	S	.	*			trans	-38.2	137.5	-171.1	57.1	0	0	0	0	116.7	V682 H683	S680-V682 PolarHBondContact O-N 3.4Å; S680-H683 PolarHBondContact O-N 3.16Å
681	W	44.7	Very low	37.4	Very low	244 Å²	244	135.4 Å²	135.4	92%	0.924	69%	0.692	S	S	*	*	H	α-helix	trans	-44.9	-35.6	173.9	-88.3	48.9	0	0	0	114.2	H683	W681-H683 PolarHBondContact O-N 3.1Å
682	V	46.5	Very low	38.4	Very low	104 Å²	104	132.5 Å²	132.5	63%	0.63	67%	0.674	S	S	*	*	H	α-helix	trans	-65.9	-20.7	-178.2	-172.8	0	0	0	0	113.4	S680 N686	S680-V682 PolarHBondContact O-N 3.4Å; V682-N686 PolarHBondContact O-ND2 3.03Å
683	H	45.9	Very low	39.8	Very low	123 Å²	123	130 Å²	130	57%	0.569	67%	0.665	S	S	*	*	H	α-helix	trans	-88.4	-30.4	-177.4	-99.2	-79.6	0	0	0	114.5	S680 W681 N686 L687	S680-H683 PolarHBondContact O-N 3.16Å; W681-H683 PolarHBondContact O-N 3.1Å; H683-N686 PolarHBondContact O-N 3.33Å; H683-L687 PolarHBondContact O-N 3.47Å
684	F	35.9	Very low	41.6	Very low	140 Å²	140	129.8 Å²	129.8	61%	0.614	66%	0.658	S	S	*	*	H	α-helix	trans	-69.5	-41.1	-178.7	-92	-84.4	0	0	0	112.8	N686 L687 K688	F684-N686 PolarHBondContact O-N 3.09Å; F684-L687 PolarHBondContact O-N 3.01Å; F684-K688 PolarHBondContact O-N 2.91Å
685	D	39.7	Very low	43.8	Very low	116 Å²	116	129.8 Å²	129.8	62%	0.62	66%	0.658	S	S	*	*	H	α-helix	trans	-65.9	-21.2	176.2	-77.9	-4	0	0	0	113.6	K688 G690	D685-K688 CarbonylContact O-C 3.45Å; D685-G690 PolarHBondContact O-N 3.08Å
686	N	44.6	Very low	46.5	Very low	113 Å²	113	121.9 Å²	121.9	60%	0.604	62%	0.624	S	S	*	*	H	α-helix	trans	-85.7	-25.1	176.3	-80.1	-66.2	0	0	0	113	V682 H683 F684	V682-N686 PolarHBondContact O-ND2 3.03Å; H683-N686 PolarHBondContact O-N 3.33Å; F684-N686 PolarHBondContact O-N 3.09Å
687	L	45.2	Very low	49.2	Very low	148 Å²	148	119 Å²	119	78%	0.775	60%	0.601	S	S	*	*	H	α-helix	trans	-79.1	-43.6	169.2	-96.1	69	0	0	0	111.4	H683 F684 G689	H683-L687 PolarHBondContact O-N 3.47Å; F684-L687 PolarHBondContact O-N 3.01Å; L687-G689 PolarHBondContact O-N 2.88Å; L687-G689 VanDerWaalsContact O-N 3.1Å
688	K	41.6	Very low	51.5	Low	175 Å²	175	113.1 Å²	113.1	76%	0.761	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	64.9	170.5	-71.3	-170.9	174.9	-173.5	0	110.4	F684 D685 G690	F684-K688 PolarHBondContact O-N 2.91Å; D685-K688 CarbonylContact O-C 3.45Å; K688-G690 PolarHBondContact O-N 2.96Å; K688-G690 VanDerWaalsContact O-N 3.09Å
689	G	41.1	Very low	53.7	Low	24 Å²	24	113.7 Å²	113.7	25%	0.247	58%	0.575	C	S	.	*	T	Hydrogen-bonded Turn	trans	-33.1	109.5	-169.5	0	0	0	0	0	114	R581 L687	R581-G689 PolarHBondContact NH1-O 2.84Å; L687-G689 PolarHBondContact O-N 2.88Å; L687-G689 VanDerWaalsContact O-N 3.1Å
690	G	40.5	Very low	56.2	Low	38 Å²	38	111 Å²	111	39%	0.392	55%	0.552	S	S	.	*	S	Bend	trans	-65.8	151	-154.8	0	0	0	0	0	117	D685 K688	D685-G690 PolarHBondContact O-N 3.08Å; K688-G690 PolarHBondContact O-N 2.96Å; K688-G690 VanDerWaalsContact O-N 3.09Å
691	K	47.6	Very low	58.4	Low	196 Å²	196	115.8 Å²	115.8	85%	0.852	56%	0.559	S	S	*	*	S	Bend	trans	48.2	92.2	-179	-67.1	-167.9	177.2	-172.2	0	113.9	L693	K691-L693 PolarHBondContact O-N 3.27Å
692	Q	48.5	Very low	60.4	Low	109 Å²	109	106 Å²	106	51%	0.509	53%	0.525	S	S	.	.			trans	-43.3	110.9	161.5	-75.6	-76.5	18.9	0	0	110	N710	Q692-N710 PolarHBondContact OE1-ND2 2.95Å
693	L	55.6	Low	62.4	Low	87 Å²	87	101 Å²	101	46%	0.455	50%	0.495	S	S	.	.			trans	-90.1	107.8	170.2	-78.6	170.2	0	0	0	107.3	K691 K695 F705 N710	K691-L693 PolarHBondContact O-N 3.27Å; L693-K695 PolarHBondContact O-N 3.49Å; L693-F705 WeakPolarHBondContact CD1-O 3.24Å; L693-N710 PolarHBondContact O-ND2 3.26Å; L693-N710 VanDerWaalsContact O-ND2 3.07Å
694	N	64.1	Low	64.3	Low	141 Å²	141	97 Å²	97	75%	0.754	48%	0.478	S	S	*	.	S	Bend	trans	-71.1	12.9	177.1	-59.4	12.3	0	0	0	112.6
695	K	77.8	Confident	66.6	Low	169 Å²	169	95.6 Å²	95.6	74%	0.735	47%	0.471	S	S	*	.	S	Bend	trans	-150	130.9	-177.3	-170.7	167	-174.4	167.5	0	110.2	L693	L693-K695 PolarHBondContact O-N 3.49Å
696	Y	85.6	Confident	68.7	Low	28 Å²	28	90.2 Å²	90.2	11%	0.11	44%	0.443	C	S	.	.			trans	-71.6	134.3	177.8	172.6	-104.8	0	0	0	112.3	K588 Q592 P698 C706 A708	K588-Y696 HydrophobicContact CB-CE2 4.46Å; K588-Y696 HydrophobicContact CG-CD2 4.26Å; K588-Y696 HydrophobicContact CG-CE1 4.22Å; K588-Y696 HydrophobicContact CG-CE2 3.86Å; Q592-Y696 PolarHBondContact OE1-OH 3.06Å; Y696-P698 HydrophobicContact CD1-CG 3.94Å; Y696-P698 HydrophobicContact CE1-CB 3.88Å; Y696-P698 HydrophobicContact CE1-CG 3.7Å; Y696-C706 CarbonylContact C-O 3.6Å; Y696-C706 VanDerWaalsContact CA-O 3.24Å; Y696-C706 WeakPolarHBondContact CA-O 3.29Å; Y696-C706 HydrophobicContact CD2-CB 4.3Å; Y696-C706 VanDerWaalsContact CD2-O 3.27Å; Y696-C706 WeakPolarHBondContact CD2-O 3.39Å; Y696-C706 HydrophobicContact CE2-CB 4.15Å; Y696-A708 HydrophobicContact CD2-CB 3.68Å; Y696-A708 HydrophobicContact CE2-CB 3.87Å
697	D	87	Confident	70.4	Confident	67 Å²	67	85.2 Å²	85.2	36%	0.358	42%	0.418	S	S	.	.			trans	-104.2	107.9	169.7	172.3	20	0	0	0	110.9	F699 S700 C706	D697-F699 VanDerWaalsContact C-N 3.25Å; D697-F699 PolarHBondContact O-N 3.45Å; D697-F699 PolarHBondContact OD1-N 3.39Å; D697-S700 WeakPolarHBondContact O-CB 3.41Å; D697-S700 PolarHBondContact O-N 2.89Å; D697-S700 PolarHBondContact O-OG 2.88Å; D697-S700 PolarHBondContact OD1-N 2.94Å; D697-S700 VanDerWaalsContact OD2-CA 3.27Å; D697-S700 WeakPolarHBondContact OD2-CA 3.27Å; D697-S700 WeakPolarHBondContact OD2-CB 3.38Å; D697-S700 PolarHBondContact OD2-N 3.14Å; D697-C706 PolarHBondContact N-O 2.88Å
698	P	83.1	Confident	72.3	Confident	52 Å²	52	78.2 Å²	78.2	34%	0.338	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.4	176.9	-19	30	0	0	0	114.7	R589 Y696	R589-P698 PolarHBondContact NH2-O 2.99Å; Y696-P698 HydrophobicContact CD1-CG 3.94Å; Y696-P698 HydrophobicContact CE1-CB 3.88Å; Y696-P698 HydrophobicContact CE1-CG 3.7Å
699	F	84	Confident	74	Confident	176 Å²	176	72.3 Å²	72.3	77%	0.772	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-5	-173.8	-63	-75.4	0	0	0	113.8	D697 R701	D697-F699 VanDerWaalsContact C-N 3.25Å; D697-F699 PolarHBondContact O-N 3.45Å; D697-F699 PolarHBondContact OD1-N 3.39Å; F699-R701 PolarHBondContact O-N 2.93Å
700	S	84.6	Confident	75.8	Confident	12 Å²	12	74.4 Å²	74.4	8%	0.084	36%	0.362	C	S	.	.			trans	-46.4	131.2	175.2	56.1	0	0	0	0	112.7	R589 D697 C706	R589-S700 PolarHBondContact NH2-O 3.45Å; D697-S700 WeakPolarHBondContact O-CB 3.41Å; D697-S700 PolarHBondContact O-N 2.89Å; D697-S700 PolarHBondContact O-OG 2.88Å; D697-S700 PolarHBondContact OD1-N 2.94Å; D697-S700 VanDerWaalsContact OD2-CA 3.27Å; D697-S700 WeakPolarHBondContact OD2-CA 3.27Å; D697-S700 WeakPolarHBondContact OD2-CB 3.38Å; D697-S700 PolarHBondContact OD2-N 3.14Å; S700-C706 WeakPolarHBondContact OG-CB 3.39Å
701	R	83.7	Confident	77.8	Confident	169 Å²	169	74.1 Å²	74.1	64%	0.638	35%	0.353	S	S	*	.	S	Bend	trans	-78.5	-41.7	-176.1	-179.1	175	174.5	-179.4	-1.6	112.8	T546 F699	T546-R701 HydrophobicContact CG2-CG 3.92Å; F699-R701 PolarHBondContact O-N 2.93Å
702	N	86.3	Confident	79.5	Confident	38 Å²	38	65.9 Å²	65.9	20%	0.203	32%	0.32	C	S	.	.	S	Bend	trans	-102.6	124	179.8	179.2	-13.6	0	0	0	109	L704 F705	N702-L704 PolarHBondContact O-N 3.28Å; N702-L704 VanDerWaalsContact O-N 3.14Å; N702-L704 WeakPolarHBondContact OD1-CB 3.29Å; N702-L704 PolarHBondContact OD1-N 3.47Å; N702-F705 HydrophobicContact CB-CD2 4.13Å; N702-F705 PolarHBondContact O-N 3.09Å
703	P	87.8	Confident	81.3	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.006	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-62.6	-17.4	-178.9	25	-34.3	0	0	0	114.7	Y549 R582 A585 F586 F705 C706	Y549-P703 HydrophobicContact CD1-CB 3.63Å; Y549-P703 HydrophobicContact CD1-CG 4.02Å; Y549-P703 HydrophobicContact CD2-CB 3.96Å; Y549-P703 VanDerWaalsContact CE1-CA 3.5Å; Y549-P703 HydrophobicContact CE1-CB 3.73Å; Y549-P703 HydrophobicContact CE2-CB 4.07Å; Y549-P703 HydrophobicContact CG-CB 3.76Å; Y549-P703 HydrophobicContact CG-CG 4.02Å; R582-P703 HydrophobicContact CG-CB 4.07Å; R582-P703 HydrophobicContact CG-CG 3.8Å; A585-P703 HydrophobicContact CB-CB 3.76Å; A585-P703 WeakPolarHBondContact CB-O 3.35Å; F586-P703 HydrophobicContact CD2-CB 4.24Å; F586-P703 HydrophobicContact CD2-CG 4.42Å; F586-P703 HydrophobicContact CE2-CB 4.15Å; F586-P703 HydrophobicContact CE2-CG 3.86Å; P703-F705 VanDerWaalsContact C-N 3.3Å; P703-F705 PolarHBondContact O-N 2.65Å; P703-C706 PolarHBondContact O-SG 3.2Å; P703-C706 VanDerWaalsContact O-SG 3.34Å
704	L	86.6	Confident	82.9	Confident	39 Å²	39	64 Å²	64	20%	0.204	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-71.4	-22	177.8	-65.3	172.8	0	0	0	113.8	D542 V579 R582 N702	D542-L704 WeakPolarHBondContact OD2-CD1 3.46Å; V579-L704 HydrophobicContact CG1-CD2 3.66Å; R582-L704 HydrophobicContact CB-CD2 3.9Å; N702-L704 PolarHBondContact O-N 3.28Å; N702-L704 VanDerWaalsContact O-N 3.14Å; N702-L704 WeakPolarHBondContact OD1-CB 3.29Å; N702-L704 PolarHBondContact OD1-N 3.47Å
705	F	83.4	Confident	84.1	Confident	109 Å²	109	58.6 Å²	58.6	48%	0.478	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-118.3	21.3	-171.8	-59	-71.9	0	0	0	113.1	L693 N702 P703	L693-F705 WeakPolarHBondContact CD1-O 3.24Å; N702-F705 HydrophobicContact CB-CD2 4.13Å; N702-F705 PolarHBondContact O-N 3.09Å; P703-F705 VanDerWaalsContact C-N 3.3Å; P703-F705 PolarHBondContact O-N 2.65Å
706	C	84.1	Confident	84.7	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.02	24%	0.238	C	C	.	.	S	Bend	trans	-89.1	-7.4	-175.7	70.9	0	0	0	0	114.9	A585 Y696 D697 S700 P703 A708	A585-C706 WeakPolarHBondContact CB-SG 3.4Å; Y696-C706 CarbonylContact C-O 3.6Å; Y696-C706 VanDerWaalsContact CA-O 3.24Å; Y696-C706 WeakPolarHBondContact CA-O 3.29Å; Y696-C706 HydrophobicContact CD2-CB 4.3Å; Y696-C706 VanDerWaalsContact CD2-O 3.27Å; Y696-C706 WeakPolarHBondContact CD2-O 3.39Å; Y696-C706 HydrophobicContact CE2-CB 4.15Å; D697-C706 PolarHBondContact N-O 2.88Å; S700-C706 WeakPolarHBondContact OG-CB 3.39Å; P703-C706 PolarHBondContact O-SG 3.2Å; P703-C706 VanDerWaalsContact O-SG 3.34Å; C706-A708 VanDerWaalsContact C-N 3.27Å; C706-A708 PolarHBondContact O-N 3.04Å; C706-A708 WeakPolarHBondContact SG-CB 3.49Å; C706-A708 PolarHBondContact SG-N 3.23Å; C706-A708 VanDerWaalsContact SG-N 3.44Å
707	G	81.4	Confident	84.9	Confident	8 Å²	8	54.1 Å²	54.1	8%	0.082	25%	0.254	C	S	.	.			trans	72.3	8.2	-177.3	0	0	0	0	0	115.8	E709 N710	G707-E709 PolarHBondContact O-N 3.36Å; G707-N710 PolarHBondContact O-N 3.04Å
708	A	83.8	Confident	85.1	Confident	2 Å²	2	58.4 Å²	58.4	2%	0.017	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-62.5	-25.1	-175.5	0	0	0	0	0	114.2	A585 K588 Q622 Y696 C706 N710 T711	A585-A708 HydrophobicContact CB-CB 4.13Å; K588-A708 HydrophobicContact CB-CB 4.17Å; K588-A708 HydrophobicContact CG-CB 4.35Å; Q622-A708 PolarHBondContact NE2-O 2.93Å; Y696-A708 HydrophobicContact CD2-CB 3.68Å; Y696-A708 HydrophobicContact CE2-CB 3.87Å; C706-A708 VanDerWaalsContact C-N 3.27Å; C706-A708 PolarHBondContact O-N 3.04Å; C706-A708 WeakPolarHBondContact SG-CB 3.49Å; C706-A708 PolarHBondContact SG-N 3.23Å; C706-A708 VanDerWaalsContact SG-N 3.44Å; A708-N710 PolarHBondContact O-N 3.06Å; A708-T711 PolarHBondContact O-N 2.78Å; A708-T711 PolarHBondContact O-OG1 2.89Å
709	E	78.6	Confident	85.4	Confident	50 Å²	50	56.1 Å²	56.1	23%	0.234	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-61.6	-27.1	-178.3	67.6	-172.3	120.3	0	0	113.6	R581 K584 G707	R581-E709 WeakPolarHBondContact CD-OE1 3.43Å; R581-E709 IonicContact CZ-OE1 2.88Å; R581-E709 IonicContact CZ-OE2 2.94Å; R581-E709 IonicContact NE-OE1 2.68Å; R581-E709 PolarHBondContact NE-OE1 3Å; R581-E709 IonicContact NE-OE2 2.73Å; R581-E709 PolarHBondContact NE-OE2 3.33Å; R581-E709 IonicContact NH1-OE1 2.79Å; R581-E709 VanDerWaalsContact NH2-CD 3.29Å; R581-E709 IonicContact NH2-OE1 2.87Å; R581-E709 PolarHBondContact NH2-OE1 3.46Å; R581-E709 IonicContact NH2-OE2 2.65Å; R581-E709 PolarHBondContact NH2-OE2 2.88Å; K584-E709 HydrophobicContact CD-CB 3.98Å; G707-E709 PolarHBondContact O-N 3.36Å
710	N	77.9	Confident	85.7	Confident	69 Å²	69	48.6 Å²	48.6	37%	0.369	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-97.7	22.4	-179	-58.7	-35.7	0	0	0	112.4	Q692 L693 G707 A708	Q692-N710 PolarHBondContact OE1-ND2 2.95Å; L693-N710 PolarHBondContact O-ND2 3.26Å; L693-N710 VanDerWaalsContact O-ND2 3.07Å; G707-N710 PolarHBondContact O-N 3.04Å; A708-N710 PolarHBondContact O-N 3.06Å
711	T	82.2	Confident	86	Confident	31 Å²	31	53.2 Å²	53.2	19%	0.19	25%	0.251	C	S	.	.			trans	-138.6	134.3	-178.6	62.3	0	0	0	0	113.9	Q622 A708	Q622-T711 PolarHBondContact NE2-O 3.18Å; A708-T711 PolarHBondContact O-N 2.78Å; A708-T711 PolarHBondContact O-OG1 2.89Å
712	S	83.9	Confident	86.2	Confident	23 Å²	23	47 Å²	47	16%	0.161	23%	0.229	C	C	.	.			trans	-68.1	158.3	173.7	-38.3	0	0	0	0	112.9	K588 D625 W714	K588-S712 PolarHBondContact NZ-O 3.38Å; D625-S712 PolarHBondContact OD1-OG 3.21Å; S712-W714 VanDerWaalsContact C-N 3.29Å; S712-W714 VanDerWaalsContact O-CD1 3.3Å; S712-W714 PolarHBondContact O-N 2.93Å
713	L	86.7	Confident	86.3	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.052	26%	0.255	C	S	.	.			trans	-85.8	55.3	-177.6	-56.5	-173.2	0	0	0	113.5	V587 K588 L591 Q622 L623 E715 L716	V587-L713 HydrophobicContact CG1-CD1 3.99Å; K588-L713 HydrophobicContact CB-CD2 4.46Å; K588-L713 HydrophobicContact CD-CD2 3.88Å; L591-L713 HydrophobicContact CD1-CB 4.11Å; L591-L713 HydrophobicContact CD1-CD1 3.85Å; L591-L713 HydrophobicContact CD1-CD2 4.17Å; L591-L713 HydrophobicContact CD1-CG 4.26Å; Q622-L713 HydrophobicContact CB-CD1 4.36Å; Q622-L713 HydrophobicContact CB-CD2 4.28Å; Q622-L713 HydrophobicContact CB-CG 3.91Å; Q622-L713 PolarHBondContact O-N 3.39Å; L623-L713 HydrophobicContact CD1-CD1 3.73Å; L713-E715 PolarHBondContact O-N 2.88Å; L713-L716 HydrophobicContact CB-CD1 3.84Å; L713-L716 HydrophobicContact CB-CG 4.3Å; L713-L716 HydrophobicContact CD1-CD1 3.97Å; L713-L716 WeakPolarHBondContact O-CB 3.31Å; L713-L716 PolarHBondContact O-N 2.98Å
714	W	87.8	Confident	86.1	Confident	148 Å²	148	54.9 Å²	54.9	56%	0.561	26%	0.263	S	S	*	.	H	α-helix	trans	-45.6	-30.3	179.4	-66.4	102.5	0	0	0	115.5	S712 L716 K717 K718	S712-W714 VanDerWaalsContact C-N 3.29Å; S712-W714 VanDerWaalsContact O-CD1 3.3Å; S712-W714 PolarHBondContact O-N 2.93Å; W714-L716 VanDerWaalsContact C-N 3.31Å; W714-L716 PolarHBondContact O-N 3.11Å; W714-K717 HydrophobicContact CE3-CD 4.02Å; W714-K717 HydrophobicContact CZ3-CD 3.99Å; W714-K717 VanDerWaalsContact O-CB 3.29Å; W714-K717 WeakPolarHBondContact O-CB 3.44Å; W714-K717 PolarHBondContact O-N 2.94Å; W714-K717 VanDerWaalsContact O-N 3.12Å; W714-K718 PolarHBondContact O-N 2.73Å
715	E	91.1	Very high	86.1	Confident	26 Å²	26	55.6 Å²	55.6	12%	0.121	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-37.6	176.6	-61.1	81.5	-179.3	0	0	112.1	K588 L591 Q592 L713 K717 K718 L719	K588-E715 VanDerWaalsContact CE-OE1 3.29Å; K588-E715 WeakPolarHBondContact CE-OE1 3.49Å; K588-E715 IonicContact NZ-OE1 2.75Å; K588-E715 PolarHBondContact NZ-OE1 2.96Å; K588-E715 IonicContact NZ-OE2 3.55Å; K588-E715 PolarHBondContact NZ-OE2 3.46Å; L591-E715 HydrophobicContact CB-CB 3.79Å; L591-E715 HydrophobicContact CB-CG 4.27Å; Q592-E715 HydrophobicContact CG-CG 3.76Å; Q592-E715 WeakPolarHBondContact CG-OE1 3.14Å; Q592-E715 PolarHBondContact NE2-OE1 3.46Å; L713-E715 PolarHBondContact O-N 2.88Å; E715-K717 VanDerWaalsContact C-N 3.34Å; E715-K717 PolarHBondContact O-N 2.91Å; E715-K718 PolarHBondContact O-N 2.89Å; E715-L719 WeakPolarHBondContact O-CG 3.4Å; E715-L719 PolarHBondContact O-N 2.86Å
716	L	89.1	Confident	86.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63	-40	173.6	-70.7	170.9	0	0	0	111.6	L591 L606 L713 W714 K718 L719 S720 I734 L735	L591-L716 HydrophobicContact CD1-CD1 4.29Å; L591-L716 HydrophobicContact CD1-CD2 4.4Å; L591-L716 HydrophobicContact CD1-CG 3.97Å; L591-L716 HydrophobicContact CD2-CD2 3.64Å; L591-L716 HydrophobicContact CD2-CG 4.07Å; L606-L716 HydrophobicContact CD2-CD2 3.53Å; L713-L716 HydrophobicContact CB-CD1 3.84Å; L713-L716 HydrophobicContact CB-CG 4.3Å; L713-L716 HydrophobicContact CD1-CD1 3.97Å; L713-L716 WeakPolarHBondContact O-CB 3.31Å; L713-L716 PolarHBondContact O-N 2.98Å; W714-L716 VanDerWaalsContact C-N 3.31Å; W714-L716 PolarHBondContact O-N 3.11Å; L716-K718 VanDerWaalsContact C-N 3.27Å; L716-K718 PolarHBondContact O-N 2.86Å; L716-L719 PolarHBondContact O-N 3.33Å; L716-S720 PolarHBondContact O-N 3.47Å; L716-I734 HydrophobicContact CD1-CG2 3.66Å; L716-I734 HydrophobicContact CD2-CD1 4.43Å; L716-I734 HydrophobicContact CD2-CG2 4.27Å; L716-L735 HydrophobicContact CB-CD1 4.32Å; L716-L735 HydrophobicContact CB-CD2 3.85Å; L716-L735 HydrophobicContact CB-CG 4.02Å; L716-L735 HydrophobicContact CD1-CD2 4.39Å
717	K	89.8	Confident	86.4	Confident	103 Å²	103	50.4 Å²	50.4	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-39.5	177	-152.3	165.8	-168.3	159.5	0	110.3	D625 W714 E715 S720	D625-K717 IonicContact OD2-NZ 2.71Å; D625-K717 PolarHBondContact OD2-NZ 3.11Å; W714-K717 HydrophobicContact CE3-CD 4.02Å; W714-K717 HydrophobicContact CZ3-CD 3.99Å; W714-K717 VanDerWaalsContact O-CB 3.29Å; W714-K717 WeakPolarHBondContact O-CB 3.44Å; W714-K717 PolarHBondContact O-N 2.94Å; W714-K717 VanDerWaalsContact O-N 3.12Å; E715-K717 VanDerWaalsContact C-N 3.34Å; E715-K717 PolarHBondContact O-N 2.91Å; K717-S720 WeakPolarHBondContact O-CB 3.21Å; K717-S720 PolarHBondContact O-OG 3.49Å
718	K	90.4	Very high	86.8	Confident	157 Å²	157	50.6 Å²	50.6	68%	0.683	25%	0.248	S	C	*	.	H	α-helix	trans	-71	-41.3	173.4	-173.1	58	174.6	175.9	0	113.1	W714 E715 L716 S720 V721	W714-K718 PolarHBondContact O-N 2.73Å; E715-K718 PolarHBondContact O-N 2.89Å; L716-K718 VanDerWaalsContact C-N 3.27Å; L716-K718 PolarHBondContact O-N 2.86Å; K718-S720 PolarHBondContact O-N 3.31Å; K718-V721 PolarHBondContact O-N 3.14Å; K718-V721 VanDerWaalsContact O-N 3.15Å
719	L	90.4	Very high	87	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-65.4	-24.9	176.3	-69.2	171.4	0	0	0	113.1	L591 I602 L606 E715 L716 V721 H722 V727 A728 A731	L591-L719 HydrophobicContact CD2-CD1 4.46Å; I602-L719 HydrophobicContact CD1-CD2 4.39Å; I602-L719 HydrophobicContact CG2-CD1 4.37Å; I602-L719 HydrophobicContact CG2-CD2 4.04Å; L606-L719 HydrophobicContact CD2-CD1 4.08Å; E715-L719 WeakPolarHBondContact O-CG 3.4Å; E715-L719 PolarHBondContact O-N 2.86Å; L716-L719 PolarHBondContact O-N 3.33Å; L719-V721 PolarHBondContact O-N 3.16Å; L719-V721 VanDerWaalsContact O-N 3.15Å; L719-H722 WeakPolarHBondContact O-CB 3.36Å; L719-H722 PolarHBondContact O-N 2.94Å; L719-H722 VanDerWaalsContact O-N 3.08Å; L719-V727 HydrophobicContact CB-CG1 4.39Å; L719-V727 HydrophobicContact CD2-CG1 4.13Å; L719-A728 WeakPolarHBondContact O-CA 3.36Å; L719-A731 HydrophobicContact CB-CB 3.77Å
720	S	89.6	Confident	87.5	Confident	18 Å²	18	51.6 Å²	51.6	13%	0.126	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.5	173.1	85.1	0	0	0	0	114.2	L716 K717 K718 K732	L716-S720 PolarHBondContact O-N 3.47Å; K717-S720 WeakPolarHBondContact O-CB 3.21Å; K717-S720 PolarHBondContact O-OG 3.49Å; K718-S720 PolarHBondContact O-N 3.31Å; S720-K732 WeakPolarHBondContact O-CE 3.41Å; S720-K732 PolarHBondContact O-NZ 3.32Å; S720-K732 VanDerWaalsContact O-NZ 3.11Å
721	V	90.8	Very high	88.2	Confident	108 Å²	108	48.3 Å²	48.3	66%	0.655	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.3	25	177.7	-155.2	0	0	0	0	110.8	K718 L719	K718-V721 PolarHBondContact O-N 3.14Å; K718-V721 VanDerWaalsContact O-N 3.15Å; L719-V721 PolarHBondContact O-N 3.16Å; L719-V721 VanDerWaalsContact O-N 3.15Å
722	H	89.5	Confident	88.5	Confident	39 Å²	39	51.8 Å²	51.8	18%	0.181	25%	0.248	C	C	.	.			trans	-75.3	146.2	176	-171.3	-94.7	0	0	0	111.6	L719 H724 V727	L719-H722 WeakPolarHBondContact O-CB 3.36Å; L719-H722 PolarHBondContact O-N 2.94Å; L719-H722 VanDerWaalsContact O-N 3.08Å; H722-H724 VanDerWaalsContact C-N 3.33Å; H722-H724 WeakPolarHBondContact ND1-CB 3.36Å; H722-H724 PolarHBondContact ND1-N 3.28Å; H722-H724 VanDerWaalsContact ND1-N 3.15Å; H722-H724 PolarHBondContact O-N 3.46Å; H722-V727 HydrophobicContact CB-CB 4.2Å; H722-V727 HydrophobicContact CB-CG1 3.66Å
723	F	87.2	Confident	88.8	Confident	170 Å²	170	52 Å²	52	75%	0.746	25%	0.249	S	C	*	.	S	Bend	trans	-63.4	-35.2	-176.3	63.8	-91.8	0	0	0	113.4	P599	P599-F723 HydrophobicContact CG-CE2 4.3Å; P599-F723 HydrophobicContact CG-CZ 4.08Å
724	H	85	Confident	88.9	Confident	35 Å²	35	51.6 Å²	51.6	16%	0.162	25%	0.246	C	C	.	.	S	Bend	trans	-75.9	121.1	177.8	-170.7	-100.8	0	0	0	111.1	P599 H722 S726 V727 A728 F750	P599-H724 HydrophobicContact CB-CB 4.24Å; P599-H724 HydrophobicContact CG-CB 4.35Å; H722-H724 VanDerWaalsContact C-N 3.33Å; H722-H724 WeakPolarHBondContact ND1-CB 3.36Å; H722-H724 PolarHBondContact ND1-N 3.28Å; H722-H724 VanDerWaalsContact ND1-N 3.15Å; H722-H724 PolarHBondContact O-N 3.46Å; H724-S726 PolarHBondContact CE1-OG 3.31Å; H724-S726 PolarHBondContact O-N 3.14Å; H724-V727 HydrophobicContact CB-CB 4.38Å; H724-V727 HydrophobicContact CB-CG2 4.12Å; H724-V727 WeakPolarHBondContact O-CB 3.32Å; H724-V727 PolarHBondContact O-N 3.14Å; H724-V727 VanDerWaalsContact O-N 3.12Å; H724-A728 PolarHBondContact O-N 3.46Å; H724-F750 AromaticContact CE1-CD1 3.89Å
725	P	84.8	Confident	88.8	Confident	54 Å²	54	47.6 Å²	47.6	35%	0.351	24%	0.236	S	C	.	.	H	α-helix	trans	-63.9	-38.2	-167.7	24.2	-34.4	0	0	0	113.4	V727 A728 L729 V809	P725-V727 VanDerWaalsContact C-N 3.32Å; P725-V727 PolarHBondContact O-N 3.29Å; P725-A728 PolarHBondContact O-N 3.1Å; P725-L729 PolarHBondContact O-N 3.06Å; P725-V809 HydrophobicContact CB-CG1 4.22Å
726	S	86.1	Confident	88.6	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-33.2	178.4	-38.1	0	0	0	0	112.6	H724 F730 F750	H724-S726 PolarHBondContact CE1-OG 3.31Å; H724-S726 PolarHBondContact O-N 3.14Å; S726-F730 WeakPolarHBondContact O-CB 3.5Å; S726-F730 WeakPolarHBondContact O-CD1 3.34Å; S726-F730 VanDerWaalsContact O-CG 3.24Å; S726-F730 WeakPolarHBondContact O-CG 3.33Å; S726-F730 PolarHBondContact O-N 2.86Å; S726-F750 WeakPolarHBondContact OG-CE1 3.44Å
727	V	88.7	Confident	88.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.1	-46.8	175.1	172.2	0	0	0	0	109.7	P599 I602 C603 L606 L719 H722 H724 P725 L729 F730 A731	P599-V727 HydrophobicContact CB-CG2 4.43Å; I602-V727 HydrophobicContact CB-CG2 4.1Å; I602-V727 HydrophobicContact CG2-CB 4.43Å; I602-V727 HydrophobicContact CG2-CG1 3.59Å; I602-V727 HydrophobicContact CG2-CG2 3.96Å; C603-V727 VanDerWaalsContact SG-CG2 3.52Å; L606-V727 HydrophobicContact CD1-CG1 4.21Å; L719-V727 HydrophobicContact CB-CG1 4.39Å; L719-V727 HydrophobicContact CD2-CG1 4.13Å; H722-V727 HydrophobicContact CB-CB 4.2Å; H722-V727 HydrophobicContact CB-CG1 3.66Å; H724-V727 HydrophobicContact CB-CB 4.38Å; H724-V727 HydrophobicContact CB-CG2 4.12Å; H724-V727 WeakPolarHBondContact O-CB 3.32Å; H724-V727 PolarHBondContact O-N 3.14Å; H724-V727 VanDerWaalsContact O-N 3.12Å; P725-V727 VanDerWaalsContact C-N 3.32Å; P725-V727 PolarHBondContact O-N 3.29Å; V727-L729 VanDerWaalsContact C-N 3.29Å; V727-L729 PolarHBondContact O-N 2.87Å; V727-F730 PolarHBondContact O-N 3.48Å; V727-A731 WeakPolarHBondContact O-CB 3.45Å; V727-A731 PolarHBondContact O-N 3.22Å
728	A	89.6	Confident	87.8	Confident	12 Å²	12	52.9 Å²	52.9	10%	0.099	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-36.5	178	0	0	0	0	0	112.3	L719 H724 P725 K732	L719-A728 WeakPolarHBondContact O-CA 3.36Å; H724-A728 PolarHBondContact O-N 3.46Å; P725-A728 PolarHBondContact O-N 3.1Å; A728-K732 WeakPolarHBondContact O-CB 3.35Å; A728-K732 WeakPolarHBondContact O-CD 3.45Å; A728-K732 WeakPolarHBondContact O-CG 3.14Å; A728-K732 PolarHBondContact O-N 2.86Å
729	L	87.9	Confident	87.5	Confident	62 Å²	62	49.8 Å²	49.8	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-68.2	-51.9	172.7	-173.4	152.5	0	0	0	111.8	P725 V727 A731 K732 T733 V809	P725-L729 PolarHBondContact O-N 3.06Å; V727-L729 VanDerWaalsContact C-N 3.29Å; V727-L729 PolarHBondContact O-N 2.87Å; L729-A731 VanDerWaalsContact C-N 3.27Å; L729-A731 PolarHBondContact O-N 3.25Å; L729-K732 CarbonylContact O-C 3.6Å; L729-K732 WeakPolarHBondContact O-CA 3.35Å; L729-K732 WeakPolarHBondContact O-CB 3.35Å; L729-K732 PolarHBondContact O-N 2.87Å; L729-T733 HydrophobicContact CD2-CG2 3.73Å; L729-T733 HydrophobicContact CG-CG2 4.42Å; L729-T733 PolarHBondContact O-N 3.34Å; L729-T733 PolarHBondContact O-OG1 2.95Å; L729-V809 HydrophobicContact CB-CG1 4.33Å; L729-V809 HydrophobicContact CD1-CB 3.94Å; L729-V809 HydrophobicContact CD1-CG1 3.86Å; L729-V809 HydrophobicContact CD1-CG2 3.59Å
730	F	90.2	Very high	87.3	Confident	11 Å²	11	49.8 Å²	49.8	5%	0.048	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-38.4	-177.8	-76	5.2	0	0	0	112	C603 L606 S726 V727 T733 I734 I740 Y742 F750	C603-F730 HydrophobicContact CB-CD2 4.08Å; C603-F730 HydrophobicContact CB-CE2 3.94Å; L606-F730 HydrophobicContact CB-CB 4.18Å; L606-F730 HydrophobicContact CB-CD2 4.49Å; L606-F730 HydrophobicContact CD1-CB 3.84Å; S726-F730 WeakPolarHBondContact O-CB 3.5Å; S726-F730 WeakPolarHBondContact O-CD1 3.34Å; S726-F730 VanDerWaalsContact O-CG 3.24Å; S726-F730 WeakPolarHBondContact O-CG 3.33Å; S726-F730 PolarHBondContact O-N 2.86Å; V727-F730 PolarHBondContact O-N 3.48Å; F730-T733 PolarHBondContact O-OG1 2.83Å; F730-T733 VanDerWaalsContact O-OG1 3.04Å; F730-I734 WeakPolarHBondContact O-CD1 3.44Å; F730-I734 VanDerWaalsContact O-CG1 3.28Å; F730-I734 WeakPolarHBondContact O-CG1 3.23Å; F730-I734 PolarHBondContact O-N 3.02Å; F730-I740 HydrophobicContact CB-CD1 3.64Å; F730-I740 HydrophobicContact CB-CG1 4.36Å; F730-I740 HydrophobicContact CD1-CD1 4.17Å; F730-I740 HydrophobicContact CD1-CG1 4.22Å; F730-I740 HydrophobicContact CD1-CG2 3.9Å; F730-I740 HydrophobicContact CD2-CD1 3.98Å; F730-I740 HydrophobicContact CD2-CG2 4.48Å; F730-I740 HydrophobicContact CE1-CG2 3.65Å; F730-I740 HydrophobicContact CE2-CG2 4.25Å; F730-I740 HydrophobicContact CG-CD1 3.68Å; F730-I740 HydrophobicContact CG-CG1 4.23Å; F730-I740 HydrophobicContact CG-CG2 4.32Å; F730-I740 HydrophobicContact CZ-CG2 3.84Å; F730-Y742 HydrophobicContact CE1-CD2 4.49Å; F730-Y742 AromaticContact CZ-CD2 3.91Å; F730-Y742 HydrophobicContact CZ-CD2 3.91Å; F730-Y742 HydrophobicContact CZ-CE2 4.38Å; F730-Y742 HydrophobicContact CZ-CG 4.19Å; F730-F750 AromaticContact CE2-CE2 3.94Å; F730-F750 HydrophobicContact CE2-CE2 3.94Å; F730-F750 HydrophobicContact CE2-CZ 4.25Å; F730-F750 HydrophobicContact CZ-CE2 4.17Å; F730-F750 HydrophobicContact CZ-CZ 4.03Å
731	A	91.1	Very high	86.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.1	-41.1	172.4	0	0	0	0	0	112.4	L606 L719 V727 L729 L735	L606-A731 HydrophobicContact CD1-CB 4.43Å; L719-A731 HydrophobicContact CB-CB 3.77Å; V727-A731 WeakPolarHBondContact O-CB 3.45Å; V727-A731 PolarHBondContact O-N 3.22Å; L729-A731 VanDerWaalsContact C-N 3.27Å; L729-A731 PolarHBondContact O-N 3.25Å; A731-L735 WeakPolarHBondContact O-CB 3.43Å; A731-L735 VanDerWaalsContact O-CG 3.27Å; A731-L735 WeakPolarHBondContact O-CG 3.39Å; A731-L735 PolarHBondContact O-N 3.11Å
732	K	89.9	Confident	86.1	Confident	104 Å²	104	54.5 Å²	54.5	45%	0.452	27%	0.266	S	S	.	.	H	α-helix	trans	-66.9	-40.5	177.6	-76.8	169	-178.1	159	0	113.1	S720 A728 L729 L735 Q736	S720-K732 WeakPolarHBondContact O-CE 3.41Å; S720-K732 PolarHBondContact O-NZ 3.32Å; S720-K732 VanDerWaalsContact O-NZ 3.11Å; A728-K732 WeakPolarHBondContact O-CB 3.35Å; A728-K732 WeakPolarHBondContact O-CD 3.45Å; A728-K732 WeakPolarHBondContact O-CG 3.14Å; A728-K732 PolarHBondContact O-N 2.86Å; L729-K732 CarbonylContact O-C 3.6Å; L729-K732 WeakPolarHBondContact O-CA 3.35Å; L729-K732 WeakPolarHBondContact O-CB 3.35Å; L729-K732 PolarHBondContact O-N 2.87Å; K732-L735 PolarHBondContact O-N 3.3Å; K732-Q736 VanDerWaalsContact O-CG 3.28Å; K732-Q736 WeakPolarHBondContact O-CG 3.31Å; K732-Q736 PolarHBondContact O-N 2.89Å; K732-Q736 VanDerWaalsContact O-N 3.08Å
733	T	89.1	Confident	84.8	Confident	27 Å²	27	58 Å²	58	17%	0.166	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-44	176.5	47.9	0	0	0	0	111	L729 F730 L735 Q736 N738	L729-T733 HydrophobicContact CD2-CG2 3.73Å; L729-T733 HydrophobicContact CG-CG2 4.42Å; L729-T733 PolarHBondContact O-N 3.34Å; L729-T733 PolarHBondContact O-OG1 2.95Å; F730-T733 PolarHBondContact O-OG1 2.83Å; F730-T733 VanDerWaalsContact O-OG1 3.04Å; T733-L735 PolarHBondContact O-N 3.3Å; T733-Q736 PolarHBondContact O-N 3.2Å; T733-Q736 VanDerWaalsContact O-N 3.17Å; T733-N738 CarbonylContact C-O 3.57Å; T733-N738 WeakPolarHBondContact O-CA 3.39Å; T733-N738 WeakPolarHBondContact O-CB 3.21Å; T733-N738 PolarHBondContact O-N 3.29Å; T733-N738 VanDerWaalsContact O-O 3.09Å
734	I	88.2	Confident	84.2	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-60.4	-46	175	-66.8	166.9	0	0	0	111	L606 V609 L613 L623 L716 F730 Q736 G737 I740	L606-I734 HydrophobicContact CB-CD1 4.09Å; L606-I734 HydrophobicContact CD2-CD1 4Å; L606-I734 WeakPolarHBondContact O-CD1 3.26Å; V609-I734 HydrophobicContact CG1-CD1 4.46Å; L613-I734 HydrophobicContact CD1-CG2 3.69Å; L623-I734 HydrophobicContact CD2-CG2 4.2Å; L623-I734 WeakPolarHBondContact CD2-O 3.47Å; L716-I734 HydrophobicContact CD1-CG2 3.66Å; L716-I734 HydrophobicContact CD2-CD1 4.43Å; L716-I734 HydrophobicContact CD2-CG2 4.27Å; F730-I734 WeakPolarHBondContact O-CD1 3.44Å; F730-I734 VanDerWaalsContact O-CG1 3.28Å; F730-I734 WeakPolarHBondContact O-CG1 3.23Å; F730-I734 PolarHBondContact O-N 3.02Å; I734-Q736 PolarHBondContact O-N 3.06Å; I734-G737 WeakPolarHBondContact O-CA 3.44Å; I734-G737 PolarHBondContact O-N 3.11Å; I734-I740 HydrophobicContact CD1-CD1 3.81Å; I734-I740 HydrophobicContact CG1-CD1 4.09Å; I734-I740 HydrophobicContact CG1-CG1 4.4Å
735	L	87.4	Confident	83.8	Confident	65 Å²	65	52.3 Å²	52.3	34%	0.34	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-25.5	177.7	-74.2	168.3	0	0	0	113.7	L716 A731 K732 T733 G737	L716-L735 HydrophobicContact CB-CD1 4.32Å; L716-L735 HydrophobicContact CB-CD2 3.85Å; L716-L735 HydrophobicContact CB-CG 4.02Å; L716-L735 HydrophobicContact CD1-CD2 4.39Å; A731-L735 WeakPolarHBondContact O-CB 3.43Å; A731-L735 VanDerWaalsContact O-CG 3.27Å; A731-L735 WeakPolarHBondContact O-CG 3.39Å; A731-L735 PolarHBondContact O-N 3.11Å; K732-L735 PolarHBondContact O-N 3.3Å; T733-L735 PolarHBondContact O-N 3.3Å; L735-G737 PolarHBondContact O-N 2.94Å
736	Q	85.8	Confident	83.5	Confident	131 Å²	131	50.4 Å²	50.4	61%	0.612	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	4.9	172.5	-69	168.8	-10.4	0	0	113.2	K732 T733 I734 N738	K732-Q736 VanDerWaalsContact O-CG 3.28Å; K732-Q736 WeakPolarHBondContact O-CG 3.31Å; K732-Q736 PolarHBondContact O-N 2.89Å; K732-Q736 VanDerWaalsContact O-N 3.08Å; T733-Q736 PolarHBondContact O-N 3.2Å; T733-Q736 VanDerWaalsContact O-N 3.17Å; I734-Q736 PolarHBondContact O-N 3.06Å; Q736-N738 HydrophobicContact CB-CB 4.41Å; Q736-N738 WeakPolarHBondContact CB-ND2 3.5Å; Q736-N738 PolarHBondContact O-N 3.37Å; Q736-N738 PolarHBondContact OE1-ND2 3.07Å
737	G	79.4	Confident	83.3	Confident	21 Å²	21	51.7 Å²	51.7	22%	0.216	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	1.7	-171.1	0	0	0	0	0	114.2	R620 I734 L735	R620-G737 PolarHBondContact NH2-O 2.94Å; I734-G737 WeakPolarHBondContact O-CA 3.44Å; I734-G737 PolarHBondContact O-N 3.11Å; L735-G737 PolarHBondContact O-N 2.94Å
738	N	83.8	Confident	82.8	Confident	88 Å²	88	56.2 Å²	56.2	47%	0.471	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-81.5	153.1	-178.8	-72.5	-43.1	0	0	0	111.5	T733 Q736	T733-N738 CarbonylContact C-O 3.57Å; T733-N738 WeakPolarHBondContact O-CA 3.39Å; T733-N738 WeakPolarHBondContact O-CB 3.21Å; T733-N738 PolarHBondContact O-N 3.29Å; T733-N738 VanDerWaalsContact O-O 3.09Å; Q736-N738 HydrophobicContact CB-CB 4.41Å; Q736-N738 WeakPolarHBondContact CB-ND2 3.5Å; Q736-N738 PolarHBondContact O-N 3.37Å; Q736-N738 PolarHBondContact OE1-ND2 3.07Å
739	Y	84	Confident	82.2	Confident	92 Å²	92	58.2 Å²	58.2	36%	0.361	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-92.8	146.3	-179.9	-55.1	-52	0	0	0	111.9	K614 R620	K614-Y739 HydrophobicContact CB-CE1 4.14Å; K614-Y739 HydrophobicContact CD-CD1 4.35Å; K614-Y739 HydrophobicContact CD-CG 4.25Å; K614-Y739 VanDerWaalsContact CE-CB 3.48Å; K614-Y739 HydrophobicContact CG-CD1 3.36Å; K614-Y739 HydrophobicContact CG-CD2 3.97Å; K614-Y739 HydrophobicContact CG-CE1 3.4Å; K614-Y739 VanDerWaalsContact CG-CE1 3.4Å; K614-Y739 HydrophobicContact CG-CE2 3.99Å; K614-Y739 HydrophobicContact CG-CG 3.66Å; R620-Y739 PolarHBondContact NH2-OH 3.38Å
740	I	84.4	Confident	81.8	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-76.2	127.7	172.3	-60.6	165.5	0	0	0	108.5	L606 Y607 S610 F730 I734	L606-I740 HydrophobicContact CB-CD1 4.29Å; Y607-I740 HydrophobicContact CD2-CB 4.21Å; Y607-I740 HydrophobicContact CD2-CG2 3.86Å; Y607-I740 HydrophobicContact CE2-CG2 4.5Å; S610-I740 PolarHBondContact OG-N 3.39Å; F730-I740 HydrophobicContact CB-CD1 3.64Å; F730-I740 HydrophobicContact CB-CG1 4.36Å; F730-I740 HydrophobicContact CD1-CD1 4.17Å; F730-I740 HydrophobicContact CD1-CG1 4.22Å; F730-I740 HydrophobicContact CD1-CG2 3.9Å; F730-I740 HydrophobicContact CD2-CD1 3.98Å; F730-I740 HydrophobicContact CD2-CG2 4.48Å; F730-I740 HydrophobicContact CE1-CG2 3.65Å; F730-I740 HydrophobicContact CE2-CG2 4.25Å; F730-I740 HydrophobicContact CG-CD1 3.68Å; F730-I740 HydrophobicContact CG-CG1 4.23Å; F730-I740 HydrophobicContact CG-CG2 4.32Å; F730-I740 HydrophobicContact CZ-CG2 3.84Å; I734-I740 HydrophobicContact CD1-CD1 3.81Å; I734-I740 HydrophobicContact CG1-CD1 4.09Å; I734-I740 HydrophobicContact CG1-CG1 4.4Å
741	Q	76.6	Confident	81.5	Confident	182 Å²	182	57.8 Å²	57.8	85%	0.85	31%	0.305	S	S	*	.			trans	-110.8	115.9	166.2	-66	-176	-2.2	0	0	107.8
742	Y	79.9	Confident	81	Confident	42 Å²	42	63.1 Å²	63.1	17%	0.165	33%	0.333	C	S	.	.			trans	-142.6	138.5	178.6	-164.4	-105.8	0	0	0	108.9	F730 G744 P746 D749 F750 R790 D810	F730-Y742 HydrophobicContact CE1-CD2 4.49Å; F730-Y742 AromaticContact CZ-CD2 3.91Å; F730-Y742 HydrophobicContact CZ-CD2 3.91Å; F730-Y742 HydrophobicContact CZ-CE2 4.38Å; F730-Y742 HydrophobicContact CZ-CG 4.19Å; Y742-G744 WeakPolarHBondContact CD1-O 3.22Å; Y742-P746 HydrophobicContact CD1-CG 3.91Å; Y742-P746 HydrophobicContact CE1-CG 4.14Å; Y742-D749 VanDerWaalsContact OH-CB 3.26Å; Y742-D749 WeakPolarHBondContact OH-CB 3.35Å; Y742-D749 PolarHBondContact OH-OD2 3.18Å; Y742-F750 HydrophobicContact CD2-CZ 4.43Å; Y742-F750 HydrophobicContact CE1-CE2 4.33Å; Y742-F750 HydrophobicContact CE1-CZ 4.17Å; Y742-F750 HydrophobicContact CE2-CE1 4.21Å; Y742-F750 HydrophobicContact CE2-CE2 4.41Å; Y742-F750 AromaticContact CE2-CZ 3.56Å; Y742-F750 HydrophobicContact CE2-CZ 3.56Å; Y742-F750 AromaticContact CZ-CE1 3.98Å; Y742-F750 AromaticContact CZ-CE2 3.96Å; Y742-F750 AromaticContact CZ-CZ 3.37Å; Y742-F750 VanDerWaalsContact OH-CE1 3.29Å; Y742-F750 WeakPolarHBondContact OH-CE1 3.28Å; Y742-F750 WeakPolarHBondContact OH-CZ 3.46Å; Y742-R790 VanDerWaalsContact CZ-NH2 3.27Å; Y742-R790 PolarHBondContact OH-NH2 2.96Å; Y742-D810 PolarHBondContact OH-OD2 2.82Å
743	S	62.8	Low	80.4	Confident	112 Å²	112	64.3 Å²	64.3	78%	0.783	34%	0.342	S	S	*	.			trans	-110.9	-6	-170.7	51.9	0	0	0	0	114.5
744	G	73.1	Confident	79.7	Confident	29 Å²	29	67.2 Å²	67.2	30%	0.299	35%	0.349	S	S	.	.	S	Bend	trans	-103.8	-167.1	173.6	0	0	0	0	0	112.8	Y742 P746 D749	Y742-G744 WeakPolarHBondContact CD1-O 3.22Å; G744-P746 WeakPolarHBondContact O-CD 3.49Å; G744-D749 WeakPolarHBondContact CA-OD2 3.29Å
745	D	76.8	Confident	79.2	Confident	58 Å²	58	70.5 Å²	70.5	31%	0.31	36%	0.364	S	S	.	.			trans	-100.7	110.6	174.5	174.2	5.1	0	0	0	110	L747 Q748 D749	D745-L747 PolarHBondContact O-N 3.1Å; D745-L747 VanDerWaalsContact O-N 3.14Å; D745-L747 WeakPolarHBondContact OD1-CB 3.44Å; D745-L747 PolarHBondContact OD1-N 2.84Å; D745-Q748 HydrophobicContact CB-CB 4.31Å; D745-Q748 PolarHBondContact O-N 3.49Å; D745-Q748 VanDerWaalsContact O-N 3.16Å; D745-Q748 WeakPolarHBondContact OD2-CG 3.49Å; D745-Q748 PolarHBondContact OD2-NE2 2.81Å; D745-D749 WeakPolarHBondContact O-CB 3.36Å; D745-D749 PolarHBondContact O-N 2.83Å
746	P	79.8	Confident	78.7	Confident	13 Å²	13	71 Å²	71	8%	0.084	37%	0.366	C	S	.	.	H	α-helix	trans	-57	-26.4	178.7	-26.8	36.1	0	0	0	115.2	C603 Y742 G744 F750	C603-P746 HydrophobicContact CB-CB 4.02Å; Y742-P746 HydrophobicContact CD1-CG 3.91Å; Y742-P746 HydrophobicContact CE1-CG 4.14Å; G744-P746 WeakPolarHBondContact O-CD 3.49Å; P746-F750 HydrophobicContact CB-CD2 4.09Å; P746-F750 HydrophobicContact CB-CE2 3.92Å; P746-F750 WeakPolarHBondContact O-CD2 3.42Å
747	L	80.5	Confident	78.1	Confident	30 Å²	30	67.2 Å²	67.2	16%	0.157	35%	0.351	C	S	.	.	H	α-helix	trans	-77.5	-32.8	-179.1	-63.1	173.1	0	0	0	111.5	A564 L567 P600 D745 T751	A564-L747 HydrophobicContact CB-CD1 3.6Å; L567-L747 HydrophobicContact CD1-CD1 4.41Å; L567-L747 HydrophobicContact CD1-CD2 4.12Å; P600-L747 WeakPolarHBondContact CB-O 3.42Å; D745-L747 PolarHBondContact O-N 3.1Å; D745-L747 VanDerWaalsContact O-N 3.14Å; D745-L747 WeakPolarHBondContact OD1-CB 3.44Å; D745-L747 PolarHBondContact OD1-N 2.84Å; L747-T751 PolarHBondContact O-OG1 2.83Å
748	Q	78.6	Confident	77.6	Confident	95 Å²	95	68 Å²	68	44%	0.444	35%	0.347	S	S	.	.	H	α-helix	trans	-89.7	-49.8	177.1	-71.7	-178	69.4	0	0	112.5	D745 F750 T751 R754	D745-Q748 HydrophobicContact CB-CB 4.31Å; D745-Q748 PolarHBondContact O-N 3.49Å; D745-Q748 VanDerWaalsContact O-N 3.16Å; D745-Q748 WeakPolarHBondContact OD2-CG 3.49Å; D745-Q748 PolarHBondContact OD2-NE2 2.81Å; Q748-F750 VanDerWaalsContact C-N 3.32Å; Q748-F750 PolarHBondContact O-N 3.38Å; Q748-T751 WeakPolarHBondContact O-CB 3.44Å; Q748-T751 PolarHBondContact O-N 3.19Å; Q748-T751 VanDerWaalsContact O-N 3.14Å; Q748-R754 WeakPolarHBondContact O-CG 3.28Å
749	D	77.7	Confident	76.9	Confident	54 Å²	54	65.8 Å²	65.8	29%	0.289	33%	0.333	S	S	.	.	H	α-helix	trans	-63	-35.5	-168.6	-75.6	-5.5	0	0	0	112.7	Y742 G744 D745 R790	Y742-D749 VanDerWaalsContact OH-CB 3.26Å; Y742-D749 WeakPolarHBondContact OH-CB 3.35Å; Y742-D749 PolarHBondContact OH-OD2 3.18Å; G744-D749 WeakPolarHBondContact CA-OD2 3.29Å; D745-D749 WeakPolarHBondContact O-CB 3.36Å; D745-D749 PolarHBondContact O-N 2.83Å; D749-R790 IonicContact OD2-CZ 2.77Å; D749-R790 IonicContact OD2-NH1 3.26Å; D749-R790 PolarHBondContact OD2-NH1 3.5Å; D749-R790 IonicContact OD2-NH2 3.46Å
750	F	79.5	Confident	75.9	Confident	14 Å²	14	65.6 Å²	65.6	6%	0.061	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	8.6	-179.6	-52.7	-51.5	0	0	0	114.4	P600 C603 H724 S726 F730 Y742 P746 Q748 D810	P600-F750 HydrophobicContact CG-CB 4.48Å; C603-F750 HydrophobicContact CB-CD2 3.32Å; C603-F750 HydrophobicContact CB-CE2 3.46Å; C603-F750 VanDerWaalsContact CB-CE2 3.46Å; C603-F750 HydrophobicContact CB-CG 4.44Å; C603-F750 WeakPolarHBondContact SG-CD2 3.39Å; C603-F750 VanDerWaalsContact SG-CE2 3.57Å; H724-F750 AromaticContact CE1-CD1 3.89Å; S726-F750 WeakPolarHBondContact OG-CE1 3.44Å; F730-F750 AromaticContact CE2-CE2 3.94Å; F730-F750 HydrophobicContact CE2-CE2 3.94Å; F730-F750 HydrophobicContact CE2-CZ 4.25Å; F730-F750 HydrophobicContact CZ-CE2 4.17Å; F730-F750 HydrophobicContact CZ-CZ 4.03Å; Y742-F750 HydrophobicContact CD2-CZ 4.43Å; Y742-F750 HydrophobicContact CE1-CE2 4.33Å; Y742-F750 HydrophobicContact CE1-CZ 4.17Å; Y742-F750 HydrophobicContact CE2-CE1 4.21Å; Y742-F750 HydrophobicContact CE2-CE2 4.41Å; Y742-F750 AromaticContact CE2-CZ 3.56Å; Y742-F750 HydrophobicContact CE2-CZ 3.56Å; Y742-F750 AromaticContact CZ-CE1 3.98Å; Y742-F750 AromaticContact CZ-CE2 3.96Å; Y742-F750 AromaticContact CZ-CZ 3.37Å; Y742-F750 VanDerWaalsContact OH-CE1 3.29Å; Y742-F750 WeakPolarHBondContact OH-CE1 3.28Å; Y742-F750 WeakPolarHBondContact OH-CZ 3.46Å; P746-F750 HydrophobicContact CB-CD2 4.09Å; P746-F750 HydrophobicContact CB-CE2 3.92Å; P746-F750 WeakPolarHBondContact O-CD2 3.42Å; Q748-F750 VanDerWaalsContact C-N 3.32Å; Q748-F750 PolarHBondContact O-N 3.38Å; F750-D810 HydrophobicContact CD1-CB 4.25Å; F750-D810 HydrophobicContact CE1-CB 3.83Å; F750-D810 WeakPolarHBondContact CE1-OD2 3.24Å
751	T	83	Confident	74.6	Confident	50 Å²	50	70.4 Å²	70.4	31%	0.307	36%	0.36	S	S	.	.			trans	-72.1	136.9	179.3	-78.9	0	0	0	0	111.5	L747 Q748 M753 R754 F755	L747-T751 PolarHBondContact O-OG1 2.83Å; Q748-T751 WeakPolarHBondContact O-CB 3.44Å; Q748-T751 PolarHBondContact O-N 3.19Å; Q748-T751 VanDerWaalsContact O-N 3.14Å; T751-M753 HydrophobicContact CG2-CB 4.05Å; T751-M753 PolarHBondContact O-N 3.24Å; T751-M753 VanDerWaalsContact O-N 3.1Å; T751-R754 WeakPolarHBondContact O-CA 3.34Å; T751-R754 WeakPolarHBondContact O-CB 3.48Å; T751-R754 PolarHBondContact O-N 2.7Å; T751-F755 PolarHBondContact O-N 3.08Å; T751-F755 VanDerWaalsContact O-N 3.14Å
752	L	80.4	Confident	73.6	Confident	112 Å²	112	68.6 Å²	68.6	59%	0.586	35%	0.345	S	S	*	.	H	α-helix	trans	-52.1	-37.4	-178.2	179.4	61.7	0	0	0	113	R754 F755 L756	L752-R754 PolarHBondContact O-N 2.96Å; L752-F755 HydrophobicContact CD1-CD1 4.29Å; L752-F755 PolarHBondContact O-N 3.34Å; L752-L756 HydrophobicContact CD1-CD1 4.12Å; L752-L756 HydrophobicContact CD1-CG 4.02Å; L752-L756 HydrophobicContact CD2-CD1 4.49Å; L752-L756 HydrophobicContact CG-CD1 3.92Å; L752-L756 HydrophobicContact CG-CG 4.26Å; L752-L756 WeakPolarHBondContact O-CB 3.14Å; L752-L756 WeakPolarHBondContact O-CG 3.12Å; L752-L756 PolarHBondContact O-N 2.83Å
753	M	78.3	Confident	72.2	Confident	130 Å²	130	72 Å²	72	64%	0.64	37%	0.367	S	S	*	.	H	α-helix	trans	-61.2	-40.1	175.3	-167.8	65	72.8	0	0	112.7	T751 L756 D757	T751-M753 HydrophobicContact CG2-CB 4.05Å; T751-M753 PolarHBondContact O-N 3.24Å; T751-M753 VanDerWaalsContact O-N 3.1Å; M753-L756 PolarHBondContact O-N 3.16Å; M753-D757 WeakPolarHBondContact O-CB 3.49Å; M753-D757 PolarHBondContact O-N 2.99Å
754	R	74.5	Confident	71.6	Confident	87 Å²	87	68.6 Å²	68.6	33%	0.328	34%	0.341	S	S	.	.	H	α-helix	trans	-69	-39	176	-66.6	-65.3	-165.2	153.2	4.9	111.6	Q748 T751 L752 R758 H767	Q748-R754 WeakPolarHBondContact O-CG 3.28Å; T751-R754 WeakPolarHBondContact O-CA 3.34Å; T751-R754 WeakPolarHBondContact O-CB 3.48Å; T751-R754 PolarHBondContact O-N 2.7Å; L752-R754 PolarHBondContact O-N 2.96Å; R754-R758 WeakPolarHBondContact O-CB 3.26Å; R754-R758 PolarHBondContact O-N 3.06Å; R754-H767 PolarHBondContact NH1-ND1 3.12Å; R754-H767 PolarHBondContact NH2-CE1 3.01Å; R754-H767 VanDerWaalsContact NH2-CE1 3.27Å
755	F	76.9	Confident	70.5	Confident	70 Å²	70	72.4 Å²	72.4	31%	0.307	35%	0.35	S	S	.	.	H	α-helix	trans	-60.8	-48.3	173.5	176.8	-90	0	0	0	111.2	T751 L752 R758 F759 F813 F814	T751-F755 PolarHBondContact O-N 3.08Å; T751-F755 VanDerWaalsContact O-N 3.14Å; L752-F755 HydrophobicContact CD1-CD1 4.29Å; L752-F755 PolarHBondContact O-N 3.34Å; F755-R758 PolarHBondContact O-N 3Å; F755-F759 WeakPolarHBondContact O-CB 3.45Å; F755-F759 PolarHBondContact O-N 2.87Å; F755-F813 AromaticContact CE2-CD1 3.82Å; F755-F813 HydrophobicContact CE2-CD1 3.82Å; F755-F813 HydrophobicContact CE2-CE1 4.15Å; F755-F813 AromaticContact CZ-CD1 3.84Å; F755-F813 HydrophobicContact CZ-CD1 3.84Å; F755-F813 AromaticContact CZ-CE1 3.67Å; F755-F813 HydrophobicContact CZ-CE1 3.67Å; F755-F813 HydrophobicContact CZ-CZ 4.44Å; F755-F814 AromaticContact CD2-CE1 3.87Å; F755-F814 HydrophobicContact CD2-CE1 3.87Å; F755-F814 HydrophobicContact CD2-CE2 4.36Å; F755-F814 AromaticContact CD2-CZ 3.44Å; F755-F814 HydrophobicContact CD2-CZ 3.44Å; F755-F814 VanDerWaalsContact CD2-CZ 3.44Å; F755-F814 HydrophobicContact CE2-CD1 4.41Å; F755-F814 AromaticContact CE2-CE1 3.46Å; F755-F814 HydrophobicContact CE2-CE1 3.46Å; F755-F814 VanDerWaalsContact CE2-CE1 3.46Å; F755-F814 HydrophobicContact CE2-CE2 4.44Å; F755-F814 AromaticContact CE2-CZ 3.49Å; F755-F814 HydrophobicContact CE2-CZ 3.49Å; F755-F814 VanDerWaalsContact CE2-CZ 3.49Å; F755-F814 HydrophobicContact CG-CZ 4.19Å; F755-F814 AromaticContact CZ-CE1 3.84Å; F755-F814 HydrophobicContact CZ-CE1 3.84Å; F755-F814 HydrophobicContact CZ-CZ 4.28Å
756	L	77.5	Confident	69.2	Low	75 Å²	75	74.9 Å²	74.9	39%	0.393	37%	0.369	S	S	.	.	H	α-helix	trans	-67.7	-43.9	178.3	-69.3	174.9	0	0	0	112.6	L752 M753 R758 F759 V760	L752-L756 HydrophobicContact CD1-CD1 4.12Å; L752-L756 HydrophobicContact CD1-CG 4.02Å; L752-L756 HydrophobicContact CD2-CD1 4.49Å; L752-L756 HydrophobicContact CG-CD1 3.92Å; L752-L756 HydrophobicContact CG-CG 4.26Å; L752-L756 WeakPolarHBondContact O-CB 3.14Å; L752-L756 WeakPolarHBondContact O-CG 3.12Å; L752-L756 PolarHBondContact O-N 2.83Å; M753-L756 PolarHBondContact O-N 3.16Å; L756-R758 PolarHBondContact O-N 3.16Å; L756-F759 PolarHBondContact O-N 3.25Å; L756-V760 WeakPolarHBondContact O-CB 3.29Å; L756-V760 WeakPolarHBondContact O-CG2 3.5Å; L756-V760 PolarHBondContact O-N 2.68Å
757	D	72.6	Confident	67.6	Low	53 Å²	53	78.5 Å²	78.5	28%	0.283	39%	0.385	S	S	.	.	H	α-helix	trans	-53.8	-41.3	172.7	-104.1	-38.7	0	0	0	110.2	M753 Y761 K765	M753-D757 WeakPolarHBondContact O-CB 3.49Å; M753-D757 PolarHBondContact O-N 2.99Å; D757-Y761 HydrophobicContact CB-CD2 4.34Å; D757-Y761 WeakPolarHBondContact O-CA 3.41Å; D757-Y761 VanDerWaalsContact O-CB 3.22Å; D757-Y761 WeakPolarHBondContact O-CB 3.5Å; D757-Y761 VanDerWaalsContact O-CD2 3.23Å; D757-Y761 WeakPolarHBondContact O-CD2 3.36Å; D757-Y761 PolarHBondContact O-N 2.99Å; D757-Y761 WeakPolarHBondContact OD1-CD2 3.22Å; D757-Y761 WeakPolarHBondContact OD1-CE2 3.44Å; D757-K765 IonicContact OD1-NZ 3.49Å; D757-K765 PolarHBondContact OD1-NZ 3.21Å
758	R	68.6	Low	65.7	Low	37 Å²	37	86.8 Å²	86.8	14%	0.14	42%	0.419	C	S	.	.	H	α-helix	trans	-84.6	-18.3	-176.9	-166	157.9	179.6	-145.3	-11.3	114.6	R754 F755 L756 I789 R790 V794 E811	R754-R758 WeakPolarHBondContact O-CB 3.26Å; R754-R758 PolarHBondContact O-N 3.06Å; F755-R758 PolarHBondContact O-N 3Å; L756-R758 PolarHBondContact O-N 3.16Å; R758-I789 PolarHBondContact NH2-O 3.15Å; R758-R790 VanDerWaalsContact CZ-O 3.32Å; R758-R790 PolarHBondContact NH2-O 3.15Å; R758-V794 HydrophobicContact CG-CG2 3.79Å; R758-E811 IonicContact CZ-OE1 3.58Å; R758-E811 IonicContact CZ-OE2 3.76Å; R758-E811 IonicContact NH1-OE1 3.62Å; R758-E811 PolarHBondContact NH1-OE1 2.96Å; R758-E811 IonicContact NH1-OE2 2.67Å; R758-E811 IonicContact NH2-OE1 2.78Å; R758-E811 PolarHBondContact NH2-OE1 3.07Å; R758-E811 IonicContact NH2-OE2 3.2Å; R758-E811 PolarHBondContact NH2-OE2 3.15Å
759	F	69.2	Low	63.7	Low	42 Å²	42	83.9 Å²	83.9	18%	0.184	42%	0.415	C	S	.	.	H	α-helix	trans	-81.7	-42.8	170.8	-172.1	-109.3	0	0	0	111.9	F755 L756 F814 Y817 Y818 F844	F755-F759 WeakPolarHBondContact O-CB 3.45Å; F755-F759 PolarHBondContact O-N 2.87Å; L756-F759 PolarHBondContact O-N 3.25Å; F759-F814 HydrophobicContact CB-CE1 4.04Å; F759-F814 AromaticContact CD2-CD1 3.99Å; F759-F814 HydrophobicContact CD2-CD1 3.99Å; F759-F814 AromaticContact CD2-CE1 3.89Å; F759-F814 HydrophobicContact CD2-CE1 3.89Å; F759-F814 HydrophobicContact CG-CE1 4.44Å; F759-Y817 AromaticContact CE2-CD1 3.97Å; F759-Y817 HydrophobicContact CE2-CD1 3.97Å; F759-Y817 AromaticContact CE2-CE1 3.74Å; F759-Y817 HydrophobicContact CE2-CE1 3.74Å; F759-Y817 AromaticContact CZ-CE1 4Å; F759-Y817 HydrophobicContact CZ-CE1 4Å; F759-Y817 AromaticContact CZ-CZ 3.96Å; F759-Y818 PolarHBondContact O-OH 2.76Å; F759-F844 HydrophobicContact CE1-CE2 4.29Å
760	V	64.5	Low	61.7	Low	88 Å²	88	90.5 Å²	90.5	53%	0.533	44%	0.441	S	S	.	.	H	α-helix	trans	-80.3	-49.9	-178.4	176	0	0	0	0	111.3	L756 R762	L756-V760 WeakPolarHBondContact O-CB 3.29Å; L756-V760 WeakPolarHBondContact O-CG2 3.5Å; L756-V760 PolarHBondContact O-N 2.68Å; V760-R762 PolarHBondContact O-N 3.11Å; V760-R762 VanDerWaalsContact O-N 3.1Å
761	Y	55.8	Low	59.7	Low	106 Å²	106	96.4 Å²	96.4	42%	0.416	47%	0.469	S	S	.	.	S	Bend	trans	-84.6	93.9	178.8	-56	-71.8	0	0	0	109.9	D757 N763 K765	D757-Y761 HydrophobicContact CB-CD2 4.34Å; D757-Y761 WeakPolarHBondContact O-CA 3.41Å; D757-Y761 VanDerWaalsContact O-CB 3.22Å; D757-Y761 WeakPolarHBondContact O-CB 3.5Å; D757-Y761 VanDerWaalsContact O-CD2 3.23Å; D757-Y761 WeakPolarHBondContact O-CD2 3.36Å; D757-Y761 PolarHBondContact O-N 2.99Å; D757-Y761 WeakPolarHBondContact OD1-CD2 3.22Å; D757-Y761 WeakPolarHBondContact OD1-CE2 3.44Å; Y761-N763 CarbonylContact C-O 3.45Å; Y761-N763 VanDerWaalsContact CB-O 3.31Å; Y761-N763 WeakPolarHBondContact CB-O 3.31Å; Y761-N763 CarbonylContact O-C 3.52Å; Y761-N763 PolarHBondContact O-N 2.79Å; Y761-K765 HydrophobicContact CD2-CD 4.27Å; Y761-K765 VanDerWaalsContact CD2-CE 3.44Å; Y761-K765 HydrophobicContact CD2-CG 4.43Å; Y761-K765 HydrophobicContact CE2-CD 4.44Å; Y761-K765 HydrophobicContact CG-CG 4.32Å; Y761-K765 PolarHBondContact OH-NZ 2.91Å
762	R	56.4	Low	57.4	Low	143 Å²	143	98 Å²	98	54%	0.54	48%	0.476	S	S	.	.	S	Bend	trans	-44.5	-35.1	178.7	-58.5	176.2	-174.1	163.6	5.4	112.7	V760 P793 D838	V760-R762 PolarHBondContact O-N 3.11Å; V760-R762 VanDerWaalsContact O-N 3.1Å; R762-P793 WeakPolarHBondContact O-CA 3.47Å; R762-P793 WeakPolarHBondContact O-CB 3.11Å; R762-D838 IonicContact NH2-OD1 3.24Å; R762-D838 PolarHBondContact NH2-OD1 3Å
763	N	50	Low	55.3	Low	115 Å²	115	97.3 Å²	97.3	62%	0.615	48%	0.477	S	S	*	.	S	Bend	trans	-100.5	124.7	156.9	-68.7	-13.5	0	0	0	108.9	Y761 K765 P793	Y761-N763 CarbonylContact C-O 3.45Å; Y761-N763 VanDerWaalsContact CB-O 3.31Å; Y761-N763 WeakPolarHBondContact CB-O 3.31Å; Y761-N763 CarbonylContact O-C 3.52Å; Y761-N763 PolarHBondContact O-N 2.79Å; N763-K765 PolarHBondContact O-N 3.38Å; N763-P793 WeakPolarHBondContact OD1-CB 3.36Å
764	P	50.4	Low	53	Low	39 Å²	39	99.5 Å²	99.5	25%	0.253	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-59.7	129.3	173.1	25.5	-33.2	0	0	0	109.5
765	K	49.1	Very low	51	Low	110 Å²	110	100.2 Å²	100.2	48%	0.478	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-57.8	128.9	176.1	-64.3	170.3	-171.4	146	0	108.5	D757 Y761 N763 H767	D757-K765 IonicContact OD1-NZ 3.49Å; D757-K765 PolarHBondContact OD1-NZ 3.21Å; Y761-K765 HydrophobicContact CD2-CD 4.27Å; Y761-K765 VanDerWaalsContact CD2-CE 3.44Å; Y761-K765 HydrophobicContact CD2-CG 4.43Å; Y761-K765 HydrophobicContact CE2-CD 4.44Å; Y761-K765 HydrophobicContact CG-CG 4.32Å; Y761-K765 PolarHBondContact OH-NZ 2.91Å; N763-K765 PolarHBondContact O-N 3.38Å; K765-H767 PolarHBondContact O-N 3.22Å
766	P	51	Low	48.7	Very low	109 Å²	109	101.5 Å²	101.5	71%	0.708	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-57.6	133.7	168	26.2	-33.5	0	0	0	108	K768	P766-K768 PolarHBondContact O-N 3.41Å; P766-K768 VanDerWaalsContact O-N 3.16Å
767	H	45.9	Very low	46.6	Very low	89 Å²	89	104.3 Å²	104.3	41%	0.412	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-62.5	121.8	-166.8	-168.1	49.9	0	0	0	110.4	R754 K765	R754-H767 PolarHBondContact NH1-ND1 3.12Å; R754-H767 PolarHBondContact NH2-CE1 3.01Å; R754-H767 VanDerWaalsContact NH2-CE1 3.27Å; K765-H767 PolarHBondContact O-N 3.22Å
768	K	39.3	Very low	44.4	Very low	204 Å²	204	109.8 Å²	109.8	89%	0.887	57%	0.568	S	S	*	*			trans	-102.4	7.3	175.7	-73.8	-167.4	177.1	-175.2	0	113.2	P766	P766-K768 PolarHBondContact O-N 3.41Å; P766-K768 VanDerWaalsContact O-N 3.16Å
769	G	36.6	Very low	42.5	Very low	35 Å²	35	115.9 Å²	115.9	36%	0.361	60%	0.598	S	S	.	*	S	Bend	trans	-62	149.1	152.3	0	0	0	0	0	108.3	E771	G769-E771 PolarHBondContact O-N 2.91Å
770	K	35.4	Very low	40.4	Very low	192 Å²	192	119.6 Å²	119.6	84%	0.835	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-67.7	118.6	165.5	-65.2	174.5	-175.7	170.6	0	106.3	N772	K770-N772 PolarHBondContact O-N 3.48Å
771	E	37.3	Very low	38.8	Very low	138 Å²	138	124.4 Å²	124.4	65%	0.645	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-67.4	116	169.8	-66.6	178.9	167.2	0	0	107.1	G769 T773	G769-E771 PolarHBondContact O-N 2.91Å; E771-T773 PolarHBondContact O-N 2.89Å
772	N	36	Very low	37.4	Very low	85 Å²	85	128.8 Å²	128.8	46%	0.455	66%	0.656	S	S	.	*	S	Bend	trans	-73.5	68.8	-175.4	-76.7	-12.1	0	0	0	110.9	K770	K770-N772 PolarHBondContact O-N 3.48Å
773	T	35.5	Very low	36.3	Very low	97 Å²	97	130.7 Å²	130.7	60%	0.595	67%	0.669	S	S	*	*			trans	-136.1	27.7	-173.5	64.5	0	0	0	0	113.5	E771 S775	E771-T773 PolarHBondContact O-N 2.89Å; T773-S775 VanDerWaalsContact C-N 3.34Å
774	D	30.2	Very low	35.3	Very low	175 Å²	175	131.1 Å²	131.1	94%	0.936	67%	0.666	S	S	*	*	S	Bend	trans	-96.2	10.1	170.7	-149.6	31.8	0	0	0	112.1
775	S	33.4	Very low	34.4	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	69%	0.694	S	S	*	*	S	Bend	trans	-130.4	-2.2	-179.5	55.7	0	0	0	0	114.2	T773 V777	T773-S775 VanDerWaalsContact C-N 3.34Å; S775-V777 PolarHBondContact O-N 3.18Å
776	V	29	Very low	33.7	Very low	97 Å²	97	139.1 Å²	139.1	59%	0.588	70%	0.702	S	S	*	*			trans	-97.4	86.5	177.6	-175.8	0	0	0	0	109.4
777	V	31.7	Very low	33.1	Very low	134 Å²	134	141.6 Å²	141.6	81%	0.812	70%	0.702	S	S	*	*			trans	-79	136.7	166.2	-178.5	0	0	0	0	108	S775	S775-V777 PolarHBondContact O-N 3.18Å
778	M	26.1	Very low	33.3	Very low	168 Å²	168	140.7 Å²	140.7	83%	0.828	70%	0.7	S	S	*	*	S	Bend	trans	61.4	105.1	-169.3	-55	177	82.8	0	0	112.9
779	Q	29.4	Very low	34.2	Very low	165 Å²	165	132 Å²	132	77%	0.771	66%	0.663	S	S	*	*			cis	-123.7	154.9	21.8	-63.2	-178.4	-10	0	0	112.7	K781	Q779-K781 VanDerWaalsContact C-N 3.33Å; Q779-K781 PolarHBondContact O-N 3.37Å
780	P	26.3	Very low	35.3	Very low	120 Å²	120	132.6 Å²	132.6	78%	0.779	65%	0.654	S	S	*	*			trans	-65.6	95.8	160.2	30.1	-33	0	0	0	108.6	R782	P780-R782 VanDerWaalsContact C-N 3.31Å; P780-R782 PolarHBondContact O-N 3.3Å
781	K	30.2	Very low	36.3	Very low	189 Å²	189	130.6 Å²	130.6	82%	0.822	65%	0.648	S	S	*	*			trans	-54.3	101.5	161.7	-80.4	-173.9	177.8	179.1	0	106.8	Q779 K783	Q779-K781 VanDerWaalsContact C-N 3.33Å; Q779-K781 PolarHBondContact O-N 3.37Å; K781-K783 PolarHBondContact O-N 2.95Å; K781-K783 VanDerWaalsContact O-N 3.11Å
782	R	26.6	Very low	37.4	Very low	199 Å²	199	125.5 Å²	125.5	75%	0.751	63%	0.625	S	S	*	*			trans	-45.8	125.4	168.6	-83.9	-178.4	170.3	170.9	-1.4	106	P780 H784	P780-R782 VanDerWaalsContact C-N 3.31Å; P780-R782 PolarHBondContact O-N 3.3Å; R782-H784 PolarHBondContact O-N 3.15Å
783	K	33.1	Very low	38.6	Very low	183 Å²	183	123.1 Å²	123.1	80%	0.796	61%	0.614	S	S	*	*			trans	-68.3	77.7	172.1	-74	-172.2	177.8	-178.7	0	108	K781 F785	K781-K783 PolarHBondContact O-N 2.95Å; K781-K783 VanDerWaalsContact O-N 3.11Å; K783-F785 HydrophobicContact CB-CD2 4.21Å; K783-F785 HydrophobicContact CB-CE2 4.03Å; K783-F785 WeakPolarHBondContact O-CD2 3.4Å; K783-F785 PolarHBondContact O-N 3.3Å
784	H	28.5	Very low	40	Very low	123 Å²	123	118.5 Å²	118.5	57%	0.569	59%	0.586	S	S	*	*			trans	-66.2	87.4	168.7	-81.6	-69.4	0	0	0	106.8	R782 I786	R782-H784 PolarHBondContact O-N 3.15Å; H784-I786 HydrophobicContact CB-CB 4.39Å; H784-I786 HydrophobicContact CB-CD1 3.97Å; H784-I786 HydrophobicContact CB-CG1 3.98Å; H784-I786 PolarHBondContact O-N 2.75Å
785	F	32.6	Very low	41.5	Very low	192 Å²	192	113.7 Å²	113.7	84%	0.842	56%	0.56	S	S	*	*			trans	-64.3	40.3	152.5	-70.2	-85.7	0	0	0	110.9	K783	K783-F785 HydrophobicContact CB-CD2 4.21Å; K783-F785 HydrophobicContact CB-CE2 4.03Å; K783-F785 WeakPolarHBondContact O-CD2 3.4Å; K783-F785 PolarHBondContact O-N 3.3Å
786	I	33.2	Very low	43.2	Very low	126 Å²	126	109.8 Å²	109.8	65%	0.646	53%	0.533	S	S	*	.	S	Bend	trans	-63.4	144.4	150.5	-64.8	173.5	0	0	0	105.2	H784 D788	H784-I786 HydrophobicContact CB-CB 4.39Å; H784-I786 HydrophobicContact CB-CD1 3.97Å; H784-I786 HydrophobicContact CB-CG1 3.98Å; H784-I786 PolarHBondContact O-N 2.75Å; I786-D788 PolarHBondContact O-N 2.81Å
787	K	39.2	Very low	44.9	Very low	160 Å²	160	114.1 Å²	114.1	70%	0.696	54%	0.544	S	S	*	.			trans	-75.4	66.3	-172.7	-59.5	-179.2	179.8	-172.4	0	111.3	I789	K787-I789 PolarHBondContact O-N 2.93Å
788	D	50.1	Low	46.6	Very low	70 Å²	70	113.3 Å²	113.3	37%	0.374	53%	0.531	S	S	.	.			trans	-58	125.2	178.7	-166.2	-10.8	0	0	0	109.3	I786 R790 H791	I786-D788 PolarHBondContact O-N 2.81Å; D788-R790 PolarHBondContact O-N 3.08Å; D788-R790 WeakPolarHBondContact OD1-CB 3.47Å; D788-R790 WeakPolarHBondContact OD1-CG 3.34Å; D788-R790 PolarHBondContact OD1-N 3.35Å; D788-R790 VanDerWaalsContact OD1-N 3.16Å; D788-H791 PolarHBondContact O-N 3.3Å; D788-H791 VanDerWaalsContact O-N 3.09Å
789	I	58.6	Low	48.7	Very low	21 Å²	21	105.3 Å²	105.3	11%	0.108	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-66.8	-26.5	-173.3	-50	-168.9	0	0	0	109.3	R758 K787 H791 L792 F799 K802 Q806 P808 E811	R758-I789 PolarHBondContact NH2-O 3.15Å; K787-I789 PolarHBondContact O-N 2.93Å; I789-H791 PolarHBondContact O-N 3.24Å; I789-H791 VanDerWaalsContact O-N 3.12Å; I789-L792 PolarHBondContact O-N 3.39Å; I789-F799 HydrophobicContact CG2-CD2 3.58Å; I789-F799 HydrophobicContact CG2-CE2 3.58Å; I789-K802 HydrophobicContact CD1-CD 3.96Å; I789-Q806 WeakPolarHBondContact CD1-O 3.33Å; I789-P808 HydrophobicContact CB-CG 4.41Å; I789-E811 WeakPolarHBondContact CG2-OE2 3.43Å
790	R	59.3	Low	50.6	Low	48 Å²	48	99.6 Å²	99.6	18%	0.181	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-54	-26	171.1	-69.8	170.3	163.7	-125.9	-17.7	114.6	Y742 D749 R758 D788 D810 E811	Y742-R790 VanDerWaalsContact CZ-NH2 3.27Å; Y742-R790 PolarHBondContact OH-NH2 2.96Å; D749-R790 IonicContact OD2-CZ 2.77Å; D749-R790 IonicContact OD2-NH1 3.26Å; D749-R790 PolarHBondContact OD2-NH1 3.5Å; D749-R790 IonicContact OD2-NH2 3.46Å; R758-R790 VanDerWaalsContact CZ-O 3.32Å; R758-R790 PolarHBondContact NH2-O 3.15Å; D788-R790 PolarHBondContact O-N 3.08Å; D788-R790 WeakPolarHBondContact OD1-CB 3.47Å; D788-R790 WeakPolarHBondContact OD1-CG 3.34Å; D788-R790 PolarHBondContact OD1-N 3.35Å; D788-R790 VanDerWaalsContact OD1-N 3.16Å; R790-D810 IonicContact CZ-OD2 2.84Å; R790-D810 IonicContact NH2-OD2 3.41Å; R790-D810 PolarHBondContact NH2-OD2 3.46Å; R790-E811 WeakPolarHBondContact CA-OE1 3.27Å; R790-E811 WeakPolarHBondContact CG-OE1 3.46Å
791	H	56	Low	52.7	Low	151 Å²	151	98 Å²	98	70%	0.699	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-102	-6.3	178.3	-66.2	-49.6	0	0	0	114.5	D788 I789	D788-H791 PolarHBondContact O-N 3.3Å; D788-H791 VanDerWaalsContact O-N 3.09Å; I789-H791 PolarHBondContact O-N 3.24Å; I789-H791 VanDerWaalsContact O-N 3.12Å
792	L	59.4	Low	54.8	Low	30 Å²	30	91.1 Å²	91.1	16%	0.157	43%	0.433	C	S	.	.	S	Bend	trans	-76.9	137.9	176.4	-74.3	171.1	0	0	0	110.8	I789 V794 K802	I789-L792 PolarHBondContact O-N 3.39Å; L792-V794 PolarHBondContact O-N 3.19Å; L792-K802 VanDerWaalsContact CD1-NZ 3.31Å
793	P	61.7	Low	56.8	Low	35 Å²	35	87.5 Å²	87.5	23%	0.227	43%	0.425	C	S	.	.			trans	-63.2	134	170.7	15.5	-17.4	0	0	0	110.1	R762 N763 N795 S796	R762-P793 WeakPolarHBondContact O-CA 3.47Å; R762-P793 WeakPolarHBondContact O-CB 3.11Å; N763-P793 WeakPolarHBondContact OD1-CB 3.36Å; P793-N795 VanDerWaalsContact C-N 3.28Å; P793-N795 PolarHBondContact O-N 3.42Å; P793-S796 WeakPolarHBondContact O-CB 3.48Å; P793-S796 PolarHBondContact O-N 3.12Å; P793-S796 PolarHBondContact O-OG 3.4Å
794	V	64.7	Low	58.3	Low	1 Å²	1	81.6 Å²	81.6	1%	0.006	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-19.9	-159.7	-157.7	0	0	0	0	112.4	R758 L792 F799 F814 Y818	R758-V794 HydrophobicContact CG-CG2 3.79Å; L792-V794 PolarHBondContact O-N 3.19Å; V794-F799 HydrophobicContact CG1-CD1 4.17Å; V794-F799 HydrophobicContact CG1-CE1 3.58Å; V794-F799 HydrophobicContact CG1-CE2 4.48Å; V794-F799 HydrophobicContact CG1-CZ 3.78Å; V794-F799 WeakPolarHBondContact O-CD1 3.42Å; V794-F814 HydrophobicContact CG1-CB 3.28Å; V794-F814 HydrophobicContact CG1-CD2 4.05Å; V794-F814 HydrophobicContact CG1-CG 3.78Å; V794-Y818 HydrophobicContact CB-CD2 4.33Å; V794-Y818 HydrophobicContact CB-CE2 3.91Å; V794-Y818 HydrophobicContact CG1-CD2 3.94Å; V794-Y818 HydrophobicContact CG1-CE2 3.79Å; V794-Y818 WeakPolarHBondContact O-CD2 3.1Å
795	N	62.8	Low	60.1	Low	73 Å²	73	81.4 Å²	81.4	39%	0.39	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	2	170.3	68.4	-13.7	0	0	0	113.5	P793 Y818	P793-N795 VanDerWaalsContact C-N 3.28Å; P793-N795 PolarHBondContact O-N 3.42Å; N795-Y818 HydrophobicContact CB-CE1 4.49Å
796	S	69.4	Low	61.7	Low	21 Å²	21	77.5 Å²	77.5	15%	0.147	40%	0.397	C	S	.	.			trans	-71.4	146.5	-173	68.9	0	0	0	0	112.7	P793 E798 F799 L800	P793-S796 WeakPolarHBondContact O-CB 3.48Å; P793-S796 PolarHBondContact O-N 3.12Å; P793-S796 PolarHBondContact O-OG 3.4Å; S796-E798 PolarHBondContact O-N 3.15Å; S796-F799 PolarHBondContact O-N 3.37Å; S796-F799 VanDerWaalsContact O-N 3.1Å; S796-F799 VanDerWaalsContact OG-CB 3.27Å; S796-F799 WeakPolarHBondContact OG-CB 3.4Å; S796-F799 PolarHBondContact OG-N 2.85Å; S796-F799 VanDerWaalsContact OG-N 3.17Å; S796-L800 PolarHBondContact O-N 3.27Å
797	K	64.7	Low	63.3	Low	187 Å²	187	71.9 Å²	71.9	81%	0.813	37%	0.368	S	S	*	.	H	α-helix	trans	-61.1	-28.4	175.4	-62.7	177.3	-176.7	174.8	0	111.9	A801	K797-A801 WeakPolarHBondContact O-CB 3.46Å; K797-A801 PolarHBondContact O-N 3.15Å
798	E	66.6	Low	64.6	Low	118 Å²	118	66 Å²	66	55%	0.551	35%	0.346	S	S	*	.	H	α-helix	trans	-75.1	-30.3	174.9	-67.6	-169.4	-152.7	0	0	113.9	S796 K802	S796-E798 PolarHBondContact O-N 3.15Å; E798-K802 WeakPolarHBondContact O-CG 3.15Å
799	F	70.5	Confident	65.3	Low	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-74.6	-46.8	172.1	-179.1	-97.7	0	0	0	110.4	I789 V794 S796 A801 K802 I807 E811 F814 H815	I789-F799 HydrophobicContact CG2-CD2 3.58Å; I789-F799 HydrophobicContact CG2-CE2 3.58Å; V794-F799 HydrophobicContact CG1-CD1 4.17Å; V794-F799 HydrophobicContact CG1-CE1 3.58Å; V794-F799 HydrophobicContact CG1-CE2 4.48Å; V794-F799 HydrophobicContact CG1-CZ 3.78Å; V794-F799 WeakPolarHBondContact O-CD1 3.42Å; S796-F799 PolarHBondContact O-N 3.37Å; S796-F799 VanDerWaalsContact O-N 3.1Å; S796-F799 VanDerWaalsContact OG-CB 3.27Å; S796-F799 WeakPolarHBondContact OG-CB 3.4Å; S796-F799 PolarHBondContact OG-N 2.85Å; S796-F799 VanDerWaalsContact OG-N 3.17Å; F799-A801 VanDerWaalsContact C-N 3.33Å; F799-A801 PolarHBondContact O-N 2.94Å; F799-K802 PolarHBondContact O-N 2.9Å; F799-I807 HydrophobicContact CE2-CG2 4.23Å; F799-I807 HydrophobicContact CZ-CG2 4.26Å; F799-E811 HydrophobicContact CE2-CB 4.37Å; F799-E811 HydrophobicContact CZ-CB 4.26Å; F799-F814 HydrophobicContact CE1-CB 4.44Å; F799-F814 HydrophobicContact CZ-CB 4.46Å; F799-H815 HydrophobicContact CE1-CB 3.78Å; F799-H815 HydrophobicContact CZ-CB 4.06Å; F799-H815 PolarHBondContact O-CD2 3.17Å; F799-H815 PolarHBondContact O-NE2 3.08Å
800	L	68.6	Low	65.4	Low	44 Å²	44	65.7 Å²	65.7	23%	0.23	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-27.9	179.8	-72.4	174.6	0	0	0	114.5	S796 K802 H815 K819 A822	S796-L800 PolarHBondContact O-N 3.27Å; L800-K802 VanDerWaalsContact C-N 3.29Å; L800-K802 PolarHBondContact O-N 3.29Å; L800-H815 PolarHBondContact O-NE2 3.05Å; L800-K819 HydrophobicContact CD2-CB 4.12Å; L800-A822 HydrophobicContact CD1-CB 4.43Å
801	A	71	Confident	66	Low	86 Å²	86	63.5 Å²	63.5	71%	0.711	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.2	177.7	0	0	0	0	0	114.4	K797 F799	K797-A801 WeakPolarHBondContact O-CB 3.46Å; K797-A801 PolarHBondContact O-N 3.15Å; F799-A801 VanDerWaalsContact C-N 3.33Å; F799-A801 PolarHBondContact O-N 2.94Å
802	K	74.1	Confident	66.7	Low	46 Å²	46	57 Å²	57	20%	0.2	31%	0.31	C	S	.	.	S	Bend	trans	-80.5	154.2	176.6	-70.6	173.2	-176	-178.4	0	111.8	I789 L792 E798 F799 L800 I807 H815	I789-K802 HydrophobicContact CD1-CD 3.96Å; L792-K802 VanDerWaalsContact CD1-NZ 3.31Å; E798-K802 WeakPolarHBondContact O-CG 3.15Å; F799-K802 PolarHBondContact O-N 2.9Å; L800-K802 VanDerWaalsContact C-N 3.29Å; L800-K802 PolarHBondContact O-N 3.29Å; K802-I807 HydrophobicContact CB-CD1 4.12Å; K802-I807 HydrophobicContact CB-CG1 4.22Å; K802-H815 PolarHBondContact O-CE1 3.08Å; K802-H815 PolarHBondContact O-NE2 3.04Å
803	E	67.7	Low	67.4	Low	122 Å²	122	60.2 Å²	60.2	57%	0.57	32%	0.322	S	S	*	.			trans	-75.8	148.6	173.9	-61.9	177.3	145.9	0	0	111	S805 Q806	E803-S805 PolarHBondContact O-N 3.43Å; E803-S805 VanDerWaalsContact O-N 3.16Å; E803-Q806 HydrophobicContact CB-CG 4.24Å; E803-Q806 PolarHBondContact O-N 3.13Å; E803-Q806 PolarHBondContact OE2-NE2 3.17Å
804	E	65.3	Low	67.9	Low	59 Å²	59	58.8 Å²	58.8	28%	0.276	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-60.5	-28.3	-178.2	-72.1	172.3	-136.5	0	0	112.8	Q806 H815 R816 K819	E804-Q806 VanDerWaalsContact C-N 3.27Å; E804-Q806 PolarHBondContact O-N 2.9Å; E804-H815 WeakPolarHBondContact CG-ND1 3.45Å; E804-R816 IonicContact OE2-CZ 3.8Å; E804-R816 IonicContact OE2-NE 2.66Å; E804-R816 PolarHBondContact OE2-NE 2.99Å; E804-R816 IonicContact OE2-NH2 3.59Å; E804-R816 PolarHBondContact OE2-NH2 3.33Å; E804-K819 IonicContact OE1-NZ 3.1Å; E804-K819 PolarHBondContact OE1-NZ 3.1Å
805	S	66.4	Low	68.4	Low	119 Å²	119	58.8 Å²	58.8	83%	0.832	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-71.4	-16	175.8	-47	0	0	0	0	114.4	E803	E803-S805 PolarHBondContact O-N 3.43Å; E803-S805 VanDerWaalsContact O-N 3.16Å
806	Q	65.3	Low	69.1	Low	110 Å²	110	61.9 Å²	61.9	51%	0.514	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-97.6	-2.5	-178.4	-60.1	180	23.3	0	0	112.6	I789 E803 E804	I789-Q806 WeakPolarHBondContact CD1-O 3.33Å; E803-Q806 HydrophobicContact CB-CG 4.24Å; E803-Q806 PolarHBondContact O-N 3.13Å; E803-Q806 PolarHBondContact OE2-NE2 3.17Å; E804-Q806 VanDerWaalsContact C-N 3.27Å; E804-Q806 PolarHBondContact O-N 2.9Å
807	I	68.5	Low	69.5	Low	8 Å²	8	62.7 Å²	62.7	4%	0.041	32%	0.319	C	S	.	.	S	Bend	trans	-106	135.4	-171.4	-65.1	174.4	0	0	0	108.9	F799 K802 V809 E811 V812 H815	F799-I807 HydrophobicContact CE2-CG2 4.23Å; F799-I807 HydrophobicContact CZ-CG2 4.26Å; K802-I807 HydrophobicContact CB-CD1 4.12Å; K802-I807 HydrophobicContact CB-CG1 4.22Å; I807-V809 PolarHBondContact O-N 2.92Å; I807-E811 HydrophobicContact CG2-CB 3.67Å; I807-V812 HydrophobicContact CB-CG2 4.21Å; I807-V812 HydrophobicContact CG2-CG2 4.13Å; I807-H815 HydrophobicContact CD1-CB 3.72Å; I807-H815 WeakPolarHBondContact CD1-CD2 3.47Å
808	P	66.9	Low	69.9	Low	36 Å²	36	55.6 Å²	55.6	23%	0.234	29%	0.287	C	S	.	.			trans	-52.3	140.3	174.5	-26.7	35.5	0	0	0	111.3	I789 D810 E811 V812	I789-P808 HydrophobicContact CB-CG 4.41Å; P808-D810 VanDerWaalsContact C-OD1 3.28Å; P808-D810 WeakPolarHBondContact CB-OD1 3.38Å; P808-D810 PolarHBondContact O-N 3.37Å; P808-E811 HydrophobicContact CB-CB 4.4Å; P808-E811 HydrophobicContact CB-CG 4.2Å; P808-E811 CarbonylContact O-C 3.55Å; P808-E811 VanDerWaalsContact O-CA 3.32Å; P808-E811 WeakPolarHBondContact O-CA 3.47Å; P808-E811 WeakPolarHBondContact O-CB 3.37Å; P808-E811 PolarHBondContact O-N 3.04Å; P808-V812 PolarHBondContact O-N 3.2Å
809	V	63.2	Low	70.4	Confident	54 Å²	54	54.1 Å²	54.1	33%	0.327	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-19.4	-167.8	172.8	0	0	0	0	113.4	P725 L729 I807 E811	P725-V809 HydrophobicContact CB-CG1 4.22Å; L729-V809 HydrophobicContact CB-CG1 4.33Å; L729-V809 HydrophobicContact CD1-CB 3.94Å; L729-V809 HydrophobicContact CD1-CG1 3.86Å; L729-V809 HydrophobicContact CD1-CG2 3.59Å; I807-V809 PolarHBondContact O-N 2.92Å; V809-E811 VanDerWaalsContact C-N 3.28Å
810	D	61.7	Low	70.3	Confident	32 Å²	32	58.7 Å²	58.7	17%	0.171	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.8	160.9	30.1	-0.9	0	0	0	113.8	Y742 F750 R790 P808	Y742-D810 PolarHBondContact OH-OD2 2.82Å; F750-D810 HydrophobicContact CD1-CB 4.25Å; F750-D810 HydrophobicContact CE1-CB 3.83Å; F750-D810 WeakPolarHBondContact CE1-OD2 3.24Å; R790-D810 IonicContact CZ-OD2 2.84Å; R790-D810 IonicContact NH2-OD2 3.41Å; R790-D810 PolarHBondContact NH2-OD2 3.46Å; P808-D810 VanDerWaalsContact C-OD1 3.28Å; P808-D810 WeakPolarHBondContact CB-OD1 3.38Å; P808-D810 PolarHBondContact O-N 3.37Å
811	E	70.5	Confident	70.4	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-14.5	-176.1	-59.9	-178.2	-156	0	0	114	R758 I789 R790 F799 I807 P808 V809 F813 F814 H815	R758-E811 IonicContact CZ-OE1 3.58Å; R758-E811 IonicContact CZ-OE2 3.76Å; R758-E811 IonicContact NH1-OE1 3.62Å; R758-E811 PolarHBondContact NH1-OE1 2.96Å; R758-E811 IonicContact NH1-OE2 2.67Å; R758-E811 IonicContact NH2-OE1 2.78Å; R758-E811 PolarHBondContact NH2-OE1 3.07Å; R758-E811 IonicContact NH2-OE2 3.2Å; R758-E811 PolarHBondContact NH2-OE2 3.15Å; I789-E811 WeakPolarHBondContact CG2-OE2 3.43Å; R790-E811 WeakPolarHBondContact CA-OE1 3.27Å; R790-E811 WeakPolarHBondContact CG-OE1 3.46Å; F799-E811 HydrophobicContact CE2-CB 4.37Å; F799-E811 HydrophobicContact CZ-CB 4.26Å; I807-E811 HydrophobicContact CG2-CB 3.67Å; P808-E811 HydrophobicContact CB-CB 4.4Å; P808-E811 HydrophobicContact CB-CG 4.2Å; P808-E811 CarbonylContact O-C 3.55Å; P808-E811 VanDerWaalsContact O-CA 3.32Å; P808-E811 WeakPolarHBondContact O-CA 3.47Å; P808-E811 WeakPolarHBondContact O-CB 3.37Å; P808-E811 PolarHBondContact O-N 3.04Å; V809-E811 VanDerWaalsContact C-N 3.28Å; E811-F813 PolarHBondContact O-N 3.14Å; E811-F814 HydrophobicContact CB-CD2 4.42Å; E811-F814 PolarHBondContact O-N 2.91Å; E811-H815 PolarHBondContact O-N 3.16Å
812	V	72.3	Confident	70.2	Confident	16 Å²	16	55.6 Å²	55.6	10%	0.097	28%	0.276	C	S	.	.	H	α-helix	trans	-57.1	-31.7	175.9	168.2	0	0	0	0	112	I807 P808 H815 R816	I807-V812 HydrophobicContact CB-CG2 4.21Å; I807-V812 HydrophobicContact CG2-CG2 4.13Å; P808-V812 PolarHBondContact O-N 3.2Å; V812-H815 PolarHBondContact O-N 3.19Å; V812-R816 HydrophobicContact CG1-CG 4.38Å; V812-R816 WeakPolarHBondContact O-CB 3.44Å; V812-R816 WeakPolarHBondContact O-CG 3.18Å; V812-R816 PolarHBondContact O-N 3.42Å
813	F	73.1	Confident	69.9	Low	96 Å²	96	57 Å²	57	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-57.2	-52.9	171.1	172.9	-94.7	0	0	0	111.3	F755 E811 H815 R816 Y817	F755-F813 AromaticContact CE2-CD1 3.82Å; F755-F813 HydrophobicContact CE2-CD1 3.82Å; F755-F813 HydrophobicContact CE2-CE1 4.15Å; F755-F813 AromaticContact CZ-CD1 3.84Å; F755-F813 HydrophobicContact CZ-CD1 3.84Å; F755-F813 AromaticContact CZ-CE1 3.67Å; F755-F813 HydrophobicContact CZ-CE1 3.67Å; F755-F813 HydrophobicContact CZ-CZ 4.44Å; E811-F813 PolarHBondContact O-N 3.14Å; F813-H815 PolarHBondContact O-N 3.34Å; F813-R816 PolarHBondContact O-N 3.46Å; F813-Y817 WeakPolarHBondContact O-CB 3.4Å; F813-Y817 PolarHBondContact O-N 2.94Å
814	F	72.7	Confident	69.6	Low	6 Å²	6	55.2 Å²	55.2	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-37.5	-178.2	-53.6	-61.5	0	0	0	112.2	F755 F759 V794 F799 E811 Y817 Y818	F755-F814 AromaticContact CD2-CE1 3.87Å; F755-F814 HydrophobicContact CD2-CE1 3.87Å; F755-F814 HydrophobicContact CD2-CE2 4.36Å; F755-F814 AromaticContact CD2-CZ 3.44Å; F755-F814 HydrophobicContact CD2-CZ 3.44Å; F755-F814 VanDerWaalsContact CD2-CZ 3.44Å; F755-F814 HydrophobicContact CE2-CD1 4.41Å; F755-F814 AromaticContact CE2-CE1 3.46Å; F755-F814 HydrophobicContact CE2-CE1 3.46Å; F755-F814 VanDerWaalsContact CE2-CE1 3.46Å; F755-F814 HydrophobicContact CE2-CE2 4.44Å; F755-F814 AromaticContact CE2-CZ 3.49Å; F755-F814 HydrophobicContact CE2-CZ 3.49Å; F755-F814 VanDerWaalsContact CE2-CZ 3.49Å; F755-F814 HydrophobicContact CG-CZ 4.19Å; F755-F814 AromaticContact CZ-CE1 3.84Å; F755-F814 HydrophobicContact CZ-CE1 3.84Å; F755-F814 HydrophobicContact CZ-CZ 4.28Å; F759-F814 HydrophobicContact CB-CE1 4.04Å; F759-F814 AromaticContact CD2-CD1 3.99Å; F759-F814 HydrophobicContact CD2-CD1 3.99Å; F759-F814 AromaticContact CD2-CE1 3.89Å; F759-F814 HydrophobicContact CD2-CE1 3.89Å; F759-F814 HydrophobicContact CG-CE1 4.44Å; V794-F814 HydrophobicContact CG1-CB 3.28Å; V794-F814 HydrophobicContact CG1-CD2 4.05Å; V794-F814 HydrophobicContact CG1-CG 3.78Å; F799-F814 HydrophobicContact CE1-CB 4.44Å; F799-F814 HydrophobicContact CZ-CB 4.46Å; E811-F814 HydrophobicContact CB-CD2 4.42Å; E811-F814 PolarHBondContact O-N 2.91Å; F814-Y817 PolarHBondContact O-N 3.22Å; F814-Y818 HydrophobicContact CB-CD2 4.28Å; F814-Y818 HydrophobicContact CB-CE2 4.37Å; F814-Y818 VanDerWaalsContact O-CD2 3.29Å; F814-Y818 WeakPolarHBondContact O-CD2 3.49Å; F814-Y818 PolarHBondContact O-N 3.14Å
815	H	74.8	Confident	69.2	Low	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-50	175.2	-175.9	-105.8	0	0	0	110.8	F799 L800 K802 E804 I807 E811 V812 F813 Y817 K819	F799-H815 HydrophobicContact CE1-CB 3.78Å; F799-H815 HydrophobicContact CZ-CB 4.06Å; F799-H815 PolarHBondContact O-CD2 3.17Å; F799-H815 PolarHBondContact O-NE2 3.08Å; L800-H815 PolarHBondContact O-NE2 3.05Å; K802-H815 PolarHBondContact O-CE1 3.08Å; K802-H815 PolarHBondContact O-NE2 3.04Å; E804-H815 WeakPolarHBondContact CG-ND1 3.45Å; I807-H815 HydrophobicContact CD1-CB 3.72Å; I807-H815 WeakPolarHBondContact CD1-CD2 3.47Å; E811-H815 PolarHBondContact O-N 3.16Å; V812-H815 PolarHBondContact O-N 3.19Å; F813-H815 PolarHBondContact O-N 3.34Å; H815-Y817 VanDerWaalsContact C-N 3.33Å; H815-Y817 PolarHBondContact O-N 3.46Å; H815-K819 WeakPolarHBondContact O-CB 3.46Å; H815-K819 PolarHBondContact O-N 3.44Å
816	R	78.2	Confident	68.8	Low	139 Å²	139	57.3 Å²	57.3	53%	0.525	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-40.5	176.3	-72.6	175.6	173.7	171.9	1.6	112.4	E804 V812 F813 K820	E804-R816 IonicContact OE2-CZ 3.8Å; E804-R816 IonicContact OE2-NE 2.66Å; E804-R816 PolarHBondContact OE2-NE 2.99Å; E804-R816 IonicContact OE2-NH2 3.59Å; E804-R816 PolarHBondContact OE2-NH2 3.33Å; V812-R816 HydrophobicContact CG1-CG 4.38Å; V812-R816 WeakPolarHBondContact O-CB 3.44Å; V812-R816 WeakPolarHBondContact O-CG 3.18Å; V812-R816 PolarHBondContact O-N 3.42Å; F813-R816 PolarHBondContact O-N 3.46Å; R816-K820 WeakPolarHBondContact O-CB 3.5Å; R816-K820 PolarHBondContact O-N 2.92Å
817	Y	76.6	Confident	68.4	Low	38 Å²	38	58.7 Å²	58.7	15%	0.149	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-62.5	176.1	-178.5	-99.7	0	0	0	111.6	F759 F813 F814 H815 K819 K820 V821 F851	F759-Y817 AromaticContact CE2-CD1 3.97Å; F759-Y817 HydrophobicContact CE2-CD1 3.97Å; F759-Y817 AromaticContact CE2-CE1 3.74Å; F759-Y817 HydrophobicContact CE2-CE1 3.74Å; F759-Y817 AromaticContact CZ-CE1 4Å; F759-Y817 HydrophobicContact CZ-CE1 4Å; F759-Y817 AromaticContact CZ-CZ 3.96Å; F813-Y817 WeakPolarHBondContact O-CB 3.4Å; F813-Y817 PolarHBondContact O-N 2.94Å; F814-Y817 PolarHBondContact O-N 3.22Å; H815-Y817 VanDerWaalsContact C-N 3.33Å; H815-Y817 PolarHBondContact O-N 3.46Å; Y817-K819 VanDerWaalsContact C-N 3.26Å; Y817-K819 PolarHBondContact O-N 2.96Å; Y817-K820 PolarHBondContact O-N 3.05Å; Y817-K820 VanDerWaalsContact O-N 3.11Å; Y817-V821 HydrophobicContact CD1-CG2 4.33Å; Y817-V821 HydrophobicContact CE1-CG2 4.04Å; Y817-V821 HydrophobicContact CE2-CG2 4.46Å; Y817-V821 WeakPolarHBondContact O-CG2 3.35Å; Y817-V821 PolarHBondContact O-N 3.31Å; Y817-F851 HydrophobicContact CD2-CE2 4.48Å; Y817-F851 HydrophobicContact CD2-CZ 4.45Å
818	Y	73.3	Confident	67.6	Low	37 Å²	37	64.4 Å²	64.4	15%	0.145	30%	0.304	C	S	.	.	H	α-helix	trans	-67.3	-24.6	-177.8	-69.1	-65.5	0	0	0	113	F759 V794 N795 F814 A822	F759-Y818 PolarHBondContact O-OH 2.76Å; V794-Y818 HydrophobicContact CB-CD2 4.33Å; V794-Y818 HydrophobicContact CB-CE2 3.91Å; V794-Y818 HydrophobicContact CG1-CD2 3.94Å; V794-Y818 HydrophobicContact CG1-CE2 3.79Å; V794-Y818 WeakPolarHBondContact O-CD2 3.1Å; N795-Y818 HydrophobicContact CB-CE1 4.49Å; F814-Y818 HydrophobicContact CB-CD2 4.28Å; F814-Y818 HydrophobicContact CB-CE2 4.37Å; F814-Y818 VanDerWaalsContact O-CD2 3.29Å; F814-Y818 WeakPolarHBondContact O-CD2 3.49Å; F814-Y818 PolarHBondContact O-N 3.14Å; Y818-A822 WeakPolarHBondContact O-CB 3.12Å; Y818-A822 PolarHBondContact O-N 2.98Å
819	K	77.8	Confident	66.7	Low	87 Å²	87	69.7 Å²	69.7	38%	0.378	32%	0.319	S	S	.	.	H	α-helix	trans	-70.4	-43.3	170.4	-176.9	176.2	172.4	-175.8	0	111.7	L800 E804 H815 Y817 V823	L800-K819 HydrophobicContact CD2-CB 4.12Å; E804-K819 IonicContact OE1-NZ 3.1Å; E804-K819 PolarHBondContact OE1-NZ 3.1Å; H815-K819 WeakPolarHBondContact O-CB 3.46Å; H815-K819 PolarHBondContact O-N 3.44Å; Y817-K819 VanDerWaalsContact C-N 3.26Å; Y817-K819 PolarHBondContact O-N 2.96Å; K819-V823 WeakPolarHBondContact O-CG2 2.97Å; K819-V823 PolarHBondContact O-N 3.37Å; K819-V823 VanDerWaalsContact O-N 3.11Å
820	K	69.1	Low	65.8	Low	97 Å²	97	74.7 Å²	74.7	42%	0.422	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-42.8	170.4	-85.4	-167.2	169.7	-163.6	0	111	R816 Y817 V823 K824 F851 D854	R816-K820 WeakPolarHBondContact O-CB 3.5Å; R816-K820 PolarHBondContact O-N 2.92Å; Y817-K820 PolarHBondContact O-N 3.05Å; Y817-K820 VanDerWaalsContact O-N 3.11Å; K820-V823 PolarHBondContact O-N 3.44Å; K820-K824 PolarHBondContact O-N 3.43Å; K820-F851 HydrophobicContact CD-CE1 4.13Å; K820-F851 HydrophobicContact CD-CZ 3.95Å; K820-D854 IonicContact NZ-OD2 2.74Å; K820-D854 PolarHBondContact NZ-OD2 2.75Å; K820-D854 VanDerWaalsContact NZ-OD2 3.1Å
821	V	70.9	Confident	65.2	Low	37 Å²	37	76.8 Å²	76.8	22%	0.224	37%	0.366	C	S	.	.	H	α-helix	trans	-62.2	-48.6	176	173.5	0	0	0	0	111.2	Y817 V823 K824 E825	Y817-V821 HydrophobicContact CD1-CG2 4.33Å; Y817-V821 HydrophobicContact CE1-CG2 4.04Å; Y817-V821 HydrophobicContact CE2-CG2 4.46Å; Y817-V821 WeakPolarHBondContact O-CG2 3.35Å; Y817-V821 PolarHBondContact O-N 3.31Å; V821-V823 PolarHBondContact O-N 3.28Å; V821-K824 CarbonylContact O-C 3.47Å; V821-K824 PolarHBondContact O-N 2.81Å; V821-K824 VanDerWaalsContact O-N 3.11Å; V821-E825 HydrophobicContact CG1-CG 4.36Å; V821-E825 PolarHBondContact O-N 3.07Å
822	A	65.6	Low	63.6	Low	28 Å²	28	83.9 Å²	83.9	23%	0.231	40%	0.404	C	S	.	.	H	α-helix	trans	-64.8	-20.3	177.8	0	0	0	0	0	113.8	L800 Y818 K826	L800-A822 HydrophobicContact CD1-CB 4.43Å; Y818-A822 WeakPolarHBondContact O-CB 3.12Å; Y818-A822 PolarHBondContact O-N 2.98Å; A822-K826 VanDerWaalsContact O-CG 3.29Å; A822-K826 WeakPolarHBondContact O-CG 3.39Å; A822-K826 PolarHBondContact O-N 3.43Å
823	V	67.3	Low	62.3	Low	76 Å²	76	92.2 Å²	92.2	46%	0.461	44%	0.441	S	S	.	.	H	α-helix	trans	-80.6	-46.1	169.3	169.5	0	0	0	0	111.1	K819 K820 V821 E825 K826 Q827	K819-V823 WeakPolarHBondContact O-CG2 2.97Å; K819-V823 PolarHBondContact O-N 3.37Å; K819-V823 VanDerWaalsContact O-N 3.11Å; K820-V823 PolarHBondContact O-N 3.44Å; V821-V823 PolarHBondContact O-N 3.28Å; V823-E825 VanDerWaalsContact C-N 3.33Å; V823-E825 PolarHBondContact O-N 3.08Å; V823-K826 WeakPolarHBondContact O-CB 3.12Å; V823-K826 PolarHBondContact O-N 2.9Å; V823-K826 VanDerWaalsContact O-N 3.12Å; V823-Q827 PolarHBondContact O-N 2.98Å
824	K	61.4	Low	60.8	Low	84 Å²	84	96.6 Å²	96.6	37%	0.365	46%	0.463	S	S	.	.	H	α-helix	trans	-60.6	-39.7	174.1	-76.4	-170.6	174.3	-174.7	0	112	K820 V821 K826 Q827 K828 L847	K820-K824 PolarHBondContact O-N 3.43Å; V821-K824 CarbonylContact O-C 3.47Å; V821-K824 PolarHBondContact O-N 2.81Å; V821-K824 VanDerWaalsContact O-N 3.11Å; K824-K826 PolarHBondContact O-N 2.99Å; K824-Q827 PolarHBondContact O-N 2.84Å; K824-K828 PolarHBondContact O-N 3.25Å; K824-L847 HydrophobicContact CD-CD1 4.24Å
825	E	57.9	Low	59.2	Low	84 Å²	84	101.1 Å²	101.1	39%	0.393	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-38.9	172.3	-79	-175.1	-164.6	0	0	112.8	V821 V823 Q827 K828 R829	V821-E825 HydrophobicContact CG1-CG 4.36Å; V821-E825 PolarHBondContact O-N 3.07Å; V823-E825 VanDerWaalsContact C-N 3.33Å; V823-E825 PolarHBondContact O-N 3.08Å; E825-Q827 VanDerWaalsContact C-N 3.3Å; E825-K828 PolarHBondContact O-N 3.24Å; E825-R829 WeakPolarHBondContact O-CB 3.34Å; E825-R829 WeakPolarHBondContact O-CG 3.37Å; E825-R829 PolarHBondContact O-N 3.17Å; E825-R829 PolarHBondContact O-NE 2.91Å; E825-R829 IonicContact OE2-CZ 3.73Å; E825-R829 IonicContact OE2-NH2 2.67Å; E825-R829 PolarHBondContact OE2-NH2 3.41Å
826	K	58.3	Low	57.6	Low	138 Å²	138	109 Å²	109	60%	0.6	54%	0.536	S	S	*	.	H	α-helix	trans	-66.2	-36	175.7	-82.2	176.3	176.5	-175.2	0	111.3	A822 V823 K824 R829	A822-K826 VanDerWaalsContact O-CG 3.29Å; A822-K826 WeakPolarHBondContact O-CG 3.39Å; A822-K826 PolarHBondContact O-N 3.43Å; V823-K826 WeakPolarHBondContact O-CB 3.12Å; V823-K826 PolarHBondContact O-N 2.9Å; V823-K826 VanDerWaalsContact O-N 3.12Å; K824-K826 PolarHBondContact O-N 2.99Å; K826-R829 PolarHBondContact O-N 3.18Å
827	Q	55.3	Low	55.7	Low	138 Å²	138	110.5 Å²	110.5	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-71.6	-34.5	174.1	-70	174.6	-30.2	0	0	112.9	V823 K824 E825 R829	V823-Q827 PolarHBondContact O-N 2.98Å; K824-Q827 PolarHBondContact O-N 2.84Å; E825-Q827 VanDerWaalsContact C-N 3.3Å; Q827-R829 VanDerWaalsContact C-N 3.34Å
828	K	52.1	Low	53.9	Low	128 Å²	128	115.1 Å²	115.1	56%	0.557	58%	0.576	S	S	*	*	H	α-helix	trans	-65.7	-34.3	168.4	-77.7	-169.6	178.8	-178.1	0	112	K824 E825 D830 A831 E843	K824-K828 PolarHBondContact O-N 3.25Å; E825-K828 PolarHBondContact O-N 3.24Å; K828-D830 VanDerWaalsContact C-N 3.32Å; K828-D830 PolarHBondContact O-N 3.47Å; K828-A831 WeakPolarHBondContact O-CB 3.38Å; K828-A831 PolarHBondContact O-N 3.38Å; K828-A831 VanDerWaalsContact O-N 3.09Å; K828-E843 IonicContact NZ-OE1 3.58Å; K828-E843 PolarHBondContact NZ-OE1 3.26Å; K828-E843 IonicContact NZ-OE2 3.22Å
829	R	47.8	Very low	52.7	Low	147 Å²	147	118 Å²	118	56%	0.555	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-8.3	-174.4	-87	-178.8	-90.1	164.2	-16.5	116.5	E825 K826 Q827	E825-R829 WeakPolarHBondContact O-CB 3.34Å; E825-R829 WeakPolarHBondContact O-CG 3.37Å; E825-R829 PolarHBondContact O-N 3.17Å; E825-R829 PolarHBondContact O-NE 2.91Å; E825-R829 IonicContact OE2-CZ 3.73Å; E825-R829 IonicContact OE2-NH2 2.67Å; E825-R829 PolarHBondContact OE2-NH2 3.41Å; K826-R829 PolarHBondContact O-N 3.18Å; Q827-R829 VanDerWaalsContact C-N 3.34Å
830	D	45.3	Very low	50.9	Low	160 Å²	160	119.5 Å²	119.5	86%	0.856	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	3.4	166.7	-72.9	-33.7	0	0	0	112.4	K828	K828-D830 VanDerWaalsContact C-N 3.32Å; K828-D830 PolarHBondContact O-N 3.47Å
831	A	48.7	Very low	50.1	Low	76 Å²	76	120.8 Å²	120.8	63%	0.628	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	-24.5	-170.3	0	0	0	0	0	117.1	K828	K828-A831 WeakPolarHBondContact O-CB 3.38Å; K828-A831 PolarHBondContact O-N 3.38Å; K828-A831 VanDerWaalsContact O-N 3.09Å
832	D	37.3	Very low	49	Very low	150 Å²	150	126.2 Å²	126.2	80%	0.802	64%	0.644	S	S	*	*			trans	-165.6	155.7	166.7	-100.5	-37.9	0	0	0	111.5
833	E	44.9	Very low	48.4	Very low	190 Å²	190	129.2 Å²	129.2	89%	0.888	65%	0.653	S	S	*	*			trans	-129.7	79.5	-174.1	-168.1	179.1	-135.2	0	0	112.7
834	E	40.7	Very low	47.7	Very low	188 Å²	188	129.8 Å²	129.8	88%	0.879	65%	0.65	S	S	*	*			trans	-152.6	157.6	164.2	-128.9	166.6	-155.1	0	0	113.7
835	S	40.2	Very low	47.6	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	66%	0.662	S	S	*	*			trans	12.4	121.7	174.6	56.1	0	0	0	0	121.2
836	I	41.3	Very low	47.7	Very low	166 Å²	166	135 Å²	135	85%	0.851	67%	0.673	S	S	*	*			trans	-87.1	105.4	160.1	-56.2	170.3	0	0	0	109
837	E	36.9	Very low	47.5	Very low	171 Å²	171	130.4 Å²	130.4	80%	0.799	66%	0.655	S	S	*	*			trans	-106.7	176.8	157.8	-69.4	-164.9	141.8	0	0	109.8
838	D	38.9	Very low	47.6	Very low	135 Å²	135	127.6 Å²	127.6	72%	0.722	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-69.4	149.1	-164.5	-72.5	-64.2	0	0	0	114.5	R762 D840	R762-D838 IonicContact NH2-OD1 3.24Å; R762-D838 PolarHBondContact NH2-OD1 3Å; D838-D840 PolarHBondContact O-N 3.22Å
839	V	49.4	Very low	47.8	Very low	97 Å²	97	126.1 Å²	126.1	59%	0.588	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-74.2	120.3	-179.2	-177.6	0	0	0	0	109.4	E843	V839-E843 HydrophobicContact CG1-CB 3.99Å; V839-E843 HydrophobicContact CG1-CG 4.28Å
840	D	40	Very low	48.2	Very low	118 Å²	118	122.3 Å²	122.3	63%	0.631	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-74.6	153.2	178.8	-153.1	-12.4	0	0	0	111.5	D838 E842 E843 F844	D838-D840 PolarHBondContact O-N 3.22Å; D840-E842 PolarHBondContact O-N 2.82Å; D840-E842 VanDerWaalsContact O-N 3.14Å; D840-E843 PolarHBondContact O-N 2.82Å; D840-F844 PolarHBondContact O-N 2.84Å
841	D	51.7	Low	48.4	Very low	125 Å²	125	118.8 Å²	118.8	67%	0.668	61%	0.612	S	S	*	*	H	α-helix	trans	-60.5	-29.9	-174.2	-71.8	-35.7	0	0	0	111.8	E843 F844 E845	D841-E843 PolarHBondContact O-N 2.68Å; D841-F844 WeakPolarHBondContact O-CB 3.4Å; D841-F844 PolarHBondContact O-N 3.17Å; D841-F844 VanDerWaalsContact O-N 3.14Å; D841-E845 PolarHBondContact O-N 2.93Å; D841-E845 VanDerWaalsContact O-N 3.07Å
842	E	47.5	Very low	48.5	Very low	150 Å²	150	122.4 Å²	122.4	70%	0.701	62%	0.616	S	S	*	*	H	α-helix	trans	-71.6	-19.6	175.9	-62.7	-166.7	172.2	0	0	114.2	D840 K846	D840-E842 PolarHBondContact O-N 2.82Å; D840-E842 VanDerWaalsContact O-N 3.14Å; E842-K846 WeakPolarHBondContact O-CB 3.42Å
843	E	54.5	Low	48.9	Very low	91 Å²	91	122.8 Å²	122.8	43%	0.425	62%	0.618	S	S	.	*	H	α-helix	trans	-84.4	-25.2	167.1	-174.6	165.5	-140.4	0	0	111.2	K828 V839 D840 D841 L847	K828-E843 IonicContact NZ-OE1 3.58Å; K828-E843 PolarHBondContact NZ-OE1 3.26Å; K828-E843 IonicContact NZ-OE2 3.22Å; V839-E843 HydrophobicContact CG1-CB 3.99Å; V839-E843 HydrophobicContact CG1-CG 4.28Å; D840-E843 PolarHBondContact O-N 2.82Å; D841-E843 PolarHBondContact O-N 2.68Å; E843-L847 WeakPolarHBondContact O-CB 3.39Å; E843-L847 PolarHBondContact O-N 2.92Å; E843-L847 VanDerWaalsContact O-N 3.11Å
844	F	51.4	Low	49	Very low	89 Å²	89	119 Å²	119	39%	0.39	60%	0.604	S	S	.	*	H	α-helix	trans	-70.6	-51.6	176.5	179.9	-105.2	0	0	0	112.7	F759 D840 D841 K846 L847 I848	F759-F844 HydrophobicContact CE1-CE2 4.29Å; D840-F844 PolarHBondContact O-N 2.84Å; D841-F844 WeakPolarHBondContact O-CB 3.4Å; D841-F844 PolarHBondContact O-N 3.17Å; D841-F844 VanDerWaalsContact O-N 3.14Å; F844-K846 VanDerWaalsContact C-N 3.34Å; F844-K846 PolarHBondContact O-N 2.97Å; F844-L847 PolarHBondContact O-N 3.04Å; F844-I848 HydrophobicContact CD1-CD1 4.06Å; F844-I848 HydrophobicContact CE1-CD1 3.55Å; F844-I848 HydrophobicContact CE2-CD1 4.27Å; F844-I848 HydrophobicContact CZ-CD1 3.67Å; F844-I848 PolarHBondContact O-N 3.26Å; F844-I848 VanDerWaalsContact O-N 3.15Å
845	E	59.8	Low	49	Very low	133 Å²	133	115.4 Å²	115.4	62%	0.621	59%	0.591	S	S	*	*	H	α-helix	trans	-55.8	-49.9	175.5	-70.4	-171.9	154	0	0	110.7	D841 L847 I848 D849	D841-E845 PolarHBondContact O-N 2.93Å; D841-E845 VanDerWaalsContact O-N 3.07Å; E845-L847 PolarHBondContact O-N 3.32Å; E845-L847 VanDerWaalsContact O-N 3.16Å; E845-I848 WeakPolarHBondContact O-CA 3.33Å; E845-I848 WeakPolarHBondContact O-CB 3.42Å; E845-I848 PolarHBondContact O-N 3.16Å; E845-D849 PolarHBondContact O-N 2.68Å
846	K	59.3	Low	49.1	Very low	145 Å²	145	116.5 Å²	116.5	63%	0.63	60%	0.597	S	S	*	*	H	α-helix	trans	-61.9	-27.3	-179.3	-160.2	173.2	-161.9	164.8	0	114	E842 F844 T850	E842-K846 WeakPolarHBondContact O-CB 3.42Å; F844-K846 VanDerWaalsContact C-N 3.34Å; F844-K846 PolarHBondContact O-N 2.97Å; K846-T850 PolarHBondContact O-N 3.49Å; K846-T850 PolarHBondContact O-OG1 3.11Å
847	L	54	Low	48.9	Very low	40 Å²	40	116.7 Å²	116.7	21%	0.209	59%	0.592	C	S	.	*	H	α-helix	trans	-77.4	-31.9	173.6	-161.5	72	0	0	0	111.7	K824 E843 F844 E845 T850 F851	K824-L847 HydrophobicContact CD-CD1 4.24Å; E843-L847 WeakPolarHBondContact O-CB 3.39Å; E843-L847 PolarHBondContact O-N 2.92Å; E843-L847 VanDerWaalsContact O-N 3.11Å; F844-L847 PolarHBondContact O-N 3.04Å; E845-L847 PolarHBondContact O-N 3.32Å; E845-L847 VanDerWaalsContact O-N 3.16Å; L847-T850 PolarHBondContact O-N 3.32Å; L847-F851 WeakPolarHBondContact O-CD2 3.33Å
848	I	58.2	Low	48.7	Very low	79 Å²	79	114.5 Å²	114.5	41%	0.405	60%	0.596	S	S	.	*	H	α-helix	trans	-68.5	-43.9	172.8	-69.2	172.6	0	0	0	110.8	F844 E845 T850 F851 E852	F844-I848 HydrophobicContact CD1-CD1 4.06Å; F844-I848 HydrophobicContact CE1-CD1 3.55Å; F844-I848 HydrophobicContact CE2-CD1 4.27Å; F844-I848 HydrophobicContact CZ-CD1 3.67Å; F844-I848 PolarHBondContact O-N 3.26Å; F844-I848 VanDerWaalsContact O-N 3.15Å; E845-I848 WeakPolarHBondContact O-CA 3.33Å; E845-I848 WeakPolarHBondContact O-CB 3.42Å; E845-I848 PolarHBondContact O-N 3.16Å; I848-T850 PolarHBondContact O-N 3.26Å; I848-F851 WeakPolarHBondContact O-CA 3.43Å; I848-F851 WeakPolarHBondContact O-CB 3.48Å; I848-F851 PolarHBondContact O-N 3.24Å; I848-E852 PolarHBondContact O-N 3.27Å
849	D	55.6	Low	48.5	Very low	98 Å²	98	114.6 Å²	114.6	52%	0.524	61%	0.607	S	S	.	*	H	α-helix	trans	-53.3	-42.3	173.4	-58.4	-21.1	0	0	0	110.8	E845 F851 E852	E845-D849 PolarHBondContact O-N 2.68Å; D849-F851 PolarHBondContact O-N 2.71Å; D849-F851 VanDerWaalsContact O-N 3.12Å; D849-E852 PolarHBondContact O-N 3.05Å; D849-E852 VanDerWaalsContact O-N 3.12Å
850	T	56.8	Low	47.7	Very low	67 Å²	67	113.4 Å²	113.4	41%	0.411	61%	0.614	S	S	.	*	H	α-helix	trans	-67.5	-9.2	177.4	-40.1	0	0	0	0	113.6	K846 L847 I848	K846-T850 PolarHBondContact O-N 3.49Å; K846-T850 PolarHBondContact O-OG1 3.11Å; L847-T850 PolarHBondContact O-N 3.32Å; I848-T850 PolarHBondContact O-N 3.26Å
851	F	49.8	Very low	47.5	Very low	85 Å²	85	116.4 Å²	116.4	37%	0.373	62%	0.621	S	S	.	*	H	α-helix	trans	-97.4	-17.4	173.6	-93.7	-83.4	0	0	0	113.3	Y817 K820 L847 I848 D849	Y817-F851 HydrophobicContact CD2-CE2 4.48Å; Y817-F851 HydrophobicContact CD2-CZ 4.45Å; K820-F851 HydrophobicContact CD-CE1 4.13Å; K820-F851 HydrophobicContact CD-CZ 3.95Å; L847-F851 WeakPolarHBondContact O-CD2 3.33Å; I848-F851 WeakPolarHBondContact O-CA 3.43Å; I848-F851 WeakPolarHBondContact O-CB 3.48Å; I848-F851 PolarHBondContact O-N 3.24Å; D849-F851 PolarHBondContact O-N 2.71Å; D849-F851 VanDerWaalsContact O-N 3.12Å
852	E	50.8	Low	46.6	Very low	152 Å²	152	117.7 Å²	117.7	71%	0.71	63%	0.628	S	S	*	*	H	α-helix	trans	-78.1	-43.3	173.8	-60.2	-154.8	138.8	0	0	111.4	I848 D849 D854 N855	I848-E852 PolarHBondContact O-N 3.27Å; D849-E852 PolarHBondContact O-N 3.05Å; D849-E852 VanDerWaalsContact O-N 3.12Å; E852-D854 VanDerWaalsContact C-N 3.29Å; E852-D854 PolarHBondContact O-N 3.02Å; E852-N855 WeakPolarHBondContact O-CB 3.47Å; E852-N855 PolarHBondContact O-N 3.12Å
853	D	46.4	Very low	46.4	Very low	159 Å²	159	117.5 Å²	117.5	85%	0.85	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-33.9	175.6	-93.9	-16.3	0	0	0	114	N855	D853-N855 VanDerWaalsContact C-N 3.31Å; D853-N855 PolarHBondContact O-N 3.09Å
854	D	46	Very low	45.7	Very low	111 Å²	111	121.8 Å²	121.8	59%	0.594	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	12.7	-169.7	-156.2	39.5	0	0	0	112.5	K820 E852 C856	K820-D854 IonicContact NZ-OD2 2.74Å; K820-D854 PolarHBondContact NZ-OD2 2.75Å; K820-D854 VanDerWaalsContact NZ-OD2 3.1Å; E852-D854 VanDerWaalsContact C-N 3.29Å; E852-D854 PolarHBondContact O-N 3.02Å; D854-C856 PolarHBondContact O-N 3.37Å
855	N	41.6	Very low	45.3	Very low	112 Å²	112	124 Å²	124	60%	0.599	67%	0.67	S	S	*	*			trans	-86	103.8	-168.6	-162.1	9.3	0	0	0	113	E852 D853 F857	E852-N855 WeakPolarHBondContact O-CB 3.47Å; E852-N855 PolarHBondContact O-N 3.12Å; D853-N855 VanDerWaalsContact C-N 3.31Å; D853-N855 PolarHBondContact O-N 3.09Å; N855-F857 PolarHBondContact O-N 3.21Å
856	C	42.3	Very low	44.3	Very low	124 Å²	124	127.6 Å²	127.6	84%	0.838	68%	0.684	S	S	*	*			trans	-75.4	47.5	-177.1	-163.3	0	0	0	0	114.1	D854	D854-C856 PolarHBondContact O-N 3.37Å
857	F	37.1	Very low	43.5	Very low	170 Å²	170	124.8 Å²	124.8	75%	0.746	69%	0.688	S	S	*	*	S	Bend	trans	-144	119	173.5	-89.9	-80.8	0	0	0	112.1	N855	N855-F857 PolarHBondContact O-N 3.21Å
858	S	32.6	Very low	42.6	Very low	125 Å²	125	125.9 Å²	125.9	87%	0.874	71%	0.709	S	S	*	*			trans	74.5	113.6	-179.2	-47.9	0	0	0	0	115.7
859	S	33.6	Very low	41.6	Very low	137 Å²	137	129.6 Å²	129.6	96%	0.958	73%	0.73	S	S	*	*			trans	-92.6	117	164.7	-176.3	0	0	0	0	109.1
860	G	31.9	Very low	40.6	Very low	71 Å²	71	131.3 Å²	131.3	73%	0.732	74%	0.743	S	S	*	*			trans	173.4	122.1	178.6	0	0	0	0	0	110.4
861	K	36.5	Very low	39.5	Very low	181 Å²	181	137.4 Å²	137.4	79%	0.787	76%	0.764	S	S	*	*			trans	-83.1	147.7	178.3	-63.2	-175.5	174.5	-167.9	0	110.9
862	D	33.7	Very low	38.8	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	79%	0.788	S	S	*	*				-168.6	122.1	108.1	-92	-15	0	0	0	109.9
863	D	42.2	Very low	37.8	Very low	147 Å²	147	147.1 Å²	147.1	79%	0.786	80%	0.797	S	S	*	*			trans	-78.1	124.1	-176.2	-53.5	-56	0	0	0	111
864	M	39.6	Very low	37.1	Very low	180 Å²	180	146.7 Å²	146.7	89%	0.887	80%	0.801	S	S	*	*			trans	-118.9	69.9	171.1	-78.4	-69.2	-73.4	0	0	110.3	F866	M864-F866 PolarHBondContact O-N 2.78Å
865	D	43.1	Very low	36.4	Very low	136 Å²	136	151.5 Å²	151.5	73%	0.727	82%	0.816	S	S	*	*			trans	-68.1	87.9	-175.9	-172.1	0.8	0	0	0	112.2
866	F	39.9	Very low	35.8	Very low	208 Å²	208	149.9 Å²	149.9	91%	0.912	83%	0.826	S	S	*	*			trans	-83.5	-15.9	-174.5	-172.4	-106.1	0	0	0	113.9	M864	M864-F866 PolarHBondContact O-N 2.78Å
867	A	41.7	Very low	35.1	Very low	86 Å²	86	148.9 Å²	148.9	71%	0.711	83%	0.827	S	S	*	*	S	Bend	trans	-102.5	-18.9	-165.2	0	0	0	0	0	115.2	N869	A867-N869 PolarHBondContact O-N 3.44Å
868	G	36	Very low	34.7	Very low	63 Å²	63	150 Å²	150	65%	0.649	83%	0.832	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	7.8	-165.4	0	0	0	0	0	119.1
869	N	36.5	Very low	34.3	Very low	157 Å²	157	150 Å²	150	84%	0.84	82%	0.822	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	22	-163.5	-141.6	2.3	0	0	0	117.1	A867	A867-N869 PolarHBondContact O-N 3.44Å
870	V	34.9	Very low	34	Very low	134 Å²	134	149.3 Å²	149.3	81%	0.812	81%	0.807	S	S	*	*			trans	-126.4	85.3	169.2	-172.1	0	0	0	0	111.6	K872	V870-K872 PolarHBondContact O-N 3.47Å
871	K	34.3	Very low	33.7	Very low	196 Å²	196	151.2 Å²	151.2	85%	0.852	81%	0.805	S	S	*	*			trans	-70.4	107.8	173.8	-72.2	-178.5	177.1	176.3	0	111.2	R873	K871-R873 PolarHBondContact O-N 3.31Å
872	K	34.7	Very low	33.2	Very low	199 Å²	199	149.4 Å²	149.4	87%	0.865	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-53.8	118.5	161.7	-70.6	175.1	-178.2	167.6	0	108.8	V870	V870-K872 PolarHBondContact O-N 3.47Å
873	R	29.6	Very low	33	Very low	241 Å²	241	148.1 Å²	148.1	91%	0.909	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-89.8	133.6	164.7	-82.6	-163.7	175.2	-149.6	1.4	109.8	K871	K871-R873 PolarHBondContact O-N 3.31Å
874	T	32.2	Very low	32.3	Very low	150 Å²	150	149.3 Å²	149.3	92%	0.92	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-66.2	159.6	172.1	45.3	0	0	0	0	111.6
875	K	29.6	Very low	31.8	Very low	212 Å²	212	147.9 Å²	147.9	92%	0.922	79%	0.793	S	S	*	*			trans	-135.6	121.5	-169.1	-174.1	178.9	-174.8	177	0	111.6
876	G	30	Very low	31.2	Very low	79 Å²	79	145.3 Å²	145.3	81%	0.814	79%	0.786	S	S	*	*			trans	149.7	91.5	161.3	0	0	0	0	0	117.4
877	A	27	Very low	30.8	Very low	103 Å²	103	144 Å²	144	85%	0.851	78%	0.782	S	S	*	*			trans	-167.9	156.4	146.6	0	0	0	0	0	110.8
878	K	28.8	Very low	30.2	Very low	193 Å²	193	142.7 Å²	142.7	84%	0.839	78%	0.778	S	S	*	*			trans	-81.4	165.8	160.2	-73.4	-174.7	174.3	-173.8	0	108.5
879	D	25	Very low	29.8	Very low	126 Å²	126	146 Å²	146	67%	0.674	79%	0.791	S	S	*	*			cis	-171.6	166.2	49	-156.7	17.6	0	0	0	114.3
880	N	25.9	Very low	29.5	Very low	122 Å²	122	146.1 Å²	146.1	65%	0.652	79%	0.791	S	S	*	*			trans	63	124.6	159.4	-69.9	-42.4	0	0	0	124.7
881	T	25.8	Very low	29.3	Very low	110 Å²	110	143.3 Å²	143.3	68%	0.675	79%	0.789	S	S	*	*			trans	71.7	117.4	132.4	55.4	0	0	0	0	124.1
882	L	27.5	Very low	29.2	Very low	144 Å²	144	141.6 Å²	141.6	75%	0.754	78%	0.784	S	S	*	*			trans	66.1	140.3	134.7	-53.6	176.4	0	0	0	118.4
883	D	28.7	Very low	28.9	Very low	124 Å²	124	139 Å²	139	66%	0.663	78%	0.779	S	S	*	*			cis	-156.2	171.8	-5.7	-96.4	-31.5	0	0	0	109.8
884	E	28	Very low	28.9	Very low	172 Å²	172	131.1 Å²	131.1	80%	0.804	77%	0.773	S	S	*	*			trans	34.1	137.5	154.5	-64.2	174.6	152.8	0	0	120.2
885	D	29.3	Very low	29	Very low	151 Å²	151	131 Å²	131	81%	0.807	77%	0.767	S	S	*	*			cis	-158.4	177.8	36.6	-86.9	-49.1	0	0	0	109.5
886	S	31	Very low	29.1	Very low	82 Å²	82	128.6 Å²	128.6	57%	0.573	76%	0.763	S	S	*	*			cis	-166.1	169.7	-34.4	-170.2	0	0	0	0	107.9
887	E	31.5	Very low	29	Very low	179 Å²	179	131.5 Å²	131.5	84%	0.836	76%	0.76	S	S	*	*			trans	63.9	139.1	173	-44.5	-49.9	136.2	0	0	118.4
888	G	28.1	Very low	29.5	Very low	60 Å²	60	134.2 Å²	134.2	62%	0.619	76%	0.761	S	S	*	*			cis	157.2	130.6	-10.6	0	0	0	0	0	113.9
889	S	27.8	Very low	29.7	Very low	132 Å²	132	132 Å²	132	92%	0.923	76%	0.758	S	S	*	*			trans	62.9	158.7	167.7	-63.6	0	0	0	0	118.2
890	D	29.6	Very low	30.2	Very low	159 Å²	159	135 Å²	135	85%	0.85	77%	0.768	S	S	*	*			cis	-168.2	162	-24.7	178.2	27.7	0	0	0	106.9
891	G	31.4	Very low	30.4	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	78%	0.777	S	S	*	*			trans	137.2	83.2	173.9	0	0	0	0	0	114.8
892	E	32.2	Very low	30.7	Very low	160 Å²	160	135.9 Å²	135.9	75%	0.748	78%	0.782	S	S	*	*			trans	-104.3	166.8	-170.1	-155	-161.3	-177.2	0	0	114.3
893	L	29	Very low	30.8	Very low	144 Å²	144	137.9 Å²	137.9	75%	0.754	79%	0.792	S	S	*	*			trans	84.3	126.9	157.8	-54.8	176.4	0	0	0	120.4
894	G	29.3	Very low	31	Very low	76 Å²	76	135 Å²	135	78%	0.784	79%	0.791	S	S	*	*			trans	178.4	59.4	173.5	0	0	0	0	0	113.5
895	N	32.6	Very low	31.3	Very low	147 Å²	147	132.7 Å²	132.7	79%	0.786	79%	0.794	S	S	*	*			trans	-66.6	163	-178.8	-75.9	-20.7	0	0	0	114.2
896	L	32.2	Very low	31.3	Very low	162 Å²	162	134.4 Å²	134.4	85%	0.848	80%	0.8	S	S	*	*			trans	119	135.1	167.1	-69.2	163.2	0	0	0	112.1
897	D	29.1	Very low	31.3	Very low	140 Å²	140	137 Å²	137	75%	0.749	81%	0.807	S	S	*	*			cis	-153.6	173.1	-21.2	-152.2	-10.4	0	0	0	108.8
898	D	37.4	Very low	31.4	Very low	161 Å²	161	135.6 Å²	135.6	86%	0.861	81%	0.805	S	S	*	*			trans	-83.2	109.1	179.2	-165.3	23.2	0	0	0	110.9
899	D	31.9	Very low	31.9	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	80%	0.804	S	S	*	*			trans	-140.4	142.6	-175.1	-132.1	-20.6	0	0	0	112.7	V901	D899-V901 PolarHBondContact O-N 3.37Å
900	E	36.3	Very low	32.2	Very low	187 Å²	187	141.3 Å²	141.3	87%	0.874	80%	0.802	S	S	*	*			trans	-71	112.4	-165.6	-65.1	-176.2	119.7	0	0	113.6	S902	E900-S902 PolarHBondContact O-N 3.12Å
901	V	28.9	Very low	32	Very low	141 Å²	141	143.5 Å²	143.5	86%	0.855	80%	0.804	S	S	*	*			trans	-68.7	92.6	166.6	-76	0	0	0	0	111.1	D899 L903	D899-V901 PolarHBondContact O-N 3.37Å; V901-L903 PolarHBondContact O-N 3.12Å
902	S	32.8	Very low	32	Very low	110 Å²	110	143.3 Å²	143.3	77%	0.769	80%	0.795	S	S	*	*			trans	-52.4	120.2	-178.9	-166.7	0	0	0	0	112.8	E900 G904	E900-S902 PolarHBondContact O-N 3.12Å; S902-G904 PolarHBondContact O-N 2.82Å
903	L	30.6	Very low	31.9	Very low	187 Å²	187	143.4 Å²	143.4	98%	0.979	80%	0.795	S	S	*	*			trans	-74.2	65.2	168.3	-69.2	173.5	0	0	0	110.2	V901	V901-L903 PolarHBondContact O-N 3.12Å
904	G	32.6	Very low	32	Very low	62 Å²	62	142.3 Å²	142.3	64%	0.639	79%	0.789	S	S	*	*			trans	-133	33.9	-166.7	0	0	0	0	0	114.5	S902	S902-G904 PolarHBondContact O-N 2.82Å
905	S	32.9	Very low	32.1	Very low	124 Å²	124	145 Å²	145	87%	0.867	79%	0.785	S	S	*	*			trans	-150.5	77.2	173.9	-174.1	0	0	0	0	111.7
906	M	30.7	Very low	32.3	Very low	188 Å²	188	140.6 Å²	140.6	93%	0.926	76%	0.76	S	S	*	*	S	Bend	trans	-133	132.7	163.6	-173.5	166.8	175.6	0	0	106.9
907	D	29.6	Very low	32.3	Very low	135 Å²	135	138.5 Å²	138.5	72%	0.722	75%	0.75	S	S	*	*			trans	-64.7	134.8	-158.7	-86.6	-63.2	0	0	0	115.3	E909	D907-E909 HydrophobicContact CB-CB 4.42Å; D907-E909 HydrophobicContact CB-CG 4.2Å; D907-E909 PolarHBondContact O-N 3.22Å; D907-E909 VanDerWaalsContact O-N 3.16Å
908	D	35.2	Very low	32.5	Very low	150 Å²	150	134.9 Å²	134.9	80%	0.802	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	15.3	173.5	-111.1	-22.5	0	0	0	112.1
909	E	37.4	Very low	32	Very low	126 Å²	126	130 Å²	130	59%	0.589	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-28.8	-173.3	-62.5	-131	113.2	0	0	113.7	K481 D907 F911	K481-E909 IonicContact NZ-OE1 3.97Å; D907-E909 HydrophobicContact CB-CB 4.42Å; D907-E909 HydrophobicContact CB-CG 4.2Å; D907-E909 PolarHBondContact O-N 3.22Å; D907-E909 VanDerWaalsContact O-N 3.16Å; E909-F911 PolarHBondContact O-N 3.45Å; E909-F911 VanDerWaalsContact O-N 3.14Å
910	E	33.5	Very low	31.8	Very low	187 Å²	187	127.7 Å²	127.7	87%	0.874	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-17.9	-175.3	-162.2	-178.7	-175.8	0	0	113.9
911	F	27.2	Very low	31.2	Very low	204 Å²	204	126.6 Å²	126.6	90%	0.895	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	13.7	-172.7	-125.4	-83.5	0	0	0	115.1	E909	E909-F911 PolarHBondContact O-N 3.45Å; E909-F911 VanDerWaalsContact O-N 3.14Å
912	A	30.5	Very low	31.3	Very low	71 Å²	71	127.1 Å²	127.1	59%	0.587	71%	0.712	S	S	*	*	S	Bend	trans	-135.5	-5.3	-173.1	0	0	0	0	0	116.3	I914	A912-I914 PolarHBondContact O-N 3.42Å
913	E	30.1	Very low	31.1	Very low	162 Å²	162	127.8 Å²	127.8	76%	0.757	71%	0.707	S	S	*	*			trans	-83.1	103.9	167.1	-62	-141	125.6	0	0	109.3
914	I	31.9	Very low	31	Very low	122 Å²	122	125.1 Å²	125.1	63%	0.626	70%	0.699	S	S	*	*			trans	-96.2	127.4	166.3	-64.8	176	0	0	0	106.4	Q447 A912 E916	Q447-I914 VanDerWaalsContact NE2-CD1 3.34Å; A912-I914 PolarHBondContact O-N 3.42Å; I914-E916 PolarHBondContact O-N 3.11Å
915	D	31.3	Very low	30.8	Very low	131 Å²	131	130.5 Å²	130.5	70%	0.701	71%	0.712	S	S	*	*			trans	-60.8	89.3	-178.8	-61.2	-69.8	0	0	0	112.1	D917	D915-D917 PolarHBondContact O-N 2.8Å
916	E	35.1	Very low	30.5	Very low	56 Å²	56	132.5 Å²	132.5	26%	0.262	71%	0.713	S	S	.	*			trans	-84.2	62.8	-178.8	-164.2	173.6	-139	0	0	110.8	N446 T488 I914 G918	N446-E916 PolarHBondContact ND2-OE1 2.85Å; T488-E916 VanDerWaalsContact CB-CD 3.44Å; T488-E916 VanDerWaalsContact CB-OE1 3.3Å; T488-E916 WeakPolarHBondContact CB-OE1 3.26Å; T488-E916 WeakPolarHBondContact CB-OE2 3.3Å; T488-E916 VanDerWaalsContact CG2-CD 3.49Å; T488-E916 HydrophobicContact CG2-CG 4.15Å; T488-E916 VanDerWaalsContact CG2-OE2 3.26Å; T488-E916 WeakPolarHBondContact CG2-OE2 3.47Å; T488-E916 PolarHBondContact OG1-OE1 3.26Å; T488-E916 PolarHBondContact OG1-OE2 3.19Å; I914-E916 PolarHBondContact O-N 3.11Å; E916-G918 VanDerWaalsContact C-N 3.3Å; E916-G918 PolarHBondContact O-N 2.98Å
917	D	33.2	Very low	30.3	Very low	117 Å²	117	130.5 Å²	130.5	63%	0.626	71%	0.706	S	S	*	*			trans	-78.8	73.9	-178.9	-160.5	1.1	0	0	0	112	D915 G919	D915-D917 PolarHBondContact O-N 2.8Å; D917-G919 PolarHBondContact O-N 3.21Å
918	G	32.5	Very low	30.4	Very low	64 Å²	64	133.5 Å²	133.5	66%	0.66	72%	0.716	S	S	*	*			trans	-75	61.9	176.8	0	0	0	0	0	113.1	E916	E916-G918 VanDerWaalsContact C-N 3.3Å; E916-G918 PolarHBondContact O-N 2.98Å
919	G	28.3	Very low	29.9	Very low	59 Å²	59	133.4 Å²	133.4	61%	0.608	72%	0.715	S	S	*	*			trans	-98.9	17.7	-167.5	0	0	0	0	0	117.5	D917 F921	D917-G919 PolarHBondContact O-N 3.21Å; G919-F921 PolarHBondContact O-N 3.37Å; G919-F921 VanDerWaalsContact O-N 3.16Å
920	T	27.4	Very low	29.5	Very low	98 Å²	98	136.9 Å²	136.9	60%	0.601	73%	0.731	S	S	*	*			trans	-53.8	121.1	-173.8	-49.1	0	0	0	0	112.6
921	F	24.3	Very low	29.1	Very low	165 Å²	165	132.2 Å²	132.2	72%	0.724	72%	0.719	S	S	*	*			trans	-74.8	125.9	168.6	-154.4	-113.4	0	0	0	107.5	G919 D923	G919-F921 PolarHBondContact O-N 3.37Å; G919-F921 VanDerWaalsContact O-N 3.16Å; F921-D923 VanDerWaalsContact CD1-OD2 3.25Å; F921-D923 WeakPolarHBondContact CD1-OD2 3.4Å; F921-D923 WeakPolarHBondContact CE1-OD1 3.28Å; F921-D923 WeakPolarHBondContact CE1-OD2 3.32Å
922	M	30.4	Very low	29.2	Very low	151 Å²	151	128.9 Å²	128.9	74%	0.744	72%	0.715	S	S	*	*			trans	-111.9	92.3	175.9	-171.2	155	76	0	0	106.9
923	D	28.4	Very low	29.2	Very low	124 Å²	124	131.4 Å²	131.4	66%	0.663	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-65.3	141.4	175	-86.7	-51.2	0	0	0	110.6	F921	F921-D923 VanDerWaalsContact CD1-OD2 3.25Å; F921-D923 WeakPolarHBondContact CD1-OD2 3.4Å; F921-D923 WeakPolarHBondContact CE1-OD1 3.28Å; F921-D923 WeakPolarHBondContact CE1-OD2 3.32Å
924	V	28.6	Very low	28.9	Very low	132 Å²	132	132.3 Å²	132.3	80%	0.8	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-96.1	129.8	162.6	176.8	0	0	0	0	105.2	D926	V924-D926 PolarHBondContact O-N 2.93Å
925	L	28.3	Very low	28.5	Very low	174 Å²	174	134.3 Å²	134.3	91%	0.911	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-57.2	130.4	178.9	-63.5	167.7	0	0	0	110.2
926	D	26.9	Very low	28.1	Very low	167 Å²	167	136.6 Å²	136.6	89%	0.893	75%	0.748	S	S	*	*			trans	-136.5	132.9	161.2	-152.9	3.5	0	0	0	105.4	V924	V924-D926 PolarHBondContact O-N 2.93Å
927	D	26.9	Very low	27.6	Very low	145 Å²	145	140.5 Å²	140.5	78%	0.775	78%	0.775	S	S	*	*			trans	-121	91.7	-154.6	-173.1	23.5	0	0	0	111.6
928	E	30.5	Very low	27.2	Very low	199 Å²	199	143.1 Å²	143.1	93%	0.93	78%	0.783	S	S	*	*			trans	-132.2	141.2	163	-77.3	-162.3	176.7	0	0	111
929	N	26.1	Very low	26.7	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	79%	0.785	S	S	*	*			trans	-124	115.7	-159	-165.6	5	0	0	0	109.9
930	E	27.4	Very low	26.4	Very low	199 Å²	199	152.2 Å²	152.2	93%	0.93	80%	0.8	S	S	*	*			trans	-139.4	131.9	170.7	-162.9	-179.9	-132.2	0	0	110.2
931	S	26.1	Very low	26.2	Very low	89 Å²	89	153.6 Å²	153.6	62%	0.622	81%	0.808	S	S	*	*			trans	-134.9	127.7	-153.5	65.1	0	0	0	0	115.2
932	V	29.4	Very low	26.1	Very low	134 Å²	134	152.7 Å²	152.7	81%	0.812	81%	0.811	S	S	*	*			trans	61.9	171.1	160.4	-104.6	0	0	0	0	116.4
933	P	30.2	Very low	25.7	Very low	124 Å²	124	150.8 Å²	150.8	81%	0.805	81%	0.808	S	S	*	*			cis	-114.3	158.8	16.1	40.8	-29.2	0	0	0	117.7
934	E	23.3	Very low	25.5	Very low	180 Å²	180	154.6 Å²	154.6	84%	0.841	82%	0.818	S	S	*	*			trans	-114.3	157.4	168.7	-173.3	163.8	-130.5	0	0	110.1
935	L	23.7	Very low	25.3	Very low	164 Å²	164	159.9 Å²	159.9	86%	0.859	82%	0.824	S	S	*	*			trans	-138.1	112.7	-176.5	-89.8	170.1	0	0	0	112.3
936	E	24	Very low	25.1	Very low	180 Å²	180	156.1 Å²	156.1	84%	0.841	81%	0.812	S	S	*	*			trans	-92.2	122.5	176.5	-83.5	-143.9	126.8	0	0	114.3
937	V	23.9	Very low	25	Very low	138 Å²	138	158 Å²	158	84%	0.836	81%	0.813	S	S	*	*			trans	-148	120	172.4	-176.8	0	0	0	0	111.1
938	H	24.4	Very low	25	Very low	172 Å²	172	162.6 Å²	162.6	80%	0.796	82%	0.819	S	S	*	*			cis	-163.4	151.5	-21.4	-149.1	74.9	0	0	0	108.9
939	S	22.1	Very low	24.8	Very low	101 Å²	101	163 Å²	163	71%	0.706	82%	0.818	S	S	*	*			trans	-98.8	152.8	-173.4	76.1	0	0	0	0	115.3
940	K	22.2	Very low	24.7	Very low	213 Å²	213	158.7 Å²	158.7	93%	0.926	81%	0.809	S	S	*	*			trans	-141.4	141.6	168.4	-84.6	-172	176.6	171.5	0	112.9
941	V	22.6	Very low	24.6	Very low	126 Å²	126	155.1 Å²	155.1	76%	0.764	80%	0.801	S	S	*	*			trans	-108.3	149.6	-169.9	172.5	0	0	0	0	111.4
942	N	22.1	Very low	24.7	Very low	147 Å²	147	158 Å²	158	79%	0.786	81%	0.809	S	S	*	*			trans	-161.8	114.5	143.9	-108.3	-20.7	0	0	0	118
943	T	22.6	Very low	24.5	Very low	110 Å²	110	157.4 Å²	157.4	68%	0.675	80%	0.801	S	S	*	*			trans	53.1	100.3	133.6	58	0	0	0	0	124
944	K	25.3	Very low	24.2	Very low	204 Å²	204	159.7 Å²	159.7	89%	0.887	80%	0.799	S	S	*	*				11.2	127.7	127.7	-61	173.5	178.6	172.2	0	120.5
945	R	23.5	Very low	24.3	Very low	243 Å²	243	157.5 Å²	157.5	92%	0.917	79%	0.793	S	S	*	*				155.4	164.1	127.3	-90	172.5	173.3	177.8	-0.6	111.6
946	S	23.7	Very low	24.3	Very low	95 Å²	95	158.5 Å²	158.5	66%	0.664	79%	0.79	S	S	*	*			cis	179.4	152.8	-41.4	61	0	0	0	0	110.7
947	K	25.2	Very low	24.5	Very low	208 Å²	208	154.1 Å²	154.1	90%	0.904	79%	0.785	S	S	*	*			trans	89.5	161.8	152.5	-135.8	164.2	-172	171.7	0	119.2
948	R	27.2	Very low	24.6	Very low	241 Å²	241	150.6 Å²	150.6	91%	0.909	78%	0.777	S	S	*	*			trans	-114.3	175.9	-162.1	-62.1	170.7	166.6	162	-7.2	113.2
949	K	26.1	Very low	24.6	Very low	207 Å²	207	147.6 Å²	147.6	90%	0.9	78%	0.775	S	S	*	*			trans	93.5	137.1	153.1	-162.4	-177.5	-177.4	-176.8	0	115.9
950	G	23	Very low	24.8	Very low	58 Å²	58	151.7 Å²	151.7	60%	0.598	78%	0.781	S	S	*	*			cis	159.9	156.6	-11.5	0	0	0	0	0	114.6
951	T	26.5	Very low	25	Very low	124 Å²	124	151 Å²	151	76%	0.761	78%	0.781	S	S	*	*			trans	57.7	129.8	159.3	50.6	0	0	0	0	121.8
952	N	26.9	Very low	25.2	Very low	148 Å²	148	148.2 Å²	148.2	79%	0.791	78%	0.777	S	S	*	*			trans	73.9	149.7	147.9	-68.4	37.1	0	0	0	118.6
953	D	25.8	Very low	25.9	Very low	122 Å²	122	146.9 Å²	146.9	65%	0.652	78%	0.777	S	S	*	*			cis	-171.8	169.9	-18	-168.4	6	0	0	0	108.3
954	F	24.3	Very low	26.1	Very low	173 Å²	173	153.2 Å²	153.2	76%	0.759	79%	0.788	S	S	*	*			trans	64.7	153.1	174.9	-68.2	-96.9	0	0	0	118.6
955	D	25.8	Very low	26.4	Very low	133 Å²	133	153.3 Å²	153.3	71%	0.711	79%	0.788	S	S	*	*			cis	-168.1	165.2	-31.2	-158.2	0.6	0	0	0	111.6
956	F	23.4	Very low	26.7	Very low	185 Å²	185	151.6 Å²	151.6	81%	0.811	79%	0.788	S	S	*	*			trans	60.9	137.2	145.1	-150.4	-110.7	0	0	0	123.8
957	A	27.4	Very low	27.1	Very low	89 Å²	89	156.9 Å²	156.9	74%	0.736	80%	0.799	S	S	*	*			trans	66.1	150.4	165.5	0	0	0	0	0	119.2
958	G	25.6	Very low	27.3	Very low	64 Å²	64	158.7 Å²	158.7	66%	0.66	80%	0.8	S	S	*	*			cis	171.8	107	-10.3	0	0	0	0	0	116.9
959	S	25.6	Very low	27.3	Very low	109 Å²	109	154.2 Å²	154.2	76%	0.762	79%	0.794	S	S	*	*			trans	70.5	152.8	152.7	83.2	0	0	0	0	121.4
960	F	25.7	Very low	27.5	Very low	187 Å²	187	153 Å²	153	82%	0.82	79%	0.789	S	S	*	*			trans	44.8	96.6	159.3	-64.4	-69.1	0	0	0	120.8
961	Q	27.6	Very low	27.8	Very low	199 Å²	199	156.8 Å²	156.8	93%	0.93	80%	0.796	S	S	*	*				-159.1	129.3	119.2	-116.3	164.4	84.3	0	0	114
962	G	25.7	Very low	28.2	Very low	66 Å²	66	158.2 Å²	158.2	68%	0.68	80%	0.798	S	S	*	*			trans	-122.9	-170	144.5	0	0	0	0	0	107.8
963	P	37.6	Very low	28.7	Very low	120 Å²	120	156.1 Å²	156.1	78%	0.779	80%	0.796	S	S	*	*			cis	-128	-178.7	-2.7	41.8	-28.6	0	0	0	112.5
964	R	27	Very low	28.9	Very low	242 Å²	242	155.3 Å²	155.3	91%	0.913	80%	0.799	S	S	*	*				-175.8	135.5	125.7	-101.9	155.2	-179.4	176.9	0.3	112.9
965	K	30.1	Very low	29.8	Very low	206 Å²	206	155.2 Å²	155.2	90%	0.896	81%	0.806	S	S	*	*			trans	-73.7	142.3	166.9	-62.3	-179.3	178.6	-177.3	0	109.7
966	K	30	Very low	30.5	Very low	207 Å²	207	158.7 Å²	158.7	90%	0.9	82%	0.815	S	S	*	*			trans	-126.1	131.3	150	-83.2	-170.8	174.5	-178.2	0	108.4
967	K	32.2	Very low	31.4	Very low	207 Å²	207	154.1 Å²	154.1	90%	0.9	80%	0.802	S	S	*	*			trans	-67	146.6	163.1	-67.6	-176.8	175.2	-173.8	0	108.4
968	R	29.9	Very low	32	Very low	245 Å²	245	153.2 Å²	153.2	93%	0.925	79%	0.791	S	S	*	*			trans	-142.2	150.6	154.5	-164.6	163.7	177.1	155.5	-1.8	107.9
969	N	26.8	Very low	32.9	Very low	147 Å²	147	154.4 Å²	154.4	79%	0.786	79%	0.794	S	S	*	*			trans	-77.9	158	-162.9	-58.8	-4.4	0	0	0	112.4
970	F	31.6	Very low	33.7	Very low	181 Å²	181	157.3 Å²	157.3	79%	0.794	80%	0.796	S	S	*	*			trans	-55.3	142.3	157.1	-106.2	-108.1	0	0	0	110.3
971	N	27.7	Very low	34.5	Very low	139 Å²	139	154.1 Å²	154.1	74%	0.743	78%	0.783	S	S	*	*			trans	-155.8	118.6	161.2	-111.3	29.7	0	0	0	105.5	S973	N971-S973 PolarHBondContact O-N 3.44Å
972	D	34.6	Very low	35.3	Very low	153 Å²	153	150.7 Å²	150.7	82%	0.818	77%	0.765	S	S	*	*	S	Bend	trans	-76.8	87.6	-175.8	-65.2	-60.5	0	0	0	111.6
973	S	38.5	Very low	36.6	Very low	105 Å²	105	149 Å²	149	73%	0.734	75%	0.748	S	S	*	*			trans	-154.6	34	178.4	69.4	0	0	0	0	114.3	N971	N971-S973 PolarHBondContact O-N 3.44Å
974	S	30.8	Very low	37.2	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	74%	0.739	S	S	*	*			trans	-150	58.2	177.4	66.7	0	0	0	0	113.2
975	L	42.7	Very low	38.1	Very low	171 Å²	171	142.7 Å²	142.7	90%	0.895	72%	0.721	S	S	*	*			trans	-92.6	2.2	173.6	-86.4	171.1	0	0	0	114.2
976	F	39.4	Very low	39	Very low	207 Å²	207	137 Å²	137	91%	0.908	70%	0.7	S	S	*	*			trans	-106.6	92.8	171.5	-72.7	-78.6	0	0	0	110.2
977	V	42.4	Very low	40.2	Very low	88 Å²	88	132.6 Å²	132.6	53%	0.533	69%	0.686	S	S	.	*			trans	-74.9	143.2	164.3	171.5	0	0	0	0	108.6	E981	V977-E981 HydrophobicContact CG1-CB 3.74Å; V977-E981 HydrophobicContact CG1-CG 3.77Å
978	S	40.9	Very low	41.1	Very low	71 Å²	71	129.5 Å²	129.5	50%	0.497	68%	0.675	S	S	.	*			trans	-60	140.3	179.5	-50.3	0	0	0	0	110.9	E980 E981 F982	S978-E980 PolarHBondContact O-N 2.94Å; S978-E980 VanDerWaalsContact O-N 3.15Å; S978-E981 WeakPolarHBondContact O-CB 3.08Å; S978-E981 PolarHBondContact O-N 3.42Å; S978-F982 PolarHBondContact O-N 3.34Å
979	A	43.2	Very low	41.9	Very low	89 Å²	89	120.2 Å²	120.2	74%	0.736	64%	0.644	S	S	*	*	H	α-helix	trans	-57.6	-33.4	-178.7	0	0	0	0	0	113.1	G983	A979-G983 PolarHBondContact O-N 3.23Å
980	E	43.6	Very low	43	Very low	170 Å²	170	120.9 Å²	120.9	79%	0.794	64%	0.644	S	S	*	*	H	α-helix	trans	-66.3	-35.8	174.2	-61	-179.2	128.1	0	0	112.8	S978 G983 H984	S978-E980 PolarHBondContact O-N 2.94Å; S978-E980 VanDerWaalsContact O-N 3.15Å; E980-G983 PolarHBondContact O-N 3.33Å; E980-H984 PolarHBondContact O-N 3.23Å
981	E	41.7	Very low	43.6	Very low	119 Å²	119	115.8 Å²	115.8	56%	0.556	64%	0.643	S	S	*	*	H	α-helix	trans	-76.6	-34.9	-179.9	-174.6	171.3	-158.1	0	0	111.2	V977 S978 L985	V977-E981 HydrophobicContact CG1-CB 3.74Å; V977-E981 HydrophobicContact CG1-CG 3.77Å; S978-E981 WeakPolarHBondContact O-CB 3.08Å; S978-E981 PolarHBondContact O-N 3.42Å; E981-L985 PolarHBondContact O-N 3.25Å
982	F	45	Very low	44.7	Very low	127 Å²	127	109.9 Å²	109.9	56%	0.557	61%	0.612	S	S	*	*	H	α-helix	trans	-66.7	-40.4	167.7	-175.5	-105.3	0	0	0	112.1	S978 L985 L986	S978-F982 PolarHBondContact O-N 3.34Å; F982-L985 WeakPolarHBondContact O-CB 3.48Å; F982-L985 PolarHBondContact O-N 3.12Å; F982-L985 VanDerWaalsContact O-N 3.17Å; F982-L986 HydrophobicContact CD1-CD1 4.12Å; F982-L986 HydrophobicContact CE1-CD1 3.67Å; F982-L986 HydrophobicContact CE1-CG 4.25Å; F982-L986 HydrophobicContact CZ-CD1 4.24Å; F982-L986 HydrophobicContact CZ-CD2 4.48Å; F982-L986 HydrophobicContact CZ-CG 4.45Å; F982-L986 PolarHBondContact O-N 2.83Å; F982-L986 VanDerWaalsContact O-N 3.13Å
983	G	53.3	Low	45.5	Very low	31 Å²	31	112.3 Å²	112.3	32%	0.32	62%	0.616	S	S	.	*	H	α-helix	trans	-58.9	-46.1	173.6	0	0	0	0	0	112.6	A979 E980 L985 L986 D987	A979-G983 PolarHBondContact O-N 3.23Å; E980-G983 PolarHBondContact O-N 3.33Å; G983-L985 PolarHBondContact O-N 2.77Å; G983-L986 PolarHBondContact O-N 3.03Å; G983-L986 VanDerWaalsContact O-N 3.11Å; G983-D987 PolarHBondContact O-N 2.75Å
984	H	50.1	Low	46.3	Very low	126 Å²	126	111 Å²	111	58%	0.583	60%	0.596	S	S	*	*	H	α-helix	trans	-58.5	-36.1	174.6	-122.1	-74.8	0	0	0	112.9	E980 E988	E980-H984 PolarHBondContact O-N 3.23Å; H984-E988 PolarHBondContact O-N 3Å
985	L	46.6	Very low	47.4	Very low	104 Å²	104	111.1 Å²	111.1	55%	0.545	59%	0.589	S	S	.	*	H	α-helix	trans	-70.8	-29.2	178.2	-132.7	165.1	0	0	0	112.6	E981 F982 G983 N989	E981-L985 PolarHBondContact O-N 3.25Å; F982-L985 WeakPolarHBondContact O-CB 3.48Å; F982-L985 PolarHBondContact O-N 3.12Å; F982-L985 VanDerWaalsContact O-N 3.17Å; G983-L985 PolarHBondContact O-N 2.77Å; L985-N989 PolarHBondContact O-ND2 3.04Å
986	L	48.9	Very low	47.9	Very low	85 Å²	85	106.3 Å²	106.3	45%	0.445	56%	0.564	S	S	.	*	H	α-helix	trans	-77	-42.9	172.7	-67.4	177.9	0	0	0	112.1	F982 G983 N989 M990	F982-L986 HydrophobicContact CD1-CD1 4.12Å; F982-L986 HydrophobicContact CE1-CD1 3.67Å; F982-L986 HydrophobicContact CE1-CG 4.25Å; F982-L986 HydrophobicContact CZ-CD1 4.24Å; F982-L986 HydrophobicContact CZ-CD2 4.48Å; F982-L986 HydrophobicContact CZ-CG 4.45Å; F982-L986 PolarHBondContact O-N 2.83Å; F982-L986 VanDerWaalsContact O-N 3.13Å; G983-L986 PolarHBondContact O-N 3.03Å; G983-L986 VanDerWaalsContact O-N 3.11Å; L986-N989 WeakPolarHBondContact O-CB 3.1Å; L986-N989 PolarHBondContact O-N 3.17Å; L986-N989 VanDerWaalsContact O-N 3.09Å; L986-M990 PolarHBondContact O-N 2.88Å
987	D	53.6	Low	48.5	Very low	115 Å²	115	103.5 Å²	103.5	62%	0.615	56%	0.557	S	S	*	*	H	α-helix	trans	-65.4	-37.4	177.7	-93.8	-4.6	0	0	0	112.5	G983 N989 M990	G983-D987 PolarHBondContact O-N 2.75Å; D987-N989 PolarHBondContact O-N 2.7Å; D987-M990 PolarHBondContact O-N 3.33Å
988	E	51.6	Low	49.1	Very low	143 Å²	143	101 Å²	101	67%	0.668	55%	0.549	S	S	*	.	H	α-helix	trans	-64.9	-25.8	172.3	-78.5	-163.4	-165.8	0	0	113.2	H984	H984-E988 PolarHBondContact O-N 3Å
989	N	47.6	Very low	49.5	Very low	50 Å²	50	106.3 Å²	106.3	27%	0.267	57%	0.568	S	S	.	*	H	α-helix	trans	-81.7	-40.6	176.3	-83	-24.7	0	0	0	112.7	L985 L986 D987 G991 S992	L985-N989 PolarHBondContact O-ND2 3.04Å; L986-N989 WeakPolarHBondContact O-CB 3.1Å; L986-N989 PolarHBondContact O-N 3.17Å; L986-N989 VanDerWaalsContact O-N 3.09Å; D987-N989 PolarHBondContact O-N 2.7Å; N989-G991 PolarHBondContact O-N 3.45Å; N989-G991 VanDerWaalsContact O-N 3.1Å; N989-S992 VanDerWaalsContact O-CB 3.28Å; N989-S992 WeakPolarHBondContact O-CB 3.27Å; N989-S992 PolarHBondContact O-N 3.01Å
990	M	49.3	Very low	49.9	Very low	161 Å²	161	108.1 Å²	108.1	79%	0.793	57%	0.566	S	S	*	*	H	α-helix	trans	-61.3	-22.4	-179.7	-72.6	-148.8	-64.1	0	0	114	L986 D987	L986-M990 PolarHBondContact O-N 2.88Å; D987-M990 PolarHBondContact O-N 3.33Å
991	G	45.1	Very low	50.4	Low	74 Å²	74	101.9 Å²	101.9	76%	0.763	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.8	172.6	0	0	0	0	0	115.7	N989	N989-G991 PolarHBondContact O-N 3.45Å; N989-G991 VanDerWaalsContact O-N 3.1Å
992	S	49.7	Very low	50.9	Low	14 Å²	14	104.2 Å²	104.2	10%	0.098	56%	0.556	C	S	.	*			trans	-110.9	123.3	-165.5	-174.3	0	0	0	0	112.9	N989 F994 R1014	N989-S992 VanDerWaalsContact O-CB 3.28Å; N989-S992 WeakPolarHBondContact O-CB 3.27Å; N989-S992 PolarHBondContact O-N 3.01Å; S992-F994 PolarHBondContact O-N 3.49Å; S992-R1014 VanDerWaalsContact CB-NH2 3.28Å; S992-R1014 PolarHBondContact OG-NH2 3.16Å
993	K	52.4	Low	51.4	Low	205 Å²	205	102.2 Å²	102.2	89%	0.891	56%	0.563	S	S	*	*	S	Bend	trans	-73	27.7	174.3	-61.8	-170.6	175.6	-170.9	0	114.9
994	F	54.5	Low	51.9	Low	76 Å²	76	102.5 Å²	102.5	33%	0.333	56%	0.557	S	S	.	*			trans	-130.5	92	-179.8	-86.7	-86.3	0	0	0	108.4	S992 N996 L1010 L1013 R1014 A1017	S992-F994 PolarHBondContact O-N 3.49Å; F994-N996 PolarHBondContact O-N 3.42Å; F994-N996 VanDerWaalsContact O-N 3.08Å; F994-L1010 HydrophobicContact CB-CD2 4.21Å; F994-L1013 HydrophobicContact CE1-CB 4.42Å; F994-R1014 HydrophobicContact CD2-CG 4.19Å; F994-R1014 HydrophobicContact CE2-CG 4.28Å; F994-A1017 HydrophobicContact CE2-CB 4.3Å; F994-A1017 HydrophobicContact CZ-CB 3.73Å
995	D	53.3	Low	52.6	Low	107 Å²	107	105.3 Å²	105.3	57%	0.572	57%	0.568	S	S	*	*			trans	-73.7	93.3	176.2	-68.1	-53.4	0	0	0	110.6	I997	D995-I997 PolarHBondContact O-N 3.34Å
996	N	54.2	Low	53.6	Low	71 Å²	71	107.5 Å²	107.5	38%	0.38	58%	0.58	S	S	.	*	S	Bend	trans	-73.3	4.4	170	-68.8	-7.9	0	0	0	113.2	F994 A1001 L1010	F994-N996 PolarHBondContact O-N 3.42Å; F994-N996 VanDerWaalsContact O-N 3.08Å; N996-A1001 WeakPolarHBondContact O-CB 3.34Å; N996-L1010 WeakPolarHBondContact ND2-CD2 3.43Å
997	I	52.1	Low	54.3	Low	148 Å²	148	110.6 Å²	110.6	76%	0.759	60%	0.597	S	S	*	*	S	Bend	trans	-120.8	-22.8	-175.4	-59.4	172.5	0	0	0	111.4	D995	D995-I997 PolarHBondContact O-N 3.34Å
998	G	55.3	Low	55.2	Low	35 Å²	35	105.8 Å²	105.8	36%	0.361	57%	0.573	S	S	.	*	S	Bend	trans	-86.3	-179.7	175.1	0	0	0	0	0	113.1	N1000 A1001	G998-N1000 PolarHBondContact O-N 2.85Å; G998-A1001 VanDerWaalsContact O-CB 3.26Å; G998-A1001 WeakPolarHBondContact O-CB 3.43Å; G998-A1001 PolarHBondContact O-N 2.87Å
999	M	48.1	Very low	56.2	Low	183 Å²	183	102.3 Å²	102.3	90%	0.901	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-53.9	-24.1	-176.1	-61.8	169.5	74.4	0	0	114.7	A1001	M999-A1001 VanDerWaalsContact C-N 3.26Å; M999-A1001 PolarHBondContact O-N 2.96Å
1000	N	51.2	Low	57.1	Low	126 Å²	126	102.5 Å²	102.5	67%	0.674	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-69.9	-16.6	175.9	-70.9	-34.4	0	0	0	114	G998 M1002 A1003	G998-N1000 PolarHBondContact O-N 2.85Å; N1000-M1002 PolarHBondContact O-N 2.85Å; N1000-A1003 VanDerWaalsContact O-CB 3.31Å; N1000-A1003 WeakPolarHBondContact O-CB 3.38Å; N1000-A1003 PolarHBondContact O-N 3.32Å
1001	A	55.4	Low	58.1	Low	39 Å²	39	103.5 Å²	103.5	32%	0.322	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-58.5	-34.5	175.5	0	0	0	0	0	112.2	N996 G998 M999 A1003 N1004	N996-A1001 WeakPolarHBondContact O-CB 3.34Å; G998-A1001 VanDerWaalsContact O-CB 3.26Å; G998-A1001 WeakPolarHBondContact O-CB 3.43Å; G998-A1001 PolarHBondContact O-N 2.87Å; M999-A1001 VanDerWaalsContact C-N 3.26Å; M999-A1001 PolarHBondContact O-N 2.96Å; A1001-A1003 PolarHBondContact O-N 2.83Å; A1001-N1004 PolarHBondContact O-N 3.33Å; A1001-N1004 VanDerWaalsContact O-N 3.08Å
1002	M	50.8	Low	59.6	Low	168 Å²	168	104 Å²	104	83%	0.828	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-57.1	-18.6	174.9	-69.2	-73.4	-165.8	0	0	114.1	N1000	N1000-M1002 PolarHBondContact O-N 2.85Å
1003	A	56.1	Low	61	Low	85 Å²	85	104.7 Å²	104.7	70%	0.702	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-78.4	-21.6	178.4	0	0	0	0	0	113.5	N1000 A1001 K1005	N1000-A1003 VanDerWaalsContact O-CB 3.31Å; N1000-A1003 WeakPolarHBondContact O-CB 3.38Å; N1000-A1003 PolarHBondContact O-N 3.32Å; A1001-A1003 PolarHBondContact O-N 2.83Å; A1003-K1005 VanDerWaalsContact C-N 3.33Å; A1003-K1005 PolarHBondContact O-N 3.11Å; A1003-K1005 VanDerWaalsContact O-N 3.1Å
1004	N	64.2	Low	62.1	Low	38 Å²	38	100 Å²	100	20%	0.203	53%	0.527	C	S	.	.			trans	-88.2	61.8	-176.7	-171.9	17.6	0	0	0	112.3	A1001 D1006 N1007 A1008	A1001-N1004 PolarHBondContact O-N 3.33Å; A1001-N1004 VanDerWaalsContact O-N 3.08Å; N1004-D1006 PolarHBondContact O-N 3.26Å; N1004-D1006 VanDerWaalsContact O-N 3.08Å; N1004-N1007 PolarHBondContact O-N 2.91Å; N1004-N1007 PolarHBondContact OD1-N 3.42Å; N1004-A1008 PolarHBondContact ND2-N 2.67Å; N1004-A1008 PolarHBondContact ND2-O 3.27Å; N1004-A1008 WeakPolarHBondContact OD1-CB 2.94Å; N1004-A1008 PolarHBondContact OD1-N 2.6Å
1005	K	63.9	Low	63.3	Low	185 Å²	185	103.8 Å²	103.8	80%	0.804	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.8	-178.9	-68.5	-167.1	173.9	-169.7	0	114.3	A1003	A1003-K1005 VanDerWaalsContact C-N 3.33Å; A1003-K1005 PolarHBondContact O-N 3.11Å; A1003-K1005 VanDerWaalsContact O-N 3.1Å
1006	D	68.2	Low	64.6	Low	150 Å²	150	101.9 Å²	101.9	80%	0.802	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	2	-173.6	-61.7	2.1	0	0	0	112.7	N1004 A1008	N1004-D1006 PolarHBondContact O-N 3.26Å; N1004-D1006 VanDerWaalsContact O-N 3.08Å; D1006-A1008 PolarHBondContact O-N 3.27Å
1007	N	64.8	Low	65.7	Low	149 Å²	149	100.3 Å²	100.3	80%	0.797	52%	0.524	S	S	*	.			trans	50.8	36.8	-173.2	-77.9	-44.6	0	0	0	113.3	N1004	N1004-N1007 PolarHBondContact O-N 2.91Å; N1004-N1007 PolarHBondContact OD1-N 3.42Å
1008	A	72.8	Confident	66.9	Low	14 Å²	14	100.1 Å²	100.1	12%	0.116	52%	0.52	C	S	.	.			trans	-63.3	139.5	-179.6	0	0	0	0	0	111.5	N1004 D1006 Q1012 L1013	N1004-A1008 PolarHBondContact ND2-N 2.67Å; N1004-A1008 PolarHBondContact ND2-O 3.27Å; N1004-A1008 WeakPolarHBondContact OD1-CB 2.94Å; N1004-A1008 PolarHBondContact OD1-N 2.6Å; D1006-A1008 PolarHBondContact O-N 3.27Å; A1008-Q1012 HydrophobicContact CB-CG 4.28Å; A1008-L1013 HydrophobicContact CB-CD2 4.02Å; A1008-L1013 HydrophobicContact CB-CG 4.24Å
1009	S	71	Confident	68	Low	71 Å²	71	102 Å²	102	50%	0.497	52%	0.516	S	S	.	.			trans	-67.7	152.9	-176.8	72.8	0	0	0	0	112.9	K1011 Q1012 L1013	S1009-K1011 PolarHBondContact O-N 3.22Å; S1009-Q1012 WeakPolarHBondContact O-CA 3.09Å; S1009-Q1012 WeakPolarHBondContact O-CB 3.42Å; S1009-Q1012 PolarHBondContact O-N 3.17Å; S1009-Q1012 PolarHBondContact OG-N 3.22Å; S1009-L1013 PolarHBondContact O-N 3.07Å
1010	L	67.8	Low	69.6	Low	53 Å²	53	96.4 Å²	96.4	28%	0.277	49%	0.489	S	S	.	.	H	α-helix	trans	-51.1	-34.6	177.4	-85.9	169.2	0	0	0	114.2	F994 N996 R1014	F994-L1010 HydrophobicContact CB-CD2 4.21Å; N996-L1010 WeakPolarHBondContact ND2-CD2 3.43Å; L1010-R1014 WeakPolarHBondContact O-CB 3.29Å; L1010-R1014 VanDerWaalsContact O-CG 3.26Å; L1010-R1014 WeakPolarHBondContact O-CG 3.31Å; L1010-R1014 PolarHBondContact O-N 3.23Å; L1010-R1014 VanDerWaalsContact O-N 3.11Å
1011	K	70.1	Confident	71	Confident	183 Å²	183	93.6 Å²	93.6	80%	0.796	48%	0.475	S	S	*	.	H	α-helix	trans	-72.4	-30.4	177	-70.3	177.2	-179.8	170.2	0	112.4	S1009 W1015	S1009-K1011 PolarHBondContact O-N 3.22Å; K1011-W1015 WeakPolarHBondContact O-CB 3.41Å; K1011-W1015 PolarHBondContact O-N 3.19Å
1012	Q	76.5	Confident	72.1	Confident	85 Å²	85	99.4 Å²	99.4	40%	0.397	49%	0.488	S	S	.	.	H	α-helix	trans	-75.7	-48.3	174.8	178.7	175.3	-14.8	0	0	111.2	A1008 S1009 R1014 W1015 E1016	A1008-Q1012 HydrophobicContact CB-CG 4.28Å; S1009-Q1012 WeakPolarHBondContact O-CA 3.09Å; S1009-Q1012 WeakPolarHBondContact O-CB 3.42Å; S1009-Q1012 PolarHBondContact O-N 3.17Å; S1009-Q1012 PolarHBondContact OG-N 3.22Å; Q1012-R1014 VanDerWaalsContact C-N 3.34Å; Q1012-R1014 PolarHBondContact O-N 3.04Å; Q1012-W1015 HydrophobicContact CG-CE3 4.39Å; Q1012-W1015 CarbonylContact O-C 3.44Å; Q1012-W1015 WeakPolarHBondContact O-CA 3.28Å; Q1012-W1015 WeakPolarHBondContact O-CB 3.4Å; Q1012-W1015 PolarHBondContact O-N 2.61Å; Q1012-E1016 WeakPolarHBondContact CG-OE1 3.38Å; Q1012-E1016 PolarHBondContact NE2-OE1 3.25Å; Q1012-E1016 PolarHBondContact O-N 2.72Å
1013	L	79.4	Confident	73.4	Confident	27 Å²	27	96.2 Å²	96.2	14%	0.141	47%	0.474	C	S	.	.	H	α-helix	trans	-58.3	-43.6	177	-67.3	175.5	0	0	0	112.2	F994 A1008 S1009 W1015 E1016 A1017	F994-L1013 HydrophobicContact CE1-CB 4.42Å; A1008-L1013 HydrophobicContact CB-CD2 4.02Å; A1008-L1013 HydrophobicContact CB-CG 4.24Å; S1009-L1013 PolarHBondContact O-N 3.07Å; L1013-W1015 PolarHBondContact O-N 2.91Å; L1013-E1016 PolarHBondContact O-N 3.33Å; L1013-A1017 PolarHBondContact O-N 3.18Å
1014	R	75	Confident	74.4	Confident	106 Å²	106	97.6 Å²	97.6	40%	0.4	47%	0.466	S	S	.	.	H	α-helix	trans	-61.8	-41.5	174	-73.2	178	-175.2	175.8	5.3	112	S992 F994 L1010 Q1012 E1018	S992-R1014 VanDerWaalsContact CB-NH2 3.28Å; S992-R1014 PolarHBondContact OG-NH2 3.16Å; F994-R1014 HydrophobicContact CD2-CG 4.19Å; F994-R1014 HydrophobicContact CE2-CG 4.28Å; L1010-R1014 WeakPolarHBondContact O-CB 3.29Å; L1010-R1014 VanDerWaalsContact O-CG 3.26Å; L1010-R1014 WeakPolarHBondContact O-CG 3.31Å; L1010-R1014 PolarHBondContact O-N 3.23Å; L1010-R1014 VanDerWaalsContact O-N 3.11Å; Q1012-R1014 VanDerWaalsContact C-N 3.34Å; Q1012-R1014 PolarHBondContact O-N 3.04Å; R1014-E1018 WeakPolarHBondContact O-CG 2.8Å; R1014-E1018 PolarHBondContact O-N 3.46Å
1015	W	78.5	Confident	75	Confident	157 Å²	157	99.5 Å²	99.5	60%	0.595	48%	0.476	S	S	*	.	H	α-helix	trans	-64.8	-40.2	174.5	170.7	65.4	0	0	0	112.4	K1011 Q1012 L1013 E1018 R1019	K1011-W1015 WeakPolarHBondContact O-CB 3.41Å; K1011-W1015 PolarHBondContact O-N 3.19Å; Q1012-W1015 HydrophobicContact CG-CE3 4.39Å; Q1012-W1015 CarbonylContact O-C 3.44Å; Q1012-W1015 WeakPolarHBondContact O-CA 3.28Å; Q1012-W1015 WeakPolarHBondContact O-CB 3.4Å; Q1012-W1015 PolarHBondContact O-N 2.61Å; L1013-W1015 PolarHBondContact O-N 2.91Å; W1015-E1018 PolarHBondContact O-N 3.47Å; W1015-R1019 WeakPolarHBondContact O-CB 3.47Å; W1015-R1019 PolarHBondContact O-N 2.9Å
1016	E	80.8	Confident	75.4	Confident	66 Å²	66	97.7 Å²	97.7	31%	0.308	46%	0.464	S	S	.	.	H	α-helix	trans	-64.1	-42.7	178.2	-79.8	157.2	-170.8	0	0	111.3	Q1012 L1013 R1019 D1020	Q1012-E1016 WeakPolarHBondContact CG-OE1 3.38Å; Q1012-E1016 PolarHBondContact NE2-OE1 3.25Å; Q1012-E1016 PolarHBondContact O-N 2.72Å; L1013-E1016 PolarHBondContact O-N 3.33Å; E1016-R1019 WeakPolarHBondContact O-CB 3.23Å; E1016-R1019 PolarHBondContact O-N 2.75Å; E1016-D1020 WeakPolarHBondContact O-CB 3.48Å; E1016-D1020 PolarHBondContact O-N 2.83Å
1017	A	77.8	Confident	75.9	Confident	38 Å²	38	92.4 Å²	92.4	31%	0.314	44%	0.436	S	S	.	.	H	α-helix	trans	-67	-43.7	173.6	0	0	0	0	0	113.4	F994 L1013 R1019 D1020 D1021	F994-A1017 HydrophobicContact CE2-CB 4.3Å; F994-A1017 HydrophobicContact CZ-CB 3.73Å; L1013-A1017 PolarHBondContact O-N 3.18Å; A1017-R1019 VanDerWaalsContact C-N 3.26Å; A1017-R1019 PolarHBondContact O-N 3.11Å; A1017-D1020 PolarHBondContact O-N 3.2Å; A1017-D1021 WeakPolarHBondContact O-CB 3.44Å; A1017-D1021 PolarHBondContact O-N 3.16Å
1018	E	77.4	Confident	76.2	Confident	145 Å²	145	90.2 Å²	90.2	68%	0.678	43%	0.427	S	S	*	.	H	α-helix	trans	-62.5	-34.7	174.7	-76.2	-174.8	178	0	0	112.4	R1014 W1015 W1022	R1014-E1018 WeakPolarHBondContact O-CG 2.8Å; R1014-E1018 PolarHBondContact O-N 3.46Å; W1015-E1018 PolarHBondContact O-N 3.47Å; E1018-W1022 VanDerWaalsContact O-CB 3.3Å; E1018-W1022 WeakPolarHBondContact O-CB 3.23Å; E1018-W1022 PolarHBondContact O-N 2.76Å
1019	R	78.9	Confident	76.2	Confident	74 Å²	74	96.9 Å²	96.9	28%	0.279	45%	0.454	S	S	.	.	H	α-helix	trans	-69.5	-42	175.9	-178.9	-169.8	-56.5	164.4	-35.1	111.4	W1015 E1016 A1017 W1022 L1023	W1015-R1019 WeakPolarHBondContact O-CB 3.47Å; W1015-R1019 PolarHBondContact O-N 2.9Å; E1016-R1019 WeakPolarHBondContact O-CB 3.23Å; E1016-R1019 PolarHBondContact O-N 2.75Å; A1017-R1019 VanDerWaalsContact C-N 3.26Å; A1017-R1019 PolarHBondContact O-N 3.11Å; R1019-W1022 PolarHBondContact O-N 2.75Å; R1019-L1023 HydrophobicContact CG-CD1 4.46Å; R1019-L1023 VanDerWaalsContact O-CG 3.3Å; R1019-L1023 WeakPolarHBondContact O-CG 3.2Å; R1019-L1023 PolarHBondContact O-N 3.33Å
1020	D	80.8	Confident	76.4	Confident	65 Å²	65	94.3 Å²	94.3	35%	0.348	44%	0.436	S	S	.	.	H	α-helix	trans	-68	-46.2	176.6	-166.7	66.8	0	0	0	111.9	E1016 A1017 W1022 L1023 H1024	E1016-D1020 WeakPolarHBondContact O-CB 3.48Å; E1016-D1020 PolarHBondContact O-N 2.83Å; A1017-D1020 PolarHBondContact O-N 3.2Å; D1020-W1022 PolarHBondContact O-N 2.95Å; D1020-L1023 PolarHBondContact O-N 3.15Å; D1020-H1024 WeakPolarHBondContact O-CB 3.47Å; D1020-H1024 PolarHBondContact O-N 3.46Å; D1020-H1024 IonicContact OD1-CD2 3.82Å; D1020-H1024 PolarHBondContact OD1-CD2 3.33Å; D1020-H1024 VanDerWaalsContact OD1-CD2 3.28Å; D1020-H1024 IonicContact OD1-NE2 3.59Å; D1020-H1024 IonicContact OD2-CD2 3.81Å; D1020-H1024 PolarHBondContact OD2-CD2 3.28Å
1021	D	81.1	Confident	76.5	Confident	68 Å²	68	95 Å²	95	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-61.9	-30.6	173.8	-99.2	-6	0	0	0	112.2	A1017 N1025 R1026 D1027	A1017-D1021 WeakPolarHBondContact O-CB 3.44Å; A1017-D1021 PolarHBondContact O-N 3.16Å; D1021-N1025 CarbonylContact O-C 3.3Å; D1021-N1025 PolarHBondContact O-N 3.4Å; D1021-R1026 HydrophobicContact CB-CB 4.11Å; D1021-R1026 WeakPolarHBondContact O-CA 3.42Å; D1021-R1026 PolarHBondContact O-N 2.97Å; D1021-R1026 WeakPolarHBondContact OD1-CB 3.15Å; D1021-R1026 WeakPolarHBondContact OD1-CD 3.46Å; D1021-D1027 PolarHBondContact O-N 2.66Å
1022	W	78.5	Confident	76.5	Confident	161 Å²	161	90.2 Å²	90.2	61%	0.61	42%	0.422	S	S	*	.	H	α-helix	trans	-70.2	-50.9	171.9	-178.6	81.8	0	0	0	111.8	E1018 R1019 D1020 H1024 N1025	E1018-W1022 VanDerWaalsContact O-CB 3.3Å; E1018-W1022 WeakPolarHBondContact O-CB 3.23Å; E1018-W1022 PolarHBondContact O-N 2.76Å; R1019-W1022 PolarHBondContact O-N 2.75Å; D1020-W1022 PolarHBondContact O-N 2.95Å; W1022-H1024 PolarHBondContact O-N 3.2Å; W1022-N1025 PolarHBondContact O-N 3.47Å; W1022-N1025 VanDerWaalsContact O-N 3.07Å
1023	L	77.4	Confident	76.3	Confident	101 Å²	101	93.2 Å²	93.2	53%	0.529	43%	0.433	S	S	.	.	H	α-helix	trans	-57.1	-50.9	177.6	-73.6	168.4	0	0	0	111.5	R1019 D1020 N1025	R1019-L1023 HydrophobicContact CG-CD1 4.46Å; R1019-L1023 VanDerWaalsContact O-CG 3.3Å; R1019-L1023 WeakPolarHBondContact O-CG 3.2Å; R1019-L1023 PolarHBondContact O-N 3.33Å; D1020-L1023 PolarHBondContact O-N 3.15Å; L1023-N1025 PolarHBondContact O-N 3.38Å; L1023-N1025 PolarHBondContact O-ND2 3.03Å
1024	H	78	Confident	75.9	Confident	113 Å²	113	97.4 Å²	97.4	52%	0.523	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	6.8	178.3	-69.2	-59.7	0	0	0	114.1	D1020 W1022 R1026	D1020-H1024 WeakPolarHBondContact O-CB 3.47Å; D1020-H1024 PolarHBondContact O-N 3.46Å; D1020-H1024 IonicContact OD1-CD2 3.82Å; D1020-H1024 PolarHBondContact OD1-CD2 3.33Å; D1020-H1024 VanDerWaalsContact OD1-CD2 3.28Å; D1020-H1024 IonicContact OD1-NE2 3.59Å; D1020-H1024 IonicContact OD2-CD2 3.81Å; D1020-H1024 PolarHBondContact OD2-CD2 3.28Å; W1022-H1024 PolarHBondContact O-N 3.2Å; H1024-R1026 HydrophobicContact CB-CG 4.26Å; H1024-R1026 PolarHBondContact O-N 3.1Å
1025	N	75.8	Confident	75.6	Confident	79 Å²	79	99.2 Å²	99.2	42%	0.422	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	33.6	175.2	-73.4	-117	0	0	0	113.6	D1021 W1022 L1023 K1034	D1021-N1025 CarbonylContact O-C 3.3Å; D1021-N1025 PolarHBondContact O-N 3.4Å; W1022-N1025 PolarHBondContact O-N 3.47Å; W1022-N1025 VanDerWaalsContact O-N 3.07Å; L1023-N1025 PolarHBondContact O-N 3.38Å; L1023-N1025 PolarHBondContact O-ND2 3.03Å; N1025-K1034 VanDerWaalsContact CB-NZ 3.32Å; N1025-K1034 PolarHBondContact O-NZ 3.25Å
1026	R	73.1	Confident	75.1	Confident	147 Å²	147	98.9 Å²	98.9	56%	0.555	46%	0.464	S	S	*	.			trans	-91.7	-21.6	174.8	-68.1	175.1	178	167.2	0.3	112.6	D1021 H1024 V1028 I1031	D1021-R1026 HydrophobicContact CB-CB 4.11Å; D1021-R1026 WeakPolarHBondContact O-CA 3.42Å; D1021-R1026 PolarHBondContact O-N 2.97Å; D1021-R1026 WeakPolarHBondContact OD1-CB 3.15Å; D1021-R1026 WeakPolarHBondContact OD1-CD 3.46Å; H1024-R1026 HydrophobicContact CB-CG 4.26Å; H1024-R1026 PolarHBondContact O-N 3.1Å; R1026-V1028 PolarHBondContact O-N 3.24Å; R1026-I1031 WeakPolarHBondContact O-CD1 3.33Å; R1026-I1031 WeakPolarHBondContact O-CG1 3.35Å
1027	D	78.1	Confident	74.2	Confident	39 Å²	39	102.4 Å²	102.4	21%	0.209	48%	0.48	C	S	.	.	S	Bend	trans	-42.5	132.8	171	164.1	18.7	0	0	0	111.7	D1021 K1029 S1030 I1031	D1021-D1027 PolarHBondContact O-N 2.66Å; D1027-K1029 PolarHBondContact O-N 2.97Å; D1027-K1029 VanDerWaalsContact O-N 3.12Å; D1027-K1029 PolarHBondContact OD1-N 3.1Å; D1027-K1029 WeakPolarHBondContact OD2-CB 3.29Å; D1027-S1030 CarbonylContact O-C 3.59Å; D1027-S1030 WeakPolarHBondContact O-CA 3.32Å; D1027-S1030 VanDerWaalsContact O-CB 3.27Å; D1027-S1030 WeakPolarHBondContact O-CB 3.33Å; D1027-S1030 PolarHBondContact O-N 3.11Å; D1027-I1031 PolarHBondContact O-N 2.83Å
1028	V	71.1	Confident	73.2	Confident	102 Å²	102	107.8 Å²	107.8	62%	0.618	50%	0.496	S	S	*	.	H	α-helix	trans	-46.6	-40.1	175.6	179.1	0	0	0	0	112.3	R1026 I1031 I1032	R1026-V1028 PolarHBondContact O-N 3.24Å; V1028-I1031 PolarHBondContact O-N 3.11Å; V1028-I1032 HydrophobicContact CG1-CD1 3.74Å; V1028-I1032 HydrophobicContact CG1-CG1 4.41Å; V1028-I1032 WeakPolarHBondContact O-CB 3.2Å; V1028-I1032 WeakPolarHBondContact O-CG1 3.35Å; V1028-I1032 PolarHBondContact O-N 3.18Å
1029	K	73.3	Confident	72.2	Confident	154 Å²	154	109 Å²	109	67%	0.67	50%	0.499	S	S	*	.	H	α-helix	trans	-67.3	-38.9	177.4	-60.1	161.6	-177.1	158.7	0	111.6	D1027 I1032 K1033	D1027-K1029 PolarHBondContact O-N 2.97Å; D1027-K1029 VanDerWaalsContact O-N 3.12Å; D1027-K1029 PolarHBondContact OD1-N 3.1Å; D1027-K1029 WeakPolarHBondContact OD2-CB 3.29Å; K1029-I1032 PolarHBondContact O-N 3.26Å; K1029-K1033 WeakPolarHBondContact O-CG 3.36Å; K1029-K1033 PolarHBondContact O-N 2.78Å
1030	S	74.1	Confident	71	Confident	18 Å²	18	113.4 Å²	113.4	13%	0.126	52%	0.521	C	S	.	.	H	α-helix	trans	-67.3	-43.2	174.8	-63.9	0	0	0	0	111.7	D1027 K1033 K1034	D1027-S1030 CarbonylContact O-C 3.59Å; D1027-S1030 WeakPolarHBondContact O-CA 3.32Å; D1027-S1030 VanDerWaalsContact O-CB 3.27Å; D1027-S1030 WeakPolarHBondContact O-CB 3.33Å; D1027-S1030 PolarHBondContact O-N 3.11Å; S1030-K1033 PolarHBondContact O-N 2.67Å; S1030-K1034 WeakPolarHBondContact O-CG 3.37Å; S1030-K1034 PolarHBondContact O-N 3.44Å
1031	I	70.1	Confident	69.5	Low	67 Å²	67	120.3 Å²	120.3	34%	0.344	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-42.4	173.3	-67.3	-179.4	0	0	0	111.2	R1026 D1027 V1028 K1034 K1035	R1026-I1031 WeakPolarHBondContact O-CD1 3.33Å; R1026-I1031 WeakPolarHBondContact O-CG1 3.35Å; D1027-I1031 PolarHBondContact O-N 2.83Å; V1028-I1031 PolarHBondContact O-N 3.11Å; I1031-K1034 PolarHBondContact O-N 2.91Å; I1031-K1035 HydrophobicContact CG2-CD 4.02Å; I1031-K1035 HydrophobicContact CG2-CG 4.41Å; I1031-K1035 WeakPolarHBondContact O-CB 3.43Å; I1031-K1035 WeakPolarHBondContact O-CG 3.14Å; I1031-K1035 PolarHBondContact O-N 3.25Å
1032	I	71.5	Confident	68.2	Low	83 Å²	83	122.4 Å²	122.4	43%	0.426	55%	0.552	S	S	.	*	H	α-helix	trans	-65	-40.2	176.6	-73	168.4	0	0	0	111.2	V1028 K1029 K1036	V1028-I1032 HydrophobicContact CG1-CD1 3.74Å; V1028-I1032 HydrophobicContact CG1-CG1 4.41Å; V1028-I1032 WeakPolarHBondContact O-CB 3.2Å; V1028-I1032 WeakPolarHBondContact O-CG1 3.35Å; V1028-I1032 PolarHBondContact O-N 3.18Å; K1029-I1032 PolarHBondContact O-N 3.26Å; I1032-K1036 HydrophobicContact CG2-CD 4.34Å; I1032-K1036 WeakPolarHBondContact O-CB 3.5Å; I1032-K1036 WeakPolarHBondContact O-CG 3.44Å; I1032-K1036 PolarHBondContact O-N 3.4Å
1033	K	72.6	Confident	66.7	Low	147 Å²	147	123.7 Å²	123.7	64%	0.639	56%	0.562	S	S	*	*	H	α-helix	trans	-59.8	-52.3	171.3	-80.5	-180	177	177.1	0	111	K1029 S1030 K1035 K1036 H1037	K1029-K1033 WeakPolarHBondContact O-CG 3.36Å; K1029-K1033 PolarHBondContact O-N 2.78Å; S1030-K1033 PolarHBondContact O-N 2.67Å; K1033-K1035 PolarHBondContact O-N 2.88Å; K1033-K1036 PolarHBondContact O-N 2.93Å; K1033-K1036 VanDerWaalsContact O-N 3.17Å; K1033-H1037 PolarHBondContact O-CD2 3.44Å; K1033-H1037 PolarHBondContact O-N 2.9Å
1034	K	70.6	Confident	65.3	Low	115 Å²	115	124.7 Å²	124.7	50%	0.5	57%	0.572	S	S	.	*	H	α-helix	trans	-54.8	-49.3	176.8	-74	173.5	178.8	171.5	0	111.6	N1025 S1030 I1031 K1036 H1037 F1038	N1025-K1034 VanDerWaalsContact CB-NZ 3.32Å; N1025-K1034 PolarHBondContact O-NZ 3.25Å; S1030-K1034 WeakPolarHBondContact O-CG 3.37Å; S1030-K1034 PolarHBondContact O-N 3.44Å; I1031-K1034 PolarHBondContact O-N 2.91Å; K1034-K1036 PolarHBondContact O-N 3.18Å; K1034-H1037 PolarHBondContact O-N 3.38Å; K1034-F1038 PolarHBondContact O-N 3.49Å
1035	K	67.8	Low	63.9	Low	145 Å²	145	124.7 Å²	124.7	63%	0.63	58%	0.581	S	S	*	*	H	α-helix	trans	-63	-36.5	177.4	-73.9	-179.4	177.8	177.2	0	113.2	I1031 K1033 K1039	I1031-K1035 HydrophobicContact CG2-CD 4.02Å; I1031-K1035 HydrophobicContact CG2-CG 4.41Å; I1031-K1035 WeakPolarHBondContact O-CB 3.43Å; I1031-K1035 WeakPolarHBondContact O-CG 3.14Å; I1031-K1035 PolarHBondContact O-N 3.25Å; K1033-K1035 PolarHBondContact O-N 2.88Å; K1035-K1039 PolarHBondContact O-N 2.94Å; K1035-K1039 VanDerWaalsContact O-N 3.14Å
1036	K	68.3	Low	62.3	Low	149 Å²	149	129.8 Å²	129.8	65%	0.648	60%	0.602	S	S	*	*	H	α-helix	trans	-68.1	-39.8	173.5	-81.1	-176.9	176	179	0	112.6	I1032 K1033 K1034 K1040	I1032-K1036 HydrophobicContact CG2-CD 4.34Å; I1032-K1036 WeakPolarHBondContact O-CB 3.5Å; I1032-K1036 WeakPolarHBondContact O-CG 3.44Å; I1032-K1036 PolarHBondContact O-N 3.4Å; K1033-K1036 PolarHBondContact O-N 2.93Å; K1033-K1036 VanDerWaalsContact O-N 3.17Å; K1034-K1036 PolarHBondContact O-N 3.18Å; K1036-K1040 PolarHBondContact O-N 2.89Å
1037	H	61.1	Low	60.9	Low	140 Å²	140	132.7 Å²	132.7	65%	0.648	62%	0.619	S	S	*	*	H	α-helix	trans	-65.8	-42.1	174.7	-84.9	-93.7	0	0	0	112	K1033 K1034 K1039 K1040 R1041	K1033-H1037 PolarHBondContact O-CD2 3.44Å; K1033-H1037 PolarHBondContact O-N 2.9Å; K1034-H1037 PolarHBondContact O-N 3.38Å; H1037-K1039 PolarHBondContact O-N 3.12Å; H1037-K1040 PolarHBondContact O-N 2.97Å; H1037-K1040 VanDerWaalsContact O-N 3.15Å; H1037-R1041 PolarHBondContact O-N 3Å; H1037-R1041 VanDerWaalsContact O-N 3.08Å
1038	F	58	Low	59.2	Low	151 Å²	151	137.4 Å²	137.4	66%	0.662	65%	0.649	S	S	*	*	H	α-helix	trans	-59.8	-46.4	176.6	-137.4	-93	0	0	0	111.9	K1034 K1040 R1041 I1042	K1034-F1038 PolarHBondContact O-N 3.49Å; F1038-K1040 VanDerWaalsContact C-N 3.28Å; F1038-K1040 PolarHBondContact O-N 3.38Å; F1038-R1041 PolarHBondContact O-N 3.12Å; F1038-I1042 HydrophobicContact CD1-CD1 3.93Å; F1038-I1042 HydrophobicContact CE1-CD1 4.19Å; F1038-I1042 PolarHBondContact O-N 3.5Å
1039	K	55.8	Low	57.6	Low	170 Å²	170	142.8 Å²	142.8	74%	0.739	66%	0.664	S	S	*	*	H	α-helix	trans	-66.7	-20.7	176.2	-75.8	-169.1	174.7	-174.1	0	114.6	K1035 H1037	K1035-K1039 PolarHBondContact O-N 2.94Å; K1035-K1039 VanDerWaalsContact O-N 3.14Å; H1037-K1039 PolarHBondContact O-N 3.12Å
1040	K	54.7	Low	55.9	Low	168 Å²	168	144.7 Å²	144.7	73%	0.73	67%	0.672	S	S	*	*	H	α-helix	trans	-77.4	-41.5	169.4	-86.1	-168.5	172	-173.1	0	112.3	K1036 H1037 F1038 I1042 K1043	K1036-K1040 PolarHBondContact O-N 2.89Å; H1037-K1040 PolarHBondContact O-N 2.97Å; H1037-K1040 VanDerWaalsContact O-N 3.15Å; F1038-K1040 VanDerWaalsContact C-N 3.28Å; F1038-K1040 PolarHBondContact O-N 3.38Å; K1040-I1042 VanDerWaalsContact C-N 3.3Å; K1040-I1042 PolarHBondContact O-N 3.34Å; K1040-K1043 PolarHBondContact O-N 3.09Å
1041	R	48.9	Very low	54.2	Low	209 Å²	209	152.2 Å²	152.2	79%	0.789	71%	0.705	S	S	*	*	H	α-helix	trans	-68.3	-24.1	-173	-160.8	173.6	-176.5	-178.9	0.3	114.2	H1037 F1038	H1037-R1041 PolarHBondContact O-N 3Å; H1037-R1041 VanDerWaalsContact O-N 3.08Å; F1038-R1041 PolarHBondContact O-N 3.12Å
1042	I	52.5	Low	52.6	Low	113 Å²	113	160.8 Å²	160.8	58%	0.579	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-80	-19.6	179.8	-67.1	169.5	0	0	0	112.9	F1038 K1040 T1044	F1038-I1042 HydrophobicContact CD1-CD1 3.93Å; F1038-I1042 HydrophobicContact CE1-CD1 4.19Å; F1038-I1042 PolarHBondContact O-N 3.5Å; K1040-I1042 VanDerWaalsContact C-N 3.3Å; K1040-I1042 PolarHBondContact O-N 3.34Å; I1042-T1044 PolarHBondContact O-N 3.33Å
1043	K	48.2	Very low	50.9	Low	188 Å²	188	170.2 Å²	170.2	82%	0.817	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-87.3	0.8	-172.5	-76.9	-163.3	170.8	-167.2	0	116	K1040	K1040-K1043 PolarHBondContact O-N 3.09Å
1044	T	48	Very low	49.8	Very low	121 Å²	121	171.4 Å²	171.4	74%	0.742	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-111.1	0.2	-172.3	36	0	0	0	0	115.7	I1042	I1042-T1044 PolarHBondContact O-N 3.33Å
1045	T	48.1	Very low	48.7	Very low	114 Å²	114	174.3 Å²	174.3	70%	0.699	79%	0.792	S	S	*	*	S	Bend	trans	-116.8	16.6	-168.9	44.8	0	0	0	0	116.1
1046	Q	43.5	Very low	47.6	Very low	186 Å²	186	175.9 Å²	175.9	87%	0.869	80%	0.801	S	S	*	*			trans	-135.7	81.3	173.8	-73.9	-170.3	-18.9	0	0	113
1047	K	42.7	Very low	46.4	Very low	208 Å²	208	177.5 Å²	177.5	90%	0.904	81%	0.81	S	S	*	*			trans	-157.2	29.7	162.7	-129	175	-174.1	-178.6	0	118.2
1048	T	42.6	Very low	45.5	Very low	138 Å²	138	179.9 Å²	179.9	85%	0.847	82%	0.821	S	S	*	*			trans	-146.3	95.7	174.5	31.4	0	0	0	0	114.2
1049	K	37.1	Very low	44.7	Very low	214 Å²	214	181.8 Å²	181.8	93%	0.93	83%	0.831	S	S	*	*				173.9	121.5	127.8	-96.5	167.9	-179.1	-179.5	0	110.6
1050	K	38	Very low	43.9	Very low	194 Å²	194	182.6 Å²	182.6	84%	0.843	84%	0.838	S	S	*	*			trans	-89.6	160.1	159.5	-99	-170.4	173.6	-172.6	0	109.4
1051	Q	37.4	Very low	43.1	Very low	176 Å²	176	183.8 Å²	183.8	82%	0.822	85%	0.846	S	S	*	*			trans	-36.3	150.3	174.7	-58.8	151.6	-66.2	0	0	115.5
1052	R	37.5	Very low	42.6	Very low	247 Å²	247	181.7 Å²	181.7	93%	0.932	85%	0.851	S	S	*	*			trans	-153.7	123.2	133.2	-141.3	176.5	-173.7	-173.9	0.9	112.1
1053	K	35.2	Very low	41.7	Very low	281 Å²	281	187.9 Å²	187.9	100%	1.222	88%	0.875	S	S	*	*			trans	66.2	0	-163.9	-62.2	-169	174.5	-172.8	0	112.3

Retrieved 1,053 of 1,053 residues in 571 ms (Link to these results)

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